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covid19Mpro_HomoDim.pdb
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covid19Mpro_HomoDim.pdb
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REMARK 4 COMPLIES WITH FORMAT V. 3.0, 1-DEC-2006
REMARK 888
REMARK 888 WRITTEN BY MAESTRO (A PRODUCT OF SCHRODINGER, LLC)
TITLE new-0 - homology model built on 2GT7_A 2GT7_B
MODEL 1
ATOM 1 N SER A 1 -17.402 -14.516 32.460 1.00 47.72 N1+
ATOM 2 CA SER A 1 -17.475 -15.187 31.132 1.00 48.13 C
ATOM 3 C SER A 1 -17.627 -14.165 30.018 1.00 47.98 C
ATOM 4 O SER A 1 -18.071 -13.028 30.256 1.00 48.21 O
ATOM 5 CB SER A 1 -18.666 -16.144 31.080 1.00 48.50 C
ATOM 6 OG SER A 1 -19.894 -15.414 31.125 1.00 49.64 O
ATOM 7 H1 SER A 1 -17.301 -15.212 33.185 1.00 0.00 H
ATOM 8 H2 SER A 1 -16.607 -13.893 32.480 1.00 0.00 H
ATOM 9 H3 SER A 1 -18.248 -13.987 32.617 1.00 0.00 H
ATOM 10 HA SER A 1 -16.558 -15.754 30.970 1.00 0.00 H
ATOM 11 HB3 SER A 1 -18.619 -16.828 31.927 1.00 0.00 H
ATOM 12 HB2 SER A 1 -18.624 -16.727 30.160 1.00 0.00 H
ATOM 13 HG SER A 1 -20.632 -16.027 31.092 1.00 0.00 H
ATOM 14 N GLY A 2 -17.307 -14.599 28.803 1.00 47.23 N
ATOM 15 CA GLY A 2 -17.272 -13.721 27.652 1.00 46.76 C
ATOM 16 C GLY A 2 -15.845 -13.241 27.432 1.00 46.40 C
ATOM 17 O GLY A 2 -15.008 -13.197 28.354 1.00 47.39 O
ATOM 18 H GLY A 2 -17.077 -15.572 28.659 1.00 0.00 H
ATOM 19 HA3 GLY A 2 -17.920 -12.863 27.830 1.00 0.00 H
ATOM 20 HA2 GLY A 2 -17.612 -14.264 26.770 1.00 0.00 H
ATOM 21 N PHE A 3 -15.549 -12.918 26.189 1.00 45.64 N
ATOM 22 CA PHE A 3 -14.307 -12.246 25.853 1.00 43.12 C
ATOM 23 C PHE A 3 -14.811 -11.305 24.792 1.00 43.26 C
ATOM 24 O PHE A 3 -15.620 -11.657 23.886 1.00 42.62 O
ATOM 25 CB PHE A 3 -13.183 -13.194 25.383 1.00 43.97 C
ATOM 26 CG PHE A 3 -11.766 -12.644 25.633 1.00 42.65 C
ATOM 27 CD1 PHE A 3 -11.238 -12.564 26.921 1.00 41.56 C
ATOM 28 CD2 PHE A 3 -10.984 -12.183 24.574 1.00 44.06 C
ATOM 29 CE1 PHE A 3 -9.952 -12.041 27.155 1.00 42.17 C
ATOM 30 CE2 PHE A 3 -9.688 -11.673 24.792 1.00 41.33 C
ATOM 31 CZ PHE A 3 -9.175 -11.587 26.093 1.00 42.56 C
ATOM 32 H PHE A 3 -16.193 -13.138 25.443 1.00 0.00 H
ATOM 33 HA PHE A 3 -13.961 -11.672 26.713 1.00 0.00 H
ATOM 34 HB3 PHE A 3 -13.307 -13.404 24.321 1.00 0.00 H
ATOM 35 HB2 PHE A 3 -13.290 -14.157 25.882 1.00 0.00 H
ATOM 36 HD1 PHE A 3 -11.818 -12.907 27.765 1.00 0.00 H
ATOM 37 HD2 PHE A 3 -11.369 -12.213 23.565 1.00 0.00 H
ATOM 38 HE1 PHE A 3 -9.564 -11.991 28.162 1.00 0.00 H
ATOM 39 HE2 PHE A 3 -9.088 -11.347 23.955 1.00 0.00 H
ATOM 40 HZ PHE A 3 -8.193 -11.177 26.279 1.00 0.00 H
ATOM 41 N ARG A 4 -14.484 -10.052 25.007 1.00 40.83 N
ATOM 42 CA ARG A 4 -14.931 -9.055 24.097 1.00 38.58 C
ATOM 43 C ARG A 4 -13.689 -8.208 23.966 1.00 37.26 C
ATOM 44 O ARG A 4 -12.937 -8.066 24.915 1.00 35.62 O
ATOM 45 CB ARG A 4 -16.111 -8.260 24.676 1.00 38.02 C
ATOM 46 CG ARG A 4 -17.484 -8.893 24.370 1.00 38.33 C
ATOM 47 CD ARG A 4 -18.454 -7.882 23.764 1.00 39.23 C
ATOM 48 NE ARG A 4 -19.809 -8.389 23.531 1.00 40.29 N
ATOM 49 CZ ARG A 4 -20.441 -8.403 22.341 1.00 44.04 C
ATOM 50 NH1 ARG A 4 -19.820 -7.933 21.249 1.00 45.17 N
ATOM 51 NH2 ARG A 4 -21.712 -8.863 22.235 1.00 38.81 N1+
ATOM 52 H ARG A 4 -13.922 -9.807 25.810 1.00 0.00 H
ATOM 53 HA ARG A 4 -15.198 -9.499 23.138 1.00 0.00 H
ATOM 54 HB3 ARG A 4 -16.087 -7.242 24.287 1.00 0.00 H
ATOM 55 HB2 ARG A 4 -15.989 -8.165 25.755 1.00 0.00 H
ATOM 56 HG3 ARG A 4 -17.909 -9.298 25.288 1.00 0.00 H
ATOM 57 HG2 ARG A 4 -17.353 -9.728 23.681 1.00 0.00 H
ATOM 58 HD3 ARG A 4 -18.044 -7.506 22.827 1.00 0.00 H
ATOM 59 HD2 ARG A 4 -18.504 -7.001 24.404 1.00 0.00 H
ATOM 60 HE ARG A 4 -20.273 -8.748 24.353 1.00 0.00 H
ATOM 61 HH12 ARG A 4 -20.292 -7.943 20.356 1.00 0.00 H
ATOM 62 HH11 ARG A 4 -18.880 -7.569 21.320 1.00 0.00 H
ATOM 63 HH22 ARG A 4 -22.174 -8.868 21.337 1.00 0.00 H
ATOM 64 HH21 ARG A 4 -22.197 -9.201 23.054 1.00 0.00 H
ATOM 65 N LYS A 5 -13.500 -7.640 22.794 1.00 36.18 N
ATOM 66 CA LYS A 5 -12.568 -6.559 22.682 1.00 35.78 C
ATOM 67 C LYS A 5 -13.215 -5.451 23.517 1.00 34.23 C
ATOM 68 O LYS A 5 -14.428 -5.222 23.445 1.00 35.27 O
ATOM 69 CB LYS A 5 -12.398 -6.183 21.227 1.00 35.94 C
ATOM 70 CG LYS A 5 -11.007 -5.603 20.912 1.00 39.79 C
ATOM 71 CD LYS A 5 -10.746 -5.697 19.422 1.00 42.44 C
ATOM 72 CE LYS A 5 -10.308 -7.099 18.958 1.00 39.33 C
ATOM 73 NZ LYS A 5 -10.455 -7.079 17.443 1.00 39.46 N1+
ATOM 74 H LYS A 5 -14.010 -7.968 21.986 1.00 0.00 H
ATOM 75 HA LYS A 5 -11.608 -6.843 23.112 1.00 0.00 H
ATOM 76 HB3 LYS A 5 -13.164 -5.459 20.948 1.00 0.00 H
ATOM 77 HB2 LYS A 5 -12.574 -7.060 20.604 1.00 0.00 H
ATOM 78 HG3 LYS A 5 -10.247 -6.170 21.450 1.00 0.00 H
ATOM 79 HG2 LYS A 5 -10.970 -4.559 21.222 1.00 0.00 H
ATOM 80 HD3 LYS A 5 -9.985 -4.969 19.142 1.00 0.00 H
ATOM 81 HD2 LYS A 5 -11.643 -5.400 18.878 1.00 0.00 H
ATOM 82 HE3 LYS A 5 -10.983 -7.846 19.377 1.00 0.00 H
ATOM 83 HE2 LYS A 5 -9.261 -7.255 19.218 1.00 0.00 H
ATOM 84 HZ1 LYS A 5 -10.182 -7.975 17.066 1.00 0.00 H
ATOM 85 HZ2 LYS A 5 -11.417 -6.891 17.200 1.00 0.00 H
ATOM 86 HZ3 LYS A 5 -9.863 -6.358 17.056 1.00 0.00 H
ATOM 87 N MET A 6 -12.463 -4.851 24.411 1.00 32.13 N
ATOM 88 CA MET A 6 -13.037 -3.756 25.197 1.00 34.56 C
ATOM 89 C MET A 6 -12.146 -2.547 25.043 1.00 31.41 C
ATOM 90 O MET A 6 -10.961 -2.700 24.940 1.00 31.19 O
ATOM 91 CB MET A 6 -13.099 -4.132 26.669 1.00 34.25 C
ATOM 92 CG MET A 6 -14.183 -5.153 26.986 1.00 39.33 C
ATOM 93 SD MET A 6 -14.370 -5.143 28.781 1.00 44.74 S
ATOM 94 CE MET A 6 -12.628 -5.146 29.167 1.00 38.55 C
ATOM 95 H MET A 6 -11.507 -5.147 24.547 1.00 0.00 H
ATOM 96 HA MET A 6 -14.038 -3.525 24.833 1.00 0.00 H
ATOM 97 HB3 MET A 6 -13.262 -3.234 27.265 1.00 0.00 H
ATOM 98 HB2 MET A 6 -12.131 -4.522 26.984 1.00 0.00 H
ATOM 99 HG3 MET A 6 -13.856 -6.141 26.661 1.00 0.00 H
ATOM 100 HG2 MET A 6 -15.119 -4.843 26.523 1.00 0.00 H
ATOM 101 HE1 MET A 6 -12.495 -5.141 30.249 1.00 0.00 H
ATOM 102 HE2 MET A 6 -12.164 -6.039 28.749 1.00 0.00 H
ATOM 103 HE3 MET A 6 -12.159 -4.260 28.739 1.00 0.00 H
ATOM 104 N ALA A 7 -12.726 -1.362 25.013 1.00 29.11 N
ATOM 105 CA ALA A 7 -11.939 -0.154 25.018 1.00 26.84 C
ATOM 106 C ALA A 7 -11.794 0.319 26.458 1.00 25.28 C
ATOM 107 O ALA A 7 -12.590 -0.122 27.347 1.00 24.16 O
ATOM 108 CB ALA A 7 -12.612 0.894 24.155 1.00 28.37 C
ATOM 109 H ALA A 7 -13.733 -1.293 24.986 1.00 0.00 H
ATOM 110 HA ALA A 7 -10.951 -0.370 24.612 1.00 0.00 H
ATOM 111 HB1 ALA A 7 -12.016 1.807 24.160 1.00 0.00 H
ATOM 112 HB2 ALA A 7 -12.699 0.523 23.134 1.00 0.00 H
ATOM 113 HB3 ALA A 7 -13.605 1.107 24.550 1.00 0.00 H
ATOM 114 N PHE A 8 -10.776 1.158 26.729 1.00 25.08 N
ATOM 115 CA PHE A 8 -10.712 1.784 28.055 1.00 25.70 C
ATOM 116 C PHE A 8 -11.907 2.706 28.250 1.00 26.92 C
ATOM 117 O PHE A 8 -12.397 3.269 27.294 1.00 25.78 O
ATOM 118 CB PHE A 8 -9.428 2.579 28.234 1.00 28.27 C
ATOM 119 CG PHE A 8 -8.199 1.722 28.358 1.00 29.99 C
ATOM 120 CD1 PHE A 8 -7.816 1.179 29.598 1.00 32.39 C
ATOM 121 CD2 PHE A 8 -7.447 1.453 27.255 1.00 29.48 C
ATOM 122 CE1 PHE A 8 -6.662 0.375 29.699 1.00 31.03 C
ATOM 123 CE2 PHE A 8 -6.307 0.637 27.326 1.00 32.88 C
ATOM 124 CZ PHE A 8 -5.908 0.089 28.546 1.00 31.66 C
ATOM 125 H PHE A 8 -10.076 1.346 26.026 1.00 0.00 H
ATOM 126 HA PHE A 8 -10.747 1.001 28.813 1.00 0.00 H
ATOM 127 HB3 PHE A 8 -9.516 3.215 29.115 1.00 0.00 H
ATOM 128 HB2 PHE A 8 -9.307 3.265 27.395 1.00 0.00 H
ATOM 129 HD1 PHE A 8 -8.407 1.377 30.480 1.00 0.00 H
ATOM 130 HD2 PHE A 8 -7.723 1.871 26.298 1.00 0.00 H
ATOM 131 HE1 PHE A 8 -6.360 -0.018 30.658 1.00 0.00 H
ATOM 132 HE2 PHE A 8 -5.734 0.431 26.434 1.00 0.00 H
ATOM 133 HZ PHE A 8 -5.036 -0.545 28.614 1.00 0.00 H
ATOM 134 N PRO A 9 -12.335 2.942 29.504 1.00 25.45 N
ATOM 135 CA PRO A 9 -13.352 3.943 29.718 1.00 26.29 C
ATOM 136 C PRO A 9 -12.808 5.276 29.201 1.00 26.18 C
ATOM 137 O PRO A 9 -11.642 5.588 29.473 1.00 27.29 O
ATOM 138 CB PRO A 9 -13.497 3.956 31.250 1.00 26.04 C
ATOM 139 CG PRO A 9 -12.995 2.556 31.667 1.00 27.05 C
ATOM 140 CD PRO A 9 -11.852 2.326 30.755 1.00 24.55 C
ATOM 141 HA PRO A 9 -14.288 3.675 29.229 1.00 0.00 H
ATOM 142 HB3 PRO A 9 -14.551 4.053 31.511 1.00 0.00 H
ATOM 143 HB2 PRO A 9 -12.835 4.715 31.668 1.00 0.00 H
ATOM 144 HG3 PRO A 9 -13.772 1.820 31.462 1.00 0.00 H
ATOM 145 HG2 PRO A 9 -12.633 2.595 32.694 1.00 0.00 H
ATOM 146 HD2 PRO A 9 -10.987 2.882 31.117 1.00 0.00 H
ATOM 147 HD3 PRO A 9 -11.726 1.254 30.601 1.00 0.00 H
ATOM 148 N SER A 10 -13.609 6.060 28.475 1.00 25.26 N
ATOM 149 CA SER A 10 -13.043 7.167 27.684 1.00 24.69 C
ATOM 150 C SER A 10 -13.199 8.538 28.337 1.00 24.03 C
ATOM 151 O SER A 10 -12.787 9.562 27.762 1.00 25.93 O
ATOM 152 CB SER A 10 -13.698 7.244 26.299 1.00 24.56 C
ATOM 153 OG SER A 10 -15.071 7.256 26.463 1.00 24.44 O
ATOM 154 H SER A 10 -14.605 5.895 28.467 1.00 0.00 H
ATOM 155 HA SER A 10 -11.979 6.976 27.546 1.00 0.00 H
ATOM 156 HB3 SER A 10 -13.410 6.372 25.712 1.00 0.00 H
ATOM 157 HB2 SER A 10 -13.384 8.161 25.799 1.00 0.00 H
ATOM 158 HG SER A 10 -15.496 7.304 25.604 1.00 0.00 H
ATOM 159 N GLY A 11 -13.844 8.569 29.503 1.00 24.38 N
ATOM 160 CA GLY A 11 -14.217 9.838 30.156 1.00 22.51 C
ATOM 161 C GLY A 11 -13.038 10.778 30.393 1.00 22.93 C
ATOM 162 O GLY A 11 -13.152 11.993 30.157 1.00 24.33 O
ATOM 163 H GLY A 11 -14.092 7.706 29.966 1.00 0.00 H
ATOM 164 HA3 GLY A 11 -14.707 9.625 31.106 1.00 0.00 H
ATOM 165 HA2 GLY A 11 -14.970 10.347 29.554 1.00 0.00 H
ATOM 166 N LYS A 12 -11.887 10.242 30.821 1.00 23.50 N
ATOM 167 CA LYS A 12 -10.749 11.131 31.113 1.00 24.30 C
ATOM 168 C LYS A 12 -10.238 11.829 29.839 1.00 24.71 C
ATOM 169 O LYS A 12 -9.677 12.903 29.899 1.00 26.26 O
ATOM 170 CB LYS A 12 -9.608 10.354 31.768 1.00 23.96 C
ATOM 171 CG LYS A 12 -9.827 10.080 33.277 1.00 26.10 C
ATOM 172 CD LYS A 12 -8.662 9.180 33.734 1.00 30.78 C
ATOM 173 CE LYS A 12 -8.640 9.040 35.256 1.00 32.65 C
ATOM 174 NZ LYS A 12 -9.907 8.343 35.659 1.00 37.28 N1+
ATOM 175 H LYS A 12 -11.809 9.242 30.939 1.00 0.00 H
ATOM 176 HA LYS A 12 -11.085 11.898 31.811 1.00 0.00 H
ATOM 177 HB3 LYS A 12 -8.674 10.899 31.631 1.00 0.00 H
ATOM 178 HB2 LYS A 12 -9.468 9.408 31.245 1.00 0.00 H
ATOM 179 HG3 LYS A 12 -10.770 9.551 33.416 1.00 0.00 H
ATOM 180 HG2 LYS A 12 -9.794 11.022 33.825 1.00 0.00 H
ATOM 181 HD3 LYS A 12 -7.718 9.608 33.395 1.00 0.00 H
ATOM 182 HD2 LYS A 12 -8.765 8.194 33.280 1.00 0.00 H
ATOM 183 HE3 LYS A 12 -8.610 10.030 35.711 1.00 0.00 H
ATOM 184 HE2 LYS A 12 -7.783 8.435 35.552 1.00 0.00 H
ATOM 185 HZ1 LYS A 12 -9.927 8.233 36.663 1.00 0.00 H
ATOM 186 HZ2 LYS A 12 -10.702 8.892 35.365 1.00 0.00 H
ATOM 187 HZ3 LYS A 12 -9.946 7.434 35.220 1.00 0.00 H
ATOM 188 N VAL A 13 -10.403 11.176 28.687 1.00 23.94 N
ATOM 189 CA VAL A 13 -10.023 11.758 27.395 1.00 24.98 C
ATOM 190 C VAL A 13 -11.100 12.689 26.823 1.00 25.41 C
ATOM 191 O VAL A 13 -10.805 13.697 26.171 1.00 25.64 O
ATOM 192 CB VAL A 13 -9.690 10.597 26.396 1.00 24.88 C
ATOM 193 CG1 VAL A 13 -9.353 11.169 25.027 1.00 23.14 C
ATOM 194 CG2 VAL A 13 -8.493 9.835 26.966 1.00 24.11 C
ATOM 195 H VAL A 13 -10.802 10.248 28.685 1.00 0.00 H
ATOM 196 HA VAL A 13 -9.116 12.344 27.544 1.00 0.00 H
ATOM 197 HB VAL A 13 -10.546 9.927 26.313 1.00 0.00 H
ATOM 198 HG11 VAL A 13 -9.123 10.355 24.339 1.00 0.00 H
ATOM 199 HG12 VAL A 13 -10.205 11.734 24.649 1.00 0.00 H
ATOM 200 HG13 VAL A 13 -8.489 11.828 25.111 1.00 0.00 H
ATOM 201 HG21 VAL A 13 -8.230 9.016 26.296 1.00 0.00 H
ATOM 202 HG22 VAL A 13 -7.644 10.511 27.063 1.00 0.00 H
ATOM 203 HG23 VAL A 13 -8.750 9.434 27.946 1.00 0.00 H
ATOM 204 N GLU A 14 -12.370 12.334 27.020 1.00 24.61 N
ATOM 205 CA GLU A 14 -13.486 13.136 26.547 1.00 24.27 C
ATOM 206 C GLU A 14 -13.365 14.543 27.086 1.00 25.20 C
ATOM 207 O GLU A 14 -13.655 15.496 26.370 1.00 24.83 O
ATOM 208 CB GLU A 14 -14.807 12.577 27.052 1.00 24.82 C
ATOM 209 CG GLU A 14 -15.146 11.213 26.402 1.00 24.82 C
ATOM 210 CD GLU A 14 -16.360 10.595 27.034 1.00 21.89 C
ATOM 211 OE1 GLU A 14 -16.321 9.402 27.398 1.00 24.58 O
ATOM 212 OE2 GLU A 14 -17.350 11.300 27.154 1.00 22.08 O1-
ATOM 213 H GLU A 14 -12.585 11.480 27.514 1.00 0.00 H
ATOM 214 HA GLU A 14 -13.488 13.158 25.457 1.00 0.00 H
ATOM 215 HB3 GLU A 14 -15.606 13.288 26.841 1.00 0.00 H
ATOM 216 HB2 GLU A 14 -14.761 12.461 28.135 1.00 0.00 H
ATOM 217 HG3 GLU A 14 -14.297 10.538 26.511 1.00 0.00 H
ATOM 218 HG2 GLU A 14 -15.324 11.353 25.336 1.00 0.00 H
ATOM 219 N GLY A 15 -12.916 14.659 28.334 1.00 23.32 N
ATOM 220 CA GLY A 15 -12.805 15.990 29.002 1.00 24.51 C
ATOM 221 C GLY A 15 -11.652 16.832 28.482 1.00 25.30 C
ATOM 222 O GLY A 15 -11.483 17.978 28.912 1.00 24.93 O
ATOM 223 H GLY A 15 -12.641 13.836 28.850 1.00 0.00 H
ATOM 224 HA3 GLY A 15 -12.693 15.847 30.077 1.00 0.00 H
ATOM 225 HA2 GLY A 15 -13.739 16.538 28.875 1.00 0.00 H
ATOM 226 N CYS A 16 -10.877 16.259 27.573 1.00 23.60 N
ATOM 227 CA CYS A 16 -9.770 16.930 26.910 1.00 26.30 C
ATOM 228 C CYS A 16 -10.002 17.348 25.462 1.00 25.77 C
ATOM 229 O CYS A 16 -9.108 17.964 24.880 1.00 24.62 O
ATOM 230 CB CYS A 16 -8.502 16.058 26.972 1.00 24.34 C
ATOM 231 SG CYS A 16 -7.948 15.645 28.655 1.00 28.81 S
ATOM 232 H CYS A 16 -11.040 15.299 27.303 1.00 0.00 H
ATOM 233 HA CYS A 16 -9.562 17.838 27.476 1.00 0.00 H
ATOM 234 HB3 CYS A 16 -7.694 16.558 26.438 1.00 0.00 H
ATOM 235 HB2 CYS A 16 -8.669 15.138 26.411 1.00 0.00 H
ATOM 236 HG CYS A 16 -6.847 14.890 28.590 1.00 0.00 H
ATOM 237 N MET A 17 -11.129 16.960 24.855 1.00 25.92 N
ATOM 238 CA MET A 17 -11.379 17.187 23.395 1.00 26.39 C
ATOM 239 C MET A 17 -11.978 18.566 23.174 1.00 25.90 C
ATOM 240 O MET A 17 -12.894 18.947 23.878 1.00 26.27 O
ATOM 241 CB MET A 17 -12.283 16.090 22.752 1.00 25.54 C
ATOM 242 CG MET A 17 -11.666 14.669 22.965 1.00 24.24 C
ATOM 243 SD MET A 17 -9.953 14.505 22.472 1.00 27.08 S
ATOM 244 CE MET A 17 -10.012 15.123 20.731 1.00 27.08 C
ATOM 245 H MET A 17 -11.853 16.494 25.384 1.00 0.00 H
ATOM 246 HA MET A 17 -10.415 17.160 22.887 1.00 0.00 H
ATOM 247 HB3 MET A 17 -12.386 16.285 21.684 1.00 0.00 H
ATOM 248 HB2 MET A 17 -13.275 16.126 23.203 1.00 0.00 H
ATOM 249 HG3 MET A 17 -12.267 13.932 22.432 1.00 0.00 H
ATOM 250 HG2 MET A 17 -11.769 14.385 24.012 1.00 0.00 H
ATOM 251 HE1 MET A 17 -9.014 15.079 20.295 1.00 0.00 H
ATOM 252 HE2 MET A 17 -10.690 14.501 20.147 1.00 0.00 H
ATOM 253 HE3 MET A 17 -10.367 16.154 20.723 1.00 0.00 H
ATOM 254 N VAL A 18 -11.435 19.281 22.194 1.00 26.38 N
ATOM 255 CA VAL A 18 -11.867 20.607 21.809 1.00 25.86 C
ATOM 256 C VAL A 18 -11.875 20.684 20.283 1.00 27.39 C
ATOM 257 O VAL A 18 -11.340 19.803 19.602 1.00 26.46 O
ATOM 258 CB VAL A 18 -10.931 21.704 22.393 1.00 26.20 C
ATOM 259 CG1 VAL A 18 -10.946 21.709 23.970 1.00 24.79 C
ATOM 260 CG2 VAL A 18 -9.502 21.638 21.786 1.00 25.91 C
ATOM 261 H VAL A 18 -10.665 18.903 21.660 1.00 0.00 H
ATOM 262 HA VAL A 18 -12.879 20.771 22.178 1.00 0.00 H
ATOM 263 HB VAL A 18 -11.351 22.660 22.081 1.00 0.00 H
ATOM 264 HG11 VAL A 18 -10.280 22.489 24.338 1.00 0.00 H
ATOM 265 HG12 VAL A 18 -11.959 21.901 24.324 1.00 0.00 H
ATOM 266 HG13 VAL A 18 -10.610 20.741 24.340 1.00 0.00 H
ATOM 267 HG21 VAL A 18 -8.884 22.422 22.223 1.00 0.00 H
ATOM 268 HG22 VAL A 18 -9.060 20.665 22.001 1.00 0.00 H
ATOM 269 HG23 VAL A 18 -9.558 21.780 20.707 1.00 0.00 H
ATOM 270 N GLN A 19 -12.537 21.709 19.751 1.00 27.89 N
ATOM 271 CA GLN A 19 -12.485 21.932 18.301 1.00 29.81 C
ATOM 272 C GLN A 19 -11.590 23.106 17.985 1.00 28.33 C
ATOM 273 O GLN A 19 -11.563 24.086 18.732 1.00 27.82 O
ATOM 274 CB GLN A 19 -13.860 22.090 17.682 1.00 31.24 C
ATOM 275 CG GLN A 19 -14.466 23.389 17.794 1.00 36.46 C
ATOM 276 CD GLN A 19 -15.892 23.396 17.248 1.00 40.56 C
ATOM 277 OE1 GLN A 19 -16.826 23.728 17.978 1.00 44.31 O
ATOM 278 NE2 GLN A 19 -16.063 23.014 15.986 1.00 39.69 N
ATOM 279 H GLN A 19 -13.071 22.328 20.344 1.00 0.00 H
ATOM 280 HA GLN A 19 -12.029 21.048 17.854 1.00 0.00 H
ATOM 281 HB3 GLN A 19 -14.532 21.343 18.104 1.00 0.00 H
ATOM 282 HB2 GLN A 19 -13.816 21.804 16.631 1.00 0.00 H
ATOM 283 HG3 GLN A 19 -13.865 24.118 17.249 1.00 0.00 H
ATOM 284 HG2 GLN A 19 -14.477 23.695 18.840 1.00 0.00 H
ATOM 285 HE22 GLN A 19 -16.989 23.003 15.583 1.00 0.00 H
ATOM 286 HE21 GLN A 19 -15.267 22.735 15.431 1.00 0.00 H
ATOM 287 N VAL A 20 -10.836 22.973 16.894 1.00 27.73 N
ATOM 288 CA VAL A 20 -9.876 23.959 16.459 1.00 27.50 C
ATOM 289 C VAL A 20 -10.297 24.298 15.037 1.00 28.34 C
ATOM 290 O VAL A 20 -10.510 23.406 14.227 1.00 27.15 O
ATOM 291 CB VAL A 20 -8.398 23.423 16.465 1.00 27.67 C
ATOM 292 CG1 VAL A 20 -7.426 24.597 16.026 1.00 27.39 C
ATOM 293 CG2 VAL A 20 -7.972 22.870 17.842 1.00 27.07 C
ATOM 294 H VAL A 20 -10.920 22.146 16.320 1.00 0.00 H
ATOM 295 HA VAL A 20 -9.949 24.847 17.087 1.00 0.00 H
ATOM 296 HB VAL A 20 -8.320 22.620 15.732 1.00 0.00 H
ATOM 297 HG11 VAL A 20 -6.397 24.237 16.026 1.00 0.00 H
ATOM 298 HG12 VAL A 20 -7.692 24.934 15.024 1.00 0.00 H
ATOM 299 HG13 VAL A 20 -7.520 25.428 16.725 1.00 0.00 H
ATOM 300 HG21 VAL A 20 -6.943 22.514 17.789 1.00 0.00 H
ATOM 301 HG22 VAL A 20 -8.044 23.660 18.589 1.00 0.00 H
ATOM 302 HG23 VAL A 20 -8.628 22.045 18.122 1.00 0.00 H
ATOM 303 N THR A 21 -10.446 25.585 14.757 1.00 29.18 N
ATOM 304 CA THR A 21 -10.881 26.033 13.433 1.00 30.50 C
ATOM 305 C THR A 21 -9.892 27.053 12.959 1.00 31.06 C
ATOM 306 O THR A 21 -9.527 27.970 13.705 1.00 30.95 O
ATOM 307 CB THR A 21 -12.331 26.622 13.453 1.00 30.84 C
ATOM 308 OG1 THR A 21 -13.253 25.588 13.834 1.00 31.06 O
ATOM 309 CG2 THR A 21 -12.742 27.156 12.062 1.00 28.32 C
ATOM 310 H THR A 21 -10.258 26.281 15.465 1.00 0.00 H
ATOM 311 HA THR A 21 -10.859 25.182 12.752 1.00 0.00 H
ATOM 312 HB THR A 21 -12.380 27.434 14.179 1.00 0.00 H
ATOM 313 HG1 THR A 21 -14.145 25.943 13.848 1.00 0.00 H
ATOM 314 HG21 THR A 21 -13.754 27.558 12.111 1.00 0.00 H
ATOM 315 HG22 THR A 21 -12.053 27.944 11.757 1.00 0.00 H
ATOM 316 HG23 THR A 21 -12.709 26.344 11.336 1.00 0.00 H
ATOM 317 N CYS A 22 -9.441 26.864 11.726 1.00 32.21 N
ATOM 318 CA CYS A 22 -8.649 27.837 11.017 1.00 34.13 C
ATOM 319 C CYS A 22 -9.350 28.062 9.697 1.00 33.22 C
ATOM 320 O CYS A 22 -9.452 27.127 8.883 1.00 32.81 O
ATOM 321 CB CYS A 22 -7.278 27.284 10.701 1.00 34.64 C
ATOM 322 SG CYS A 22 -6.045 27.760 11.833 1.00 42.52 S
ATOM 323 H CYS A 22 -9.649 26.004 11.238 1.00 0.00 H
ATOM 324 HA CYS A 22 -8.574 28.766 11.582 1.00 0.00 H
ATOM 325 HB3 CYS A 22 -6.986 27.593 9.697 1.00 0.00 H
ATOM 326 HB2 CYS A 22 -7.328 26.196 10.658 1.00 0.00 H
ATOM 327 HG CYS A 22 -4.876 27.224 11.470 1.00 0.00 H
ATOM 328 N GLY A 23 -9.853 29.276 9.503 1.00 33.52 N
ATOM 329 CA GLY A 23 -10.641 29.582 8.309 1.00 34.06 C
ATOM 330 C GLY A 23 -11.774 28.592 8.138 1.00 33.63 C
ATOM 331 O GLY A 23 -12.644 28.472 8.982 1.00 34.50 O
ATOM 332 H GLY A 23 -9.694 30.004 10.185 1.00 0.00 H
ATOM 333 HA3 GLY A 23 -9.996 29.551 7.431 1.00 0.00 H
ATOM 334 HA2 GLY A 23 -11.049 30.589 8.392 1.00 0.00 H
ATOM 335 N THR A 24 -11.729 27.844 7.054 1.00 34.31 N
ATOM 336 CA THR A 24 -12.777 26.884 6.734 1.00 34.07 C
ATOM 337 C THR A 24 -12.443 25.443 7.179 1.00 33.94 C
ATOM 338 O THR A 24 -13.178 24.492 6.859 1.00 34.57 O
ATOM 339 CB THR A 24 -13.063 26.900 5.204 1.00 33.65 C
ATOM 340 OG1 THR A 24 -11.949 26.339 4.498 1.00 33.51 O
ATOM 341 CG2 THR A 24 -13.328 28.327 4.682 1.00 34.94 C
ATOM 342 H THR A 24 -10.951 27.927 6.415 1.00 0.00 H
ATOM 343 HA THR A 24 -13.686 27.193 7.250 1.00 0.00 H
ATOM 344 HB THR A 24 -13.944 26.288 5.008 1.00 0.00 H
ATOM 345 HG1 THR A 24 -12.129 26.350 3.555 1.00 0.00 H
ATOM 346 HG21 THR A 24 -13.523 28.292 3.610 1.00 0.00 H
ATOM 347 HG22 THR A 24 -14.193 28.747 5.195 1.00 0.00 H
ATOM 348 HG23 THR A 24 -12.455 28.952 4.872 1.00 0.00 H
ATOM 349 N THR A 25 -11.324 25.254 7.886 1.00 33.40 N
ATOM 350 CA THR A 25 -10.916 23.900 8.289 1.00 33.03 C
ATOM 351 C THR A 25 -11.166 23.765 9.771 1.00 31.65 C
ATOM 352 O THR A 25 -10.657 24.577 10.539 1.00 31.44 O
ATOM 353 CB THR A 25 -9.416 23.633 7.998 1.00 33.24 C
ATOM 354 OG1 THR A 25 -9.220 23.612 6.581 1.00 36.71 O
ATOM 355 CG2 THR A 25 -8.944 22.274 8.582 1.00 34.18 C
ATOM 356 H THR A 25 -10.752 26.044 8.147 1.00 0.00 H
ATOM 357 HA THR A 25 -11.522 23.168 7.754 1.00 0.00 H
ATOM 358 HB THR A 25 -8.819 24.436 8.430 1.00 0.00 H
ATOM 359 HG1 THR A 25 -8.294 23.447 6.388 1.00 0.00 H
ATOM 360 HG21 THR A 25 -7.888 22.128 8.355 1.00 0.00 H
ATOM 361 HG22 THR A 25 -9.086 22.273 9.663 1.00 0.00 H
ATOM 362 HG23 THR A 25 -9.526 21.466 8.139 1.00 0.00 H
ATOM 363 N THR A 26 -11.962 22.774 10.159 1.00 31.44 N
ATOM 364 CA THR A 26 -12.182 22.457 11.580 1.00 30.83 C
ATOM 365 C THR A 26 -11.716 21.038 11.836 1.00 30.04 C
ATOM 366 O THR A 26 -11.950 20.142 11.030 1.00 29.89 O
ATOM 367 CB THR A 26 -13.656 22.620 12.001 1.00 31.47 C
ATOM 368 OG1 THR A 26 -14.039 23.987 11.846 1.00 32.69 O
ATOM 369 CG2 THR A 26 -13.859 22.230 13.459 1.00 32.40 C
ATOM 370 H THR A 26 -12.439 22.210 9.470 1.00 0.00 H
ATOM 371 HA THR A 26 -11.575 23.133 12.182 1.00 0.00 H
ATOM 372 HB THR A 26 -14.285 21.994 11.368 1.00 0.00 H
ATOM 373 HG1 THR A 26 -14.957 24.094 12.107 1.00 0.00 H
ATOM 374 HG21 THR A 26 -14.908 22.355 13.727 1.00 0.00 H
ATOM 375 HG22 THR A 26 -13.571 21.188 13.601 1.00 0.00 H
ATOM 376 HG23 THR A 26 -13.244 22.867 14.095 1.00 0.00 H
ATOM 377 N LEU A 27 -10.981 20.845 12.932 1.00 27.92 N
ATOM 378 CA LEU A 27 -10.640 19.497 13.323 1.00 27.31 C
ATOM 379 C LEU A 27 -10.636 19.483 14.825 1.00 26.27 C
ATOM 380 O LEU A 27 -11.103 20.445 15.458 1.00 27.13 O
ATOM 381 CB LEU A 27 -9.298 19.049 12.714 1.00 27.71 C
ATOM 382 CG LEU A 27 -8.078 19.953 12.572 1.00 29.75 C
ATOM 383 CD1 LEU A 27 -7.478 20.335 13.945 1.00 29.37 C
ATOM 384 CD2 LEU A 27 -7.085 19.146 11.741 1.00 27.21 C
ATOM 385 H LEU A 27 -10.670 21.636 13.477 1.00 0.00 H
ATOM 386 HA LEU A 27 -11.423 18.825 12.971 1.00 0.00 H
ATOM 387 HB3 LEU A 27 -9.495 18.581 11.749 1.00 0.00 H
ATOM 388 HB2 LEU A 27 -8.988 18.125 13.203 1.00 0.00 H
ATOM 389 HG LEU A 27 -8.356 20.858 12.031 1.00 0.00 H
ATOM 390 HD11 LEU A 27 -6.611 20.979 13.797 1.00 0.00 H
ATOM 391 HD12 LEU A 27 -8.227 20.864 14.535 1.00 0.00 H
ATOM 392 HD13 LEU A 27 -7.172 19.431 14.473 1.00 0.00 H
ATOM 393 HD21 LEU A 27 -6.176 19.729 11.593 1.00 0.00 H
ATOM 394 HD22 LEU A 27 -6.842 18.220 12.263 1.00 0.00 H
ATOM 395 HD23 LEU A 27 -7.527 18.911 10.773 1.00 0.00 H
ATOM 396 N ASN A 28 -10.167 18.387 15.402 1.00 25.61 N
ATOM 397 CA ASN A 28 -10.131 18.260 16.868 1.00 24.75 C
ATOM 398 C ASN A 28 -8.769 18.617 17.451 1.00 25.75 C
ATOM 399 O ASN A 28 -7.711 18.435 16.780 1.00 25.39 O
ATOM 400 CB ASN A 28 -10.508 16.783 17.201 1.00 23.91 C
ATOM 401 CG ASN A 28 -11.837 16.379 16.560 1.00 23.64 C
ATOM 402 OD1 ASN A 28 -12.893 16.793 17.027 1.00 23.91 O
ATOM 403 ND2 ASN A 28 -11.802 15.559 15.501 1.00 21.77 N
ATOM 404 H ASN A 28 -9.828 17.623 14.835 1.00 0.00 H
ATOM 405 HA ASN A 28 -10.883 18.922 17.298 1.00 0.00 H
ATOM 406 HB3 ASN A 28 -10.575 16.661 18.282 1.00 0.00 H
ATOM 407 HB2 ASN A 28 -9.719 16.119 16.849 1.00 0.00 H
ATOM 408 HD22 ASN A 28 -12.662 15.273 15.055 1.00 0.00 H
ATOM 409 HD21 ASN A 28 -10.916 15.227 15.149 1.00 0.00 H
ATOM 410 N GLY A 29 -8.761 19.080 18.698 1.00 23.95 N
ATOM 411 CA GLY A 29 -7.495 19.294 19.448 1.00 24.22 C
ATOM 412 C GLY A 29 -7.587 18.629 20.840 1.00 24.58 C
ATOM 413 O GLY A 29 -8.682 18.277 21.299 1.00 27.15 O
ATOM 414 H GLY A 29 -9.632 19.297 19.162 1.00 0.00 H
ATOM 415 HA3 GLY A 29 -7.320 20.363 19.567 1.00 0.00 H
ATOM 416 HA2 GLY A 29 -6.665 18.858 18.892 1.00 0.00 H
ATOM 417 N LEU A 30 -6.430 18.410 21.456 1.00 25.92 N
ATOM 418 CA LEU A 30 -6.359 17.785 22.759 1.00 25.36 C
ATOM 419 C LEU A 30 -5.865 18.876 23.706 1.00 25.13 C
ATOM 420 O LEU A 30 -4.738 19.395 23.581 1.00 23.70 O
ATOM 421 CB LEU A 30 -5.349 16.614 22.719 1.00 25.15 C
ATOM 422 CG LEU A 30 -5.189 15.819 24.017 1.00 25.97 C
ATOM 423 CD1 LEU A 30 -6.472 15.019 24.347 1.00 24.60 C
ATOM 424 CD2 LEU A 30 -3.949 14.907 23.898 1.00 25.14 C
ATOM 425 H LEU A 30 -5.563 18.682 21.015 1.00 0.00 H
ATOM 426 HA LEU A 30 -7.343 17.430 23.066 1.00 0.00 H
ATOM 427 HB3 LEU A 30 -4.375 16.990 22.405 1.00 0.00 H
ATOM 428 HB2 LEU A 30 -5.619 15.933 21.912 1.00 0.00 H
ATOM 429 HG LEU A 30 -5.013 16.526 24.828 1.00 0.00 H
ATOM 430 HD11 LEU A 30 -6.327 14.465 25.274 1.00 0.00 H
ATOM 431 HD12 LEU A 30 -7.310 15.707 24.462 1.00 0.00 H
ATOM 432 HD13 LEU A 30 -6.684 14.321 23.537 1.00 0.00 H
ATOM 433 HD21 LEU A 30 -3.827 14.337 24.819 1.00 0.00 H
ATOM 434 HD22 LEU A 30 -4.081 14.221 23.061 1.00 0.00 H
ATOM 435 HD23 LEU A 30 -3.062 15.518 23.730 1.00 0.00 H
ATOM 436 N TRP A 31 -6.685 19.156 24.705 1.00 24.32 N
ATOM 437 CA TRP A 31 -6.411 20.275 25.614 1.00 23.62 C
ATOM 438 C TRP A 31 -5.921 19.679 26.934 1.00 23.86 C
ATOM 439 O TRP A 31 -6.690 19.004 27.643 1.00 25.17 O
ATOM 440 CB TRP A 31 -7.724 21.056 25.797 1.00 23.62 C
ATOM 441 CG TRP A 31 -7.671 22.268 26.752 1.00 25.10 C
ATOM 442 CD1 TRP A 31 -6.593 23.027 27.104 1.00 24.50 C
ATOM 443 CD2 TRP A 31 -8.799 22.837 27.404 1.00 24.41 C
ATOM 444 NE1 TRP A 31 -6.980 24.023 27.987 1.00 23.01 N
ATOM 445 CE2 TRP A 31 -8.337 23.939 28.175 1.00 23.11 C
ATOM 446 CE3 TRP A 31 -10.154 22.512 27.421 1.00 23.59 C
ATOM 447 CZ2 TRP A 31 -9.195 24.736 28.924 1.00 21.70 C
ATOM 448 CZ3 TRP A 31 -11.032 23.314 28.154 1.00 25.03 C
ATOM 449 CH2 TRP A 31 -10.553 24.401 28.916 1.00 23.68 C
ATOM 450 H TRP A 31 -7.513 18.596 24.851 1.00 0.00 H
ATOM 451 HA TRP A 31 -5.645 20.924 25.189 1.00 0.00 H
ATOM 452 HB3 TRP A 31 -8.506 20.372 26.128 1.00 0.00 H
ATOM 453 HB2 TRP A 31 -8.087 21.382 24.822 1.00 0.00 H
ATOM 454 HD1 TRP A 31 -5.618 22.802 26.697 1.00 0.00 H
ATOM 455 HE1 TRP A 31 -6.291 24.654 28.370 1.00 0.00 H
ATOM 456 HE3 TRP A 31 -10.510 21.652 26.873 1.00 0.00 H
ATOM 457 HZ2 TRP A 31 -8.804 25.575 29.481 1.00 0.00 H
ATOM 458 HZ3 TRP A 31 -12.092 23.105 28.142 1.00 0.00 H
ATOM 459 HH2 TRP A 31 -11.255 24.978 29.500 1.00 0.00 H
ATOM 460 N LEU A 32 -4.639 19.859 27.230 1.00 24.13 N
ATOM 461 CA LEU A 32 -4.050 19.428 28.487 1.00 23.54 C
ATOM 462 C LEU A 32 -3.364 20.603 29.116 1.00 23.46 C
ATOM 463 O LEU A 32 -2.559 21.297 28.462 1.00 23.15 O
ATOM 464 CB LEU A 32 -3.031 18.274 28.262 1.00 24.58 C
ATOM 465 CG LEU A 32 -3.597 17.020 27.563 1.00 25.17 C
ATOM 466 CD1 LEU A 32 -2.471 16.139 26.936 1.00 25.18 C
ATOM 467 CD2 LEU A 32 -4.497 16.208 28.546 1.00 24.88 C
ATOM 468 H LEU A 32 -4.027 20.313 26.568 1.00 0.00 H
ATOM 469 HA LEU A 32 -4.842 19.080 29.151 1.00 0.00 H
ATOM 470 HB3 LEU A 32 -2.595 17.987 29.219 1.00 0.00 H
ATOM 471 HB2 LEU A 32 -2.180 18.650 27.694 1.00 0.00 H
ATOM 472 HG LEU A 32 -4.234 17.362 26.747 1.00 0.00 H
ATOM 473 HD11 LEU A 32 -2.916 15.268 26.455 1.00 0.00 H
ATOM 474 HD12 LEU A 32 -1.923 16.722 26.196 1.00 0.00 H
ATOM 475 HD13 LEU A 32 -1.787 15.811 27.719 1.00 0.00 H
ATOM 476 HD21 LEU A 32 -4.888 15.327 28.038 1.00 0.00 H
ATOM 477 HD22 LEU A 32 -3.906 15.897 29.408 1.00 0.00 H
ATOM 478 HD23 LEU A 32 -5.326 16.832 28.880 1.00 0.00 H
ATOM 479 N ASP A 33 -3.693 20.852 30.378 1.00 21.79 N
ATOM 480 CA ASP A 33 -3.189 22.045 31.062 1.00 21.63 C
ATOM 481 C ASP A 33 -3.458 23.253 30.152 1.00 23.03 C
ATOM 482 O ASP A 33 -4.573 23.377 29.675 1.00 21.17 O
ATOM 483 CB ASP A 33 -1.743 21.870 31.507 1.00 23.86 C
ATOM 484 CG ASP A 33 -1.634 20.883 32.646 1.00 26.53 C
ATOM 485 OD1 ASP A 33 -2.346 21.065 33.619 1.00 29.60 O
ATOM 486 OD2 ASP A 33 -0.873 19.936 32.562 1.00 32.64 O1-
ATOM 487 H ASP A 33 -4.297 20.215 30.877 1.00 0.00 H
ATOM 488 HA ASP A 33 -3.789 22.179 31.962 1.00 0.00 H
ATOM 489 HB3 ASP A 33 -1.341 22.833 31.822 1.00 0.00 H
ATOM 490 HB2 ASP A 33 -1.144 21.521 30.666 1.00 0.00 H
ATOM 491 N ASP A 34 -2.481 24.130 29.873 1.00 21.27 N
ATOM 492 CA ASP A 34 -2.867 25.302 29.044 1.00 22.83 C
ATOM 493 C ASP A 34 -2.372 25.198 27.604 1.00 23.74 C
ATOM 494 O ASP A 34 -2.104 26.234 26.983 1.00 24.33 O
ATOM 495 CB ASP A 34 -2.370 26.607 29.684 1.00 23.38 C
ATOM 496 CG ASP A 34 -0.842 26.668 29.812 1.00 26.42 C
ATOM 497 OD1 ASP A 34 -0.302 27.782 30.094 1.00 30.19 O
ATOM 498 OD2 ASP A 34 -0.193 25.618 29.704 1.00 29.14 O1-
ATOM 499 H ASP A 34 -1.546 23.973 30.222 1.00 0.00 H
ATOM 500 HA ASP A 34 -3.956 25.342 29.016 1.00 0.00 H
ATOM 501 HB3 ASP A 34 -2.821 26.721 30.670 1.00 0.00 H
ATOM 502 HB2 ASP A 34 -2.718 27.455 29.094 1.00 0.00 H
ATOM 503 N VAL A 35 -2.290 23.976 27.077 1.00 22.21 N
ATOM 504 CA VAL A 35 -1.811 23.730 25.704 1.00 23.48 C
ATOM 505 C VAL A 35 -2.899 22.928 24.980 1.00 23.13 C
ATOM 506 O VAL A 35 -3.498 22.004 25.546 1.00 23.26 O
ATOM 507 CB VAL A 35 -0.471 22.970 25.709 1.00 0.00 C
ATOM 508 CG1 VAL A 35 0.314 23.335 24.448 1.00 0.00 C
ATOM 509 CG2 VAL A 35 0.382 23.306 26.940 1.00 0.00 C
ATOM 510 HB VAL A 35 -0.662 21.897 25.738 1.00 0.00 H
ATOM 511 HG11 VAL A 35 1.264 22.801 24.443 1.00 0.00 H
ATOM 512 HG12 VAL A 35 -0.264 23.056 23.566 1.00 0.00 H
ATOM 513 HG13 VAL A 35 0.501 24.409 24.433 1.00 0.00 H
ATOM 514 HG21 VAL A 35 1.317 22.746 26.898 1.00 0.00 H
ATOM 515 HG22 VAL A 35 0.600 24.374 26.951 1.00 0.00 H
ATOM 516 HG23 VAL A 35 -0.162 23.037 27.845 1.00 0.00 H
ATOM 517 H VAL A 35 -2.562 23.171 27.623 1.00 0.00 H
ATOM 518 HA VAL A 35 -1.676 24.686 25.197 1.00 0.00 H
ATOM 519 N VAL A 36 -3.203 23.327 23.754 1.00 22.50 N
ATOM 520 CA VAL A 36 -3.997 22.503 22.878 1.00 23.77 C
ATOM 521 C VAL A 36 -3.112 21.961 21.725 1.00 24.41 C
ATOM 522 O VAL A 36 -2.428 22.753 21.046 1.00 25.32 O
ATOM 523 CB VAL A 36 -5.133 23.316 22.283 1.00 22.36 C
ATOM 524 CG1 VAL A 36 -5.912 22.514 21.281 1.00 24.55 C
ATOM 525 CG2 VAL A 36 -6.113 23.874 23.401 1.00 24.66 C
ATOM 526 H VAL A 36 -2.877 24.222 23.419 1.00 0.00 H
ATOM 527 HA VAL A 36 -4.408 21.666 23.443 1.00 0.00 H
ATOM 528 HB VAL A 36 -4.698 24.169 21.763 1.00 0.00 H
ATOM 529 HG11 VAL A 36 -6.718 23.125 20.874 1.00 0.00 H
ATOM 530 HG12 VAL A 36 -5.251 22.200 20.473 1.00 0.00 H
ATOM 531 HG13 VAL A 36 -6.334 21.634 21.768 1.00 0.00 H
ATOM 532 HG21 VAL A 36 -6.911 24.449 22.931 1.00 0.00 H
ATOM 533 HG22 VAL A 36 -6.545 23.041 23.955 1.00 0.00 H
ATOM 534 HG23 VAL A 36 -5.557 24.515 24.085 1.00 0.00 H
ATOM 535 N TYR A 37 -3.086 20.640 21.575 1.00 24.88 N
ATOM 536 CA TYR A 37 -2.345 19.954 20.520 1.00 25.43 C
ATOM 537 C TYR A 37 -3.295 19.589 19.398 1.00 25.18 C
ATOM 538 O TYR A 37 -4.386 19.037 19.645 1.00 24.88 O
ATOM 539 CB TYR A 37 -1.736 18.655 21.038 1.00 25.99 C
ATOM 540 CG TYR A 37 -0.872 18.852 22.245 1.00 29.23 C
ATOM 541 CD1 TYR A 37 0.511 18.984 22.115 1.00 29.64 C
ATOM 542 CD2 TYR A 37 -1.429 18.947 23.517 1.00 27.32 C
ATOM 543 CE1 TYR A 37 1.313 19.171 23.219 1.00 29.50 C
ATOM 544 CE2 TYR A 37 -0.623 19.133 24.641 1.00 27.89 C
ATOM 545 CZ TYR A 37 0.754 19.228 24.472 1.00 29.77 C
ATOM 546 OH TYR A 37 1.594 19.440 25.552 1.00 31.19 O
ATOM 547 H TYR A 37 -3.599 20.049 22.213 1.00 0.00 H
ATOM 548 HA TYR A 37 -1.558 20.605 20.140 1.00 0.00 H
ATOM 549 HB3 TYR A 37 -1.150 18.189 20.246 1.00 0.00 H
ATOM 550 HB2 TYR A 37 -2.533 17.950 21.275 1.00 0.00 H
ATOM 551 HD1 TYR A 37 0.968 18.940 21.138 1.00 0.00 H
ATOM 552 HD2 TYR A 37 -2.499 18.877 23.645 1.00 0.00 H
ATOM 553 HE1 TYR A 37 2.382 19.273 23.099 1.00 0.00 H
ATOM 554 HE2 TYR A 37 -1.071 19.201 25.621 1.00 0.00 H
ATOM 555 HH TYR A 37 1.078 19.458 26.361 1.00 0.00 H
ATOM 556 N CYS A 38 -2.883 19.894 18.161 1.00 25.79 N
ATOM 557 CA CYS A 38 -3.650 19.435 17.007 1.00 25.60 C
ATOM 558 C CYS A 38 -2.752 19.219 15.782 1.00 25.39 C
ATOM 559 O CYS A 38 -1.586 19.615 15.782 1.00 24.90 O
ATOM 560 CB CYS A 38 -4.795 20.390 16.676 1.00 25.97 C
ATOM 561 SG CYS A 38 -4.224 21.990 15.973 1.00 28.78 S
ATOM 562 H CYS A 38 -2.044 20.440 18.029 1.00 0.00 H
ATOM 563 HA CYS A 38 -4.090 18.472 17.266 1.00 0.00 H
ATOM 564 HB3 CYS A 38 -5.381 20.578 17.576 1.00 0.00 H
ATOM 565 HB2 CYS A 38 -5.476 19.909 15.974 1.00 0.00 H
ATOM 566 HG CYS A 38 -5.281 22.765 15.712 1.00 0.00 H
ATOM 567 N PRO A 39 -3.272 18.516 14.768 1.00 25.85 N
ATOM 568 CA PRO A 39 -2.453 18.337 13.565 1.00 25.87 C
ATOM 569 C PRO A 39 -2.106 19.698 12.925 1.00 26.37 C
ATOM 570 O PRO A 39 -2.960 20.606 12.804 1.00 26.07 O
ATOM 571 CB PRO A 39 -3.365 17.496 12.651 1.00 26.25 C
ATOM 572 CG PRO A 39 -4.294 16.758 13.632 1.00 24.62 C
ATOM 573 CD PRO A 39 -4.584 17.830 14.659 1.00 24.99 C
ATOM 574 HA PRO A 39 -1.543 17.787 13.804 1.00 0.00 H
ATOM 575 HB3 PRO A 39 -2.761 16.768 12.110 1.00 0.00 H
ATOM 576 HB2 PRO A 39 -3.958 18.161 12.024 1.00 0.00 H
ATOM 577 HG3 PRO A 39 -3.742 15.947 14.107 1.00 0.00 H
ATOM 578 HG2 PRO A 39 -5.219 16.493 13.119 1.00 0.00 H
ATOM 579 HD2 PRO A 39 -5.319 18.525 14.254 1.00 0.00 H
ATOM 580 HD3 PRO A 39 -4.822 17.358 15.612 1.00 0.00 H
ATOM 581 N ARG A 40 -0.852 19.852 12.522 1.00 26.85 N
ATOM 582 CA ARG A 40 -0.464 21.092 11.877 1.00 28.48 C
ATOM 583 C ARG A 40 -1.218 21.355 10.553 1.00 29.59 C
ATOM 584 O ARG A 40 -1.318 22.513 10.118 1.00 29.56 O
ATOM 585 CB ARG A 40 1.048 21.152 11.671 1.00 27.81 C
ATOM 586 CG ARG A 40 1.566 20.229 10.615 1.00 27.96 C
ATOM 587 CD ARG A 40 2.992 20.507 10.408 1.00 28.09 C
ATOM 588 NE ARG A 40 3.582 19.501 9.532 1.00 28.89 N
ATOM 589 CZ ARG A 40 4.826 19.571 9.075 1.00 29.05 C
ATOM 590 NH1 ARG A 40 5.591 20.623 9.407 1.00 24.95 N
ATOM 591 NH2 ARG A 40 5.288 18.605 8.284 1.00 26.78 N1+
ATOM 592 H ARG A 40 -0.181 19.111 12.666 1.00 0.00 H
ATOM 593 HA ARG A 40 -0.725 21.901 12.559 1.00 0.00 H
ATOM 594 HB3 ARG A 40 1.550 20.939 12.615 1.00 0.00 H
ATOM 595 HB2 ARG A 40 1.339 22.175 11.431 1.00 0.00 H
ATOM 596 HG3 ARG A 40 1.024 20.401 9.685 1.00 0.00 H
ATOM 597 HG2 ARG A 40 1.441 19.197 10.942 1.00 0.00 H
ATOM 598 HD3 ARG A 40 3.507 20.499 11.369 1.00 0.00 H
ATOM 599 HD2 ARG A 40 3.108 21.493 9.958 1.00 0.00 H
ATOM 600 HE ARG A 40 2.993 18.722 9.275 1.00 0.00 H
ATOM 601 HH12 ARG A 40 6.539 20.686 9.065 1.00 0.00 H
ATOM 602 HH11 ARG A 40 5.218 21.351 9.999 1.00 0.00 H
ATOM 603 HH22 ARG A 40 6.233 18.650 7.931 1.00 0.00 H
ATOM 604 HH21 ARG A 40 4.693 17.827 8.036 1.00 0.00 H
ATOM 605 N HIS A 41 -1.783 20.311 9.932 1.00 29.75 N
ATOM 606 CA HIS A 41 -2.528 20.537 8.691 1.00 30.81 C
ATOM 607 C HIS A 41 -3.829 21.337 8.832 1.00 32.28 C
ATOM 608 O HIS A 41 -4.474 21.643 7.815 1.00 34.36 O
ATOM 609 CB HIS A 41 -2.707 19.250 7.846 1.00 31.92 C
ATOM 610 CG HIS A 41 -3.758 18.294 8.359 1.00 30.78 C
ATOM 611 ND1 HIS A 41 -3.459 17.013 8.793 1.00 37.21 N
ATOM 612 CD2 HIS A 41 -5.107 18.393 8.396 1.00 33.13 C
ATOM 613 CE1 HIS A 41 -4.577 16.386 9.124 1.00 32.09 C
ATOM 614 NE2 HIS A 41 -5.591 17.207 8.896 1.00 36.86 N
ATOM 615 H HIS A 41 -1.692 19.383 10.320 1.00 0.00 H
ATOM 616 HA HIS A 41 -1.877 21.173 8.091 1.00 0.00 H
ATOM 617 HB3 HIS A 41 -1.752 18.730 7.773 1.00 0.00 H
ATOM 618 HB2 HIS A 41 -2.940 19.524 6.817 1.00 0.00 H
ATOM 619 HD1 HIS A 41 -2.499 16.699 8.816 1.00 0.00 H
ATOM 620 HD2 HIS A 41 -5.591 19.299 8.062 1.00 0.00 H
ATOM 621 HE1 HIS A 41 -4.537 15.376 9.505 1.00 0.00 H
ATOM 622 N VAL A 42 -4.197 21.709 10.063 1.00 31.13 N
ATOM 623 CA VAL A 42 -5.358 22.582 10.276 1.00 31.39 C
ATOM 624 C VAL A 42 -5.181 23.932 9.561 1.00 32.19 C
ATOM 625 O VAL A 42 -6.168 24.610 9.259 1.00 33.33 O
ATOM 626 CB VAL A 42 -5.716 22.765 11.770 1.00 30.60 C
ATOM 627 CG1 VAL A 42 -4.622 23.554 12.519 1.00 31.18 C
ATOM 628 CG2 VAL A 42 -7.103 23.462 11.917 1.00 30.27 C
ATOM 629 H VAL A 42 -3.673 21.389 10.865 1.00 0.00 H
ATOM 630 HA VAL A 42 -6.210 22.089 9.808 1.00 0.00 H
ATOM 631 HB VAL A 42 -5.787 21.776 12.223 1.00 0.00 H
ATOM 632 HG11 VAL A 42 -4.905 23.664 13.566 1.00 0.00 H
ATOM 633 HG12 VAL A 42 -3.676 23.016 12.454 1.00 0.00 H
ATOM 634 HG13 VAL A 42 -4.511 24.540 12.067 1.00 0.00 H
ATOM 635 HG21 VAL A 42 -7.339 23.583 12.974 1.00 0.00 H
ATOM 636 HG22 VAL A 42 -7.071 24.441 11.438 1.00 0.00 H
ATOM 637 HG23 VAL A 42 -7.870 22.850 11.442 1.00 0.00 H
ATOM 638 N ILE A 43 -3.931 24.320 9.318 1.00 32.73 N
ATOM 639 CA ILE A 43 -3.618 25.605 8.698 1.00 34.33 C
ATOM 640 C ILE A 43 -3.559 25.505 7.181 1.00 35.37 C
ATOM 641 O ILE A 43 -3.201 26.473 6.514 1.00 35.11 O
ATOM 642 CB ILE A 43 -2.255 26.207 9.203 1.00 34.63 C
ATOM 643 CG1 ILE A 43 -1.057 25.407 8.645 1.00 34.45 C
ATOM 644 CG2 ILE A 43 -2.253 26.315 10.748 1.00 35.20 C
ATOM 645 CD1 ILE A 43 0.330 25.781 9.234 1.00 34.25 C
ATOM 646 H ILE A 43 -3.158 23.718 9.564 1.00 0.00 H
ATOM 647 HA ILE A 43 -4.412 26.306 8.958 1.00 0.00 H
ATOM 648 HB ILE A 43 -2.181 27.220 8.807 1.00 0.00 H
ATOM 649 HG13 ILE A 43 -1.028 25.512 7.560 1.00 0.00 H
ATOM 650 HG12 ILE A 43 -1.235 24.342 8.792 1.00 0.00 H
ATOM 651 HG21 ILE A 43 -1.304 26.733 11.082 1.00 0.00 H
ATOM 652 HG22 ILE A 43 -3.068 26.964 11.068 1.00 0.00 H
ATOM 653 HG23 ILE A 43 -2.386 25.324 11.182 1.00 0.00 H
ATOM 654 HD11 ILE A 43 1.100 25.161 8.775 1.00 0.00 H
ATOM 655 HD12 ILE A 43 0.541 26.831 9.030 1.00 0.00 H
ATOM 656 HD13 ILE A 43 0.325 25.614 10.311 1.00 0.00 H
ATOM 657 N CYS A 44 -3.892 24.340 6.639 1.00 36.70 N
ATOM 658 CA CYS A 44 -3.829 24.110 5.186 1.00 37.60 C
ATOM 659 C CYS A 44 -5.281 24.196 4.490 1.00 39.09 C
ATOM 660 O CYS A 44 -6.124 25.078 4.709 1.00 41.22 O
ATOM 661 CB CYS A 44 -3.299 22.724 4.900 1.00 36.83 C
ATOM 662 SG CYS A 44 -1.555 22.617 5.079 1.00 37.93 S
ATOM 663 H CYS A 44 -4.200 23.579 7.227 1.00 0.00 H
ATOM 664 HA CYS A 44 -3.171 24.850 4.731 1.00 0.00 H
ATOM 665 HB3 CYS A 44 -3.578 22.431 3.888 1.00 0.00 H
ATOM 666 HB2 CYS A 44 -3.776 22.008 5.569 1.00 0.00 H
ATOM 667 HG CYS A 44 -1.155 21.370 4.813 1.00 0.00 H
ATOM 668 N THR A 45 -5.511 23.215 3.603 1.00 45.49 N
ATOM 669 CA THR A 45 -6.560 22.535 2.860 1.00 46.48 C
ATOM 670 C THR A 45 -7.077 21.377 3.788 1.00 46.57 C
ATOM 671 O THR A 45 -7.170 21.607 4.994 1.00 47.48 O
ATOM 672 CB THR A 45 -5.820 22.000 1.556 1.00 0.00 C
ATOM 673 OG1 THR A 45 -4.561 21.432 1.865 1.00 0.00 O
ATOM 674 CG2 THR A 45 -5.458 23.001 0.441 1.00 0.00 C
ATOM 675 HB THR A 45 -6.393 21.214 1.084 1.00 0.00 H
ATOM 676 HG1 THR A 45 -4.626 20.803 2.575 1.00 0.00 H
ATOM 677 HG21 THR A 45 -4.920 22.486 -0.369 1.00 0.00 H
ATOM 678 HG22 THR A 45 -6.311 23.462 -0.045 1.00 0.00 H
ATOM 679 HG23 THR A 45 -4.808 23.806 0.777 1.00 0.00 H
ATOM 680 H THR A 45 -4.681 22.631 3.603 1.00 0.00 H
ATOM 681 HA THR A 45 -7.366 23.215 2.587 1.00 0.00 H
ATOM 682 N SER A 46 -7.427 20.191 3.264 1.00 46.56 N
ATOM 683 CA SER A 46 -8.208 19.172 3.964 1.00 46.60 C
ATOM 684 C SER A 46 -7.355 18.395 4.981 1.00 45.94 C
ATOM 685 O SER A 46 -7.682 18.319 6.153 1.00 45.45 O
ATOM 686 CB SER A 46 -8.813 18.226 2.913 1.00 0.00 C
ATOM 687 OG SER A 46 -8.034 18.259 1.723 1.00 0.00 O
ATOM 688 HB2 SER A 46 -8.900 17.209 3.267 1.00 0.00 H
ATOM 689 HB3 SER A 46 -9.822 18.472 2.633 1.00 0.00 H
ATOM 690 HG SER A 46 -7.533 17.436 1.744 1.00 0.00 H
ATOM 691 H SER A 46 -7.332 19.964 2.275 1.00 0.00 H
ATOM 692 HA SER A 46 -9.024 19.682 4.447 1.00 0.00 H
ATOM 693 N GLU A 47 -6.307 17.732 4.507 1.00 45.12 N
ATOM 694 CA GLU A 47 -5.261 16.937 5.175 1.00 45.15 C
ATOM 695 C GLU A 47 -3.895 17.647 5.085 1.00 44.68 C
ATOM 696 O GLU A 47 -2.900 17.080 5.547 1.00 44.85 O
ATOM 697 CB GLU A 47 -5.034 15.667 4.360 1.00 0.00 C
ATOM 698 CG GLU A 47 -6.222 14.676 4.324 1.00 0.00 C
ATOM 699 CD GLU A 47 -7.201 14.875 3.173 1.00 0.00 C
ATOM 700 OE1 GLU A 47 -7.135 15.938 2.525 1.00 0.00 O
ATOM 701 OE2 GLU A 47 -7.772 13.839 2.759 1.00 0.00 O1-
ATOM 702 HB2 GLU A 47 -4.833 16.041 3.379 1.00 0.00 H
ATOM 703 HB3 GLU A 47 -4.055 15.207 4.586 1.00 0.00 H
ATOM 704 HG2 GLU A 47 -5.855 13.661 4.320 1.00 0.00 H
ATOM 705 HG3 GLU A 47 -6.833 14.735 5.214 1.00 0.00 H
ATOM 706 H GLU A 47 -6.367 17.514 3.518 1.00 0.00 H
ATOM 707 HA GLU A 47 -5.431 16.692 6.204 1.00 0.00 H
ATOM 708 N ASP A 48 -3.880 18.794 4.391 1.00 43.43 N
ATOM 709 CA ASP A 48 -2.846 19.696 4.062 1.00 42.93 C
ATOM 710 C ASP A 48 -2.062 19.346 2.869 1.00 42.14 C
ATOM 711 O ASP A 48 -1.159 18.514 2.958 1.00 42.83 O
ATOM 712 CB ASP A 48 -1.731 19.817 4.981 1.00 0.00 C
ATOM 713 CG ASP A 48 -1.520 20.623 6.368 1.00 0.00 C
ATOM 714 OD1 ASP A 48 -0.574 20.071 7.861 1.00 0.00 O
ATOM 715 OD2 ASP A 48 -2.553 21.165 6.474 1.00 0.00 O1-
ATOM 716 HB2 ASP A 48 -1.452 18.780 5.171 1.00 0.00 H
ATOM 717 HB3 ASP A 48 -0.874 20.319 4.479 1.00 0.00 H
ATOM 718 H ASP A 48 -4.771 19.142 4.154 1.00 0.00 H
ATOM 719 HA ASP A 48 -3.379 20.542 3.769 1.00 0.00 H
ATOM 720 N MET A 49 -2.259 19.955 1.715 1.00 42.35 N
ATOM 721 CA MET A 49 -1.697 19.228 0.631 1.00 41.75 C
ATOM 722 C MET A 49 -1.023 20.124 -0.393 1.00 41.87 C
ATOM 723 O MET A 49 -0.333 21.076 -0.068 1.00 42.26 O
ATOM 724 CB MET A 49 -2.521 17.899 0.385 1.00 0.00 C
ATOM 725 CG MET A 49 -2.902 16.875 1.573 1.00 0.00 C
ATOM 726 SD MET A 49 -3.053 14.990 1.722 1.00 0.00 S
ATOM 727 CE MET A 49 -4.777 14.493 1.404 1.00 0.00 C
ATOM 728 HB2 MET A 49 -3.341 18.042 -0.337 1.00 0.00 H
ATOM 729 HB3 MET A 49 -1.633 17.501 0.054 1.00 0.00 H
ATOM 730 HG2 MET A 49 -1.933 16.738 2.072 1.00 0.00 H
ATOM 731 HG3 MET A 49 -3.620 17.383 2.169 1.00 0.00 H
ATOM 732 HE1 MET A 49 -4.989 13.641 0.807 1.00 0.00 H
ATOM 733 HE2 MET A 49 -5.117 14.012 2.288 1.00 0.00 H
ATOM 734 HE3 MET A 49 -5.328 15.362 1.055 1.00 0.00 H
ATOM 735 H MET A 49 -2.796 20.818 1.567 1.00 0.00 H
ATOM 736 HA MET A 49 -0.690 18.934 0.912 1.00 0.00 H
ATOM 737 N LEU A 50 -0.991 19.696 -1.620 1.00 48.17 N
ATOM 738 CA LEU A 50 0.152 19.199 -2.345 1.00 48.78 C
ATOM 739 C LEU A 50 1.631 19.116 -1.955 1.00 48.78 C
ATOM 740 O LEU A 50 2.246 18.026 -1.996 1.00 49.88 O
ATOM 741 CB LEU A 50 -0.008 19.936 -3.668 1.00 48.50 C
ATOM 742 CG LEU A 50 -0.184 19.170 -4.968 1.00 49.29 C
ATOM 743 CD1 LEU A 50 -1.247 19.880 -5.778 1.00 48.46 C
ATOM 744 CD2 LEU A 50 1.126 19.116 -5.760 1.00 50.52 C
ATOM 745 HA LEU A 50 -0.247 18.190 -2.449 1.00 0.00 H
ATOM 746 HB3 LEU A 50 0.817 20.639 -3.782 1.00 0.00 H
ATOM 747 HB2 LEU A 50 -0.818 20.660 -3.573 1.00 0.00 H
ATOM 748 HG LEU A 50 -0.515 18.155 -4.748 1.00 0.00 H
ATOM 749 HD11 LEU A 50 -1.398 19.354 -6.721 1.00 0.00 H
ATOM 750 HD12 LEU A 50 -2.182 19.896 -5.217 1.00 0.00 H
ATOM 751 HD13 LEU A 50 -0.928 20.902 -5.980 1.00 0.00 H
ATOM 752 HD21 LEU A 50 0.969 18.562 -6.685 1.00 0.00 H
ATOM 753 HD22 LEU A 50 1.451 20.129 -5.995 1.00 0.00 H
ATOM 754 HD23 LEU A 50 1.891 18.618 -5.164 1.00 0.00 H
ATOM 755 H LEU A 50 -1.872 19.326 -1.954 1.00 0.00 H
ATOM 756 N ASN A 51 2.180 20.277 -1.578 1.00 48.51 N
ATOM 757 CA ASN A 51 3.525 20.405 -1.034 1.00 47.64 C
ATOM 758 C ASN A 51 3.447 21.575 -0.020 1.00 46.78 C
ATOM 759 O ASN A 51 3.859 22.698 -0.320 1.00 47.16 O
ATOM 760 CB ASN A 51 4.559 20.690 -2.160 1.00 48.78 C
ATOM 761 CG ASN A 51 5.936 20.034 -1.839 1.00 49.94 C
ATOM 762 OD1 ASN A 51 6.078 19.223 -0.902 1.00 51.93 O
ATOM 763 ND2 ASN A 51 6.954 20.379 -2.631 1.00 52.20 N
ATOM 764 H ASN A 51 1.655 21.135 -1.664 1.00 0.00 H
ATOM 765 HA ASN A 51 3.797 19.487 -0.512 1.00 0.00 H
ATOM 766 HB3 ASN A 51 4.687 21.767 -2.271 1.00 0.00 H
ATOM 767 HB2 ASN A 51 4.183 20.300 -3.106 1.00 0.00 H
ATOM 768 HD22 ASN A 51 7.872 19.987 -2.474 1.00 0.00 H
ATOM 769 HD21 ASN A 51 6.807 21.032 -3.388 1.00 0.00 H
ATOM 770 N PRO A 52 2.903 21.304 1.189 1.00 45.51 N
ATOM 771 CA PRO A 52 2.638 22.430 2.061 1.00 44.36 C
ATOM 772 C PRO A 52 3.972 22.917 2.621 1.00 43.45 C
ATOM 773 O PRO A 52 4.883 22.108 2.901 1.00 43.63 O
ATOM 774 CB PRO A 52 1.729 21.854 3.149 1.00 44.81 C
ATOM 775 CG PRO A 52 1.532 20.343 2.797 1.00 45.21 C
ATOM 776 CD PRO A 52 2.609 20.002 1.811 1.00 45.49 C
ATOM 777 HA PRO A 52 2.132 23.229 1.518 1.00 0.00 H
ATOM 778 HB3 PRO A 52 0.765 22.361 3.121 1.00 0.00 H
ATOM 779 HB2 PRO A 52 2.224 21.939 4.117 1.00 0.00 H
ATOM 780 HG3 PRO A 52 0.557 20.204 2.330 1.00 0.00 H
ATOM 781 HG2 PRO A 52 1.661 19.742 3.697 1.00 0.00 H
ATOM 782 HD2 PRO A 52 3.491 19.653 2.348 1.00 0.00 H
ATOM 783 HD3 PRO A 52 2.205 19.327 1.057 1.00 0.00 H
ATOM 784 N AASN A 53 4.091 24.232 2.757 0.50 42.77 N
ATOM 785 N BASN A 53 4.127 24.237 2.712 0.50 42.65 N
ATOM 786 CA AASN A 53 5.223 24.820 3.441 0.50 41.80 C
ATOM 787 CA BASN A 53 5.245 24.761 3.474 0.50 41.50 C
ATOM 788 C ASN A 53 4.744 25.217 4.818 1.00 40.53 C
ATOM 789 O ASN A 53 4.317 26.343 5.019 1.00 40.24 O
ATOM 790 CB AASN A 53 5.735 26.024 2.668 0.50 41.67 C
ATOM 791 CB BASN A 53 6.023 25.863 2.781 0.50 41.12 C
ATOM 792 CG AASN A 53 4.657 26.661 1.791 0.50 42.97 C
ATOM 793 CG BASN A 53 7.282 26.233 3.460 0.50 41.31 C
ATOM 794 OD1AASN A 53 3.499 26.200 1.781 0.50 41.11 O
ATOM 795 OD1BASN A 53 7.429 26.035 4.670 0.50 37.77 O
ATOM 796 ND2AASN A 53 5.034 27.774 1.054 0.50 41.70 N
ATOM 797 ND2BASN A 53 8.193 27.122 2.605 0.50 40.36 N
ATOM 798 H AASN A 53 3.383 24.845 2.379 0.50 0.00 H
ATOM 799 H BASN A 53 3.472 24.855 2.255 0.50 0.00 H
ATOM 800 HA AASN A 53 6.018 24.080 3.531 0.50 0.00 H
ATOM 801 HA BASN A 53 5.935 23.936 3.648 0.50 0.00 H
ATOM 802 HB3AASN A 53 6.578 25.723 2.045 0.50 0.00 H
ATOM 803 HB3BASN A 53 5.391 26.746 2.685 0.50 0.00 H
ATOM 804 HB2AASN A 53 6.119 26.767 3.367 0.50 0.00 H
ATOM 805 HB2BASN A 53 6.240 25.562 1.756 0.50 0.00 H
ATOM 806 HD22AASN A 53 4.363 28.236 0.457 0.50 0.00 H
ATOM 807 HD22BASN A 53 9.081 27.435 2.971 0.50 0.00 H
ATOM 808 HD21AASN A 53 5.980 28.123 1.114 0.50 0.00 H
ATOM 809 HD21BASN A 53 7.905 27.394 1.676 0.50 0.00 H
ATOM 810 N TYR A 54 4.795 24.279 5.750 1.00 39.19 N
ATOM 811 CA TYR A 54 4.182 24.548 7.022 1.00 36.11 C
ATOM 812 C TYR A 54 4.830 25.742 7.712 1.00 35.79 C
ATOM 813 O TYR A 54 4.128 26.630 8.222 1.00 34.66 O
ATOM 814 CB TYR A 54 4.234 23.277 7.850 1.00 35.13 C
ATOM 815 CG TYR A 54 3.189 22.302 7.372 1.00 33.94 C
ATOM 816 CD1 TYR A 54 3.545 21.118 6.714 1.00 33.75 C
ATOM 817 CD2 TYR A 54 1.825 22.560 7.599 1.00 34.99 C
ATOM 818 CE1 TYR A 54 2.576 20.202 6.315 1.00 30.31 C
ATOM 819 CE2 TYR A 54 0.851 21.652 7.209 1.00 31.80 C
ATOM 820 CZ TYR A 54 1.231 20.484 6.542 1.00 31.08 C
ATOM 821 OH TYR A 54 0.253 19.586 6.162 1.00 32.38 O
ATOM 822 H TYR A 54 5.256 23.401 5.558 1.00 0.00 H
ATOM 823 HA TYR A 54 3.134 24.791 6.845 1.00 0.00 H
ATOM 824 HB3 TYR A 54 4.053 23.518 8.897 1.00 0.00 H
ATOM 825 HB2 TYR A 54 5.221 22.824 7.759 1.00 0.00 H
ATOM 826 HD1 TYR A 54 4.584 20.905 6.510 1.00 0.00 H
ATOM 827 HD2 TYR A 54 1.522 23.476 8.084 1.00 0.00 H
ATOM 828 HE1 TYR A 54 2.869 19.281 5.833 1.00 0.00 H
ATOM 829 HE2 TYR A 54 -0.189 21.851 7.421 1.00 0.00 H
ATOM 830 HH TYR A 54 -0.611 19.937 6.392 1.00 0.00 H
ATOM 831 N GLU A 55 6.159 25.795 7.702 1.00 35.77 N
ATOM 832 CA GLU A 55 6.917 26.824 8.439 1.00 37.34 C
ATOM 833 C GLU A 55 6.573 28.209 7.897 1.00 37.04 C
ATOM 834 O GLU A 55 6.387 29.185 8.638 1.00 36.83 O
ATOM 835 CB GLU A 55 8.415 26.520 8.345 1.00 37.62 C
ATOM 836 CG GLU A 55 8.780 25.031 8.660 1.00 42.42 C
ATOM 837 CD GLU A 55 8.340 23.998 7.569 1.00 45.91 C
ATOM 838 OE1 GLU A 55 8.067 24.386 6.410 1.00 47.81 O
ATOM 839 OE2 GLU A 55 8.264 22.778 7.867 1.00 50.42 O1-
ATOM 840 H GLU A 55 6.688 25.114 7.176 1.00 0.00 H
ATOM 841 HA GLU A 55 6.623 26.782 9.488 1.00 0.00 H
ATOM 842 HB3 GLU A 55 8.960 27.177 9.022 1.00 0.00 H
ATOM 843 HB2 GLU A 55 8.774 26.777 7.349 1.00 0.00 H
ATOM 844 HG3 GLU A 55 8.347 24.749 9.619 1.00 0.00 H
ATOM 845 HG2 GLU A 55 9.855 24.950 8.821 1.00 0.00 H
ATOM 846 N ASP A 56 6.456 28.268 6.581 1.00 37.08 N
ATOM 847 CA ASP A 56 6.105 29.484 5.865 1.00 36.88 C
ATOM 848 C ASP A 56 4.604 29.835 6.038 1.00 36.35 C
ATOM 849 O ASP A 56 4.266 30.993 6.250 1.00 35.77 O
ATOM 850 CB ASP A 56 6.551 29.323 4.402 1.00 37.48 C
ATOM 851 CG ASP A 56 5.963 30.346 3.485 1.00 39.71 C
ATOM 852 OD1 ASP A 56 6.456 31.505 3.466 1.00 42.05 O
ATOM 853 OD2 ASP A 56 5.011 29.977 2.758 1.00 42.26 O1-
ATOM 854 H ASP A 56 6.613 27.441 6.022 1.00 0.00 H
ATOM 855 HA ASP A 56 6.685 30.299 6.298 1.00 0.00 H
ATOM 856 HB3 ASP A 56 6.285 28.326 4.050 1.00 0.00 H
ATOM 857 HB2 ASP A 56 7.639 29.371 4.348 1.00 0.00 H
ATOM 858 N LEU A 57 3.722 28.827 6.005 1.00 35.83 N
ATOM 859 CA LEU A 57 2.275 29.028 6.208 1.00 35.77 C
ATOM 860 C LEU A 57 1.948 29.546 7.622 1.00 35.34 C
ATOM 861 O LEU A 57 1.078 30.397 7.803 1.00 35.37 O
ATOM 862 CB LEU A 57 1.509 27.713 5.953 1.00 36.87 C
ATOM 863 CG LEU A 57 1.352 27.197 4.512 1.00 38.28 C
ATOM 864 CD1 LEU A 57 0.822 25.766 4.493 1.00 39.65 C
ATOM 865 CD2 LEU A 57 0.462 28.119 3.670 1.00 40.33 C
ATOM 866 H LEU A 57 4.040 27.883 5.836 1.00 0.00 H
ATOM 867 HA LEU A 57 1.930 29.768 5.486 1.00 0.00 H
ATOM 868 HB3 LEU A 57 0.524 27.781 6.415 1.00 0.00 H
ATOM 869 HB2 LEU A 57 1.944 26.924 6.567 1.00 0.00 H
ATOM 870 HG LEU A 57 2.342 27.188 4.056 1.00 0.00 H
ATOM 871 HD11 LEU A 57 0.722 25.429 3.461 1.00 0.00 H
ATOM 872 HD12 LEU A 57 1.517 25.114 5.022 1.00 0.00 H
ATOM 873 HD13 LEU A 57 -0.151 25.732 4.982 1.00 0.00 H
ATOM 874 HD21 LEU A 57 0.377 27.719 2.660 1.00 0.00 H
ATOM 875 HD22 LEU A 57 -0.529 28.180 4.121 1.00 0.00 H
ATOM 876 HD23 LEU A 57 0.904 29.114 3.630 1.00 0.00 H
ATOM 877 N LEU A 58 2.678 29.033 8.608 1.00 34.80 N
ATOM 878 CA LEU A 58 2.482 29.367 10.013 1.00 34.64 C
ATOM 879 C LEU A 58 2.910 30.795 10.297 1.00 34.70 C
ATOM 880 O LEU A 58 2.318 31.457 11.135 1.00 33.72 O
ATOM 881 CB LEU A 58 3.227 28.370 10.916 1.00 34.56 C
ATOM 882 CG LEU A 58 2.842 28.365 12.408 1.00 34.84 C
ATOM 883 CD1 LEU A 58 1.337 28.139 12.585 1.00 33.27 C
ATOM 884 CD2 LEU A 58 3.653 27.337 13.190 1.00 35.10 C
ATOM 885 H LEU A 58 3.415 28.374 8.401 1.00 0.00 H
ATOM 886 HA LEU A 58 1.417 29.286 10.231 1.00 0.00 H
ATOM 887 HB3 LEU A 58 4.300 28.535 10.823 1.00 0.00 H
ATOM 888 HB2 LEU A 58 3.111 27.364 10.512 1.00 0.00 H
ATOM 889 HG LEU A 58 3.078 29.349 12.813 1.00 0.00 H
ATOM 890 HD11 LEU A 58 1.091 28.140 13.647 1.00 0.00 H
ATOM 891 HD12 LEU A 58 0.788 28.937 12.085 1.00 0.00 H
ATOM 892 HD13 LEU A 58 1.059 27.179 12.149 1.00 0.00 H
ATOM 893 HD21 LEU A 58 3.356 27.360 14.238 1.00 0.00 H
ATOM 894 HD22 LEU A 58 3.469 26.343 12.783 1.00 0.00 H
ATOM 895 HD23 LEU A 58 4.714 27.572 13.108 1.00 0.00 H
ATOM 896 N ILE A 59 3.923 31.281 9.575 1.00 35.51 N
ATOM 897 CA ILE A 59 4.279 32.705 9.601 1.00 36.77 C
ATOM 898 C ILE A 59 3.064 33.621 9.416 1.00 36.90 C
ATOM 899 O ILE A 59 2.925 34.622 10.116 1.00 38.38 O
ATOM 900 CB ILE A 59 5.380 32.998 8.552 1.00 36.42 C
ATOM 901 CG1 ILE A 59 6.772 32.702 9.143 1.00 38.45 C
ATOM 902 CG2 ILE A 59 5.254 34.403 7.967 1.00 38.46 C
ATOM 903 CD1 ILE A 59 7.470 33.913 9.842 1.00 40.70 C
ATOM 904 H ILE A 59 4.468 30.664 8.990 1.00 0.00 H
ATOM 905 HA ILE A 59 4.700 32.917 10.584 1.00 0.00 H
ATOM 906 HB ILE A 59 5.229 32.298 7.730 1.00 0.00 H
ATOM 907 HG13 ILE A 59 7.422 32.315 8.358 1.00 0.00 H
ATOM 908 HG12 ILE A 59 6.696 31.874 9.848 1.00 0.00 H
ATOM 909 HG21 ILE A 59 6.046 34.565 7.236 1.00 0.00 H
ATOM 910 HG22 ILE A 59 4.284 34.509 7.481 1.00 0.00 H
ATOM 911 HG23 ILE A 59 5.341 35.139 8.766 1.00 0.00 H
ATOM 912 HD11 ILE A 59 8.442 33.602 10.224 1.00 0.00 H
ATOM 913 HD12 ILE A 59 7.604 34.720 9.122 1.00 0.00 H
ATOM 914 HD13 ILE A 59 6.851 34.263 10.668 1.00 0.00 H
ATOM 915 N ARG A 60 2.175 33.277 8.492 1.00 37.37 N
ATOM 916 CA ARG A 60 1.013 34.116 8.195 1.00 38.48 C
ATOM 917 C ARG A 60 -0.127 34.007 9.212 1.00 38.22 C
ATOM 918 O ARG A 60 -1.151 34.687 9.085 1.00 38.94 O
ATOM 919 CB ARG A 60 0.466 33.811 6.802 1.00 38.81 C
ATOM 920 CG ARG A 60 0.761 34.882 5.782 1.00 42.25 C
ATOM 921 CD ARG A 60 2.120 34.675 5.177 1.00 44.11 C
ATOM 922 NE ARG A 60 2.122 33.509 4.303 1.00 45.19 N
ATOM 923 CZ ARG A 60 3.219 32.899 3.867 1.00 45.00 C
ATOM 924 NH1 ARG A 60 4.419 33.331 4.241 1.00 44.73 N
ATOM 925 NH2 ARG A 60 3.110 31.845 3.065 1.00 45.91 N1+
ATOM 926 H ARG A 60 2.292 32.418 7.974 1.00 0.00 H
ATOM 927 HA ARG A 60 1.351 35.152 8.193 1.00 0.00 H
ATOM 928 HB3 ARG A 60 -0.611 33.656 6.863 1.00 0.00 H
ATOM 929 HB2 ARG A 60 0.870 32.860 6.455 1.00 0.00 H
ATOM 930 HG3 ARG A 60 0.722 35.860 6.261 1.00 0.00 H
ATOM 931 HG2 ARG A 60 0.006 34.853 4.997 1.00 0.00 H
ATOM 932 HD3 ARG A 60 2.853 34.535 5.971 1.00 0.00 H
ATOM 933 HD2 ARG A 60 2.401 35.559 4.604 1.00 0.00 H
ATOM 934 HE ARG A 60 1.212 33.168 4.029 1.00 0.00 H
ATOM 935 HH12 ARG A 60 5.250 32.864 3.907 1.00 0.00 H
ATOM 936 HH11 ARG A 60 4.500 34.126 4.859 1.00 0.00 H
ATOM 937 HH22 ARG A 60 3.940 31.377 2.730 1.00 0.00 H
ATOM 938 HH21 ARG A 60 2.197 31.512 2.790 1.00 0.00 H
ATOM 939 N LYS A 61 0.053 33.162 10.219 1.00 37.43 N
ATOM 940 CA LYS A 61 -0.994 32.908 11.201 1.00 36.65 C
ATOM 941 C LYS A 61 -0.765 33.723 12.460 1.00 36.33 C
ATOM 942 O LYS A 61 0.339 33.785 12.988 1.00 36.86 O
ATOM 943 CB LYS A 61 -1.036 31.407 11.546 1.00 36.24 C
ATOM 944 CG LYS A 61 -1.292 30.461 10.360 1.00 35.57 C
ATOM 945 CD LYS A 61 -2.713 30.550 9.794 1.00 37.71 C
ATOM 946 CE LYS A 61 -3.800 30.257 10.865 1.00 37.84 C
ATOM 947 NZ LYS A 61 -4.604 29.022 10.670 1.00 38.69 N1+
ATOM 948 H LYS A 61 0.933 32.676 10.319 1.00 0.00 H
ATOM 949 HA LYS A 61 -1.953 33.194 10.770 1.00 0.00 H
ATOM 950 HB3 LYS A 61 -1.791 31.235 12.313 1.00 0.00 H
ATOM 951 HB2 LYS A 61 -0.105 31.124 12.038 1.00 0.00 H
ATOM 952 HG3 LYS A 61 -1.088 29.435 10.666 1.00 0.00 H
ATOM 953 HG2 LYS A 61 -0.573 30.672 9.568 1.00 0.00 H
ATOM 954 HD3 LYS A 61 -2.819 29.846 8.968 1.00 0.00 H
ATOM 955 HD2 LYS A 61 -2.875 31.544 9.376 1.00 0.00 H
ATOM 956 HE3 LYS A 61 -4.470 31.113 10.940 1.00 0.00 H
ATOM 957 HE2 LYS A 61 -3.335 30.231 11.851 1.00 0.00 H
ATOM 958 HZ1 LYS A 61 -5.274 28.934 11.420 1.00 0.00 H
ATOM 959 HZ2 LYS A 61 -5.092 29.073 9.787 1.00 0.00 H
ATOM 960 HZ3 LYS A 61 -3.992 28.218 10.670 1.00 0.00 H
ATOM 961 N SER A 62 -1.819 34.349 12.939 1.00 35.60 N
ATOM 962 CA SER A 62 -1.765 35.032 14.208 1.00 35.81 C
ATOM 963 C SER A 62 -2.500 34.142 15.219 1.00 35.20 C
ATOM 964 O SER A 62 -3.251 33.247 14.824 1.00 34.58 O
ATOM 965 CB SER A 62 -2.452 36.373 14.087 1.00 35.82 C
ATOM 966 OG SER A 62 -3.853 36.178 14.030 1.00 38.52 O
ATOM 967 H SER A 62 -2.683 34.356 12.416 1.00 0.00 H
ATOM 968 HA SER A 62 -0.728 35.169 14.515 1.00 0.00 H
ATOM 969 HB3 SER A 62 -2.118 36.872 13.177 1.00 0.00 H
ATOM 970 HB2 SER A 62 -2.206 36.987 14.954 1.00 0.00 H
ATOM 971 HG SER A 62 -4.292 37.028 13.953 1.00 0.00 H
ATOM 972 N ASN A 63 -2.292 34.400 16.505 1.00 34.47 N
ATOM 973 CA ASN A 63 -3.074 33.723 17.549 1.00 33.76 C
ATOM 974 C ASN A 63 -4.574 33.824 17.290 1.00 34.37 C
ATOM 975 O ASN A 63 -5.305 32.855 17.425 1.00 32.79 O
ATOM 976 CB ASN A 63 -2.756 34.351 18.902 1.00 33.21 C
ATOM 977 CG ASN A 63 -1.357 34.062 19.357 1.00 30.95 C
ATOM 978 OD1 ASN A 63 -0.791 32.997 19.068 1.00 29.50 O
ATOM 979 ND2 ASN A 63 -0.806 34.977 20.140 1.00 30.96 N
ATOM 980 H ASN A 63 -1.588 35.070 16.778 1.00 0.00 H
ATOM 981 HA ASN A 63 -2.791 32.671 17.574 1.00 0.00 H
ATOM 982 HB3 ASN A 63 -3.462 33.984 19.647 1.00 0.00 H
ATOM 983 HB2 ASN A 63 -2.903 35.430 18.844 1.00 0.00 H
ATOM 984 HD22 ASN A 63 0.135 34.847 20.484 1.00 0.00 H
ATOM 985 HD21 ASN A 63 -1.327 35.805 20.393 1.00 0.00 H
ATOM 986 N HIS A 64 -5.036 35.010 16.896 1.00 35.83 N
ATOM 987 CA HIS A 64 -6.463 35.238 16.656 1.00 37.21 C
ATOM 988 C HIS A 64 -7.063 34.381 15.515 1.00 35.98 C
ATOM 989 O HIS A 64 -8.273 34.132 15.496 1.00 37.27 O
ATOM 990 CB HIS A 64 -6.738 36.740 16.419 1.00 38.53 C
ATOM 991 CG HIS A 64 -5.710 37.647 17.031 1.00 44.27 C
ATOM 992 ND1 HIS A 64 -4.356 37.521 16.775 1.00 47.83 N
ATOM 993 CD2 HIS A 64 -5.835 38.696 17.880 1.00 49.46 C
ATOM 994 CE1 HIS A 64 -3.693 38.439 17.454 1.00 50.52 C
ATOM 995 NE2 HIS A 64 -4.567 39.175 18.122 1.00 51.98 N