USER MOD reduce.3.24.130724 H: found=0, std=0, add=1010, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1012 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 42 SER OG : rot 68:sc= 1.61 USER MOD Set 1.2: A 127 LYS NZ :NH3+ -173:sc= 2.12 (180deg=1.58) USER MOD Set 2.1: A 89 HIS : no HE2:sc= -7.57! C(o=-9.5!,f=-11!) USER MOD Set 2.2: A 107 ASN : amide:sc= -1.94! C(o=-9.5!,f=-11!) USER MOD Set 3.1: A 32 SER OG : rot -72:sc= 0.048 USER MOD Set 3.2: A 37 HIS : no HD1:sc= -2.2 K(o=-2.2,f=-4.2!) USER MOD Set 4.1: A 11 GLN : amide:sc= -0.0871 K(o=-2.9,f=-4.2!) USER MOD Set 4.2: A 13 ASN : amide:sc= -2.02! C(o=-2.9!,f=-6.8!) USER MOD Set 4.3: A 15 TYR OH : rot 60:sc= -0.451 USER MOD Set 4.4: A 43 THR OG1 : rot 130:sc= -0.293 USER MOD Single : A 12 SER OG : rot 180:sc= -0.0772 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0.00218 USER MOD Single : A 21 ASN : amide:sc= 1.2 K(o=1.2,f=-5.3!) USER MOD Single : A 22 LYS NZ :NH3+ 164:sc= 2.37 (180deg=1.98) USER MOD Single : A 23 THR OG1 : rot -76:sc= 0.0966 USER MOD Single : A 27 SER OG : rot -82:sc= 0.811 USER MOD Single : A 30 ASN : amide:sc= 0.962 K(o=0.96,f=-5.8!) USER MOD Single : A 34 MET CE :methyl -168:sc= -0.0939 (180deg=-0.344) USER MOD Single : A 39 MET CE :methyl -143:sc= -1.23 (180deg=-4.87!) USER MOD Single : A 40 THR OG1 : rot 68:sc= 0.071 USER MOD Single : A 47 GLN : amide:sc= -0.43 X(o=-0.43,f=-0.66) USER MOD Single : A 48 ASN : amide:sc= 1.16 K(o=1.2,f=-0.11) USER MOD Single : A 52 GLN :FLIP amide:sc= 0 F(o=-1.6!,f=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 TYR OH : rot 180:sc= 0.0529 USER MOD Single : A 68 ASN : amide:sc= 1.12 K(o=1.1,f=-0.24) USER MOD Single : A 70 LYS NZ :NH3+ -114:sc= 1.13 (180deg=-3.27!) USER MOD Single : A 72 GLN : amide:sc= 1.61 K(o=1.6,f=-4.6!) USER MOD Single : A 78 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0.0138 USER MOD Single : A 82 ASN : amide:sc= 1.05 K(o=1,f=-4.7!) USER MOD Single : A 100 ASN :FLIP amide:sc= -0.0428 F(o=-1!,f=-0.043) USER MOD Single : A 106 TYR OH : rot -125:sc= 1.26 USER MOD Single : A 108 GLN :FLIP amide:sc= 0 F(o=-0.94,f=0) USER MOD Single : A 110 LYS NZ :NH3+ -168:sc= -0.425 (180deg=-0.748) USER MOD Single : A 114 ASN :FLIP amide:sc= 0 F(o=-1.5!,f=0) USER MOD Single : A 119 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 123 SER OG : rot 107:sc= -1.19 USER MOD Single : A 131 THR OG1 : rot -18:sc= 0.154 USER MOD Single : A 132 THR OG1 : rot 151:sc= 1.04 USER MOD Single : A 134 ASN : amide:sc= -0.0196 X(o=-0.02,f=0) USER MOD Single : A 137 ASN : amide:sc= 1.19 K(o=1.2,f=-0.21) USER MOD Single : A 139 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 GLN :FLIP amide:sc= -0.0995 F(o=-1.6!,f=-0.099) USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 36 N CYS A 3 20.355 58.970 -11.155 1.00 0.00 N ATOM 37 CA CYS A 3 20.083 59.664 -9.912 1.00 0.00 C ATOM 38 C CYS A 3 18.598 59.634 -9.578 1.00 0.00 C ATOM 39 O CYS A 3 17.768 60.153 -10.324 1.00 0.00 O ATOM 40 CB CYS A 3 20.607 61.101 -9.963 1.00 0.00 C ATOM 41 SG CYS A 3 20.161 62.027 -11.462 1.00 0.00 S ATOM 0 HA CYS A 3 20.612 59.141 -9.115 1.00 0.00 H new ATOM 0 HB2 CYS A 3 20.229 61.641 -9.095 1.00 0.00 H new ATOM 0 HB3 CYS A 3 21.693 61.079 -9.877 1.00 0.00 H new ATOM 46 N PRO A 4 18.251 58.975 -8.461 1.00 0.00 N ATOM 47 CA PRO A 4 16.883 58.952 -7.937 1.00 0.00 C ATOM 48 C PRO A 4 16.466 60.321 -7.421 1.00 0.00 C ATOM 49 O PRO A 4 17.294 61.230 -7.332 1.00 0.00 O ATOM 50 CB PRO A 4 16.952 57.943 -6.789 1.00 0.00 C ATOM 51 CG PRO A 4 18.381 57.945 -6.370 1.00 0.00 C ATOM 52 CD PRO A 4 19.174 58.192 -7.622 1.00 0.00 C ATOM 0 HA PRO A 4 16.150 58.686 -8.698 1.00 0.00 H new ATOM 0 HB2 PRO A 4 16.298 58.233 -5.967 1.00 0.00 H new ATOM 0 HB3 PRO A 4 16.636 56.952 -7.113 1.00 0.00 H new ATOM 0 HG2 PRO A 4 18.570 58.721 -5.628 1.00 0.00 H new ATOM 0 HG3 PRO A 4 18.656 56.994 -5.914 1.00 0.00 H new ATOM 0 HD2 PRO A 4 20.092 58.741 -7.414 1.00 0.00 H new ATOM 0 HD3 PRO A 4 19.463 57.259 -8.105 1.00 0.00 H new ATOM 60 N ILE A 5 15.185 60.469 -7.089 1.00 0.00 N ATOM 61 CA ILE A 5 14.662 61.741 -6.598 1.00 0.00 C ATOM 62 C ILE A 5 15.184 62.048 -5.188 1.00 0.00 C ATOM 63 O ILE A 5 14.455 61.965 -4.199 1.00 0.00 O ATOM 64 CB ILE A 5 13.115 61.765 -6.606 1.00 0.00 C ATOM 65 CG1 ILE A 5 12.585 61.304 -7.970 1.00 0.00 C ATOM 66 CG2 ILE A 5 12.605 63.168 -6.287 1.00 0.00 C ATOM 67 CD1 ILE A 5 11.074 61.225 -8.046 1.00 0.00 C ATOM 0 H ILE A 5 14.491 59.724 -7.151 1.00 0.00 H new ATOM 0 HA ILE A 5 15.018 62.514 -7.279 1.00 0.00 H new ATOM 0 HB ILE A 5 12.751 61.080 -5.840 1.00 0.00 H new ATOM 0 HG12 ILE A 5 12.942 61.990 -8.738 1.00 0.00 H new ATOM 0 HG13 ILE A 5 13.002 60.323 -8.199 1.00 0.00 H new ATOM 0 HG21 ILE A 5 11.515 63.170 -6.296 1.00 0.00 H new ATOM 0 HG22 ILE A 5 12.960 63.469 -5.301 1.00 0.00 H new ATOM 0 HG23 ILE A 5 12.975 63.869 -7.035 1.00 0.00 H new ATOM 0 HD11 ILE A 5 10.777 60.892 -9.040 1.00 0.00 H new ATOM 0 HD12 ILE A 5 10.709 60.517 -7.302 1.00 0.00 H new ATOM 0 HD13 ILE A 5 10.648 62.209 -7.850 1.00 0.00 H new ATOM 79 N ASP A 6 16.470 62.361 -5.126 1.00 0.00 N ATOM 80 CA ASP A 6 17.137 62.798 -3.906 1.00 0.00 C ATOM 81 C ASP A 6 18.494 63.368 -4.288 1.00 0.00 C ATOM 82 O ASP A 6 18.913 64.410 -3.794 1.00 0.00 O ATOM 83 CB ASP A 6 17.303 61.661 -2.898 1.00 0.00 C ATOM 84 CG ASP A 6 17.849 62.165 -1.575 1.00 0.00 C ATOM 85 OD1 ASP A 6 17.315 63.177 -1.055 1.00 0.00 O ATOM 86 OD2 ASP A 6 18.817 61.565 -1.066 1.00 0.00 O ATOM 0 H ASP A 6 17.090 62.318 -5.935 1.00 0.00 H new ATOM 0 HA ASP A 6 16.522 63.555 -3.420 1.00 0.00 H new ATOM 0 HB2 ASP A 6 16.341 61.175 -2.734 1.00 0.00 H new ATOM 0 HB3 ASP A 6 17.975 60.907 -3.307 1.00 0.00 H new ATOM 91 N TRP A 7 19.174 62.683 -5.197 1.00 0.00 N ATOM 92 CA TRP A 7 20.309 63.279 -5.874 1.00 0.00 C ATOM 93 C TRP A 7 19.797 64.480 -6.659 1.00 0.00 C ATOM 94 O TRP A 7 18.945 64.336 -7.536 1.00 0.00 O ATOM 95 CB TRP A 7 20.989 62.276 -6.812 1.00 0.00 C ATOM 96 CG TRP A 7 21.795 61.219 -6.110 1.00 0.00 C ATOM 97 CD1 TRP A 7 21.323 60.193 -5.343 1.00 0.00 C ATOM 98 CD2 TRP A 7 23.221 61.078 -6.134 1.00 0.00 C ATOM 99 NE1 TRP A 7 22.369 59.425 -4.885 1.00 0.00 N ATOM 100 CE2 TRP A 7 23.544 59.947 -5.356 1.00 0.00 C ATOM 101 CE3 TRP A 7 24.256 61.800 -6.735 1.00 0.00 C ATOM 102 CZ2 TRP A 7 24.862 59.524 -5.168 1.00 0.00 C ATOM 103 CZ3 TRP A 7 25.559 61.379 -6.546 1.00 0.00 C ATOM 104 CH2 TRP A 7 25.852 60.250 -5.771 1.00 0.00 C ATOM 0 H TRP A 7 18.960 61.726 -5.478 1.00 0.00 H new ATOM 0 HA TRP A 7 21.057 63.586 -5.143 1.00 0.00 H new ATOM 0 HB2 TRP A 7 20.226 61.790 -7.420 1.00 0.00 H new ATOM 0 HB3 TRP A 7 21.642 62.820 -7.495 1.00 0.00 H new ATOM 0 HD1 TRP A 7 20.281 60.011 -5.127 1.00 0.00 H new ATOM 0 HE1 TRP A 7 22.283 58.600 -4.291 1.00 0.00 H new ATOM 0 HE3 TRP A 7 24.042 62.671 -7.336 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 25.091 58.655 -4.568 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 26.366 61.931 -7.005 1.00 0.00 H new ATOM 0 HH2 TRP A 7 26.881 59.946 -5.647 1.00 0.00 H new ATOM 115 N ARG A 8 20.303 65.657 -6.337 1.00 0.00 N ATOM 116 CA ARG A 8 19.743 66.895 -6.857 1.00 0.00 C ATOM 117 C ARG A 8 20.077 67.061 -8.329 1.00 0.00 C ATOM 118 O ARG A 8 21.227 67.287 -8.693 1.00 0.00 O ATOM 119 CB ARG A 8 20.269 68.096 -6.065 1.00 0.00 C ATOM 120 CG ARG A 8 20.107 67.954 -4.560 1.00 0.00 C ATOM 121 CD ARG A 8 18.655 67.726 -4.169 1.00 0.00 C ATOM 122 NE ARG A 8 18.508 67.531 -2.722 1.00 0.00 N ATOM 123 CZ ARG A 8 17.680 66.639 -2.163 1.00 0.00 C ATOM 124 NH1 ARG A 8 16.811 65.964 -2.905 1.00 0.00 N ATOM 125 NH2 ARG A 8 17.710 66.443 -0.854 1.00 0.00 N ATOM 0 H ARG A 8 21.103 65.783 -5.716 1.00 0.00 H new ATOM 0 HA ARG A 8 18.659 66.847 -6.749 1.00 0.00 H new ATOM 0 HB2 ARG A 8 21.325 68.238 -6.296 1.00 0.00 H new ATOM 0 HB3 ARG A 8 19.747 68.994 -6.395 1.00 0.00 H new ATOM 0 HG2 ARG A 8 20.714 67.121 -4.206 1.00 0.00 H new ATOM 0 HG3 ARG A 8 20.480 68.852 -4.068 1.00 0.00 H new ATOM 0 HD2 ARG A 8 18.055 68.579 -4.484 1.00 0.00 H new ATOM 0 HD3 ARG A 8 18.269 66.853 -4.695 1.00 0.00 H new ATOM 0 HE ARG A 8 19.073 68.112 -2.102 1.00 0.00 H new ATOM 0 HH11 ARG A 8 16.769 66.122 -3.912 1.00 0.00 H new ATOM 0 HH12 ARG A 8 16.185 65.287 -2.468 1.00 0.00 H new ATOM 0 HH21 ARG A 8 18.362 66.971 -0.274 1.00 0.00 H new ATOM 0 HH22 ARG A 8 17.081 65.764 -0.425 1.00 0.00 H new ATOM 139 N ALA A 9 19.064 66.921 -9.167 1.00 0.00 N ATOM 140 CA ALA A 9 19.231 67.090 -10.598 1.00 0.00 C ATOM 141 C ALA A 9 19.238 68.567 -10.956 1.00 0.00 C ATOM 142 O ALA A 9 18.285 69.292 -10.670 1.00 0.00 O ATOM 143 CB ALA A 9 18.128 66.360 -11.350 1.00 0.00 C ATOM 0 H ALA A 9 18.114 66.690 -8.878 1.00 0.00 H new ATOM 0 HA ALA A 9 20.188 66.660 -10.892 1.00 0.00 H new ATOM 0 HB1 ALA A 9 18.267 66.496 -12.422 1.00 0.00 H new ATOM 0 HB2 ALA A 9 18.167 65.297 -11.111 1.00 0.00 H new ATOM 0 HB3 ALA A 9 17.159 66.763 -11.056 1.00 0.00 H new ATOM 149 N PHE A 10 20.320 69.009 -11.570 1.00 0.00 N ATOM 150 CA PHE A 10 20.459 70.398 -11.972 1.00 0.00 C ATOM 151 C PHE A 10 21.102 70.467 -13.352 1.00 0.00 C ATOM 152 O PHE A 10 22.131 69.829 -13.595 1.00 0.00 O ATOM 153 CB PHE A 10 21.284 71.174 -10.934 1.00 0.00 C ATOM 154 CG PHE A 10 21.458 72.631 -11.255 1.00 0.00 C ATOM 155 CD1 PHE A 10 20.403 73.518 -11.111 1.00 0.00 C ATOM 156 CD2 PHE A 10 22.674 73.114 -11.710 1.00 0.00 C ATOM 157 CE1 PHE A 10 20.558 74.855 -11.417 1.00 0.00 C ATOM 158 CE2 PHE A 10 22.833 74.451 -12.018 1.00 0.00 C ATOM 159 CZ PHE A 10 21.774 75.322 -11.872 1.00 0.00 C ATOM 0 H PHE A 10 21.121 68.422 -11.803 1.00 0.00 H new ATOM 0 HA PHE A 10 19.474 70.861 -12.025 1.00 0.00 H new ATOM 0 HB2 PHE A 10 20.802 71.082 -9.960 1.00 0.00 H new ATOM 0 HB3 PHE A 10 22.267 70.712 -10.848 1.00 0.00 H new ATOM 0 HD1 PHE A 10 19.449 73.159 -10.755 1.00 0.00 H new ATOM 0 HD2 PHE A 10 23.508 72.437 -11.825 1.00 0.00 H new ATOM 0 HE1 PHE A 10 19.728 75.536 -11.300 1.00 0.00 H new ATOM 0 HE2 PHE A 10 23.786 74.814 -12.373 1.00 0.00 H new ATOM 0 HZ PHE A 10 21.896 76.368 -12.113 1.00 0.00 H new ATOM 169 N GLN A 11 20.476 71.233 -14.249 1.00 0.00 N ATOM 170 CA GLN A 11 20.897 71.331 -15.651 1.00 0.00 C ATOM 171 C GLN A 11 20.698 69.995 -16.359 1.00 0.00 C ATOM 172 O GLN A 11 19.694 69.779 -17.033 1.00 0.00 O ATOM 173 CB GLN A 11 22.361 71.771 -15.779 1.00 0.00 C ATOM 174 CG GLN A 11 22.659 73.123 -15.162 1.00 0.00 C ATOM 175 CD GLN A 11 24.141 73.428 -15.133 1.00 0.00 C ATOM 176 OE1 GLN A 11 24.839 73.067 -14.189 1.00 0.00 O ATOM 177 NE2 GLN A 11 24.632 74.101 -16.158 1.00 0.00 N ATOM 0 H GLN A 11 19.661 71.804 -14.024 1.00 0.00 H new ATOM 0 HA GLN A 11 20.275 72.091 -16.124 1.00 0.00 H new ATOM 0 HB2 GLN A 11 22.997 71.021 -15.308 1.00 0.00 H new ATOM 0 HB3 GLN A 11 22.629 71.799 -16.835 1.00 0.00 H new ATOM 0 HG2 GLN A 11 22.142 73.899 -15.726 1.00 0.00 H new ATOM 0 HG3 GLN A 11 22.265 73.151 -14.146 1.00 0.00 H new ATOM 0 HE21 GLN A 11 24.020 74.383 -16.923 1.00 0.00 H new ATOM 0 HE22 GLN A 11 25.624 74.339 -16.184 1.00 0.00 H new ATOM 186 N SER A 12 21.662 69.104 -16.191 1.00 0.00 N ATOM 187 CA SER A 12 21.607 67.778 -16.781 1.00 0.00 C ATOM 188 C SER A 12 22.404 66.800 -15.925 1.00 0.00 C ATOM 189 O SER A 12 22.615 65.653 -16.305 1.00 0.00 O ATOM 190 CB SER A 12 22.170 67.813 -18.204 1.00 0.00 C ATOM 191 OG SER A 12 21.501 68.783 -18.994 1.00 0.00 O ATOM 0 H SER A 12 22.503 69.280 -15.642 1.00 0.00 H new ATOM 0 HA SER A 12 20.569 67.449 -16.824 1.00 0.00 H new ATOM 0 HB2 SER A 12 23.236 68.038 -18.171 1.00 0.00 H new ATOM 0 HB3 SER A 12 22.066 66.830 -18.664 1.00 0.00 H new ATOM 0 HG SER A 12 21.880 68.787 -19.898 1.00 0.00 H new ATOM 197 N ASN A 13 22.828 67.266 -14.757 1.00 0.00 N ATOM 198 CA ASN A 13 23.702 66.487 -13.891 1.00 0.00 C ATOM 199 C ASN A 13 23.005 66.179 -12.571 1.00 0.00 C ATOM 200 O ASN A 13 21.984 66.786 -12.246 1.00 0.00 O ATOM 201 CB ASN A 13 24.996 67.254 -13.612 1.00 0.00 C ATOM 202 CG ASN A 13 25.832 67.482 -14.858 1.00 0.00 C ATOM 203 OD1 ASN A 13 26.595 66.611 -15.277 1.00 0.00 O ATOM 204 ND2 ASN A 13 25.731 68.672 -15.429 1.00 0.00 N ATOM 0 H ASN A 13 22.579 68.183 -14.387 1.00 0.00 H new ATOM 0 HA ASN A 13 23.939 65.552 -14.399 1.00 0.00 H new ATOM 0 HB2 ASN A 13 24.751 68.217 -13.164 1.00 0.00 H new ATOM 0 HB3 ASN A 13 25.587 66.703 -12.880 1.00 0.00 H new ATOM 0 HD21 ASN A 13 26.298 68.895 -16.247 1.00 0.00 H new ATOM 0 HD22 ASN A 13 25.086 69.366 -15.051 1.00 0.00 H new ATOM 211 N CYS A 14 23.571 65.256 -11.807 1.00 0.00 N ATOM 212 CA CYS A 14 23.012 64.882 -10.514 1.00 0.00 C ATOM 213 C CYS A 14 24.018 65.200 -9.404 1.00 0.00 C ATOM 214 O CYS A 14 25.177 64.791 -9.473 1.00 0.00 O ATOM 215 CB CYS A 14 22.670 63.391 -10.511 1.00 0.00 C ATOM 216 SG CYS A 14 21.928 62.797 -12.063 1.00 0.00 S ATOM 0 H CYS A 14 24.420 64.750 -12.060 1.00 0.00 H new ATOM 0 HA CYS A 14 22.100 65.452 -10.335 1.00 0.00 H new ATOM 0 HB2 CYS A 14 23.578 62.821 -10.313 1.00 0.00 H new ATOM 0 HB3 CYS A 14 21.982 63.189 -9.691 1.00 0.00 H new ATOM 221 N TYR A 15 23.577 65.934 -8.389 1.00 0.00 N ATOM 222 CA TYR A 15 24.470 66.401 -7.330 1.00 0.00 C ATOM 223 C TYR A 15 23.995 65.923 -5.964 1.00 0.00 C ATOM 224 O TYR A 15 22.818 66.038 -5.639 1.00 0.00 O ATOM 225 CB TYR A 15 24.519 67.934 -7.324 1.00 0.00 C ATOM 226 CG TYR A 15 24.820 68.547 -8.672 1.00 0.00 C ATOM 227 CD1 TYR A 15 23.811 68.738 -9.608 1.00 0.00 C ATOM 228 CD2 TYR A 15 26.108 68.929 -9.012 1.00 0.00 C ATOM 229 CE1 TYR A 15 24.082 69.289 -10.844 1.00 0.00 C ATOM 230 CE2 TYR A 15 26.382 69.485 -10.245 1.00 0.00 C ATOM 231 CZ TYR A 15 25.366 69.664 -11.157 1.00 0.00 C ATOM 232 OH TYR A 15 25.640 70.205 -12.394 1.00 0.00 O ATOM 0 H TYR A 15 22.605 66.220 -8.275 1.00 0.00 H new ATOM 0 HA TYR A 15 25.462 65.993 -7.526 1.00 0.00 H new ATOM 0 HB2 TYR A 15 23.562 68.316 -6.969 1.00 0.00 H new ATOM 0 HB3 TYR A 15 25.277 68.260 -6.611 1.00 0.00 H new ATOM 0 HD1 TYR A 15 22.799 68.451 -9.364 1.00 0.00 H new ATOM 0 HD2 TYR A 15 26.909 68.790 -8.301 1.00 0.00 H new ATOM 0 HE1 TYR A 15 23.287 69.425 -11.563 1.00 0.00 H new ATOM 0 HE2 TYR A 15 27.391 69.779 -10.494 1.00 0.00 H new ATOM 0 HH TYR A 15 25.116 71.024 -12.516 1.00 0.00 H new ATOM 242 N PHE A 16 24.902 65.394 -5.160 1.00 0.00 N ATOM 243 CA PHE A 16 24.550 65.001 -3.803 1.00 0.00 C ATOM 244 C PHE A 16 25.672 65.351 -2.827 1.00 0.00 C ATOM 245 O PHE A 16 26.793 64.856 -2.955 1.00 0.00 O ATOM 246 CB PHE A 16 24.234 63.505 -3.740 1.00 0.00 C ATOM 247 CG PHE A 16 23.614 63.078 -2.441 1.00 0.00 C ATOM 248 CD1 PHE A 16 22.281 63.352 -2.177 1.00 0.00 C ATOM 249 CD2 PHE A 16 24.358 62.406 -1.488 1.00 0.00 C ATOM 250 CE1 PHE A 16 21.704 62.964 -0.984 1.00 0.00 C ATOM 251 CE2 PHE A 16 23.786 62.015 -0.292 1.00 0.00 C ATOM 252 CZ PHE A 16 22.458 62.294 -0.040 1.00 0.00 C ATOM 0 H PHE A 16 25.875 65.228 -5.417 1.00 0.00 H new ATOM 0 HA PHE A 16 23.658 65.555 -3.511 1.00 0.00 H new ATOM 0 HB2 PHE A 16 23.559 63.250 -4.557 1.00 0.00 H new ATOM 0 HB3 PHE A 16 25.153 62.941 -3.898 1.00 0.00 H new ATOM 0 HD1 PHE A 16 21.687 63.875 -2.912 1.00 0.00 H new ATOM 0 HD2 PHE A 16 25.397 62.184 -1.681 1.00 0.00 H new ATOM 0 HE1 PHE A 16 20.665 63.184 -0.789 1.00 0.00 H new ATOM 0 HE2 PHE A 16 24.378 61.492 0.445 1.00 0.00 H new ATOM 0 HZ PHE A 16 22.009 61.989 0.894 1.00 0.00 H new ATOM 262 N PRO A 17 25.389 66.237 -1.860 1.00 0.00 N ATOM 263 CA PRO A 17 26.336 66.616 -0.816 1.00 0.00 C ATOM 264 C PRO A 17 26.325 65.635 0.353 1.00 0.00 C ATOM 265 O PRO A 17 25.263 65.197 0.794 1.00 0.00 O ATOM 266 CB PRO A 17 25.837 67.997 -0.356 1.00 0.00 C ATOM 267 CG PRO A 17 24.578 68.272 -1.126 1.00 0.00 C ATOM 268 CD PRO A 17 24.128 66.963 -1.710 1.00 0.00 C ATOM 0 HA PRO A 17 27.363 66.621 -1.182 1.00 0.00 H new ATOM 0 HB2 PRO A 17 25.645 68.003 0.717 1.00 0.00 H new ATOM 0 HB3 PRO A 17 26.586 68.765 -0.550 1.00 0.00 H new ATOM 0 HG2 PRO A 17 23.810 68.688 -0.474 1.00 0.00 H new ATOM 0 HG3 PRO A 17 24.759 69.004 -1.913 1.00 0.00 H new ATOM 0 HD2 PRO A 17 23.434 66.441 -1.051 1.00 0.00 H new ATOM 0 HD3 PRO A 17 23.620 67.097 -2.665 1.00 0.00 H new ATOM 276 N LEU A 18 27.506 65.293 0.849 1.00 0.00 N ATOM 277 CA LEU A 18 27.628 64.373 1.970 1.00 0.00 C ATOM 278 C LEU A 18 28.528 64.973 3.044 1.00 0.00 C ATOM 279 O LEU A 18 29.547 65.596 2.738 1.00 0.00 O ATOM 280 CB LEU A 18 28.183 63.019 1.513 1.00 0.00 C ATOM 281 CG LEU A 18 27.425 62.350 0.364 1.00 0.00 C ATOM 282 CD1 LEU A 18 28.072 62.680 -0.972 1.00 0.00 C ATOM 283 CD2 LEU A 18 27.354 60.845 0.570 1.00 0.00 C ATOM 0 H LEU A 18 28.396 65.640 0.491 1.00 0.00 H new ATOM 0 HA LEU A 18 26.634 64.210 2.386 1.00 0.00 H new ATOM 0 HB2 LEU A 18 29.221 63.155 1.210 1.00 0.00 H new ATOM 0 HB3 LEU A 18 28.187 62.341 2.366 1.00 0.00 H new ATOM 0 HG LEU A 18 26.407 62.741 0.355 1.00 0.00 H new ATOM 0 HD11 LEU A 18 27.517 62.194 -1.775 1.00 0.00 H new ATOM 0 HD12 LEU A 18 28.061 63.759 -1.125 1.00 0.00 H new ATOM 0 HD13 LEU A 18 29.102 62.323 -0.975 1.00 0.00 H new ATOM 0 HD21 LEU A 18 26.811 60.390 -0.258 1.00 0.00 H new ATOM 0 HD22 LEU A 18 28.363 60.435 0.611 1.00 0.00 H new ATOM 0 HD23 LEU A 18 26.837 60.630 1.505 1.00 0.00 H new ATOM 295 N THR A 19 28.149 64.781 4.298 1.00 0.00 N ATOM 296 CA THR A 19 28.854 65.389 5.417 1.00 0.00 C ATOM 297 C THR A 19 29.777 64.394 6.119 1.00 0.00 C ATOM 298 O THR A 19 30.133 64.585 7.283 1.00 0.00 O ATOM 299 CB THR A 19 27.846 65.958 6.432 1.00 0.00 C ATOM 300 OG1 THR A 19 26.857 64.968 6.743 1.00 0.00 O ATOM 301 CG2 THR A 19 27.168 67.205 5.882 1.00 0.00 C ATOM 0 H THR A 19 27.352 64.205 4.568 1.00 0.00 H new ATOM 0 HA THR A 19 29.470 66.193 5.014 1.00 0.00 H new ATOM 0 HB THR A 19 28.388 66.230 7.338 1.00 0.00 H new ATOM 0 HG1 THR A 19 26.219 65.335 7.390 1.00 0.00 H new ATOM 0 HG21 THR A 19 26.460 67.589 6.617 1.00 0.00 H new ATOM 0 HG22 THR A 19 27.920 67.965 5.671 1.00 0.00 H new ATOM 0 HG23 THR A 19 26.637 66.955 4.963 1.00 0.00 H new ATOM 309 N ASP A 20 30.161 63.336 5.411 1.00 0.00 N ATOM 310 CA ASP A 20 31.063 62.329 5.969 1.00 0.00 C ATOM 311 C ASP A 20 32.434 62.931 6.235 1.00 0.00 C ATOM 312 O ASP A 20 32.864 63.842 5.530 1.00 0.00 O ATOM 313 CB ASP A 20 31.252 61.152 5.006 1.00 0.00 C ATOM 314 CG ASP A 20 29.960 60.601 4.454 1.00 0.00 C ATOM 315 OD1 ASP A 20 29.312 59.788 5.134 1.00 0.00 O ATOM 316 OD2 ASP A 20 29.611 60.966 3.312 1.00 0.00 O ATOM 0 H ASP A 20 29.864 63.152 4.453 1.00 0.00 H new ATOM 0 HA ASP A 20 30.610 61.978 6.896 1.00 0.00 H new ATOM 0 HB2 ASP A 20 31.883 61.471 4.177 1.00 0.00 H new ATOM 0 HB3 ASP A 20 31.785 60.354 5.523 1.00 0.00 H new ATOM 321 N ASN A 21 33.119 62.419 7.248 1.00 0.00 N ATOM 322 CA ASN A 21 34.513 62.770 7.473 1.00 0.00 C ATOM 323 C ASN A 21 35.390 61.896 6.584 1.00 0.00 C ATOM 324 O ASN A 21 35.664 60.737 6.897 1.00 0.00 O ATOM 325 CB ASN A 21 34.915 62.615 8.950 1.00 0.00 C ATOM 326 CG ASN A 21 34.632 61.232 9.526 1.00 0.00 C ATOM 327 OD1 ASN A 21 33.602 60.616 9.242 1.00 0.00 O ATOM 328 ND2 ASN A 21 35.568 60.718 10.308 1.00 0.00 N ATOM 0 H ASN A 21 32.733 61.761 7.925 1.00 0.00 H new ATOM 0 HA ASN A 21 34.652 63.821 7.218 1.00 0.00 H new ATOM 0 HB2 ASN A 21 35.979 62.829 9.051 1.00 0.00 H new ATOM 0 HB3 ASN A 21 34.382 63.360 9.541 1.00 0.00 H new ATOM 0 HD21 ASN A 21 35.450 59.783 10.697 1.00 0.00 H new ATOM 0 HD22 ASN A 21 36.407 61.257 10.521 1.00 0.00 H new ATOM 335 N LYS A 22 35.790 62.437 5.447 1.00 0.00 N ATOM 336 CA LYS A 22 36.488 61.656 4.438 1.00 0.00 C ATOM 337 C LYS A 22 37.549 62.485 3.746 1.00 0.00 C ATOM 338 O LYS A 22 37.390 63.689 3.557 1.00 0.00 O ATOM 339 CB LYS A 22 35.492 61.128 3.404 1.00 0.00 C ATOM 340 CG LYS A 22 34.595 60.025 3.936 1.00 0.00 C ATOM 341 CD LYS A 22 35.291 58.677 3.875 1.00 0.00 C ATOM 342 CE LYS A 22 35.089 57.865 5.144 1.00 0.00 C ATOM 343 NZ LYS A 22 36.092 58.215 6.188 1.00 0.00 N ATOM 0 H LYS A 22 35.644 63.415 5.198 1.00 0.00 H new ATOM 0 HA LYS A 22 36.976 60.818 4.936 1.00 0.00 H new ATOM 0 HB2 LYS A 22 34.872 61.953 3.054 1.00 0.00 H new ATOM 0 HB3 LYS A 22 36.041 60.754 2.540 1.00 0.00 H new ATOM 0 HG2 LYS A 22 34.313 60.246 4.966 1.00 0.00 H new ATOM 0 HG3 LYS A 22 33.674 59.989 3.354 1.00 0.00 H new ATOM 0 HD2 LYS A 22 34.913 58.114 3.022 1.00 0.00 H new ATOM 0 HD3 LYS A 22 36.358 58.829 3.709 1.00 0.00 H new ATOM 0 HE2 LYS A 22 34.085 58.039 5.531 1.00 0.00 H new ATOM 0 HE3 LYS A 22 35.161 56.803 4.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 35.772 57.857 7.111 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 37.008 57.784 5.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 36.198 59.249 6.235 1.00 0.00 H new ATOM 357 N THR A 23 38.633 61.830 3.385 1.00 0.00 N ATOM 358 CA THR A 23 39.669 62.449 2.587 1.00 0.00 C ATOM 359 C THR A 23 39.263 62.435 1.116 1.00 0.00 C ATOM 360 O THR A 23 38.244 61.836 0.752 1.00 0.00 O ATOM 361 CB THR A 23 41.011 61.712 2.757 1.00 0.00 C ATOM 362 OG1 THR A 23 40.842 60.326 2.445 1.00 0.00 O ATOM 363 CG2 THR A 23 41.534 61.852 4.179 1.00 0.00 C ATOM 0 H THR A 23 38.820 60.859 3.635 1.00 0.00 H new ATOM 0 HA THR A 23 39.794 63.477 2.926 1.00 0.00 H new ATOM 0 HB THR A 23 41.736 62.159 2.077 1.00 0.00 H new ATOM 0 HG1 THR A 23 40.387 59.877 3.188 1.00 0.00 H new ATOM 0 HG21 THR A 23 42.482 61.323 4.272 1.00 0.00 H new ATOM 0 HG22 THR A 23 41.683 62.907 4.410 1.00 0.00 H new ATOM 0 HG23 THR A 23 40.812 61.427 4.876 1.00 0.00 H new ATOM 371 N TRP A 24 40.054 63.082 0.272 1.00 0.00 N ATOM 372 CA TRP A 24 39.779 63.100 -1.157 1.00 0.00 C ATOM 373 C TRP A 24 39.913 61.690 -1.721 1.00 0.00 C ATOM 374 O TRP A 24 39.155 61.284 -2.596 1.00 0.00 O ATOM 375 CB TRP A 24 40.738 64.049 -1.879 1.00 0.00 C ATOM 376 CG TRP A 24 40.212 64.537 -3.194 1.00 0.00 C ATOM 377 CD1 TRP A 24 39.526 65.693 -3.410 1.00 0.00 C ATOM 378 CD2 TRP A 24 40.322 63.891 -4.470 1.00 0.00 C ATOM 379 NE1 TRP A 24 39.198 65.806 -4.736 1.00 0.00 N ATOM 380 CE2 TRP A 24 39.675 64.717 -5.408 1.00 0.00 C ATOM 381 CE3 TRP A 24 40.902 62.700 -4.914 1.00 0.00 C ATOM 382 CZ2 TRP A 24 39.589 64.389 -6.759 1.00 0.00 C ATOM 383 CZ3 TRP A 24 40.816 62.377 -6.254 1.00 0.00 C ATOM 384 CH2 TRP A 24 40.166 63.218 -7.163 1.00 0.00 C ATOM 0 H TRP A 24 40.888 63.599 0.551 1.00 0.00 H new ATOM 0 HA TRP A 24 38.761 63.457 -1.315 1.00 0.00 H new ATOM 0 HB2 TRP A 24 40.942 64.906 -1.237 1.00 0.00 H new ATOM 0 HB3 TRP A 24 41.688 63.540 -2.042 1.00 0.00 H new ATOM 0 HD1 TRP A 24 39.277 66.416 -2.647 1.00 0.00 H new ATOM 0 HE1 TRP A 24 38.681 66.579 -5.154 1.00 0.00 H new ATOM 0 HE3 TRP A 24 41.408 62.044 -4.222 1.00 0.00 H new ATOM 0 HZ2 TRP A 24 39.085 65.036 -7.461 1.00 0.00 H new ATOM 0 HZ3 TRP A 24 41.259 61.457 -6.607 1.00 0.00 H new ATOM 0 HH2 TRP A 24 40.119 62.936 -8.205 1.00 0.00 H new ATOM 395 N ALA A 25 40.868 60.940 -1.182 1.00 0.00 N ATOM 396 CA ALA A 25 41.102 59.571 -1.617 1.00 0.00 C ATOM 397 C ALA A 25 39.895 58.691 -1.311 1.00 0.00 C ATOM 398 O ALA A 25 39.411 57.965 -2.175 1.00 0.00 O ATOM 399 CB ALA A 25 42.350 59.011 -0.951 1.00 0.00 C ATOM 0 H ALA A 25 41.493 61.259 -0.442 1.00 0.00 H new ATOM 0 HA ALA A 25 41.254 59.576 -2.696 1.00 0.00 H new ATOM 0 HB1 ALA A 25 42.512 57.986 -1.286 1.00 0.00 H new ATOM 0 HB2 ALA A 25 43.212 59.622 -1.221 1.00 0.00 H new ATOM 0 HB3 ALA A 25 42.221 59.023 0.131 1.00 0.00 H new ATOM 405 N GLU A 26 39.404 58.769 -0.081 1.00 0.00 N ATOM 406 CA GLU A 26 38.255 57.972 0.334 1.00 0.00 C ATOM 407 C GLU A 26 37.013 58.336 -0.467 1.00 0.00 C ATOM 408 O GLU A 26 36.269 57.461 -0.898 1.00 0.00 O ATOM 409 CB GLU A 26 37.967 58.178 1.813 1.00 0.00 C ATOM 410 CG GLU A 26 39.089 57.749 2.735 1.00 0.00 C ATOM 411 CD GLU A 26 38.854 58.232 4.145 1.00 0.00 C ATOM 412 OE1 GLU A 26 39.212 59.389 4.433 1.00 0.00 O ATOM 413 OE2 GLU A 26 38.274 57.478 4.951 1.00 0.00 O ATOM 0 H GLU A 26 39.782 59.375 0.647 1.00 0.00 H new ATOM 0 HA GLU A 26 38.502 56.926 0.150 1.00 0.00 H new ATOM 0 HB2 GLU A 26 37.755 59.233 1.986 1.00 0.00 H new ATOM 0 HB3 GLU A 26 37.066 57.624 2.076 1.00 0.00 H new ATOM 0 HG2 GLU A 26 39.172 56.662 2.730 1.00 0.00 H new ATOM 0 HG3 GLU A 26 40.036 58.143 2.366 1.00 0.00 H new ATOM 420 N SER A 27 36.782 59.629 -0.653 1.00 0.00 N ATOM 421 CA SER A 27 35.633 60.081 -1.422 1.00 0.00 C ATOM 422 C SER A 27 35.758 59.649 -2.881 1.00 0.00 C ATOM 423 O SER A 27 34.758 59.347 -3.532 1.00 0.00 O ATOM 424 CB SER A 27 35.469 61.599 -1.303 1.00 0.00 C ATOM 425 OG SER A 27 36.700 62.266 -1.491 1.00 0.00 O ATOM 0 H SER A 27 37.370 60.377 -0.285 1.00 0.00 H new ATOM 0 HA SER A 27 34.737 59.615 -1.013 1.00 0.00 H new ATOM 0 HB2 SER A 27 34.748 61.948 -2.042 1.00 0.00 H new ATOM 0 HB3 SER A 27 35.065 61.847 -0.322 1.00 0.00 H new ATOM 0 HG SER A 27 37.210 62.253 -0.655 1.00 0.00 H new ATOM 431 N GLU A 28 36.992 59.600 -3.376 1.00 0.00 N ATOM 432 CA GLU A 28 37.275 59.087 -4.713 1.00 0.00 C ATOM 433 C GLU A 28 36.861 57.623 -4.826 1.00 0.00 C ATOM 434 O GLU A 28 36.355 57.190 -5.862 1.00 0.00 O ATOM 435 CB GLU A 28 38.771 59.225 -5.024 1.00 0.00 C ATOM 436 CG GLU A 28 39.175 58.671 -6.384 1.00 0.00 C ATOM 437 CD GLU A 28 40.675 58.491 -6.516 1.00 0.00 C ATOM 438 OE1 GLU A 28 41.189 57.449 -6.050 1.00 0.00 O ATOM 439 OE2 GLU A 28 41.341 59.377 -7.092 1.00 0.00 O ATOM 0 H GLU A 28 37.818 59.912 -2.866 1.00 0.00 H new ATOM 0 HA GLU A 28 36.701 59.671 -5.433 1.00 0.00 H new ATOM 0 HB2 GLU A 28 39.046 60.279 -4.976 1.00 0.00 H new ATOM 0 HB3 GLU A 28 39.341 58.711 -4.250 1.00 0.00 H new ATOM 0 HG2 GLU A 28 38.682 57.712 -6.543 1.00 0.00 H new ATOM 0 HG3 GLU A 28 38.823 59.344 -7.166 1.00 0.00 H new ATOM 446 N ARG A 29 37.077 56.867 -3.753 1.00 0.00 N ATOM 447 CA ARG A 29 36.798 55.435 -3.762 1.00 0.00 C ATOM 448 C ARG A 29 35.329 55.151 -3.450 1.00 0.00 C ATOM 449 O ARG A 29 34.740 54.224 -4.002 1.00 0.00 O ATOM 450 CB ARG A 29 37.690 54.688 -2.759 1.00 0.00 C ATOM 451 CG ARG A 29 39.170 55.065 -2.801 1.00 0.00 C ATOM 452 CD ARG A 29 39.693 55.263 -4.218 1.00 0.00 C ATOM 453 NE ARG A 29 39.546 54.069 -5.052 1.00 0.00 N ATOM 454 CZ ARG A 29 39.935 54.008 -6.328 1.00 0.00 C ATOM 455 NH1 ARG A 29 40.523 55.056 -6.901 1.00 0.00 N ATOM 456 NH2 ARG A 29 39.742 52.895 -7.030 1.00 0.00 N ATOM 0 H ARG A 29 37.443 57.221 -2.869 1.00 0.00 H new ATOM 0 HA ARG A 29 37.018 55.075 -4.767 1.00 0.00 H new ATOM 0 HB2 ARG A 29 37.313 54.873 -1.753 1.00 0.00 H new ATOM 0 HB3 ARG A 29 37.598 53.617 -2.942 1.00 0.00 H new ATOM 0 HG2 ARG A 29 39.322 55.982 -2.232 1.00 0.00 H new ATOM 0 HG3 ARG A 29 39.752 54.285 -2.310 1.00 0.00 H new ATOM 0 HD2 ARG A 29 39.161 56.093 -4.683 1.00 0.00 H new ATOM 0 HD3 ARG A 29 40.746 55.543 -4.175 1.00 0.00 H new ATOM 0 HE ARG A 29 39.124 53.239 -4.636 1.00 0.00 H new ATOM 0 HH11 ARG A 29 40.678 55.910 -6.365 1.00 0.00 H new ATOM 0 HH12 ARG A 29 40.819 55.005 -7.876 1.00 0.00 H new ATOM 0 HH21 ARG A 29 39.297 52.088 -6.594 1.00 0.00 H new ATOM 0 HH22 ARG A 29 40.039 52.849 -8.005 1.00 0.00 H new ATOM 470 N ASN A 30 34.746 55.941 -2.550 1.00 0.00 N ATOM 471 CA ASN A 30 33.345 55.758 -2.164 1.00 0.00 C ATOM 472 C ASN A 30 32.421 56.244 -3.277 1.00 0.00 C ATOM 473 O ASN A 30 31.381 55.646 -3.546 1.00 0.00 O ATOM 474 CB ASN A 30 33.037 56.491 -0.855 1.00 0.00 C ATOM 475 CG ASN A 30 31.638 56.194 -0.342 1.00 0.00 C ATOM 476 OD1 ASN A 30 30.682 56.901 -0.656 1.00 0.00 O ATOM 477 ND2 ASN A 30 31.511 55.148 0.459 1.00 0.00 N ATOM 0 H ASN A 30 35.218 56.711 -2.076 1.00 0.00 H new ATOM 0 HA ASN A 30 33.172 54.694 -2.004 1.00 0.00 H new ATOM 0 HB2 ASN A 30 33.767 56.202 -0.099 1.00 0.00 H new ATOM 0 HB3 ASN A 30 33.145 57.565 -1.009 1.00 0.00 H new ATOM 0 HD21 ASN A 30 30.596 54.904 0.839 1.00 0.00 H new ATOM 0 HD22 ASN A 30 32.328 54.585 0.697 1.00 0.00 H new ATOM 484 N CYS A 31 32.811 57.333 -3.921 1.00 0.00 N ATOM 485 CA CYS A 31 32.151 57.765 -5.138 1.00 0.00 C ATOM 486 C CYS A 31 32.775 57.013 -6.303 1.00 0.00 C ATOM 487 O CYS A 31 33.684 56.214 -6.095 1.00 0.00 O ATOM 488 CB CYS A 31 32.262 59.284 -5.338 1.00 0.00 C ATOM 489 SG CYS A 31 31.117 60.264 -4.313 1.00 0.00 S ATOM 0 H CYS A 31 33.580 57.931 -3.620 1.00 0.00 H new ATOM 0 HA CYS A 31 31.086 57.542 -5.073 1.00 0.00 H new ATOM 0 HB2 CYS A 31 33.284 59.594 -5.117 1.00 0.00 H new ATOM 0 HB3 CYS A 31 32.079 59.514 -6.387 1.00 0.00 H new ATOM 494 N SER A 32 32.262 57.232 -7.508 1.00 0.00 N ATOM 495 CA SER A 32 32.703 56.495 -8.699 1.00 0.00 C ATOM 496 C SER A 32 32.124 55.081 -8.701 1.00 0.00 C ATOM 497 O SER A 32 31.551 54.648 -9.699 1.00 0.00 O ATOM 498 CB SER A 32 34.235 56.461 -8.812 1.00 0.00 C ATOM 499 OG SER A 32 34.784 57.771 -8.747 1.00 0.00 O ATOM 0 H SER A 32 31.532 57.920 -7.693 1.00 0.00 H new ATOM 0 HA SER A 32 32.325 57.024 -9.574 1.00 0.00 H new ATOM 0 HB2 SER A 32 34.648 55.850 -8.009 1.00 0.00 H new ATOM 0 HB3 SER A 32 34.523 55.989 -9.752 1.00 0.00 H new ATOM 0 HG SER A 32 34.583 58.251 -9.577 1.00 0.00 H new ATOM 505 N GLY A 33 32.247 54.386 -7.573 1.00 0.00 N ATOM 506 CA GLY A 33 31.657 53.066 -7.432 1.00 0.00 C ATOM 507 C GLY A 33 30.147 53.092 -7.589 1.00 0.00 C ATOM 508 O GLY A 33 29.546 52.133 -8.067 1.00 0.00 O ATOM 0 H GLY A 33 32.749 54.717 -6.749 1.00 0.00 H new ATOM 0 HA2 GLY A 33 32.086 52.397 -8.177 1.00 0.00 H new ATOM 0 HA3 GLY A 33 31.912 52.659 -6.454 1.00 0.00 H new ATOM 512 N MET A 34 29.533 54.208 -7.202 1.00 0.00 N ATOM 513 CA MET A 34 28.090 54.387 -7.361 1.00 0.00 C ATOM 514 C MET A 34 27.749 54.792 -8.792 1.00 0.00 C ATOM 515 O MET A 34 26.590 55.054 -9.118 1.00 0.00 O ATOM 516 CB MET A 34 27.563 55.464 -6.402 1.00 0.00 C ATOM 517 CG MET A 34 27.634 55.092 -4.931 1.00 0.00 C ATOM 518 SD MET A 34 26.919 56.355 -3.859 1.00 0.00 S ATOM 519 CE MET A 34 28.086 57.695 -4.087 1.00 0.00 C ATOM 0 H MET A 34 30.011 55.002 -6.776 1.00 0.00 H new ATOM 0 HA MET A 34 27.616 53.433 -7.130 1.00 0.00 H new ATOM 0 HB2 MET A 34 28.131 56.381 -6.559 1.00 0.00 H new ATOM 0 HB3 MET A 34 26.526 55.684 -6.658 1.00 0.00 H new ATOM 0 HG2 MET A 34 27.111 54.149 -4.773 1.00 0.00 H new ATOM 0 HG3 MET A 34 28.675 54.930 -4.651 1.00 0.00 H new ATOM 0 HE1 MET A 34 27.907 58.465 -3.337 1.00 0.00 H new ATOM 0 HE2 MET A 34 29.102 57.315 -3.981 1.00 0.00 H new ATOM 0 HE3 MET A 34 27.960 58.122 -5.082 1.00 0.00 H new ATOM 529 N GLY A 35 28.755 54.831 -9.653 1.00 0.00 N ATOM 530 CA GLY A 35 28.572 55.395 -10.971 1.00 0.00 C ATOM 531 C GLY A 35 28.509 56.900 -10.888 1.00 0.00 C ATOM 532 O GLY A 35 27.570 57.524 -11.382 1.00 0.00 O ATOM 0 H GLY A 35 29.694 54.482 -9.461 1.00 0.00 H new ATOM 0 HA2 GLY A 35 29.393 55.093 -11.621 1.00 0.00 H new ATOM 0 HA3 GLY A 35 27.655 55.009 -11.416 1.00 0.00 H new ATOM 536 N ALA A 36 29.508 57.468 -10.232 1.00 0.00 N ATOM 537 CA ALA A 36 29.546 58.891 -9.942 1.00 0.00 C ATOM 538 C ALA A 36 30.982 59.384 -9.959 1.00 0.00 C ATOM 539 O ALA A 36 31.886 58.631 -10.296 1.00 0.00 O ATOM 540 CB ALA A 36 28.913 59.162 -8.586 1.00 0.00 C ATOM 0 H ALA A 36 30.317 56.953 -9.885 1.00 0.00 H new ATOM 0 HA ALA A 36 28.981 59.426 -10.706 1.00 0.00 H new ATOM 0 HB1 ALA A 36 28.946 60.231 -8.376 1.00 0.00 H new ATOM 0 HB2 ALA A 36 27.876 58.825 -8.595 1.00 0.00 H new ATOM 0 HB3 ALA A 36 29.463 58.624 -7.814 1.00 0.00 H new ATOM 546 N HIS A 37 31.182 60.644 -9.621 1.00 0.00 N ATOM 547 CA HIS A 37 32.517 61.214 -9.494 1.00 0.00 C ATOM 548 C HIS A 37 32.501 62.305 -8.440 1.00 0.00 C ATOM 549 O HIS A 37 31.439 62.666 -7.950 1.00 0.00 O ATOM 550 CB HIS A 37 33.015 61.784 -10.825 1.00 0.00 C ATOM 551 CG HIS A 37 33.455 60.745 -11.810 1.00 0.00 C ATOM 552 ND1 HIS A 37 34.320 59.722 -11.494 1.00 0.00 N ATOM 553 CD2 HIS A 37 33.162 60.593 -13.122 1.00 0.00 C ATOM 554 CE1 HIS A 37 34.542 58.992 -12.569 1.00 0.00 C ATOM 555 NE2 HIS A 37 33.848 59.492 -13.576 1.00 0.00 N ATOM 0 H HIS A 37 30.428 61.303 -9.426 1.00 0.00 H new ATOM 0 HA HIS A 37 33.200 60.418 -9.197 1.00 0.00 H new ATOM 0 HB2 HIS A 37 32.220 62.380 -11.273 1.00 0.00 H new ATOM 0 HB3 HIS A 37 33.848 62.459 -10.630 1.00 0.00 H new ATOM 0 HD2 HIS A 37 32.508 61.223 -13.707 1.00 0.00 H new ATOM 0 HE1 HIS A 37 35.186 58.126 -12.618 1.00 0.00 H new ATOM 0 HE2 HIS A 37 33.825 59.124 -14.527 1.00 0.00 H new ATOM 564 N LEU A 38 33.670 62.795 -8.059 1.00 0.00 N ATOM 565 CA LEU A 38 33.752 63.932 -7.147 1.00 0.00 C ATOM 566 C LEU A 38 33.135 65.168 -7.793 1.00 0.00 C ATOM 567 O LEU A 38 33.036 65.242 -9.020 1.00 0.00 O ATOM 568 CB LEU A 38 35.204 64.221 -6.761 1.00 0.00 C ATOM 569 CG LEU A 38 35.751 63.430 -5.570 1.00 0.00 C ATOM 570 CD1 LEU A 38 34.898 63.660 -4.331 1.00 0.00 C ATOM 571 CD2 LEU A 38 35.833 61.950 -5.900 1.00 0.00 C ATOM 0 H LEU A 38 34.572 62.428 -8.363 1.00 0.00 H new ATOM 0 HA LEU A 38 33.197 63.681 -6.243 1.00 0.00 H new ATOM 0 HB2 LEU A 38 35.836 64.021 -7.626 1.00 0.00 H new ATOM 0 HB3 LEU A 38 35.296 65.284 -6.539 1.00 0.00 H new ATOM 0 HG LEU A 38 36.759 63.788 -5.359 1.00 0.00 H new ATOM 0 HD11 LEU A 38 35.306 63.088 -3.497 1.00 0.00 H new ATOM 0 HD12 LEU A 38 34.901 64.721 -4.079 1.00 0.00 H new ATOM 0 HD13 LEU A 38 33.876 63.336 -4.528 1.00 0.00 H new ATOM 0 HD21 LEU A 38 36.224 61.407 -5.040 1.00 0.00 H new ATOM 0 HD22 LEU A 38 34.839 61.576 -6.144 1.00 0.00 H new ATOM 0 HD23 LEU A 38 36.495 61.804 -6.753 1.00 0.00 H new ATOM 583 N MET A 39 32.718 66.128 -6.972 1.00 0.00 N ATOM 584 CA MET A 39 32.062 67.333 -7.472 1.00 0.00 C ATOM 585 C MET A 39 32.978 68.129 -8.391 1.00 0.00 C ATOM 586 O MET A 39 33.802 68.925 -7.942 1.00 0.00 O ATOM 587 CB MET A 39 31.605 68.216 -6.311 1.00 0.00 C ATOM 588 CG MET A 39 30.933 69.511 -6.745 1.00 0.00 C ATOM 589 SD MET A 39 29.480 69.236 -7.775 1.00 0.00 S ATOM 590 CE MET A 39 28.948 70.925 -8.055 1.00 0.00 C ATOM 0 H MET A 39 32.823 66.095 -5.958 1.00 0.00 H new ATOM 0 HA MET A 39 31.193 67.015 -8.048 1.00 0.00 H new ATOM 0 HB2 MET A 39 30.912 67.650 -5.689 1.00 0.00 H new ATOM 0 HB3 MET A 39 32.468 68.457 -5.690 1.00 0.00 H new ATOM 0 HG2 MET A 39 30.643 70.078 -5.860 1.00 0.00 H new ATOM 0 HG3 MET A 39 31.651 70.121 -7.294 1.00 0.00 H new ATOM 0 HE1 MET A 39 27.859 70.968 -8.058 1.00 0.00 H new ATOM 0 HE2 MET A 39 29.334 71.564 -7.261 1.00 0.00 H new ATOM 0 HE3 MET A 39 29.328 71.271 -9.016 1.00 0.00 H new ATOM 600 N THR A 40 32.823 67.914 -9.679 1.00 0.00 N ATOM 601 CA THR A 40 33.566 68.660 -10.667 1.00 0.00 C ATOM 602 C THR A 40 32.677 69.744 -11.258 1.00 0.00 C ATOM 603 O THR A 40 31.839 69.478 -12.123 1.00 0.00 O ATOM 604 CB THR A 40 34.135 67.732 -11.772 1.00 0.00 C ATOM 605 OG1 THR A 40 34.553 68.494 -12.911 1.00 0.00 O ATOM 606 CG2 THR A 40 33.120 66.678 -12.192 1.00 0.00 C ATOM 0 H THR A 40 32.183 67.222 -10.068 1.00 0.00 H new ATOM 0 HA THR A 40 34.421 69.130 -10.181 1.00 0.00 H new ATOM 0 HB THR A 40 35.002 67.221 -11.353 1.00 0.00 H new ATOM 0 HG1 THR A 40 35.336 69.034 -12.674 1.00 0.00 H new ATOM 0 HG21 THR A 40 33.552 66.045 -12.967 1.00 0.00 H new ATOM 0 HG22 THR A 40 32.854 66.065 -11.331 1.00 0.00 H new ATOM 0 HG23 THR A 40 32.226 67.167 -12.579 1.00 0.00 H new ATOM 614 N ILE A 41 32.837 70.954 -10.740 1.00 0.00 N ATOM 615 CA ILE A 41 32.031 72.088 -11.162 1.00 0.00 C ATOM 616 C ILE A 41 32.299 72.424 -12.624 1.00 0.00 C ATOM 617 O ILE A 41 33.409 72.807 -12.999 1.00 0.00 O ATOM 618 CB ILE A 41 32.299 73.325 -10.277 1.00 0.00 C ATOM 619 CG1 ILE A 41 31.965 73.006 -8.815 1.00 0.00 C ATOM 620 CG2 ILE A 41 31.493 74.521 -10.763 1.00 0.00 C ATOM 621 CD1 ILE A 41 32.140 74.179 -7.873 1.00 0.00 C ATOM 0 H ILE A 41 33.525 71.175 -10.020 1.00 0.00 H new ATOM 0 HA ILE A 41 30.983 71.808 -11.051 1.00 0.00 H new ATOM 0 HB ILE A 41 33.356 73.581 -10.347 1.00 0.00 H new ATOM 0 HG12 ILE A 41 30.934 72.657 -8.756 1.00 0.00 H new ATOM 0 HG13 ILE A 41 32.599 72.186 -8.479 1.00 0.00 H new ATOM 0 HG21 ILE A 41 31.697 75.381 -10.125 1.00 0.00 H new ATOM 0 HG22 ILE A 41 31.774 74.756 -11.790 1.00 0.00 H new ATOM 0 HG23 ILE A 41 30.430 74.284 -10.723 1.00 0.00 H new ATOM 0 HD11 ILE A 41 31.884 73.872 -6.859 1.00 0.00 H new ATOM 0 HD12 ILE A 41 33.176 74.516 -7.900 1.00 0.00 H new ATOM 0 HD13 ILE A 41 31.486 74.994 -8.182 1.00 0.00 H new ATOM 633 N SER A 42 31.273 72.264 -13.441 1.00 0.00 N ATOM 634 CA SER A 42 31.385 72.481 -14.869 1.00 0.00 C ATOM 635 C SER A 42 30.991 73.910 -15.241 1.00 0.00 C ATOM 636 O SER A 42 31.475 74.457 -16.235 1.00 0.00 O ATOM 637 CB SER A 42 30.512 71.466 -15.616 1.00 0.00 C ATOM 638 OG SER A 42 29.685 70.733 -14.717 1.00 0.00 O ATOM 0 H SER A 42 30.343 71.981 -13.133 1.00 0.00 H new ATOM 0 HA SER A 42 32.425 72.339 -15.162 1.00 0.00 H new ATOM 0 HB2 SER A 42 29.890 71.985 -16.345 1.00 0.00 H new ATOM 0 HB3 SER A 42 31.147 70.777 -16.173 1.00 0.00 H new ATOM 0 HG SER A 42 29.013 71.331 -14.329 1.00 0.00 H new ATOM 644 N THR A 43 30.114 74.515 -14.444 1.00 0.00 N ATOM 645 CA THR A 43 29.679 75.886 -14.693 1.00 0.00 C ATOM 646 C THR A 43 29.521 76.672 -13.393 1.00 0.00 C ATOM 647 O THR A 43 29.289 76.108 -12.324 1.00 0.00 O ATOM 648 CB THR A 43 28.347 75.932 -15.476 1.00 0.00 C ATOM 649 OG1 THR A 43 27.370 75.089 -14.856 1.00 0.00 O ATOM 650 CG2 THR A 43 28.541 75.506 -16.924 1.00 0.00 C ATOM 0 H THR A 43 29.692 74.080 -13.624 1.00 0.00 H new ATOM 0 HA THR A 43 30.460 76.348 -15.296 1.00 0.00 H new ATOM 0 HB THR A 43 27.995 76.963 -15.462 1.00 0.00 H new ATOM 0 HG1 THR A 43 26.537 75.590 -14.732 1.00 0.00 H new ATOM 0 HG21 THR A 43 27.586 75.549 -17.447 1.00 0.00 H new ATOM 0 HG22 THR A 43 29.251 76.176 -17.409 1.00 0.00 H new ATOM 0 HG23 THR A 43 28.926 74.487 -16.955 1.00 0.00 H new ATOM 658 N GLU A 44 29.643 77.984 -13.503 1.00 0.00 N ATOM 659 CA GLU A 44 29.517 78.876 -12.363 1.00 0.00 C ATOM 660 C GLU A 44 28.086 78.887 -11.825 1.00 0.00 C ATOM 661 O GLU A 44 27.873 78.941 -10.616 1.00 0.00 O ATOM 662 CB GLU A 44 29.962 80.270 -12.791 1.00 0.00 C ATOM 663 CG GLU A 44 29.231 80.773 -14.020 1.00 0.00 C ATOM 664 CD GLU A 44 30.004 81.841 -14.751 1.00 0.00 C ATOM 665 OE1 GLU A 44 30.883 81.470 -15.562 1.00 0.00 O ATOM 666 OE2 GLU A 44 29.734 83.032 -14.523 1.00 0.00 O ATOM 0 H GLU A 44 29.832 78.461 -14.385 1.00 0.00 H new ATOM 0 HA GLU A 44 30.152 78.525 -11.550 1.00 0.00 H new ATOM 0 HB2 GLU A 44 29.800 80.966 -11.968 1.00 0.00 H new ATOM 0 HB3 GLU A 44 31.033 80.258 -12.992 1.00 0.00 H new ATOM 0 HG2 GLU A 44 29.043 79.938 -14.695 1.00 0.00 H new ATOM 0 HG3 GLU A 44 28.259 81.169 -13.725 1.00 0.00 H new ATOM 673 N ALA A 45 27.108 78.819 -12.726 1.00 0.00 N ATOM 674 CA ALA A 45 25.705 78.741 -12.327 1.00 0.00 C ATOM 675 C ALA A 45 25.473 77.497 -11.478 1.00 0.00 C ATOM 676 O ALA A 45 24.767 77.537 -10.471 1.00 0.00 O ATOM 677 CB ALA A 45 24.804 78.726 -13.553 1.00 0.00 C ATOM 0 H ALA A 45 27.261 78.816 -13.734 1.00 0.00 H new ATOM 0 HA ALA A 45 25.459 79.621 -11.733 1.00 0.00 H new ATOM 0 HB1 ALA A 45 23.762 78.668 -13.238 1.00 0.00 H new ATOM 0 HB2 ALA A 45 24.958 79.638 -14.129 1.00 0.00 H new ATOM 0 HB3 ALA A 45 25.045 77.861 -14.171 1.00 0.00 H new ATOM 683 N GLU A 46 26.094 76.405 -11.900 1.00 0.00 N ATOM 684 CA GLU A 46 26.097 75.153 -11.156 1.00 0.00 C ATOM 685 C GLU A 46 26.529 75.388 -9.712 1.00 0.00 C ATOM 686 O GLU A 46 25.837 74.993 -8.771 1.00 0.00 O ATOM 687 CB GLU A 46 27.056 74.192 -11.848 1.00 0.00 C ATOM 688 CG GLU A 46 27.271 72.867 -11.148 1.00 0.00 C ATOM 689 CD GLU A 46 28.328 72.046 -11.853 1.00 0.00 C ATOM 690 OE1 GLU A 46 28.659 72.376 -13.014 1.00 0.00 O ATOM 691 OE2 GLU A 46 28.837 71.074 -11.262 1.00 0.00 O ATOM 0 H GLU A 46 26.615 76.362 -12.776 1.00 0.00 H new ATOM 0 HA GLU A 46 25.092 74.730 -11.136 1.00 0.00 H new ATOM 0 HB2 GLU A 46 26.683 73.995 -12.853 1.00 0.00 H new ATOM 0 HB3 GLU A 46 28.021 74.686 -11.957 1.00 0.00 H new ATOM 0 HG2 GLU A 46 27.571 73.042 -10.115 1.00 0.00 H new ATOM 0 HG3 GLU A 46 26.334 72.311 -11.118 1.00 0.00 H new ATOM 698 N GLN A 47 27.669 76.053 -9.552 1.00 0.00 N ATOM 699 CA GLN A 47 28.190 76.377 -8.229 1.00 0.00 C ATOM 700 C GLN A 47 27.184 77.206 -7.430 1.00 0.00 C ATOM 701 O GLN A 47 26.859 76.871 -6.294 1.00 0.00 O ATOM 702 CB GLN A 47 29.505 77.148 -8.344 1.00 0.00 C ATOM 703 CG GLN A 47 30.127 77.473 -6.994 1.00 0.00 C ATOM 704 CD GLN A 47 31.295 78.428 -7.106 1.00 0.00 C ATOM 705 OE1 GLN A 47 31.335 79.275 -7.992 1.00 0.00 O ATOM 706 NE2 GLN A 47 32.256 78.300 -6.204 1.00 0.00 N ATOM 0 H GLN A 47 28.251 76.379 -10.324 1.00 0.00 H new ATOM 0 HA GLN A 47 28.367 75.438 -7.705 1.00 0.00 H new ATOM 0 HB2 GLN A 47 30.212 76.563 -8.932 1.00 0.00 H new ATOM 0 HB3 GLN A 47 29.329 78.075 -8.889 1.00 0.00 H new ATOM 0 HG2 GLN A 47 29.368 77.908 -6.344 1.00 0.00 H new ATOM 0 HG3 GLN A 47 30.461 76.550 -6.521 1.00 0.00 H new ATOM 0 HE21 GLN A 47 32.186 77.583 -5.482 1.00 0.00 H new ATOM 0 HE22 GLN A 47 33.066 78.919 -6.231 1.00 0.00 H new ATOM 715 N ASN A 48 26.685 78.274 -8.046 1.00 0.00 N ATOM 716 CA ASN A 48 25.768 79.204 -7.384 1.00 0.00 C ATOM 717 C ASN A 48 24.522 78.503 -6.847 1.00 0.00 C ATOM 718 O ASN A 48 23.945 78.923 -5.845 1.00 0.00 O ATOM 719 CB ASN A 48 25.354 80.322 -8.347 1.00 0.00 C ATOM 720 CG ASN A 48 26.394 81.424 -8.468 1.00 0.00 C ATOM 721 OD1 ASN A 48 26.372 82.395 -7.713 1.00 0.00 O ATOM 722 ND2 ASN A 48 27.307 81.288 -9.418 1.00 0.00 N ATOM 0 H ASN A 48 26.902 78.520 -9.012 1.00 0.00 H new ATOM 0 HA ASN A 48 26.304 79.629 -6.535 1.00 0.00 H new ATOM 0 HB2 ASN A 48 25.171 79.894 -9.333 1.00 0.00 H new ATOM 0 HB3 ASN A 48 24.413 80.755 -8.008 1.00 0.00 H new ATOM 0 HD21 ASN A 48 28.024 82.003 -9.542 1.00 0.00 H new ATOM 0 HD22 ASN A 48 27.293 80.468 -10.025 1.00 0.00 H new ATOM 729 N PHE A 49 24.098 77.439 -7.512 1.00 0.00 N ATOM 730 CA PHE A 49 22.911 76.717 -7.082 1.00 0.00 C ATOM 731 C PHE A 49 23.236 75.624 -6.067 1.00 0.00 C ATOM 732 O PHE A 49 22.498 75.444 -5.100 1.00 0.00 O ATOM 733 CB PHE A 49 22.159 76.149 -8.288 1.00 0.00 C ATOM 734 CG PHE A 49 21.288 77.173 -8.964 1.00 0.00 C ATOM 735 CD1 PHE A 49 21.826 78.085 -9.858 1.00 0.00 C ATOM 736 CD2 PHE A 49 19.929 77.222 -8.700 1.00 0.00 C ATOM 737 CE1 PHE A 49 21.026 79.026 -10.475 1.00 0.00 C ATOM 738 CE2 PHE A 49 19.122 78.161 -9.314 1.00 0.00 C ATOM 739 CZ PHE A 49 19.672 79.064 -10.202 1.00 0.00 C ATOM 0 H PHE A 49 24.553 77.060 -8.343 1.00 0.00 H new ATOM 0 HA PHE A 49 22.261 77.431 -6.576 1.00 0.00 H new ATOM 0 HB2 PHE A 49 22.878 75.757 -9.008 1.00 0.00 H new ATOM 0 HB3 PHE A 49 21.543 75.310 -7.965 1.00 0.00 H new ATOM 0 HD1 PHE A 49 22.884 78.059 -10.075 1.00 0.00 H new ATOM 0 HD2 PHE A 49 19.495 76.518 -8.006 1.00 0.00 H new ATOM 0 HE1 PHE A 49 21.458 79.731 -11.170 1.00 0.00 H new ATOM 0 HE2 PHE A 49 18.064 78.188 -9.100 1.00 0.00 H new ATOM 0 HZ PHE A 49 19.044 79.800 -10.683 1.00 0.00 H new ATOM 749 N ILE A 50 24.347 74.914 -6.255 1.00 0.00 N ATOM 750 CA ILE A 50 24.685 73.806 -5.362 1.00 0.00 C ATOM 751 C ILE A 50 25.060 74.310 -3.963 1.00 0.00 C ATOM 752 O ILE A 50 24.834 73.622 -2.967 1.00 0.00 O ATOM 753 CB ILE A 50 25.826 72.918 -5.929 1.00 0.00 C ATOM 754 CG1 ILE A 50 26.003 71.652 -5.081 1.00 0.00 C ATOM 755 CG2 ILE A 50 27.138 73.686 -5.998 1.00 0.00 C ATOM 756 CD1 ILE A 50 24.769 70.776 -5.025 1.00 0.00 C ATOM 0 H ILE A 50 25.019 75.081 -7.004 1.00 0.00 H new ATOM 0 HA ILE A 50 23.789 73.190 -5.286 1.00 0.00 H new ATOM 0 HB ILE A 50 25.544 72.627 -6.941 1.00 0.00 H new ATOM 0 HG12 ILE A 50 26.832 71.070 -5.483 1.00 0.00 H new ATOM 0 HG13 ILE A 50 26.278 71.941 -4.067 1.00 0.00 H new ATOM 0 HG21 ILE A 50 27.918 73.039 -6.399 1.00 0.00 H new ATOM 0 HG22 ILE A 50 27.018 74.554 -6.647 1.00 0.00 H new ATOM 0 HG23 ILE A 50 27.419 74.017 -4.998 1.00 0.00 H new ATOM 0 HD11 ILE A 50 24.972 69.901 -4.407 1.00 0.00 H new ATOM 0 HD12 ILE A 50 23.942 71.340 -4.595 1.00 0.00 H new ATOM 0 HD13 ILE A 50 24.504 70.456 -6.033 1.00 0.00 H new ATOM 768 N ILE A 51 25.592 75.528 -3.884 1.00 0.00 N ATOM 769 CA ILE A 51 26.002 76.096 -2.600 1.00 0.00 C ATOM 770 C ILE A 51 24.793 76.436 -1.729 1.00 0.00 C ATOM 771 O ILE A 51 24.935 76.786 -0.556 1.00 0.00 O ATOM 772 CB ILE A 51 26.877 77.357 -2.775 1.00 0.00 C ATOM 773 CG1 ILE A 51 26.120 78.433 -3.557 1.00 0.00 C ATOM 774 CG2 ILE A 51 28.186 76.998 -3.465 1.00 0.00 C ATOM 775 CD1 ILE A 51 26.884 79.734 -3.701 1.00 0.00 C ATOM 0 H ILE A 51 25.749 76.137 -4.687 1.00 0.00 H new ATOM 0 HA ILE A 51 26.597 75.329 -2.104 1.00 0.00 H new ATOM 0 HB ILE A 51 27.110 77.761 -1.790 1.00 0.00 H new ATOM 0 HG12 ILE A 51 25.884 78.049 -4.549 1.00 0.00 H new ATOM 0 HG13 ILE A 51 25.172 78.632 -3.058 1.00 0.00 H new ATOM 0 HG21 ILE A 51 28.793 77.895 -3.582 1.00 0.00 H new ATOM 0 HG22 ILE A 51 28.728 76.270 -2.862 1.00 0.00 H new ATOM 0 HG23 ILE A 51 27.975 76.572 -4.446 1.00 0.00 H new ATOM 0 HD11 ILE A 51 26.284 80.447 -4.266 1.00 0.00 H new ATOM 0 HD12 ILE A 51 27.098 80.142 -2.713 1.00 0.00 H new ATOM 0 HD13 ILE A 51 27.820 79.550 -4.228 1.00 0.00 H new ATOM 787 N GLN A 52 23.604 76.345 -2.315 1.00 0.00 N ATOM 788 CA GLN A 52 22.368 76.527 -1.568 1.00 0.00 C ATOM 789 C GLN A 52 21.915 75.201 -0.962 1.00 0.00 C ATOM 790 O GLN A 52 21.106 75.172 -0.038 1.00 0.00 O ATOM 791 CB GLN A 52 21.280 77.110 -2.470 1.00 0.00 C ATOM 792 CG GLN A 52 21.592 78.520 -2.948 1.00 0.00 C ATOM 793 CD GLN A 52 20.491 79.104 -3.807 1.00 0.00 C ATOM 794 OE1 GLN A 52 20.609 78.937 -5.111 1.00 0.00 O flip ATOM 795 NE2 GLN A 52 19.554 79.716 -3.302 1.00 0.00 N flip ATOM 0 H GLN A 52 23.472 76.146 -3.307 1.00 0.00 H new ATOM 0 HA GLN A 52 22.551 77.231 -0.756 1.00 0.00 H new ATOM 0 HB2 GLN A 52 21.148 76.461 -3.335 1.00 0.00 H new ATOM 0 HB3 GLN A 52 20.334 77.117 -1.929 1.00 0.00 H new ATOM 0 HG2 GLN A 52 21.753 79.165 -2.084 1.00 0.00 H new ATOM 0 HG3 GLN A 52 22.523 78.509 -3.516 1.00 0.00 H new ATOM 0 HE21 GLN A 52 19.501 79.822 -2.289 1.00 0.00 H new ATOM 0 HE22 GLN A 52 18.829 80.118 -3.896 1.00 0.00 H new ATOM 804 N PHE A 53 22.449 74.107 -1.495 1.00 0.00 N ATOM 805 CA PHE A 53 22.176 72.776 -0.965 1.00 0.00 C ATOM 806 C PHE A 53 23.242 72.389 0.048 1.00 0.00 C ATOM 807 O PHE A 53 23.050 71.490 0.865 1.00 0.00 O ATOM 808 CB PHE A 53 22.148 71.742 -2.093 1.00 0.00 C ATOM 809 CG PHE A 53 21.023 71.926 -3.069 1.00 0.00 C ATOM 810 CD1 PHE A 53 19.773 71.391 -2.812 1.00 0.00 C ATOM 811 CD2 PHE A 53 21.221 72.625 -4.249 1.00 0.00 C ATOM 812 CE1 PHE A 53 18.737 71.551 -3.710 1.00 0.00 C ATOM 813 CE2 PHE A 53 20.190 72.790 -5.151 1.00 0.00 C ATOM 814 CZ PHE A 53 18.945 72.252 -4.882 1.00 0.00 C ATOM 0 H PHE A 53 23.077 74.117 -2.299 1.00 0.00 H new ATOM 0 HA PHE A 53 21.201 72.796 -0.478 1.00 0.00 H new ATOM 0 HB2 PHE A 53 23.094 71.785 -2.634 1.00 0.00 H new ATOM 0 HB3 PHE A 53 22.076 70.746 -1.656 1.00 0.00 H new ATOM 0 HD1 PHE A 53 19.606 70.841 -1.897 1.00 0.00 H new ATOM 0 HD2 PHE A 53 22.192 73.045 -4.465 1.00 0.00 H new ATOM 0 HE1 PHE A 53 17.766 71.129 -3.497 1.00 0.00 H new ATOM 0 HE2 PHE A 53 20.355 73.339 -6.066 1.00 0.00 H new ATOM 0 HZ PHE A 53 18.137 72.380 -5.587 1.00 0.00 H new ATOM 824 N LEU A 54 24.379 73.063 -0.037 1.00 0.00 N ATOM 825 CA LEU A 54 25.491 72.811 0.864 1.00 0.00 C ATOM 826 C LEU A 54 25.296 73.537 2.187 1.00 0.00 C ATOM 827 O LEU A 54 24.999 74.734 2.206 1.00 0.00 O ATOM 828 CB LEU A 54 26.802 73.276 0.228 1.00 0.00 C ATOM 829 CG LEU A 54 27.135 72.650 -1.124 1.00 0.00 C ATOM 830 CD1 LEU A 54 28.416 73.246 -1.681 1.00 0.00 C ATOM 831 CD2 LEU A 54 27.258 71.142 -0.997 1.00 0.00 C ATOM 0 H LEU A 54 24.555 73.794 -0.727 1.00 0.00 H new ATOM 0 HA LEU A 54 25.532 71.738 1.051 1.00 0.00 H new ATOM 0 HB2 LEU A 54 26.763 74.359 0.108 1.00 0.00 H new ATOM 0 HB3 LEU A 54 27.617 73.061 0.919 1.00 0.00 H new ATOM 0 HG LEU A 54 26.323 72.869 -1.817 1.00 0.00 H new ATOM 0 HD11 LEU A 54 28.640 72.790 -2.645 1.00 0.00 H new ATOM 0 HD12 LEU A 54 28.292 74.321 -1.809 1.00 0.00 H new ATOM 0 HD13 LEU A 54 29.237 73.055 -0.990 1.00 0.00 H new ATOM 0 HD21 LEU A 54 27.496 70.713 -1.970 1.00 0.00 H new ATOM 0 HD22 LEU A 54 28.052 70.900 -0.290 1.00 0.00 H new ATOM 0 HD23 LEU A 54 26.315 70.729 -0.639 1.00 0.00 H new ATOM 843 N ASP A 55 25.454 72.812 3.287 1.00 0.00 N ATOM 844 CA ASP A 55 25.453 73.433 4.604 1.00 0.00 C ATOM 845 C ASP A 55 26.649 74.363 4.718 1.00 0.00 C ATOM 846 O ASP A 55 27.761 74.001 4.331 1.00 0.00 O ATOM 847 CB ASP A 55 25.512 72.385 5.712 1.00 0.00 C ATOM 848 CG ASP A 55 25.328 72.995 7.085 1.00 0.00 C ATOM 849 OD1 ASP A 55 26.273 73.646 7.579 1.00 0.00 O ATOM 850 OD2 ASP A 55 24.240 72.826 7.676 1.00 0.00 O ATOM 0 H ASP A 55 25.584 71.800 3.294 1.00 0.00 H new ATOM 0 HA ASP A 55 24.526 73.995 4.720 1.00 0.00 H new ATOM 0 HB2 ASP A 55 24.739 71.635 5.543 1.00 0.00 H new ATOM 0 HB3 ASP A 55 26.471 71.869 5.671 1.00 0.00 H new ATOM 855 N ARG A 56 26.428 75.542 5.274 1.00 0.00 N ATOM 856 CA ARG A 56 27.424 76.602 5.234 1.00 0.00 C ATOM 857 C ARG A 56 28.419 76.519 6.389 1.00 0.00 C ATOM 858 O ARG A 56 29.127 77.487 6.665 1.00 0.00 O ATOM 859 CB ARG A 56 26.735 77.969 5.228 1.00 0.00 C ATOM 860 CG ARG A 56 25.837 78.183 4.020 1.00 0.00 C ATOM 861 CD ARG A 56 25.308 79.606 3.957 1.00 0.00 C ATOM 862 NE ARG A 56 24.477 79.827 2.772 1.00 0.00 N ATOM 863 CZ ARG A 56 24.252 81.026 2.229 1.00 0.00 C ATOM 864 NH1 ARG A 56 24.792 82.118 2.758 1.00 0.00 N ATOM 865 NH2 ARG A 56 23.487 81.134 1.149 1.00 0.00 N ATOM 0 H ARG A 56 25.566 75.791 5.760 1.00 0.00 H new ATOM 0 HA ARG A 56 27.994 76.472 4.314 1.00 0.00 H new ATOM 0 HB2 ARG A 56 26.142 78.073 6.136 1.00 0.00 H new ATOM 0 HB3 ARG A 56 27.494 78.751 5.251 1.00 0.00 H new ATOM 0 HG2 ARG A 56 26.393 77.961 3.109 1.00 0.00 H new ATOM 0 HG3 ARG A 56 25.000 77.485 4.060 1.00 0.00 H new ATOM 0 HD2 ARG A 56 24.725 79.817 4.854 1.00 0.00 H new ATOM 0 HD3 ARG A 56 26.145 80.304 3.949 1.00 0.00 H new ATOM 0 HE ARG A 56 24.043 79.015 2.334 1.00 0.00 H new ATOM 0 HH11 ARG A 56 25.384 82.045 3.585 1.00 0.00 H new ATOM 0 HH12 ARG A 56 24.615 83.030 2.337 1.00 0.00 H new ATOM 0 HH21 ARG A 56 23.071 80.301 0.734 1.00 0.00 H new ATOM 0 HH22 ARG A 56 23.316 82.050 0.735 1.00 0.00 H new ATOM 879 N ARG A 57 28.484 75.380 7.068 1.00 0.00 N ATOM 880 CA ARG A 57 29.490 75.200 8.109 1.00 0.00 C ATOM 881 C ARG A 57 30.503 74.124 7.715 1.00 0.00 C ATOM 882 O ARG A 57 31.541 73.979 8.359 1.00 0.00 O ATOM 883 CB ARG A 57 28.843 74.848 9.457 1.00 0.00 C ATOM 884 CG ARG A 57 28.528 73.371 9.631 1.00 0.00 C ATOM 885 CD ARG A 57 27.758 73.107 10.914 1.00 0.00 C ATOM 886 NE ARG A 57 26.487 73.824 10.932 1.00 0.00 N ATOM 887 CZ ARG A 57 25.325 73.285 10.564 1.00 0.00 C ATOM 888 NH1 ARG A 57 25.265 72.004 10.220 1.00 0.00 N ATOM 889 NH2 ARG A 57 24.221 74.024 10.546 1.00 0.00 N ATOM 0 H ARG A 57 27.866 74.582 6.922 1.00 0.00 H new ATOM 0 HA ARG A 57 30.016 76.149 8.219 1.00 0.00 H new ATOM 0 HB2 ARG A 57 29.509 75.163 10.260 1.00 0.00 H new ATOM 0 HB3 ARG A 57 27.921 75.420 9.565 1.00 0.00 H new ATOM 0 HG2 ARG A 57 27.946 73.020 8.779 1.00 0.00 H new ATOM 0 HG3 ARG A 57 29.456 72.800 9.640 1.00 0.00 H new ATOM 0 HD2 ARG A 57 27.575 72.037 11.016 1.00 0.00 H new ATOM 0 HD3 ARG A 57 28.360 73.411 11.770 1.00 0.00 H new ATOM 0 HE ARG A 57 26.488 74.795 11.245 1.00 0.00 H new ATOM 0 HH11 ARG A 57 26.109 71.431 10.237 1.00 0.00 H new ATOM 0 HH12 ARG A 57 24.375 71.593 9.939 1.00 0.00 H new ATOM 0 HH21 ARG A 57 24.261 75.007 10.814 1.00 0.00 H new ATOM 0 HH22 ARG A 57 23.333 73.608 10.264 1.00 0.00 H new ATOM 903 N LEU A 58 30.206 73.363 6.664 1.00 0.00 N ATOM 904 CA LEU A 58 31.116 72.304 6.233 1.00 0.00 C ATOM 905 C LEU A 58 31.983 72.748 5.053 1.00 0.00 C ATOM 906 O LEU A 58 31.704 73.750 4.397 1.00 0.00 O ATOM 907 CB LEU A 58 30.359 71.021 5.858 1.00 0.00 C ATOM 908 CG LEU A 58 29.678 70.267 7.010 1.00 0.00 C ATOM 909 CD1 LEU A 58 30.554 70.259 8.254 1.00 0.00 C ATOM 910 CD2 LEU A 58 28.312 70.854 7.315 1.00 0.00 C ATOM 0 H LEU A 58 29.359 73.456 6.104 1.00 0.00 H new ATOM 0 HA LEU A 58 31.764 72.092 7.083 1.00 0.00 H new ATOM 0 HB2 LEU A 58 29.598 71.277 5.120 1.00 0.00 H new ATOM 0 HB3 LEU A 58 31.059 70.341 5.372 1.00 0.00 H new ATOM 0 HG LEU A 58 29.537 69.234 6.692 1.00 0.00 H new ATOM 0 HD11 LEU A 58 30.046 69.718 9.053 1.00 0.00 H new ATOM 0 HD12 LEU A 58 31.501 69.769 8.029 1.00 0.00 H new ATOM 0 HD13 LEU A 58 30.743 71.284 8.573 1.00 0.00 H new ATOM 0 HD21 LEU A 58 27.853 70.301 8.134 1.00 0.00 H new ATOM 0 HD22 LEU A 58 28.421 71.900 7.600 1.00 0.00 H new ATOM 0 HD23 LEU A 58 27.680 70.783 6.430 1.00 0.00 H new ATOM 922 N SER A 59 33.043 71.986 4.803 1.00 0.00 N ATOM 923 CA SER A 59 33.939 72.227 3.679 1.00 0.00 C ATOM 924 C SER A 59 33.957 70.995 2.776 1.00 0.00 C ATOM 925 O SER A 59 34.401 69.924 3.191 1.00 0.00 O ATOM 926 CB SER A 59 35.346 72.529 4.196 1.00 0.00 C ATOM 927 OG SER A 59 35.319 73.587 5.136 1.00 0.00 O ATOM 0 H SER A 59 33.305 71.183 5.375 1.00 0.00 H new ATOM 0 HA SER A 59 33.588 73.085 3.105 1.00 0.00 H new ATOM 0 HB2 SER A 59 35.768 71.637 4.658 1.00 0.00 H new ATOM 0 HB3 SER A 59 35.996 72.794 3.362 1.00 0.00 H new ATOM 0 HG SER A 59 36.228 73.764 5.456 1.00 0.00 H new ATOM 933 N TYR A 60 33.459 71.141 1.557 1.00 0.00 N ATOM 934 CA TYR A 60 33.230 69.993 0.681 1.00 0.00 C ATOM 935 C TYR A 60 34.319 69.872 -0.383 1.00 0.00 C ATOM 936 O TYR A 60 34.586 70.825 -1.110 1.00 0.00 O ATOM 937 CB TYR A 60 31.868 70.127 -0.003 1.00 0.00 C ATOM 938 CG TYR A 60 30.711 70.287 0.958 1.00 0.00 C ATOM 939 CD1 TYR A 60 30.438 71.516 1.544 1.00 0.00 C ATOM 940 CD2 TYR A 60 29.897 69.210 1.284 1.00 0.00 C ATOM 941 CE1 TYR A 60 29.391 71.668 2.428 1.00 0.00 C ATOM 942 CE2 TYR A 60 28.847 69.354 2.170 1.00 0.00 C ATOM 943 CZ TYR A 60 28.598 70.587 2.737 1.00 0.00 C ATOM 944 OH TYR A 60 27.563 70.737 3.629 1.00 0.00 O ATOM 0 H TYR A 60 33.205 72.041 1.149 1.00 0.00 H new ATOM 0 HA TYR A 60 33.253 69.094 1.298 1.00 0.00 H new ATOM 0 HB2 TYR A 60 31.892 70.986 -0.673 1.00 0.00 H new ATOM 0 HB3 TYR A 60 31.695 69.246 -0.621 1.00 0.00 H new ATOM 0 HD1 TYR A 60 31.057 72.368 1.303 1.00 0.00 H new ATOM 0 HD2 TYR A 60 30.088 68.245 0.838 1.00 0.00 H new ATOM 0 HE1 TYR A 60 29.194 72.631 2.876 1.00 0.00 H new ATOM 0 HE2 TYR A 60 28.225 68.507 2.417 1.00 0.00 H new ATOM 0 HH TYR A 60 27.099 69.881 3.738 1.00 0.00 H new ATOM 954 N PHE A 61 34.936 68.697 -0.471 1.00 0.00 N ATOM 955 CA PHE A 61 35.953 68.433 -1.491 1.00 0.00 C ATOM 956 C PHE A 61 35.379 68.537 -2.900 1.00 0.00 C ATOM 957 O PHE A 61 34.255 68.095 -3.163 1.00 0.00 O ATOM 958 CB PHE A 61 36.565 67.041 -1.304 1.00 0.00 C ATOM 959 CG PHE A 61 37.644 66.978 -0.262 1.00 0.00 C ATOM 960 CD1 PHE A 61 38.925 67.423 -0.553 1.00 0.00 C ATOM 961 CD2 PHE A 61 37.386 66.465 0.996 1.00 0.00 C ATOM 962 CE1 PHE A 61 39.928 67.359 0.393 1.00 0.00 C ATOM 963 CE2 PHE A 61 38.386 66.399 1.947 1.00 0.00 C ATOM 964 CZ PHE A 61 39.658 66.848 1.646 1.00 0.00 C ATOM 0 H PHE A 61 34.751 67.910 0.151 1.00 0.00 H new ATOM 0 HA PHE A 61 36.725 69.192 -1.370 1.00 0.00 H new ATOM 0 HB2 PHE A 61 35.774 66.342 -1.034 1.00 0.00 H new ATOM 0 HB3 PHE A 61 36.975 66.706 -2.257 1.00 0.00 H new ATOM 0 HD1 PHE A 61 39.140 67.825 -1.532 1.00 0.00 H new ATOM 0 HD2 PHE A 61 36.394 66.113 1.237 1.00 0.00 H new ATOM 0 HE1 PHE A 61 40.922 67.708 0.153 1.00 0.00 H new ATOM 0 HE2 PHE A 61 38.174 65.996 2.926 1.00 0.00 H new ATOM 0 HZ PHE A 61 40.439 66.799 2.390 1.00 0.00 H new ATOM 974 N LEU A 62 36.158 69.124 -3.803 1.00 0.00 N ATOM 975 CA LEU A 62 35.781 69.205 -5.206 1.00 0.00 C ATOM 976 C LEU A 62 36.592 68.208 -6.026 1.00 0.00 C ATOM 977 O LEU A 62 37.673 67.795 -5.618 1.00 0.00 O ATOM 978 CB LEU A 62 35.981 70.623 -5.744 1.00 0.00 C ATOM 979 CG LEU A 62 35.116 71.694 -5.078 1.00 0.00 C ATOM 980 CD1 LEU A 62 35.330 73.042 -5.743 1.00 0.00 C ATOM 981 CD2 LEU A 62 33.648 71.302 -5.133 1.00 0.00 C ATOM 0 H LEU A 62 37.058 69.552 -3.585 1.00 0.00 H new ATOM 0 HA LEU A 62 34.723 68.956 -5.292 1.00 0.00 H new ATOM 0 HB2 LEU A 62 37.029 70.897 -5.623 1.00 0.00 H new ATOM 0 HB3 LEU A 62 35.773 70.622 -6.814 1.00 0.00 H new ATOM 0 HG LEU A 62 35.414 71.775 -4.033 1.00 0.00 H new ATOM 0 HD11 LEU A 62 34.706 73.791 -5.256 1.00 0.00 H new ATOM 0 HD12 LEU A 62 36.378 73.329 -5.655 1.00 0.00 H new ATOM 0 HD13 LEU A 62 35.060 72.975 -6.797 1.00 0.00 H new ATOM 0 HD21 LEU A 62 33.047 72.075 -4.655 1.00 0.00 H new ATOM 0 HD22 LEU A 62 33.339 71.193 -6.173 1.00 0.00 H new ATOM 0 HD23 LEU A 62 33.504 70.356 -4.611 1.00 0.00 H new ATOM 993 N GLY A 63 36.077 67.854 -7.194 1.00 0.00 N ATOM 994 CA GLY A 63 36.645 66.772 -7.974 1.00 0.00 C ATOM 995 C GLY A 63 37.828 67.170 -8.829 1.00 0.00 C ATOM 996 O GLY A 63 37.835 66.924 -10.032 1.00 0.00 O ATOM 0 H GLY A 63 35.266 68.303 -7.620 1.00 0.00 H new ATOM 0 HA2 GLY A 63 36.954 65.976 -7.297 1.00 0.00 H new ATOM 0 HA3 GLY A 63 35.869 66.359 -8.619 1.00 0.00 H new ATOM 1000 N LEU A 64 38.828 67.770 -8.212 1.00 0.00 N ATOM 1001 CA LEU A 64 40.075 68.082 -8.894 1.00 0.00 C ATOM 1002 C LEU A 64 41.228 67.697 -7.987 1.00 0.00 C ATOM 1003 O LEU A 64 41.084 67.723 -6.765 1.00 0.00 O ATOM 1004 CB LEU A 64 40.169 69.573 -9.265 1.00 0.00 C ATOM 1005 CG LEU A 64 40.559 70.530 -8.133 1.00 0.00 C ATOM 1006 CD1 LEU A 64 40.798 71.924 -8.686 1.00 0.00 C ATOM 1007 CD2 LEU A 64 39.485 70.571 -7.060 1.00 0.00 C ATOM 0 H LEU A 64 38.803 68.054 -7.233 1.00 0.00 H new ATOM 0 HA LEU A 64 40.115 67.517 -9.826 1.00 0.00 H new ATOM 0 HB2 LEU A 64 40.896 69.680 -10.070 1.00 0.00 H new ATOM 0 HB3 LEU A 64 39.204 69.888 -9.663 1.00 0.00 H new ATOM 0 HG LEU A 64 41.480 70.163 -7.679 1.00 0.00 H new ATOM 0 HD11 LEU A 64 41.074 72.595 -7.873 1.00 0.00 H new ATOM 0 HD12 LEU A 64 41.604 71.891 -9.419 1.00 0.00 H new ATOM 0 HD13 LEU A 64 39.888 72.287 -9.163 1.00 0.00 H new ATOM 0 HD21 LEU A 64 39.787 71.257 -6.269 1.00 0.00 H new ATOM 0 HD22 LEU A 64 38.547 70.912 -7.497 1.00 0.00 H new ATOM 0 HD23 LEU A 64 39.350 69.573 -6.642 1.00 0.00 H new ATOM 1019 N ARG A 65 42.360 67.325 -8.560 1.00 0.00 N ATOM 1020 CA ARG A 65 43.497 66.937 -7.744 1.00 0.00 C ATOM 1021 C ARG A 65 44.807 67.175 -8.471 1.00 0.00 C ATOM 1022 O ARG A 65 44.901 67.028 -9.693 1.00 0.00 O ATOM 1023 CB ARG A 65 43.418 65.453 -7.340 1.00 0.00 C ATOM 1024 CG ARG A 65 43.999 64.509 -8.385 1.00 0.00 C ATOM 1025 CD ARG A 65 43.942 63.048 -7.959 1.00 0.00 C ATOM 1026 NE ARG A 65 44.651 62.797 -6.701 1.00 0.00 N ATOM 1027 CZ ARG A 65 44.514 61.681 -5.977 1.00 0.00 C ATOM 1028 NH1 ARG A 65 43.636 60.747 -6.337 1.00 0.00 N ATOM 1029 NH2 ARG A 65 45.243 61.507 -4.883 1.00 0.00 N ATOM 0 H ARG A 65 42.515 67.284 -9.567 1.00 0.00 H new ATOM 0 HA ARG A 65 43.463 67.557 -6.848 1.00 0.00 H new ATOM 0 HB2 ARG A 65 43.949 65.312 -6.399 1.00 0.00 H new ATOM 0 HB3 ARG A 65 42.376 65.188 -7.161 1.00 0.00 H new ATOM 0 HG2 ARG A 65 43.454 64.631 -9.321 1.00 0.00 H new ATOM 0 HG3 ARG A 65 45.035 64.785 -8.581 1.00 0.00 H new ATOM 0 HD2 ARG A 65 42.900 62.746 -7.851 1.00 0.00 H new ATOM 0 HD3 ARG A 65 44.374 62.428 -8.745 1.00 0.00 H new ATOM 0 HE ARG A 65 45.287 63.517 -6.357 1.00 0.00 H new ATOM 0 HH11 ARG A 65 43.062 60.880 -7.170 1.00 0.00 H new ATOM 0 HH12 ARG A 65 43.537 59.898 -5.780 1.00 0.00 H new ATOM 0 HH21 ARG A 65 45.908 62.224 -4.594 1.00 0.00 H new ATOM 0 HH22 ARG A 65 45.139 60.656 -4.331 1.00 0.00 H new ATOM 1043 N ASP A 66 45.798 67.566 -7.706 1.00 0.00 N ATOM 1044 CA ASP A 66 47.175 67.493 -8.137 1.00 0.00 C ATOM 1045 C ASP A 66 47.839 66.370 -7.357 1.00 0.00 C ATOM 1046 O ASP A 66 48.287 66.555 -6.222 1.00 0.00 O ATOM 1047 CB ASP A 66 47.902 68.814 -7.925 1.00 0.00 C ATOM 1048 CG ASP A 66 49.301 68.767 -8.484 1.00 0.00 C ATOM 1049 OD1 ASP A 66 49.461 68.358 -9.652 1.00 0.00 O ATOM 1050 OD2 ASP A 66 50.252 69.108 -7.759 1.00 0.00 O ATOM 0 H ASP A 66 45.673 67.944 -6.767 1.00 0.00 H new ATOM 0 HA ASP A 66 47.219 67.291 -9.207 1.00 0.00 H new ATOM 0 HB2 ASP A 66 47.344 69.619 -8.403 1.00 0.00 H new ATOM 0 HB3 ASP A 66 47.941 69.043 -6.860 1.00 0.00 H new ATOM 1055 N GLU A 67 47.838 65.192 -7.963 1.00 0.00 N ATOM 1056 CA GLU A 67 48.186 63.954 -7.279 1.00 0.00 C ATOM 1057 C GLU A 67 49.646 63.943 -6.830 1.00 0.00 C ATOM 1058 O GLU A 67 50.559 63.918 -7.655 1.00 0.00 O ATOM 1059 CB GLU A 67 47.875 62.776 -8.208 1.00 0.00 C ATOM 1060 CG GLU A 67 48.078 61.402 -7.593 1.00 0.00 C ATOM 1061 CD GLU A 67 49.413 60.809 -7.971 1.00 0.00 C ATOM 1062 OE1 GLU A 67 49.621 60.528 -9.167 1.00 0.00 O ATOM 1063 OE2 GLU A 67 50.271 60.660 -7.089 1.00 0.00 O ATOM 0 H GLU A 67 47.595 65.067 -8.946 1.00 0.00 H new ATOM 0 HA GLU A 67 47.589 63.868 -6.371 1.00 0.00 H new ATOM 0 HB2 GLU A 67 46.841 62.859 -8.541 1.00 0.00 H new ATOM 0 HB3 GLU A 67 48.503 62.857 -9.095 1.00 0.00 H new ATOM 0 HG2 GLU A 67 48.008 61.476 -6.508 1.00 0.00 H new ATOM 0 HG3 GLU A 67 47.279 60.736 -7.920 1.00 0.00 H new ATOM 1070 N ASN A 68 49.837 63.967 -5.512 1.00 0.00 N ATOM 1071 CA ASN A 68 51.168 63.943 -4.894 1.00 0.00 C ATOM 1072 C ASN A 68 52.090 65.031 -5.441 1.00 0.00 C ATOM 1073 O ASN A 68 53.297 64.821 -5.552 1.00 0.00 O ATOM 1074 CB ASN A 68 51.825 62.569 -5.060 1.00 0.00 C ATOM 1075 CG ASN A 68 51.334 61.562 -4.036 1.00 0.00 C ATOM 1076 OD1 ASN A 68 51.799 61.542 -2.897 1.00 0.00 O ATOM 1077 ND2 ASN A 68 50.427 60.694 -4.444 1.00 0.00 N ATOM 0 H ASN A 68 49.073 64.004 -4.838 1.00 0.00 H new ATOM 0 HA ASN A 68 51.018 64.144 -3.833 1.00 0.00 H new ATOM 0 HB2 ASN A 68 51.622 62.192 -6.062 1.00 0.00 H new ATOM 0 HB3 ASN A 68 52.906 62.674 -4.972 1.00 0.00 H new ATOM 0 HD21 ASN A 68 50.087 59.974 -3.807 1.00 0.00 H new ATOM 0 HD22 ASN A 68 50.066 60.744 -5.397 1.00 0.00 H new ATOM 1084 N ALA A 69 51.510 66.189 -5.762 1.00 0.00 N ATOM 1085 CA ALA A 69 52.270 67.362 -6.203 1.00 0.00 C ATOM 1086 C ALA A 69 52.936 67.137 -7.559 1.00 0.00 C ATOM 1087 O ALA A 69 54.045 66.611 -7.654 1.00 0.00 O ATOM 1088 CB ALA A 69 53.297 67.778 -5.156 1.00 0.00 C ATOM 0 H ALA A 69 50.502 66.341 -5.724 1.00 0.00 H new ATOM 0 HA ALA A 69 51.556 68.177 -6.324 1.00 0.00 H new ATOM 0 HB1 ALA A 69 53.845 68.651 -5.511 1.00 0.00 H new ATOM 0 HB2 ALA A 69 52.788 68.024 -4.224 1.00 0.00 H new ATOM 0 HB3 ALA A 69 53.993 66.957 -4.983 1.00 0.00 H new ATOM 1094 N LYS A 70 52.231 67.527 -8.606 1.00 0.00 N ATOM 1095 CA LYS A 70 52.734 67.436 -9.963 1.00 0.00 C ATOM 1096 C LYS A 70 52.643 68.795 -10.652 1.00 0.00 C ATOM 1097 O LYS A 70 53.236 69.011 -11.710 1.00 0.00 O ATOM 1098 CB LYS A 70 51.933 66.390 -10.745 1.00 0.00 C ATOM 1099 CG LYS A 70 51.998 65.008 -10.123 1.00 0.00 C ATOM 1100 CD LYS A 70 51.241 63.970 -10.941 1.00 0.00 C ATOM 1101 CE LYS A 70 51.824 62.579 -10.736 1.00 0.00 C ATOM 1102 NZ LYS A 70 51.714 62.120 -9.325 1.00 0.00 N ATOM 0 H LYS A 70 51.291 67.917 -8.538 1.00 0.00 H new ATOM 0 HA LYS A 70 53.780 67.132 -9.934 1.00 0.00 H new ATOM 0 HB2 LYS A 70 50.892 66.707 -10.804 1.00 0.00 H new ATOM 0 HB3 LYS A 70 52.310 66.341 -11.767 1.00 0.00 H new ATOM 0 HG2 LYS A 70 53.040 64.703 -10.028 1.00 0.00 H new ATOM 0 HG3 LYS A 70 51.584 65.046 -9.115 1.00 0.00 H new ATOM 0 HD2 LYS A 70 50.189 63.973 -10.654 1.00 0.00 H new ATOM 0 HD3 LYS A 70 51.284 64.233 -11.998 1.00 0.00 H new ATOM 0 HE2 LYS A 70 51.308 61.872 -11.386 1.00 0.00 H new ATOM 0 HE3 LYS A 70 52.872 62.580 -11.034 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 52.665 62.031 -8.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 51.163 62.811 -8.777 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 51.237 61.196 -9.297 1.00 0.00 H new ATOM 1116 N GLY A 71 51.895 69.707 -10.036 1.00 0.00 N ATOM 1117 CA GLY A 71 51.700 71.030 -10.596 1.00 0.00 C ATOM 1118 C GLY A 71 50.741 71.017 -11.767 1.00 0.00 C ATOM 1119 O GLY A 71 50.719 71.947 -12.577 1.00 0.00 O ATOM 0 H GLY A 71 51.416 69.548 -9.149 1.00 0.00 H new ATOM 0 HA2 GLY A 71 51.319 71.698 -9.823 1.00 0.00 H new ATOM 0 HA3 GLY A 71 52.660 71.432 -10.919 1.00 0.00 H new ATOM 1123 N GLN A 72 49.938 69.969 -11.855 1.00 0.00 N ATOM 1124 CA GLN A 72 48.996 69.827 -12.949 1.00 0.00 C ATOM 1125 C GLN A 72 47.568 70.031 -12.460 1.00 0.00 C ATOM 1126 O GLN A 72 46.917 69.106 -11.971 1.00 0.00 O ATOM 1127 CB GLN A 72 49.146 68.462 -13.637 1.00 0.00 C ATOM 1128 CG GLN A 72 49.171 67.283 -12.678 1.00 0.00 C ATOM 1129 CD GLN A 72 48.120 66.244 -13.007 1.00 0.00 C ATOM 1130 OE1 GLN A 72 48.365 65.310 -13.769 1.00 0.00 O ATOM 1131 NE2 GLN A 72 46.935 66.409 -12.447 1.00 0.00 N ATOM 0 H GLN A 72 49.921 69.204 -11.180 1.00 0.00 H new ATOM 0 HA GLN A 72 49.220 70.599 -13.686 1.00 0.00 H new ATOM 0 HB2 GLN A 72 48.323 68.328 -14.339 1.00 0.00 H new ATOM 0 HB3 GLN A 72 50.066 68.461 -14.221 1.00 0.00 H new ATOM 0 HG2 GLN A 72 50.157 66.819 -12.704 1.00 0.00 H new ATOM 0 HG3 GLN A 72 49.015 67.643 -11.661 1.00 0.00 H new ATOM 0 HE21 GLN A 72 46.772 67.197 -11.820 1.00 0.00 H new ATOM 0 HE22 GLN A 72 46.183 65.748 -12.641 1.00 0.00 H new ATOM 1140 N TRP A 73 47.090 71.258 -12.574 1.00 0.00 N ATOM 1141 CA TRP A 73 45.727 71.568 -12.190 1.00 0.00 C ATOM 1142 C TRP A 73 44.742 70.977 -13.191 1.00 0.00 C ATOM 1143 O TRP A 73 44.565 71.495 -14.295 1.00 0.00 O ATOM 1144 CB TRP A 73 45.527 73.079 -12.082 1.00 0.00 C ATOM 1145 CG TRP A 73 46.147 73.679 -10.860 1.00 0.00 C ATOM 1146 CD1 TRP A 73 47.354 74.314 -10.773 1.00 0.00 C ATOM 1147 CD2 TRP A 73 45.586 73.700 -9.545 1.00 0.00 C ATOM 1148 NE1 TRP A 73 47.573 74.730 -9.483 1.00 0.00 N ATOM 1149 CE2 TRP A 73 46.500 74.366 -8.709 1.00 0.00 C ATOM 1150 CE3 TRP A 73 44.394 73.219 -8.992 1.00 0.00 C ATOM 1151 CZ2 TRP A 73 46.260 74.565 -7.353 1.00 0.00 C ATOM 1152 CZ3 TRP A 73 44.158 73.414 -7.646 1.00 0.00 C ATOM 1153 CH2 TRP A 73 45.086 74.083 -6.839 1.00 0.00 C ATOM 0 H TRP A 73 47.624 72.052 -12.928 1.00 0.00 H new ATOM 0 HA TRP A 73 45.540 71.123 -11.213 1.00 0.00 H new ATOM 0 HB2 TRP A 73 45.949 73.557 -12.966 1.00 0.00 H new ATOM 0 HB3 TRP A 73 44.459 73.297 -12.082 1.00 0.00 H new ATOM 0 HD1 TRP A 73 48.035 74.466 -11.597 1.00 0.00 H new ATOM 0 HE1 TRP A 73 48.399 75.229 -9.153 1.00 0.00 H new ATOM 0 HE3 TRP A 73 43.671 72.704 -9.608 1.00 0.00 H new ATOM 0 HZ2 TRP A 73 46.974 75.081 -6.728 1.00 0.00 H new ATOM 0 HZ3 TRP A 73 43.242 73.044 -7.208 1.00 0.00 H new ATOM 0 HH2 TRP A 73 44.872 74.222 -5.790 1.00 0.00 H new ATOM 1164 N ARG A 74 44.116 69.877 -12.798 1.00 0.00 N ATOM 1165 CA ARG A 74 43.100 69.225 -13.607 1.00 0.00 C ATOM 1166 C ARG A 74 42.066 68.572 -12.707 1.00 0.00 C ATOM 1167 O ARG A 74 42.350 68.251 -11.549 1.00 0.00 O ATOM 1168 CB ARG A 74 43.712 68.168 -14.540 1.00 0.00 C ATOM 1169 CG ARG A 74 44.488 68.754 -15.710 1.00 0.00 C ATOM 1170 CD ARG A 74 44.924 67.681 -16.697 1.00 0.00 C ATOM 1171 NE ARG A 74 45.943 66.785 -16.146 1.00 0.00 N ATOM 1172 CZ ARG A 74 46.603 65.879 -16.872 1.00 0.00 C ATOM 1173 NH1 ARG A 74 46.336 65.741 -18.167 1.00 0.00 N ATOM 1174 NH2 ARG A 74 47.528 65.111 -16.307 1.00 0.00 N ATOM 0 H ARG A 74 44.299 69.412 -11.909 1.00 0.00 H new ATOM 0 HA ARG A 74 42.626 69.987 -14.225 1.00 0.00 H new ATOM 0 HB2 ARG A 74 44.376 67.527 -13.961 1.00 0.00 H new ATOM 0 HB3 ARG A 74 42.915 67.534 -14.927 1.00 0.00 H new ATOM 0 HG2 ARG A 74 43.869 69.490 -16.224 1.00 0.00 H new ATOM 0 HG3 ARG A 74 45.366 69.281 -15.336 1.00 0.00 H new ATOM 0 HD2 ARG A 74 44.055 67.095 -16.997 1.00 0.00 H new ATOM 0 HD3 ARG A 74 45.314 68.158 -17.597 1.00 0.00 H new ATOM 0 HE ARG A 74 46.161 66.857 -15.152 1.00 0.00 H new ATOM 0 HH11 ARG A 74 45.627 66.327 -18.607 1.00 0.00 H new ATOM 0 HH12 ARG A 74 46.841 65.049 -18.721 1.00 0.00 H new ATOM 0 HH21 ARG A 74 47.737 65.212 -15.314 1.00 0.00 H new ATOM 0 HH22 ARG A 74 48.029 64.421 -16.866 1.00 0.00 H new ATOM 1188 N TRP A 75 40.871 68.388 -13.236 1.00 0.00 N ATOM 1189 CA TRP A 75 39.813 67.711 -12.513 1.00 0.00 C ATOM 1190 C TRP A 75 39.999 66.204 -12.642 1.00 0.00 C ATOM 1191 O TRP A 75 40.811 65.742 -13.446 1.00 0.00 O ATOM 1192 CB TRP A 75 38.440 68.142 -13.043 1.00 0.00 C ATOM 1193 CG TRP A 75 38.180 69.617 -12.900 1.00 0.00 C ATOM 1194 CD1 TRP A 75 38.555 70.596 -13.772 1.00 0.00 C ATOM 1195 CD2 TRP A 75 37.495 70.283 -11.828 1.00 0.00 C ATOM 1196 NE1 TRP A 75 38.148 71.822 -13.318 1.00 0.00 N ATOM 1197 CE2 TRP A 75 37.496 71.660 -12.126 1.00 0.00 C ATOM 1198 CE3 TRP A 75 36.882 69.853 -10.649 1.00 0.00 C ATOM 1199 CZ2 TRP A 75 36.909 72.605 -11.289 1.00 0.00 C ATOM 1200 CZ3 TRP A 75 36.301 70.793 -9.818 1.00 0.00 C ATOM 1201 CH2 TRP A 75 36.317 72.154 -10.141 1.00 0.00 C ATOM 0 H TRP A 75 40.608 68.701 -14.171 1.00 0.00 H new ATOM 0 HA TRP A 75 39.862 67.984 -11.459 1.00 0.00 H new ATOM 0 HB2 TRP A 75 38.362 67.867 -14.095 1.00 0.00 H new ATOM 0 HB3 TRP A 75 37.664 67.591 -12.512 1.00 0.00 H new ATOM 0 HD1 TRP A 75 39.097 70.428 -14.691 1.00 0.00 H new ATOM 0 HE1 TRP A 75 38.305 72.712 -13.792 1.00 0.00 H new ATOM 0 HE3 TRP A 75 36.862 68.804 -10.391 1.00 0.00 H new ATOM 0 HZ2 TRP A 75 36.921 73.656 -11.537 1.00 0.00 H new ATOM 0 HZ3 TRP A 75 35.826 70.471 -8.903 1.00 0.00 H new ATOM 0 HH2 TRP A 75 35.853 72.863 -9.471 1.00 0.00 H new ATOM 1212 N VAL A 76 39.257 65.446 -11.852 1.00 0.00 N ATOM 1213 CA VAL A 76 39.414 63.996 -11.809 1.00 0.00 C ATOM 1214 C VAL A 76 39.059 63.343 -13.150 1.00 0.00 C ATOM 1215 O VAL A 76 39.687 62.366 -13.557 1.00 0.00 O ATOM 1216 CB VAL A 76 38.570 63.376 -10.666 1.00 0.00 C ATOM 1217 CG1 VAL A 76 37.092 63.712 -10.823 1.00 0.00 C ATOM 1218 CG2 VAL A 76 38.776 61.868 -10.591 1.00 0.00 C ATOM 0 H VAL A 76 38.536 65.810 -11.228 1.00 0.00 H new ATOM 0 HA VAL A 76 40.467 63.796 -11.610 1.00 0.00 H new ATOM 0 HB VAL A 76 38.914 63.813 -9.729 1.00 0.00 H new ATOM 0 HG11 VAL A 76 36.528 63.263 -10.006 1.00 0.00 H new ATOM 0 HG12 VAL A 76 36.961 64.794 -10.803 1.00 0.00 H new ATOM 0 HG13 VAL A 76 36.729 63.320 -11.773 1.00 0.00 H new ATOM 0 HG21 VAL A 76 38.173 61.458 -9.781 1.00 0.00 H new ATOM 0 HG22 VAL A 76 38.475 61.412 -11.534 1.00 0.00 H new ATOM 0 HG23 VAL A 76 39.828 61.653 -10.404 1.00 0.00 H new ATOM 1228 N ASP A 77 38.083 63.907 -13.850 1.00 0.00 N ATOM 1229 CA ASP A 77 37.601 63.307 -15.087 1.00 0.00 C ATOM 1230 C ASP A 77 37.858 64.198 -16.290 1.00 0.00 C ATOM 1231 O ASP A 77 36.967 64.923 -16.737 1.00 0.00 O ATOM 1232 CB ASP A 77 36.118 62.972 -14.971 1.00 0.00 C ATOM 1233 CG ASP A 77 35.924 61.631 -14.329 1.00 0.00 C ATOM 1234 OD1 ASP A 77 36.030 61.549 -13.088 1.00 0.00 O ATOM 1235 OD2 ASP A 77 35.653 60.654 -15.060 1.00 0.00 O ATOM 0 H ASP A 77 37.613 64.772 -13.585 1.00 0.00 H new ATOM 0 HA ASP A 77 38.161 62.385 -15.245 1.00 0.00 H new ATOM 0 HB2 ASP A 77 35.612 63.738 -14.383 1.00 0.00 H new ATOM 0 HB3 ASP A 77 35.661 62.976 -15.961 1.00 0.00 H new ATOM 1240 N GLN A 78 39.108 64.166 -16.766 1.00 0.00 N ATOM 1241 CA GLN A 78 39.534 64.839 -18.004 1.00 0.00 C ATOM 1242 C GLN A 78 39.569 66.365 -17.876 1.00 0.00 C ATOM 1243 O GLN A 78 40.563 66.995 -18.240 1.00 0.00 O ATOM 1244 CB GLN A 78 38.632 64.462 -19.184 1.00 0.00 C ATOM 1245 CG GLN A 78 39.136 64.993 -20.517 1.00 0.00 C ATOM 1246 CD GLN A 78 38.040 65.101 -21.557 1.00 0.00 C ATOM 1247 OE1 GLN A 78 37.761 64.153 -22.285 1.00 0.00 O ATOM 1248 NE2 GLN A 78 37.425 66.273 -21.645 1.00 0.00 N ATOM 0 H GLN A 78 39.864 63.666 -16.298 1.00 0.00 H new ATOM 0 HA GLN A 78 40.550 64.491 -18.188 1.00 0.00 H new ATOM 0 HB2 GLN A 78 38.552 63.376 -19.240 1.00 0.00 H new ATOM 0 HB3 GLN A 78 37.628 64.847 -19.003 1.00 0.00 H new ATOM 0 HG2 GLN A 78 39.585 65.975 -20.366 1.00 0.00 H new ATOM 0 HG3 GLN A 78 39.922 64.337 -20.891 1.00 0.00 H new ATOM 0 HE21 GLN A 78 37.688 67.035 -21.020 1.00 0.00 H new ATOM 0 HE22 GLN A 78 36.689 66.412 -22.338 1.00 0.00 H new ATOM 1257 N THR A 79 38.479 66.936 -17.375 1.00 0.00 N ATOM 1258 CA THR A 79 38.264 68.378 -17.360 1.00 0.00 C ATOM 1259 C THR A 79 39.482 69.147 -16.848 1.00 0.00 C ATOM 1260 O THR A 79 39.997 68.875 -15.762 1.00 0.00 O ATOM 1261 CB THR A 79 37.032 68.728 -16.502 1.00 0.00 C ATOM 1262 OG1 THR A 79 35.928 67.898 -16.888 1.00 0.00 O ATOM 1263 CG2 THR A 79 36.642 70.191 -16.666 1.00 0.00 C ATOM 0 H THR A 79 37.712 66.405 -16.963 1.00 0.00 H new ATOM 0 HA THR A 79 38.094 68.682 -18.393 1.00 0.00 H new ATOM 0 HB THR A 79 37.286 68.555 -15.456 1.00 0.00 H new ATOM 0 HG1 THR A 79 35.145 68.119 -16.341 1.00 0.00 H new ATOM 0 HG21 THR A 79 35.770 70.407 -16.048 1.00 0.00 H new ATOM 0 HG22 THR A 79 37.472 70.826 -16.356 1.00 0.00 H new ATOM 0 HG23 THR A 79 36.404 70.389 -17.711 1.00 0.00 H new ATOM 1271 N PRO A 80 39.981 70.089 -17.658 1.00 0.00 N ATOM 1272 CA PRO A 80 41.078 70.976 -17.273 1.00 0.00 C ATOM 1273 C PRO A 80 40.632 72.006 -16.240 1.00 0.00 C ATOM 1274 O PRO A 80 39.451 72.355 -16.169 1.00 0.00 O ATOM 1275 CB PRO A 80 41.467 71.669 -18.592 1.00 0.00 C ATOM 1276 CG PRO A 80 40.772 70.898 -19.666 1.00 0.00 C ATOM 1277 CD PRO A 80 39.535 70.347 -19.030 1.00 0.00 C ATOM 0 HA PRO A 80 41.903 70.434 -16.811 1.00 0.00 H new ATOM 0 HB2 PRO A 80 41.155 72.713 -18.594 1.00 0.00 H new ATOM 0 HB3 PRO A 80 42.547 71.659 -18.737 1.00 0.00 H new ATOM 0 HG2 PRO A 80 40.525 71.540 -20.512 1.00 0.00 H new ATOM 0 HG3 PRO A 80 41.406 70.098 -20.047 1.00 0.00 H new ATOM 0 HD2 PRO A 80 38.709 71.058 -19.063 1.00 0.00 H new ATOM 0 HD3 PRO A 80 39.193 69.438 -19.525 1.00 0.00 H new ATOM 1285 N PHE A 81 41.575 72.480 -15.436 1.00 0.00 N ATOM 1286 CA PHE A 81 41.288 73.488 -14.425 1.00 0.00 C ATOM 1287 C PHE A 81 40.783 74.769 -15.081 1.00 0.00 C ATOM 1288 O PHE A 81 41.188 75.106 -16.192 1.00 0.00 O ATOM 1289 CB PHE A 81 42.547 73.771 -13.603 1.00 0.00 C ATOM 1290 CG PHE A 81 42.377 74.817 -12.538 1.00 0.00 C ATOM 1291 CD1 PHE A 81 41.667 74.542 -11.381 1.00 0.00 C ATOM 1292 CD2 PHE A 81 42.936 76.077 -12.694 1.00 0.00 C ATOM 1293 CE1 PHE A 81 41.518 75.502 -10.399 1.00 0.00 C ATOM 1294 CE2 PHE A 81 42.790 77.040 -11.715 1.00 0.00 C ATOM 1295 CZ PHE A 81 42.080 76.752 -10.567 1.00 0.00 C ATOM 0 H PHE A 81 42.550 72.180 -15.465 1.00 0.00 H new ATOM 0 HA PHE A 81 40.509 73.112 -13.761 1.00 0.00 H new ATOM 0 HB2 PHE A 81 42.875 72.843 -13.134 1.00 0.00 H new ATOM 0 HB3 PHE A 81 43.343 74.085 -14.278 1.00 0.00 H new ATOM 0 HD1 PHE A 81 41.225 73.566 -11.245 1.00 0.00 H new ATOM 0 HD2 PHE A 81 43.492 76.307 -13.591 1.00 0.00 H new ATOM 0 HE1 PHE A 81 40.963 75.275 -9.501 1.00 0.00 H new ATOM 0 HE2 PHE A 81 43.231 78.017 -11.847 1.00 0.00 H new ATOM 0 HZ PHE A 81 41.964 77.504 -9.800 1.00 0.00 H new ATOM 1305 N ASN A 82 39.894 75.473 -14.394 1.00 0.00 N ATOM 1306 CA ASN A 82 39.323 76.703 -14.924 1.00 0.00 C ATOM 1307 C ASN A 82 40.033 77.922 -14.349 1.00 0.00 C ATOM 1308 O ASN A 82 39.752 78.330 -13.224 1.00 0.00 O ATOM 1309 CB ASN A 82 37.825 76.792 -14.607 1.00 0.00 C ATOM 1310 CG ASN A 82 37.001 75.729 -15.305 1.00 0.00 C ATOM 1311 OD1 ASN A 82 36.564 75.916 -16.440 1.00 0.00 O ATOM 1312 ND2 ASN A 82 36.747 74.625 -14.618 1.00 0.00 N ATOM 0 H ASN A 82 39.553 75.213 -13.469 1.00 0.00 H new ATOM 0 HA ASN A 82 39.458 76.688 -16.005 1.00 0.00 H new ATOM 0 HB2 ASN A 82 37.683 76.703 -13.530 1.00 0.00 H new ATOM 0 HB3 ASN A 82 37.457 77.776 -14.897 1.00 0.00 H new ATOM 0 HD21 ASN A 82 36.170 73.891 -15.028 1.00 0.00 H new ATOM 0 HD22 ASN A 82 37.129 74.509 -13.679 1.00 0.00 H new ATOM 1319 N PRO A 83 40.965 78.520 -15.109 1.00 0.00 N ATOM 1320 CA PRO A 83 41.682 79.715 -14.671 1.00 0.00 C ATOM 1321 C PRO A 83 40.851 80.980 -14.856 1.00 0.00 C ATOM 1322 O PRO A 83 41.048 81.975 -14.166 1.00 0.00 O ATOM 1323 CB PRO A 83 42.910 79.734 -15.578 1.00 0.00 C ATOM 1324 CG PRO A 83 42.472 79.059 -16.834 1.00 0.00 C ATOM 1325 CD PRO A 83 41.401 78.072 -16.445 1.00 0.00 C ATOM 0 HA PRO A 83 41.924 79.690 -13.609 1.00 0.00 H new ATOM 0 HB2 PRO A 83 43.241 80.754 -15.773 1.00 0.00 H new ATOM 0 HB3 PRO A 83 43.748 79.209 -15.119 1.00 0.00 H new ATOM 0 HG2 PRO A 83 42.087 79.785 -17.550 1.00 0.00 H new ATOM 0 HG3 PRO A 83 43.310 78.552 -17.313 1.00 0.00 H new ATOM 0 HD2 PRO A 83 40.575 78.079 -17.157 1.00 0.00 H new ATOM 0 HD3 PRO A 83 41.789 77.054 -16.417 1.00 0.00 H new ATOM 1333 N ARG A 84 39.910 80.930 -15.793 1.00 0.00 N ATOM 1334 CA ARG A 84 39.048 82.069 -16.067 1.00 0.00 C ATOM 1335 C ARG A 84 37.783 81.987 -15.217 1.00 0.00 C ATOM 1336 O ARG A 84 36.983 82.916 -15.183 1.00 0.00 O ATOM 1337 CB ARG A 84 38.689 82.114 -17.558 1.00 0.00 C ATOM 1338 CG ARG A 84 38.081 83.435 -18.010 1.00 0.00 C ATOM 1339 CD ARG A 84 39.055 84.588 -17.822 1.00 0.00 C ATOM 1340 NE ARG A 84 38.497 85.863 -18.273 1.00 0.00 N ATOM 1341 CZ ARG A 84 39.233 86.922 -18.614 1.00 0.00 C ATOM 1342 NH1 ARG A 84 40.561 86.861 -18.555 1.00 0.00 N ATOM 1343 NH2 ARG A 84 38.642 88.044 -19.013 1.00 0.00 N ATOM 0 H ARG A 84 39.727 80.112 -16.374 1.00 0.00 H new ATOM 0 HA ARG A 84 39.581 82.984 -15.810 1.00 0.00 H new ATOM 0 HB2 ARG A 84 39.588 81.921 -18.143 1.00 0.00 H new ATOM 0 HB3 ARG A 84 37.987 81.309 -17.776 1.00 0.00 H new ATOM 0 HG2 ARG A 84 37.796 83.365 -19.060 1.00 0.00 H new ATOM 0 HG3 ARG A 84 37.170 83.630 -17.444 1.00 0.00 H new ATOM 0 HD2 ARG A 84 39.326 84.664 -16.769 1.00 0.00 H new ATOM 0 HD3 ARG A 84 39.972 84.380 -18.373 1.00 0.00 H new ATOM 0 HE ARG A 84 37.482 85.947 -18.330 1.00 0.00 H new ATOM 0 HH11 ARG A 84 41.019 86.003 -18.248 1.00 0.00 H new ATOM 0 HH12 ARG A 84 41.121 87.672 -18.816 1.00 0.00 H new ATOM 0 HH21 ARG A 84 37.624 88.096 -19.059 1.00 0.00 H new ATOM 0 HH22 ARG A 84 39.206 88.853 -19.273 1.00 0.00 H new ATOM 1357 N ARG A 85 37.618 80.861 -14.533 1.00 0.00 N ATOM 1358 CA ARG A 85 36.470 80.643 -13.662 1.00 0.00 C ATOM 1359 C ARG A 85 36.924 80.053 -12.336 1.00 0.00 C ATOM 1360 O ARG A 85 36.334 79.096 -11.840 1.00 0.00 O ATOM 1361 CB ARG A 85 35.451 79.697 -14.304 1.00 0.00 C ATOM 1362 CG ARG A 85 34.669 80.294 -15.463 1.00 0.00 C ATOM 1363 CD ARG A 85 33.569 79.346 -15.915 1.00 0.00 C ATOM 1364 NE ARG A 85 34.101 78.049 -16.331 1.00 0.00 N ATOM 1365 CZ ARG A 85 33.347 77.044 -16.758 1.00 0.00 C ATOM 1366 NH1 ARG A 85 32.037 77.211 -16.900 1.00 0.00 N ATOM 1367 NH2 ARG A 85 33.903 75.879 -17.067 1.00 0.00 N ATOM 0 H ARG A 85 38.271 80.078 -14.566 1.00 0.00 H new ATOM 0 HA ARG A 85 35.995 81.610 -13.498 1.00 0.00 H new ATOM 0 HB2 ARG A 85 35.974 78.808 -14.656 1.00 0.00 H new ATOM 0 HB3 ARG A 85 34.747 79.371 -13.539 1.00 0.00 H new ATOM 0 HG2 ARG A 85 34.234 81.247 -15.162 1.00 0.00 H new ATOM 0 HG3 ARG A 85 35.343 80.500 -16.295 1.00 0.00 H new ATOM 0 HD2 ARG A 85 32.857 79.202 -15.102 1.00 0.00 H new ATOM 0 HD3 ARG A 85 33.020 79.795 -16.743 1.00 0.00 H new ATOM 0 HE ARG A 85 35.110 77.909 -16.291 1.00 0.00 H new ATOM 0 HH11 ARG A 85 31.611 78.111 -16.681 1.00 0.00 H new ATOM 0 HH12 ARG A 85 31.457 76.439 -17.228 1.00 0.00 H new ATOM 0 HH21 ARG A 85 34.911 75.755 -16.976 1.00 0.00 H new ATOM 0 HH22 ARG A 85 33.322 75.108 -17.395 1.00 0.00 H new ATOM 1381 N VAL A 86 37.983 80.607 -11.774 1.00 0.00 N ATOM 1382 CA VAL A 86 38.465 80.146 -10.486 1.00 0.00 C ATOM 1383 C VAL A 86 37.891 81.018 -9.377 1.00 0.00 C ATOM 1384 O VAL A 86 37.909 82.246 -9.459 1.00 0.00 O ATOM 1385 CB VAL A 86 40.009 80.122 -10.413 1.00 0.00 C ATOM 1386 CG1 VAL A 86 40.605 81.514 -10.582 1.00 0.00 C ATOM 1387 CG2 VAL A 86 40.464 79.492 -9.108 1.00 0.00 C ATOM 0 H VAL A 86 38.521 81.370 -12.185 1.00 0.00 H new ATOM 0 HA VAL A 86 38.125 79.119 -10.354 1.00 0.00 H new ATOM 0 HB VAL A 86 40.373 79.514 -11.241 1.00 0.00 H new ATOM 0 HG11 VAL A 86 41.692 81.454 -10.525 1.00 0.00 H new ATOM 0 HG12 VAL A 86 40.315 81.919 -11.552 1.00 0.00 H new ATOM 0 HG13 VAL A 86 40.235 82.167 -9.791 1.00 0.00 H new ATOM 0 HG21 VAL A 86 41.553 79.481 -9.069 1.00 0.00 H new ATOM 0 HG22 VAL A 86 40.077 80.071 -8.270 1.00 0.00 H new ATOM 0 HG23 VAL A 86 40.089 78.470 -9.047 1.00 0.00 H new ATOM 1397 N PHE A 87 37.357 80.382 -8.348 1.00 0.00 N ATOM 1398 CA PHE A 87 36.688 81.108 -7.287 1.00 0.00 C ATOM 1399 C PHE A 87 37.429 80.944 -5.965 1.00 0.00 C ATOM 1400 O PHE A 87 36.985 80.195 -5.099 1.00 0.00 O ATOM 1401 CB PHE A 87 35.242 80.619 -7.127 1.00 0.00 C ATOM 1402 CG PHE A 87 34.486 80.472 -8.422 1.00 0.00 C ATOM 1403 CD1 PHE A 87 33.885 81.565 -9.028 1.00 0.00 C ATOM 1404 CD2 PHE A 87 34.366 79.230 -9.023 1.00 0.00 C ATOM 1405 CE1 PHE A 87 33.180 81.417 -10.209 1.00 0.00 C ATOM 1406 CE2 PHE A 87 33.664 79.077 -10.203 1.00 0.00 C ATOM 1407 CZ PHE A 87 33.070 80.170 -10.797 1.00 0.00 C ATOM 0 H PHE A 87 37.374 79.369 -8.227 1.00 0.00 H new ATOM 0 HA PHE A 87 36.682 82.163 -7.560 1.00 0.00 H new ATOM 0 HB2 PHE A 87 35.252 79.657 -6.615 1.00 0.00 H new ATOM 0 HB3 PHE A 87 34.705 81.316 -6.484 1.00 0.00 H new ATOM 0 HD1 PHE A 87 33.968 82.541 -8.574 1.00 0.00 H new ATOM 0 HD2 PHE A 87 34.828 78.369 -8.563 1.00 0.00 H new ATOM 0 HE1 PHE A 87 32.716 82.275 -10.672 1.00 0.00 H new ATOM 0 HE2 PHE A 87 33.581 78.102 -10.660 1.00 0.00 H new ATOM 0 HZ PHE A 87 32.520 80.053 -11.719 1.00 0.00 H new ATOM 1417 N TRP A 88 38.563 81.618 -5.819 1.00 0.00 N ATOM 1418 CA TRP A 88 39.298 81.603 -4.553 1.00 0.00 C ATOM 1419 C TRP A 88 38.596 82.485 -3.518 1.00 0.00 C ATOM 1420 O TRP A 88 37.544 83.076 -3.798 1.00 0.00 O ATOM 1421 CB TRP A 88 40.739 82.095 -4.738 1.00 0.00 C ATOM 1422 CG TRP A 88 41.609 81.192 -5.563 1.00 0.00 C ATOM 1423 CD1 TRP A 88 42.189 81.490 -6.762 1.00 0.00 C ATOM 1424 CD2 TRP A 88 42.011 79.851 -5.247 1.00 0.00 C ATOM 1425 NE1 TRP A 88 42.928 80.421 -7.210 1.00 0.00 N ATOM 1426 CE2 TRP A 88 42.833 79.402 -6.299 1.00 0.00 C ATOM 1427 CE3 TRP A 88 41.757 78.986 -4.178 1.00 0.00 C ATOM 1428 CZ2 TRP A 88 43.401 78.129 -6.313 1.00 0.00 C ATOM 1429 CZ3 TRP A 88 42.321 77.724 -4.192 1.00 0.00 C ATOM 1430 CH2 TRP A 88 43.135 77.306 -5.253 1.00 0.00 C ATOM 0 H TRP A 88 38.994 82.179 -6.554 1.00 0.00 H new ATOM 0 HA TRP A 88 39.322 80.571 -4.202 1.00 0.00 H new ATOM 0 HB2 TRP A 88 40.715 83.080 -5.205 1.00 0.00 H new ATOM 0 HB3 TRP A 88 41.195 82.219 -3.756 1.00 0.00 H new ATOM 0 HD1 TRP A 88 42.083 82.430 -7.283 1.00 0.00 H new ATOM 0 HE1 TRP A 88 43.461 80.391 -8.079 1.00 0.00 H new ATOM 0 HE3 TRP A 88 41.131 79.299 -3.355 1.00 0.00 H new ATOM 0 HZ2 TRP A 88 44.028 77.804 -7.130 1.00 0.00 H new ATOM 0 HZ3 TRP A 88 42.131 77.049 -3.371 1.00 0.00 H new ATOM 0 HH2 TRP A 88 43.561 76.314 -5.234 1.00 0.00 H new ATOM 1441 N HIS A 89 39.166 82.568 -2.324 1.00 0.00 N ATOM 1442 CA HIS A 89 38.629 83.440 -1.288 1.00 0.00 C ATOM 1443 C HIS A 89 39.257 84.819 -1.379 1.00 0.00 C ATOM 1444 O HIS A 89 38.597 85.781 -1.777 1.00 0.00 O ATOM 1445 CB HIS A 89 38.860 82.856 0.111 1.00 0.00 C ATOM 1446 CG HIS A 89 38.026 81.653 0.401 1.00 0.00 C ATOM 1447 ND1 HIS A 89 36.741 81.736 0.894 1.00 0.00 N ATOM 1448 CD2 HIS A 89 38.277 80.334 0.235 1.00 0.00 C ATOM 1449 CE1 HIS A 89 36.238 80.525 1.009 1.00 0.00 C ATOM 1450 NE2 HIS A 89 37.147 79.654 0.615 1.00 0.00 N ATOM 0 H HIS A 89 39.997 82.044 -2.049 1.00 0.00 H new ATOM 0 HA HIS A 89 37.554 83.522 -1.451 1.00 0.00 H new ATOM 0 HB2 HIS A 89 39.912 82.592 0.216 1.00 0.00 H new ATOM 0 HB3 HIS A 89 38.648 83.623 0.856 1.00 0.00 H new ATOM 0 HD1 HIS A 89 36.256 82.601 1.132 1.00 0.00 H new ATOM 0 HD2 HIS A 89 39.195 79.897 -0.129 1.00 0.00 H new ATOM 0 HE1 HIS A 89 35.247 80.285 1.366 1.00 0.00 H new ATOM 1600 N ASN A 100 47.340 68.036 -3.694 1.00 0.00 N ATOM 1601 CA ASN A 100 46.757 69.365 -3.769 1.00 0.00 C ATOM 1602 C ASN A 100 45.352 69.319 -4.366 1.00 0.00 C ATOM 1603 O ASN A 100 45.150 68.788 -5.454 1.00 0.00 O ATOM 1604 CB ASN A 100 47.664 70.256 -4.618 1.00 0.00 C ATOM 1605 CG ASN A 100 47.240 71.707 -4.634 1.00 0.00 C ATOM 1606 OD1 ASN A 100 46.704 72.188 -3.525 1.00 0.00 O flip ATOM 1607 ND2 ASN A 100 47.417 72.397 -5.633 1.00 0.00 N flip ATOM 0 HA ASN A 100 46.673 69.773 -2.762 1.00 0.00 H new ATOM 0 HB2 ASN A 100 48.684 70.188 -4.240 1.00 0.00 H new ATOM 0 HB3 ASN A 100 47.677 69.878 -5.640 1.00 0.00 H new ATOM 0 HD21 ASN A 100 47.834 71.987 -6.469 1.00 0.00 H new ATOM 0 HD22 ASN A 100 47.147 73.381 -5.628 1.00 0.00 H new ATOM 1614 N CYS A 101 44.383 69.858 -3.642 1.00 0.00 N ATOM 1615 CA CYS A 101 43.014 69.943 -4.132 1.00 0.00 C ATOM 1616 C CYS A 101 42.263 71.057 -3.411 1.00 0.00 C ATOM 1617 O CYS A 101 42.734 71.576 -2.401 1.00 0.00 O ATOM 1618 CB CYS A 101 42.299 68.596 -3.971 1.00 0.00 C ATOM 1619 SG CYS A 101 42.678 67.720 -2.424 1.00 0.00 S ATOM 0 H CYS A 101 44.520 70.245 -2.708 1.00 0.00 H new ATOM 0 HA CYS A 101 43.036 70.183 -5.195 1.00 0.00 H new ATOM 0 HB2 CYS A 101 41.223 68.762 -4.025 1.00 0.00 H new ATOM 0 HB3 CYS A 101 42.566 67.955 -4.811 1.00 0.00 H new ATOM 1624 N VAL A 102 41.106 71.446 -3.936 1.00 0.00 N ATOM 1625 CA VAL A 102 40.362 72.553 -3.354 1.00 0.00 C ATOM 1626 C VAL A 102 39.019 72.078 -2.807 1.00 0.00 C ATOM 1627 O VAL A 102 38.474 71.066 -3.258 1.00 0.00 O ATOM 1628 CB VAL A 102 40.135 73.707 -4.370 1.00 0.00 C ATOM 1629 CG1 VAL A 102 41.339 73.872 -5.283 1.00 0.00 C ATOM 1630 CG2 VAL A 102 38.868 73.503 -5.189 1.00 0.00 C ATOM 0 H VAL A 102 40.669 71.017 -4.752 1.00 0.00 H new ATOM 0 HA VAL A 102 40.968 72.941 -2.535 1.00 0.00 H new ATOM 0 HB VAL A 102 40.009 74.622 -3.792 1.00 0.00 H new ATOM 0 HG11 VAL A 102 41.155 74.686 -5.984 1.00 0.00 H new ATOM 0 HG12 VAL A 102 42.221 74.101 -4.685 1.00 0.00 H new ATOM 0 HG13 VAL A 102 41.506 72.947 -5.836 1.00 0.00 H new ATOM 0 HG21 VAL A 102 38.748 74.332 -5.886 1.00 0.00 H new ATOM 0 HG22 VAL A 102 38.941 72.569 -5.746 1.00 0.00 H new ATOM 0 HG23 VAL A 102 38.007 73.462 -4.522 1.00 0.00 H new ATOM 1640 N VAL A 103 38.505 72.800 -1.822 1.00 0.00 N ATOM 1641 CA VAL A 103 37.201 72.497 -1.248 1.00 0.00 C ATOM 1642 C VAL A 103 36.284 73.710 -1.299 1.00 0.00 C ATOM 1643 O VAL A 103 36.749 74.852 -1.315 1.00 0.00 O ATOM 1644 CB VAL A 103 37.304 72.026 0.221 1.00 0.00 C ATOM 1645 CG1 VAL A 103 38.004 70.683 0.311 1.00 0.00 C ATOM 1646 CG2 VAL A 103 38.024 73.060 1.076 1.00 0.00 C ATOM 0 H VAL A 103 38.973 73.603 -1.402 1.00 0.00 H new ATOM 0 HA VAL A 103 36.787 71.689 -1.851 1.00 0.00 H new ATOM 0 HB VAL A 103 36.291 71.911 0.606 1.00 0.00 H new ATOM 0 HG11 VAL A 103 38.064 70.373 1.354 1.00 0.00 H new ATOM 0 HG12 VAL A 103 37.442 69.941 -0.256 1.00 0.00 H new ATOM 0 HG13 VAL A 103 39.010 70.769 -0.101 1.00 0.00 H new ATOM 0 HG21 VAL A 103 38.083 72.704 2.105 1.00 0.00 H new ATOM 0 HG22 VAL A 103 39.030 73.216 0.688 1.00 0.00 H new ATOM 0 HG23 VAL A 103 37.475 74.001 1.049 1.00 0.00 H new ATOM 1656 N LEU A 104 34.985 73.455 -1.333 1.00 0.00 N ATOM 1657 CA LEU A 104 33.993 74.507 -1.204 1.00 0.00 C ATOM 1658 C LEU A 104 33.748 74.786 0.267 1.00 0.00 C ATOM 1659 O LEU A 104 33.185 73.956 0.980 1.00 0.00 O ATOM 1660 CB LEU A 104 32.677 74.124 -1.890 1.00 0.00 C ATOM 1661 CG LEU A 104 32.648 74.315 -3.406 1.00 0.00 C ATOM 1662 CD1 LEU A 104 31.303 73.882 -3.967 1.00 0.00 C ATOM 1663 CD2 LEU A 104 32.927 75.767 -3.764 1.00 0.00 C ATOM 0 H LEU A 104 34.593 72.521 -1.450 1.00 0.00 H new ATOM 0 HA LEU A 104 34.374 75.403 -1.695 1.00 0.00 H new ATOM 0 HB2 LEU A 104 32.462 73.079 -1.668 1.00 0.00 H new ATOM 0 HB3 LEU A 104 31.873 74.715 -1.451 1.00 0.00 H new ATOM 0 HG LEU A 104 33.427 73.694 -3.848 1.00 0.00 H new ATOM 0 HD11 LEU A 104 31.297 74.024 -5.048 1.00 0.00 H new ATOM 0 HD12 LEU A 104 31.135 72.830 -3.738 1.00 0.00 H new ATOM 0 HD13 LEU A 104 30.511 74.482 -3.518 1.00 0.00 H new ATOM 0 HD21 LEU A 104 32.903 75.886 -4.847 1.00 0.00 H new ATOM 0 HD22 LEU A 104 32.168 76.406 -3.312 1.00 0.00 H new ATOM 0 HD23 LEU A 104 33.910 76.052 -3.390 1.00 0.00 H new ATOM 1675 N VAL A 105 34.200 75.939 0.718 1.00 0.00 N ATOM 1676 CA VAL A 105 34.050 76.324 2.109 1.00 0.00 C ATOM 1677 C VAL A 105 33.462 77.727 2.216 1.00 0.00 C ATOM 1678 O VAL A 105 33.748 78.601 1.385 1.00 0.00 O ATOM 1679 CB VAL A 105 35.405 76.240 2.859 1.00 0.00 C ATOM 1680 CG1 VAL A 105 36.493 76.966 2.092 1.00 0.00 C ATOM 1681 CG2 VAL A 105 35.300 76.798 4.270 1.00 0.00 C ATOM 0 H VAL A 105 34.677 76.630 0.139 1.00 0.00 H new ATOM 0 HA VAL A 105 33.361 75.624 2.581 1.00 0.00 H new ATOM 0 HB VAL A 105 35.669 75.185 2.931 1.00 0.00 H new ATOM 0 HG11 VAL A 105 37.434 76.893 2.638 1.00 0.00 H new ATOM 0 HG12 VAL A 105 36.609 76.513 1.108 1.00 0.00 H new ATOM 0 HG13 VAL A 105 36.220 78.015 1.978 1.00 0.00 H new ATOM 0 HG21 VAL A 105 36.269 76.722 4.764 1.00 0.00 H new ATOM 0 HG22 VAL A 105 34.996 77.844 4.226 1.00 0.00 H new ATOM 0 HG23 VAL A 105 34.560 76.228 4.832 1.00 0.00 H new ATOM 1691 N TYR A 106 32.614 77.919 3.217 1.00 0.00 N ATOM 1692 CA TYR A 106 32.006 79.210 3.480 1.00 0.00 C ATOM 1693 C TYR A 106 32.955 80.056 4.319 1.00 0.00 C ATOM 1694 O TYR A 106 33.096 79.849 5.522 1.00 0.00 O ATOM 1695 CB TYR A 106 30.676 79.017 4.209 1.00 0.00 C ATOM 1696 CG TYR A 106 29.770 80.229 4.196 1.00 0.00 C ATOM 1697 CD1 TYR A 106 28.970 80.500 3.097 1.00 0.00 C ATOM 1698 CD2 TYR A 106 29.694 81.083 5.290 1.00 0.00 C ATOM 1699 CE1 TYR A 106 28.122 81.587 3.080 1.00 0.00 C ATOM 1700 CE2 TYR A 106 28.841 82.172 5.285 1.00 0.00 C ATOM 1701 CZ TYR A 106 28.058 82.418 4.176 1.00 0.00 C ATOM 1702 OH TYR A 106 27.195 83.490 4.165 1.00 0.00 O ATOM 0 H TYR A 106 32.331 77.185 3.866 1.00 0.00 H new ATOM 0 HA TYR A 106 31.814 79.723 2.537 1.00 0.00 H new ATOM 0 HB2 TYR A 106 30.147 78.179 3.756 1.00 0.00 H new ATOM 0 HB3 TYR A 106 30.880 78.743 5.244 1.00 0.00 H new ATOM 0 HD1 TYR A 106 29.012 79.847 2.238 1.00 0.00 H new ATOM 0 HD2 TYR A 106 30.310 80.894 6.157 1.00 0.00 H new ATOM 0 HE1 TYR A 106 27.511 81.786 2.212 1.00 0.00 H new ATOM 0 HE2 TYR A 106 28.788 82.825 6.143 1.00 0.00 H new ATOM 0 HH TYR A 106 27.694 84.314 4.345 1.00 0.00 H new ATOM 1712 N ASN A 107 33.625 80.991 3.670 1.00 0.00 N ATOM 1713 CA ASN A 107 34.617 81.826 4.330 1.00 0.00 C ATOM 1714 C ASN A 107 34.627 83.208 3.695 1.00 0.00 C ATOM 1715 O ASN A 107 34.568 83.325 2.467 1.00 0.00 O ATOM 1716 CB ASN A 107 36.000 81.171 4.242 1.00 0.00 C ATOM 1717 CG ASN A 107 37.122 82.072 4.721 1.00 0.00 C ATOM 1718 OD1 ASN A 107 37.704 82.819 3.940 1.00 0.00 O ATOM 1719 ND2 ASN A 107 37.436 82.001 6.006 1.00 0.00 N ATOM 0 H ASN A 107 33.500 81.193 2.678 1.00 0.00 H new ATOM 0 HA ASN A 107 34.359 81.931 5.384 1.00 0.00 H new ATOM 0 HB2 ASN A 107 36.000 80.256 4.835 1.00 0.00 H new ATOM 0 HB3 ASN A 107 36.192 80.881 3.209 1.00 0.00 H new ATOM 0 HD21 ASN A 107 38.187 82.581 6.380 1.00 0.00 H new ATOM 0 HD22 ASN A 107 36.927 81.366 6.621 1.00 0.00 H new ATOM 1726 N GLN A 108 34.692 84.238 4.540 1.00 0.00 N ATOM 1727 CA GLN A 108 34.550 85.632 4.114 1.00 0.00 C ATOM 1728 C GLN A 108 33.107 85.881 3.698 1.00 0.00 C ATOM 1729 O GLN A 108 32.830 86.687 2.810 1.00 0.00 O ATOM 1730 CB GLN A 108 35.513 85.994 2.974 1.00 0.00 C ATOM 1731 CG GLN A 108 36.982 85.856 3.341 1.00 0.00 C ATOM 1732 CD GLN A 108 37.908 86.282 2.218 1.00 0.00 C ATOM 1733 OE1 GLN A 108 37.436 86.167 0.984 1.00 0.00 O flip ATOM 1734 NE2 GLN A 108 39.029 86.725 2.456 1.00 0.00 N flip ATOM 0 H GLN A 108 34.845 84.129 5.543 1.00 0.00 H new ATOM 0 HA GLN A 108 34.810 86.274 4.956 1.00 0.00 H new ATOM 0 HB2 GLN A 108 35.301 85.355 2.116 1.00 0.00 H new ATOM 0 HB3 GLN A 108 35.321 87.021 2.662 1.00 0.00 H new ATOM 0 HG2 GLN A 108 37.189 86.458 4.226 1.00 0.00 H new ATOM 0 HG3 GLN A 108 37.191 84.819 3.605 1.00 0.00 H new ATOM 0 HE21 GLN A 108 39.355 86.797 3.420 1.00 0.00 H new ATOM 0 HE22 GLN A 108 39.634 87.021 1.690 1.00 0.00 H new ATOM 1743 N ASP A 109 32.201 85.160 4.366 1.00 0.00 N ATOM 1744 CA ASP A 109 30.756 85.281 4.155 1.00 0.00 C ATOM 1745 C ASP A 109 30.364 84.870 2.735 1.00 0.00 C ATOM 1746 O ASP A 109 29.301 85.235 2.232 1.00 0.00 O ATOM 1747 CB ASP A 109 30.296 86.713 4.454 1.00 0.00 C ATOM 1748 CG ASP A 109 28.795 86.832 4.614 1.00 0.00 C ATOM 1749 OD1 ASP A 109 28.149 85.842 5.023 1.00 0.00 O ATOM 1750 OD2 ASP A 109 28.252 87.927 4.353 1.00 0.00 O ATOM 0 H ASP A 109 32.453 84.470 5.074 1.00 0.00 H new ATOM 0 HA ASP A 109 30.254 84.601 4.843 1.00 0.00 H new ATOM 0 HB2 ASP A 109 30.782 87.062 5.365 1.00 0.00 H new ATOM 0 HB3 ASP A 109 30.623 87.369 3.648 1.00 0.00 H new ATOM 1755 N LYS A 110 31.216 84.076 2.099 1.00 0.00 N ATOM 1756 CA LYS A 110 30.950 83.613 0.749 1.00 0.00 C ATOM 1757 C LYS A 110 31.485 82.203 0.550 1.00 0.00 C ATOM 1758 O LYS A 110 32.438 81.787 1.212 1.00 0.00 O ATOM 1759 CB LYS A 110 31.598 84.549 -0.281 1.00 0.00 C ATOM 1760 CG LYS A 110 33.120 84.462 -0.314 1.00 0.00 C ATOM 1761 CD LYS A 110 33.725 85.410 -1.339 1.00 0.00 C ATOM 1762 CE LYS A 110 33.257 85.100 -2.756 1.00 0.00 C ATOM 1763 NZ LYS A 110 33.733 83.771 -3.235 1.00 0.00 N ATOM 0 H LYS A 110 32.094 83.742 2.497 1.00 0.00 H new ATOM 0 HA LYS A 110 29.870 83.611 0.604 1.00 0.00 H new ATOM 0 HB2 LYS A 110 31.208 84.312 -1.271 1.00 0.00 H new ATOM 0 HB3 LYS A 110 31.306 85.576 -0.060 1.00 0.00 H new ATOM 0 HG2 LYS A 110 33.518 84.695 0.674 1.00 0.00 H new ATOM 0 HG3 LYS A 110 33.419 83.440 -0.545 1.00 0.00 H new ATOM 0 HD2 LYS A 110 33.457 86.436 -1.086 1.00 0.00 H new ATOM 0 HD3 LYS A 110 34.812 85.345 -1.295 1.00 0.00 H new ATOM 0 HE2 LYS A 110 32.168 85.126 -2.790 1.00 0.00 H new ATOM 0 HE3 LYS A 110 33.616 85.876 -3.432 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 33.567 83.691 -4.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 34.750 83.676 -3.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 33.214 83.018 -2.740 1.00 0.00 H new ATOM 1777 N TRP A 111 30.867 81.471 -0.358 1.00 0.00 N ATOM 1778 CA TRP A 111 31.396 80.189 -0.782 1.00 0.00 C ATOM 1779 C TRP A 111 32.549 80.409 -1.745 1.00 0.00 C ATOM 1780 O TRP A 111 32.493 81.308 -2.593 1.00 0.00 O ATOM 1781 CB TRP A 111 30.312 79.348 -1.455 1.00 0.00 C ATOM 1782 CG TRP A 111 29.323 78.768 -0.495 1.00 0.00 C ATOM 1783 CD1 TRP A 111 28.097 79.271 -0.168 1.00 0.00 C ATOM 1784 CD2 TRP A 111 29.481 77.566 0.261 1.00 0.00 C ATOM 1785 NE1 TRP A 111 27.480 78.447 0.741 1.00 0.00 N ATOM 1786 CE2 TRP A 111 28.312 77.395 1.021 1.00 0.00 C ATOM 1787 CE3 TRP A 111 30.498 76.614 0.365 1.00 0.00 C ATOM 1788 CZ2 TRP A 111 28.133 76.311 1.876 1.00 0.00 C ATOM 1789 CZ3 TRP A 111 30.320 75.540 1.213 1.00 0.00 C ATOM 1790 CH2 TRP A 111 29.147 75.396 1.958 1.00 0.00 C ATOM 0 H TRP A 111 29.997 81.743 -0.816 1.00 0.00 H new ATOM 0 HA TRP A 111 31.750 79.651 0.097 1.00 0.00 H new ATOM 0 HB2 TRP A 111 29.783 79.966 -2.180 1.00 0.00 H new ATOM 0 HB3 TRP A 111 30.785 78.538 -2.011 1.00 0.00 H new ATOM 0 HD1 TRP A 111 27.675 80.182 -0.565 1.00 0.00 H new ATOM 0 HE1 TRP A 111 26.554 78.594 1.142 1.00 0.00 H new ATOM 0 HE3 TRP A 111 31.408 76.717 -0.208 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 27.227 76.197 2.453 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 31.100 74.799 1.302 1.00 0.00 H new ATOM 0 HH2 TRP A 111 29.038 74.544 2.613 1.00 0.00 H new ATOM 1801 N ALA A 112 33.605 79.629 -1.594 1.00 0.00 N ATOM 1802 CA ALA A 112 34.738 79.705 -2.502 1.00 0.00 C ATOM 1803 C ALA A 112 35.661 78.516 -2.318 1.00 0.00 C ATOM 1804 O ALA A 112 35.569 77.797 -1.318 1.00 0.00 O ATOM 1805 CB ALA A 112 35.504 81.004 -2.298 1.00 0.00 C ATOM 0 H ALA A 112 33.702 78.936 -0.852 1.00 0.00 H new ATOM 0 HA ALA A 112 34.352 79.685 -3.521 1.00 0.00 H new ATOM 0 HB1 ALA A 112 36.348 81.041 -2.987 1.00 0.00 H new ATOM 0 HB2 ALA A 112 34.843 81.850 -2.488 1.00 0.00 H new ATOM 0 HB3 ALA A 112 35.871 81.053 -1.273 1.00 0.00 H new ATOM 1811 N TRP A 113 36.551 78.329 -3.280 1.00 0.00 N ATOM 1812 CA TRP A 113 37.505 77.235 -3.256 1.00 0.00 C ATOM 1813 C TRP A 113 38.635 77.567 -2.297 1.00 0.00 C ATOM 1814 O TRP A 113 39.129 78.690 -2.285 1.00 0.00 O ATOM 1815 CB TRP A 113 38.084 76.991 -4.658 1.00 0.00 C ATOM 1816 CG TRP A 113 37.057 76.735 -5.728 1.00 0.00 C ATOM 1817 CD1 TRP A 113 35.708 76.604 -5.569 1.00 0.00 C ATOM 1818 CD2 TRP A 113 37.311 76.575 -7.130 1.00 0.00 C ATOM 1819 NE1 TRP A 113 35.108 76.377 -6.785 1.00 0.00 N ATOM 1820 CE2 TRP A 113 36.072 76.352 -7.757 1.00 0.00 C ATOM 1821 CE3 TRP A 113 38.467 76.599 -7.915 1.00 0.00 C ATOM 1822 CZ2 TRP A 113 35.955 76.156 -9.131 1.00 0.00 C ATOM 1823 CZ3 TRP A 113 38.350 76.403 -9.279 1.00 0.00 C ATOM 1824 CH2 TRP A 113 37.103 76.184 -9.875 1.00 0.00 C ATOM 0 H TRP A 113 36.631 78.932 -4.099 1.00 0.00 H new ATOM 0 HA TRP A 113 36.991 76.333 -2.926 1.00 0.00 H new ATOM 0 HB2 TRP A 113 38.680 77.857 -4.946 1.00 0.00 H new ATOM 0 HB3 TRP A 113 38.762 76.138 -4.613 1.00 0.00 H new ATOM 0 HD1 TRP A 113 35.187 76.669 -4.625 1.00 0.00 H new ATOM 0 HE1 TRP A 113 34.108 76.248 -6.938 1.00 0.00 H new ATOM 0 HE3 TRP A 113 39.434 76.768 -7.465 1.00 0.00 H new ATOM 0 HZ2 TRP A 113 34.993 75.988 -9.592 1.00 0.00 H new ATOM 0 HZ3 TRP A 113 39.237 76.419 -9.895 1.00 0.00 H new ATOM 0 HH2 TRP A 113 37.046 76.034 -10.943 1.00 0.00 H new ATOM 1835 N ASN A 114 39.015 76.604 -1.477 1.00 0.00 N ATOM 1836 CA ASN A 114 40.145 76.773 -0.573 1.00 0.00 C ATOM 1837 C ASN A 114 41.143 75.649 -0.790 1.00 0.00 C ATOM 1838 O ASN A 114 40.748 74.487 -0.917 1.00 0.00 O ATOM 1839 CB ASN A 114 39.674 76.781 0.885 1.00 0.00 C ATOM 1840 CG ASN A 114 40.778 77.145 1.864 1.00 0.00 C ATOM 1841 OD1 ASN A 114 41.509 76.147 2.338 1.00 0.00 O flip ATOM 1842 ND2 ASN A 114 40.968 78.313 2.194 1.00 0.00 N flip ATOM 0 H ASN A 114 38.559 75.694 -1.416 1.00 0.00 H new ATOM 0 HA ASN A 114 40.624 77.729 -0.785 1.00 0.00 H new ATOM 0 HB2 ASN A 114 38.853 77.490 0.992 1.00 0.00 H new ATOM 0 HB3 ASN A 114 39.280 75.797 1.139 1.00 0.00 H new ATOM 0 HD21 ASN A 114 40.384 79.054 1.807 1.00 0.00 H new ATOM 0 HD22 ASN A 114 41.710 78.542 2.855 1.00 0.00 H new ATOM 1849 N ASP A 115 42.420 75.994 -0.841 1.00 0.00 N ATOM 1850 CA ASP A 115 43.473 75.007 -1.063 1.00 0.00 C ATOM 1851 C ASP A 115 43.679 74.160 0.187 1.00 0.00 C ATOM 1852 O ASP A 115 43.908 74.693 1.276 1.00 0.00 O ATOM 1853 CB ASP A 115 44.780 75.706 -1.441 1.00 0.00 C ATOM 1854 CG ASP A 115 45.838 74.742 -1.943 1.00 0.00 C ATOM 1855 OD1 ASP A 115 46.338 73.919 -1.149 1.00 0.00 O ATOM 1856 OD2 ASP A 115 46.170 74.799 -3.142 1.00 0.00 O ATOM 0 H ASP A 115 42.756 76.951 -0.732 1.00 0.00 H new ATOM 0 HA ASP A 115 43.170 74.355 -1.882 1.00 0.00 H new ATOM 0 HB2 ASP A 115 44.579 76.451 -2.211 1.00 0.00 H new ATOM 0 HB3 ASP A 115 45.165 76.241 -0.573 1.00 0.00 H new ATOM 1861 N VAL A 116 43.579 72.846 0.031 1.00 0.00 N ATOM 1862 CA VAL A 116 43.742 71.922 1.146 1.00 0.00 C ATOM 1863 C VAL A 116 44.452 70.649 0.698 1.00 0.00 C ATOM 1864 O VAL A 116 44.442 70.305 -0.488 1.00 0.00 O ATOM 1865 CB VAL A 116 42.385 71.521 1.777 1.00 0.00 C ATOM 1866 CG1 VAL A 116 41.737 72.693 2.499 1.00 0.00 C ATOM 1867 CG2 VAL A 116 41.448 70.963 0.718 1.00 0.00 C ATOM 0 H VAL A 116 43.385 72.394 -0.863 1.00 0.00 H new ATOM 0 HA VAL A 116 44.339 72.448 1.891 1.00 0.00 H new ATOM 0 HB VAL A 116 42.580 70.744 2.516 1.00 0.00 H new ATOM 0 HG11 VAL A 116 40.787 72.375 2.929 1.00 0.00 H new ATOM 0 HG12 VAL A 116 42.397 73.041 3.294 1.00 0.00 H new ATOM 0 HG13 VAL A 116 41.562 73.504 1.792 1.00 0.00 H new ATOM 0 HG21 VAL A 116 40.500 70.687 1.180 1.00 0.00 H new ATOM 0 HG22 VAL A 116 41.272 71.719 -0.047 1.00 0.00 H new ATOM 0 HG23 VAL A 116 41.899 70.082 0.261 1.00 0.00 H new ATOM 1877 N PRO A 117 45.095 69.943 1.639 1.00 0.00 N ATOM 1878 CA PRO A 117 45.649 68.619 1.376 1.00 0.00 C ATOM 1879 C PRO A 117 44.540 67.605 1.130 1.00 0.00 C ATOM 1880 O PRO A 117 43.570 67.541 1.886 1.00 0.00 O ATOM 1881 CB PRO A 117 46.417 68.277 2.657 1.00 0.00 C ATOM 1882 CG PRO A 117 45.820 69.143 3.714 1.00 0.00 C ATOM 1883 CD PRO A 117 45.346 70.390 3.021 1.00 0.00 C ATOM 0 HA PRO A 117 46.280 68.600 0.487 1.00 0.00 H new ATOM 0 HB2 PRO A 117 46.314 67.221 2.908 1.00 0.00 H new ATOM 0 HB3 PRO A 117 47.483 68.474 2.542 1.00 0.00 H new ATOM 0 HG2 PRO A 117 44.993 68.636 4.210 1.00 0.00 H new ATOM 0 HG3 PRO A 117 46.555 69.381 4.483 1.00 0.00 H new ATOM 0 HD2 PRO A 117 44.443 70.788 3.484 1.00 0.00 H new ATOM 0 HD3 PRO A 117 46.097 71.179 3.057 1.00 0.00 H new ATOM 1891 N CYS A 118 44.678 66.821 0.071 1.00 0.00 N ATOM 1892 CA CYS A 118 43.675 65.816 -0.272 1.00 0.00 C ATOM 1893 C CYS A 118 43.543 64.765 0.829 1.00 0.00 C ATOM 1894 O CYS A 118 42.518 64.092 0.942 1.00 0.00 O ATOM 1895 CB CYS A 118 44.017 65.154 -1.606 1.00 0.00 C ATOM 1896 SG CYS A 118 43.977 66.291 -3.022 1.00 0.00 S ATOM 0 H CYS A 118 45.473 66.859 -0.567 1.00 0.00 H new ATOM 0 HA CYS A 118 42.714 66.321 -0.368 1.00 0.00 H new ATOM 0 HB2 CYS A 118 45.010 64.710 -1.536 1.00 0.00 H new ATOM 0 HB3 CYS A 118 43.316 64.339 -1.787 1.00 0.00 H new ATOM 1901 N ASN A 119 44.575 64.635 1.651 1.00 0.00 N ATOM 1902 CA ASN A 119 44.526 63.726 2.787 1.00 0.00 C ATOM 1903 C ASN A 119 44.105 64.479 4.042 1.00 0.00 C ATOM 1904 O ASN A 119 44.873 64.626 4.991 1.00 0.00 O ATOM 1905 CB ASN A 119 45.871 63.021 2.992 1.00 0.00 C ATOM 1906 CG ASN A 119 46.114 61.932 1.961 1.00 0.00 C ATOM 1907 OD1 ASN A 119 45.735 60.781 2.159 1.00 0.00 O ATOM 1908 ND2 ASN A 119 46.749 62.288 0.854 1.00 0.00 N ATOM 0 H ASN A 119 45.453 65.145 1.553 1.00 0.00 H new ATOM 0 HA ASN A 119 43.783 62.956 2.579 1.00 0.00 H new ATOM 0 HB2 ASN A 119 46.675 63.755 2.939 1.00 0.00 H new ATOM 0 HB3 ASN A 119 45.902 62.586 3.991 1.00 0.00 H new ATOM 0 HD21 ASN A 119 46.939 61.595 0.130 1.00 0.00 H new ATOM 0 HD22 ASN A 119 47.048 63.255 0.726 1.00 0.00 H new ATOM 1915 N PHE A 120 42.879 64.979 4.012 1.00 0.00 N ATOM 1916 CA PHE A 120 42.298 65.711 5.126 1.00 0.00 C ATOM 1917 C PHE A 120 40.830 65.321 5.272 1.00 0.00 C ATOM 1918 O PHE A 120 40.141 65.138 4.273 1.00 0.00 O ATOM 1919 CB PHE A 120 42.433 67.220 4.880 1.00 0.00 C ATOM 1920 CG PHE A 120 41.766 68.086 5.911 1.00 0.00 C ATOM 1921 CD1 PHE A 120 42.296 68.210 7.184 1.00 0.00 C ATOM 1922 CD2 PHE A 120 40.607 68.780 5.600 1.00 0.00 C ATOM 1923 CE1 PHE A 120 41.682 69.010 8.130 1.00 0.00 C ATOM 1924 CE2 PHE A 120 39.988 69.581 6.539 1.00 0.00 C ATOM 1925 CZ PHE A 120 40.526 69.697 7.807 1.00 0.00 C ATOM 0 H PHE A 120 42.256 64.888 3.209 1.00 0.00 H new ATOM 0 HA PHE A 120 42.824 65.462 6.048 1.00 0.00 H new ATOM 0 HB2 PHE A 120 43.492 67.475 4.841 1.00 0.00 H new ATOM 0 HB3 PHE A 120 42.013 67.454 3.902 1.00 0.00 H new ATOM 0 HD1 PHE A 120 43.199 67.676 7.441 1.00 0.00 H new ATOM 0 HD2 PHE A 120 40.183 68.693 4.611 1.00 0.00 H new ATOM 0 HE1 PHE A 120 42.105 69.098 9.120 1.00 0.00 H new ATOM 0 HE2 PHE A 120 39.085 70.116 6.283 1.00 0.00 H new ATOM 0 HZ PHE A 120 40.045 70.323 8.544 1.00 0.00 H new ATOM 1935 N GLU A 121 40.366 65.166 6.504 1.00 0.00 N ATOM 1936 CA GLU A 121 38.970 64.816 6.745 1.00 0.00 C ATOM 1937 C GLU A 121 38.066 66.028 6.598 1.00 0.00 C ATOM 1938 O GLU A 121 38.106 66.954 7.408 1.00 0.00 O ATOM 1939 CB GLU A 121 38.787 64.203 8.132 1.00 0.00 C ATOM 1940 CG GLU A 121 39.222 62.754 8.222 1.00 0.00 C ATOM 1941 CD GLU A 121 39.102 62.204 9.628 1.00 0.00 C ATOM 1942 OE1 GLU A 121 37.980 61.818 10.022 1.00 0.00 O ATOM 1943 OE2 GLU A 121 40.125 62.162 10.338 1.00 0.00 O ATOM 0 H GLU A 121 40.929 65.276 7.347 1.00 0.00 H new ATOM 0 HA GLU A 121 38.689 64.077 5.995 1.00 0.00 H new ATOM 0 HB2 GLU A 121 39.354 64.789 8.856 1.00 0.00 H new ATOM 0 HB3 GLU A 121 37.737 64.276 8.416 1.00 0.00 H new ATOM 0 HG2 GLU A 121 38.615 62.152 7.546 1.00 0.00 H new ATOM 0 HG3 GLU A 121 40.255 62.666 7.887 1.00 0.00 H new ATOM 1950 N ALA A 122 37.261 66.014 5.552 1.00 0.00 N ATOM 1951 CA ALA A 122 36.273 67.052 5.326 1.00 0.00 C ATOM 1952 C ALA A 122 35.060 66.454 4.632 1.00 0.00 C ATOM 1953 O ALA A 122 35.041 65.259 4.338 1.00 0.00 O ATOM 1954 CB ALA A 122 36.867 68.187 4.505 1.00 0.00 C ATOM 0 H ALA A 122 37.273 65.286 4.838 1.00 0.00 H new ATOM 0 HA ALA A 122 35.961 67.466 6.285 1.00 0.00 H new ATOM 0 HB1 ALA A 122 36.111 68.956 4.346 1.00 0.00 H new ATOM 0 HB2 ALA A 122 37.715 68.617 5.038 1.00 0.00 H new ATOM 0 HB3 ALA A 122 37.202 67.803 3.541 1.00 0.00 H new ATOM 1960 N SER A 123 34.055 67.275 4.371 1.00 0.00 N ATOM 1961 CA SER A 123 32.851 66.798 3.713 1.00 0.00 C ATOM 1962 C SER A 123 33.070 66.704 2.207 1.00 0.00 C ATOM 1963 O SER A 123 34.112 67.117 1.694 1.00 0.00 O ATOM 1964 CB SER A 123 31.668 67.705 4.045 1.00 0.00 C ATOM 1965 OG SER A 123 32.002 69.068 3.876 1.00 0.00 O ATOM 0 H SER A 123 34.049 68.268 4.603 1.00 0.00 H new ATOM 0 HA SER A 123 32.621 65.798 4.082 1.00 0.00 H new ATOM 0 HB2 SER A 123 30.823 67.453 3.404 1.00 0.00 H new ATOM 0 HB3 SER A 123 31.351 67.531 5.073 1.00 0.00 H new ATOM 0 HG SER A 123 31.564 69.415 3.071 1.00 0.00 H new ATOM 1971 N ARG A 124 32.089 66.178 1.496 1.00 0.00 N ATOM 1972 CA ARG A 124 32.266 65.878 0.087 1.00 0.00 C ATOM 1973 C ARG A 124 30.987 66.113 -0.699 1.00 0.00 C ATOM 1974 O ARG A 124 29.891 66.091 -0.146 1.00 0.00 O ATOM 1975 CB ARG A 124 32.689 64.419 -0.067 1.00 0.00 C ATOM 1976 CG ARG A 124 31.734 63.454 0.617 1.00 0.00 C ATOM 1977 CD ARG A 124 32.134 62.008 0.403 1.00 0.00 C ATOM 1978 NE ARG A 124 31.225 61.090 1.084 1.00 0.00 N ATOM 1979 CZ ARG A 124 30.851 59.912 0.600 1.00 0.00 C ATOM 1980 NH1 ARG A 124 31.257 59.520 -0.603 1.00 0.00 N ATOM 1981 NH2 ARG A 124 30.045 59.139 1.311 1.00 0.00 N ATOM 0 H ARG A 124 31.167 65.951 1.868 1.00 0.00 H new ATOM 0 HA ARG A 124 33.034 66.543 -0.308 1.00 0.00 H new ATOM 0 HB2 ARG A 124 32.750 64.173 -1.127 1.00 0.00 H new ATOM 0 HB3 ARG A 124 33.689 64.289 0.348 1.00 0.00 H new ATOM 0 HG2 ARG A 124 31.707 63.668 1.685 1.00 0.00 H new ATOM 0 HG3 ARG A 124 30.725 63.611 0.235 1.00 0.00 H new ATOM 0 HD2 ARG A 124 32.142 61.787 -0.664 1.00 0.00 H new ATOM 0 HD3 ARG A 124 33.149 61.853 0.769 1.00 0.00 H new ATOM 0 HE ARG A 124 30.853 61.373 1.991 1.00 0.00 H new ATOM 0 HH11 ARG A 124 31.860 60.126 -1.160 1.00 0.00 H new ATOM 0 HH12 ARG A 124 30.966 58.614 -0.969 1.00 0.00 H new ATOM 0 HH21 ARG A 124 29.715 59.450 2.225 1.00 0.00 H new ATOM 0 HH22 ARG A 124 29.754 58.233 0.945 1.00 0.00 H new ATOM 1995 N ILE A 125 31.138 66.345 -1.991 1.00 0.00 N ATOM 1996 CA ILE A 125 30.005 66.378 -2.897 1.00 0.00 C ATOM 1997 C ILE A 125 30.229 65.344 -3.988 1.00 0.00 C ATOM 1998 O ILE A 125 31.316 65.279 -4.568 1.00 0.00 O ATOM 1999 CB ILE A 125 29.815 67.760 -3.559 1.00 0.00 C ATOM 2000 CG1 ILE A 125 29.860 68.878 -2.520 1.00 0.00 C ATOM 2001 CG2 ILE A 125 28.491 67.801 -4.315 1.00 0.00 C ATOM 2002 CD1 ILE A 125 29.904 70.262 -3.131 1.00 0.00 C ATOM 0 H ILE A 125 32.039 66.514 -2.437 1.00 0.00 H new ATOM 0 HA ILE A 125 29.108 66.164 -2.315 1.00 0.00 H new ATOM 0 HB ILE A 125 30.634 67.916 -4.261 1.00 0.00 H new ATOM 0 HG12 ILE A 125 28.985 68.801 -1.875 1.00 0.00 H new ATOM 0 HG13 ILE A 125 30.736 68.740 -1.886 1.00 0.00 H new ATOM 0 HG21 ILE A 125 28.367 68.780 -4.778 1.00 0.00 H new ATOM 0 HG22 ILE A 125 28.489 67.031 -5.087 1.00 0.00 H new ATOM 0 HG23 ILE A 125 27.670 67.621 -3.621 1.00 0.00 H new ATOM 0 HD11 ILE A 125 29.935 71.009 -2.338 1.00 0.00 H new ATOM 0 HD12 ILE A 125 30.794 70.357 -3.753 1.00 0.00 H new ATOM 0 HD13 ILE A 125 29.015 70.418 -3.742 1.00 0.00 H new ATOM 2014 N CYS A 126 29.228 64.528 -4.256 1.00 0.00 N ATOM 2015 CA CYS A 126 29.343 63.537 -5.304 1.00 0.00 C ATOM 2016 C CYS A 126 28.575 64.018 -6.533 1.00 0.00 C ATOM 2017 O CYS A 126 27.387 64.344 -6.457 1.00 0.00 O ATOM 2018 CB CYS A 126 28.840 62.172 -4.817 1.00 0.00 C ATOM 2019 SG CYS A 126 29.649 60.750 -5.615 1.00 0.00 S ATOM 0 H CYS A 126 28.333 64.532 -3.766 1.00 0.00 H new ATOM 0 HA CYS A 126 30.391 63.410 -5.577 1.00 0.00 H new ATOM 0 HB2 CYS A 126 28.992 62.105 -3.740 1.00 0.00 H new ATOM 0 HB3 CYS A 126 27.766 62.110 -4.992 1.00 0.00 H new ATOM 2024 N LYS A 127 29.280 64.083 -7.648 1.00 0.00 N ATOM 2025 CA LYS A 127 28.770 64.662 -8.879 1.00 0.00 C ATOM 2026 C LYS A 127 28.587 63.585 -9.939 1.00 0.00 C ATOM 2027 O LYS A 127 29.554 62.998 -10.428 1.00 0.00 O ATOM 2028 CB LYS A 127 29.750 65.742 -9.362 1.00 0.00 C ATOM 2029 CG LYS A 127 29.588 66.196 -10.811 1.00 0.00 C ATOM 2030 CD LYS A 127 28.294 66.954 -11.043 1.00 0.00 C ATOM 2031 CE LYS A 127 28.275 67.622 -12.415 1.00 0.00 C ATOM 2032 NZ LYS A 127 29.186 68.801 -12.496 1.00 0.00 N ATOM 0 H LYS A 127 30.234 63.731 -7.726 1.00 0.00 H new ATOM 0 HA LYS A 127 27.795 65.114 -8.696 1.00 0.00 H new ATOM 0 HB2 LYS A 127 29.646 66.614 -8.716 1.00 0.00 H new ATOM 0 HB3 LYS A 127 30.765 65.367 -9.231 1.00 0.00 H new ATOM 0 HG2 LYS A 127 30.431 66.830 -11.086 1.00 0.00 H new ATOM 0 HG3 LYS A 127 29.617 65.325 -11.466 1.00 0.00 H new ATOM 0 HD2 LYS A 127 27.450 66.269 -10.959 1.00 0.00 H new ATOM 0 HD3 LYS A 127 28.170 67.710 -10.267 1.00 0.00 H new ATOM 0 HE2 LYS A 127 28.563 66.893 -13.173 1.00 0.00 H new ATOM 0 HE3 LYS A 127 27.258 67.938 -12.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 29.046 69.286 -13.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 28.974 69.457 -11.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 30.173 68.483 -12.421 1.00 0.00 H new ATOM 2046 N ILE A 128 27.340 63.318 -10.270 1.00 0.00 N ATOM 2047 CA ILE A 128 27.015 62.409 -11.351 1.00 0.00 C ATOM 2048 C ILE A 128 26.745 63.203 -12.620 1.00 0.00 C ATOM 2049 O ILE A 128 25.916 64.115 -12.625 1.00 0.00 O ATOM 2050 CB ILE A 128 25.792 61.517 -11.017 1.00 0.00 C ATOM 2051 CG1 ILE A 128 26.155 60.526 -9.913 1.00 0.00 C ATOM 2052 CG2 ILE A 128 25.295 60.776 -12.253 1.00 0.00 C ATOM 2053 CD1 ILE A 128 25.050 59.545 -9.576 1.00 0.00 C ATOM 0 H ILE A 128 26.529 63.721 -9.802 1.00 0.00 H new ATOM 0 HA ILE A 128 27.870 61.748 -11.497 1.00 0.00 H new ATOM 0 HB ILE A 128 24.985 62.161 -10.668 1.00 0.00 H new ATOM 0 HG12 ILE A 128 27.041 59.969 -10.216 1.00 0.00 H new ATOM 0 HG13 ILE A 128 26.420 61.081 -9.013 1.00 0.00 H new ATOM 0 HG21 ILE A 128 24.437 60.159 -11.987 1.00 0.00 H new ATOM 0 HG22 ILE A 128 25.001 61.497 -13.016 1.00 0.00 H new ATOM 0 HG23 ILE A 128 26.092 60.141 -12.642 1.00 0.00 H new ATOM 0 HD11 ILE A 128 25.386 58.876 -8.784 1.00 0.00 H new ATOM 0 HD12 ILE A 128 24.169 60.091 -9.240 1.00 0.00 H new ATOM 0 HD13 ILE A 128 24.799 58.961 -10.462 1.00 0.00 H new ATOM 2065 N PRO A 129 27.471 62.892 -13.698 1.00 0.00 N ATOM 2066 CA PRO A 129 27.278 63.540 -14.992 1.00 0.00 C ATOM 2067 C PRO A 129 25.947 63.144 -15.615 1.00 0.00 C ATOM 2068 O PRO A 129 25.274 62.242 -15.119 1.00 0.00 O ATOM 2069 CB PRO A 129 28.453 63.034 -15.834 1.00 0.00 C ATOM 2070 CG PRO A 129 28.857 61.745 -15.200 1.00 0.00 C ATOM 2071 CD PRO A 129 28.531 61.869 -13.736 1.00 0.00 C ATOM 0 HA PRO A 129 27.252 64.627 -14.916 1.00 0.00 H new ATOM 0 HB2 PRO A 129 28.159 62.887 -16.873 1.00 0.00 H new ATOM 0 HB3 PRO A 129 29.276 63.749 -15.833 1.00 0.00 H new ATOM 0 HG2 PRO A 129 28.321 60.908 -15.647 1.00 0.00 H new ATOM 0 HG3 PRO A 129 29.921 61.557 -15.346 1.00 0.00 H new ATOM 0 HD2 PRO A 129 28.188 60.921 -13.321 1.00 0.00 H new ATOM 0 HD3 PRO A 129 29.402 62.174 -13.156 1.00 0.00 H new ATOM 2079 N GLY A 130 25.557 63.842 -16.675 1.00 0.00 N ATOM 2080 CA GLY A 130 24.318 63.534 -17.380 1.00 0.00 C ATOM 2081 C GLY A 130 24.297 62.165 -18.054 1.00 0.00 C ATOM 2082 O GLY A 130 23.735 62.011 -19.137 1.00 0.00 O ATOM 0 H GLY A 130 26.081 64.625 -17.066 1.00 0.00 H new ATOM 0 HA2 GLY A 130 23.489 63.590 -16.674 1.00 0.00 H new ATOM 0 HA3 GLY A 130 24.145 64.300 -18.136 1.00 0.00 H new ATOM 2086 N THR A 131 24.885 61.167 -17.410 1.00 0.00 N ATOM 2087 CA THR A 131 24.835 59.802 -17.892 1.00 0.00 C ATOM 2088 C THR A 131 23.473 59.200 -17.567 1.00 0.00 C ATOM 2089 O THR A 131 23.070 58.195 -18.150 1.00 0.00 O ATOM 2090 CB THR A 131 25.966 58.936 -17.283 1.00 0.00 C ATOM 2091 OG1 THR A 131 25.871 57.586 -17.752 1.00 0.00 O ATOM 2092 CG2 THR A 131 25.921 58.953 -15.761 1.00 0.00 C ATOM 0 H THR A 131 25.408 61.284 -16.542 1.00 0.00 H new ATOM 0 HA THR A 131 24.983 59.815 -18.972 1.00 0.00 H new ATOM 0 HB THR A 131 26.916 59.364 -17.604 1.00 0.00 H new ATOM 0 HG1 THR A 131 24.975 57.428 -18.116 1.00 0.00 H new ATOM 0 HG21 THR A 131 26.728 58.336 -15.366 1.00 0.00 H new ATOM 0 HG22 THR A 131 26.040 59.976 -15.405 1.00 0.00 H new ATOM 0 HG23 THR A 131 24.963 58.559 -15.421 1.00 0.00 H new ATOM 2100 N THR A 132 22.765 59.838 -16.637 1.00 0.00 N ATOM 2101 CA THR A 132 21.394 59.469 -16.320 1.00 0.00 C ATOM 2102 C THR A 132 20.501 59.682 -17.542 1.00 0.00 C ATOM 2103 O THR A 132 19.525 58.963 -17.748 1.00 0.00 O ATOM 2104 CB THR A 132 20.861 60.307 -15.137 1.00 0.00 C ATOM 2105 OG1 THR A 132 21.778 60.235 -14.036 1.00 0.00 O ATOM 2106 CG2 THR A 132 19.490 59.823 -14.687 1.00 0.00 C ATOM 0 H THR A 132 23.125 60.619 -16.088 1.00 0.00 H new ATOM 0 HA THR A 132 21.379 58.416 -16.037 1.00 0.00 H new ATOM 0 HB THR A 132 20.766 61.339 -15.474 1.00 0.00 H new ATOM 0 HG1 THR A 132 21.721 61.059 -13.508 1.00 0.00 H new ATOM 0 HG21 THR A 132 19.144 60.434 -13.853 1.00 0.00 H new ATOM 0 HG22 THR A 132 18.785 59.906 -15.514 1.00 0.00 H new ATOM 0 HG23 THR A 132 19.557 58.782 -14.371 1.00 0.00 H new ATOM 2114 N LEU A 133 20.868 60.663 -18.364 1.00 0.00 N ATOM 2115 CA LEU A 133 20.126 60.964 -19.582 1.00 0.00 C ATOM 2116 C LEU A 133 20.400 59.909 -20.648 1.00 0.00 C ATOM 2117 O LEU A 133 19.558 59.640 -21.498 1.00 0.00 O ATOM 2118 CB LEU A 133 20.509 62.349 -20.110 1.00 0.00 C ATOM 2119 CG LEU A 133 20.284 63.504 -19.132 1.00 0.00 C ATOM 2120 CD1 LEU A 133 20.741 64.815 -19.748 1.00 0.00 C ATOM 2121 CD2 LEU A 133 18.820 63.585 -18.729 1.00 0.00 C ATOM 0 H LEU A 133 21.677 61.263 -18.206 1.00 0.00 H new ATOM 0 HA LEU A 133 19.062 60.957 -19.346 1.00 0.00 H new ATOM 0 HB2 LEU A 133 21.561 62.334 -20.394 1.00 0.00 H new ATOM 0 HB3 LEU A 133 19.937 62.545 -21.017 1.00 0.00 H new ATOM 0 HG LEU A 133 20.876 63.318 -18.236 1.00 0.00 H new ATOM 0 HD11 LEU A 133 20.574 65.627 -19.040 1.00 0.00 H new ATOM 0 HD12 LEU A 133 21.803 64.754 -19.987 1.00 0.00 H new ATOM 0 HD13 LEU A 133 20.174 65.006 -20.659 1.00 0.00 H new ATOM 0 HD21 LEU A 133 18.679 64.412 -18.033 1.00 0.00 H new ATOM 0 HD22 LEU A 133 18.207 63.748 -19.615 1.00 0.00 H new ATOM 0 HD23 LEU A 133 18.523 62.653 -18.249 1.00 0.00 H new ATOM 2133 N ASN A 134 21.589 59.321 -20.594 1.00 0.00 N ATOM 2134 CA ASN A 134 21.957 58.250 -21.513 1.00 0.00 C ATOM 2135 C ASN A 134 21.343 56.938 -21.042 1.00 0.00 C ATOM 2136 O ASN A 134 21.048 56.048 -21.831 1.00 0.00 O ATOM 2137 CB ASN A 134 23.484 58.123 -21.597 1.00 0.00 C ATOM 2138 CG ASN A 134 23.940 57.096 -22.621 1.00 0.00 C ATOM 2139 OD1 ASN A 134 24.149 57.418 -23.788 1.00 0.00 O ATOM 2140 ND2 ASN A 134 24.112 55.855 -22.188 1.00 0.00 N ATOM 0 H ASN A 134 22.316 59.568 -19.923 1.00 0.00 H new ATOM 0 HA ASN A 134 21.576 58.486 -22.507 1.00 0.00 H new ATOM 0 HB2 ASN A 134 23.910 59.094 -21.850 1.00 0.00 H new ATOM 0 HB3 ASN A 134 23.875 57.849 -20.617 1.00 0.00 H new ATOM 0 HD21 ASN A 134 24.428 55.130 -22.832 1.00 0.00 H new ATOM 0 HD22 ASN A 134 23.928 55.626 -21.211 1.00 0.00 H new ATOM 2147 N ALA A 135 21.161 56.833 -19.733 1.00 0.00 N ATOM 2148 CA ALA A 135 20.520 55.678 -19.122 1.00 0.00 C ATOM 2149 C ALA A 135 19.012 55.897 -19.026 1.00 0.00 C ATOM 2150 O ALA A 135 18.388 55.591 -18.006 1.00 0.00 O ATOM 2151 CB ALA A 135 21.115 55.435 -17.746 1.00 0.00 C ATOM 0 H ALA A 135 21.454 57.546 -19.065 1.00 0.00 H new ATOM 0 HA ALA A 135 20.696 54.799 -19.743 1.00 0.00 H new ATOM 0 HB1 ALA A 135 20.634 54.570 -17.289 1.00 0.00 H new ATOM 0 HB2 ALA A 135 22.185 55.248 -17.840 1.00 0.00 H new ATOM 0 HB3 ALA A 135 20.954 56.312 -17.120 1.00 0.00 H new ATOM 2157 N GLU A 136 18.437 56.395 -20.110 1.00 0.00 N ATOM 2158 CA GLU A 136 17.023 56.754 -20.151 1.00 0.00 C ATOM 2159 C GLU A 136 16.120 55.544 -19.907 1.00 0.00 C ATOM 2160 O GLU A 136 15.295 55.552 -18.991 1.00 0.00 O ATOM 2161 CB GLU A 136 16.667 57.455 -21.479 1.00 0.00 C ATOM 2162 CG GLU A 136 17.572 57.117 -22.670 1.00 0.00 C ATOM 2163 CD GLU A 136 17.481 55.669 -23.111 1.00 0.00 C ATOM 2164 OE1 GLU A 136 18.165 54.815 -22.510 1.00 0.00 O ATOM 2165 OE2 GLU A 136 16.708 55.378 -24.043 1.00 0.00 O ATOM 0 H GLU A 136 18.934 56.562 -20.985 1.00 0.00 H new ATOM 0 HA GLU A 136 16.845 57.458 -19.338 1.00 0.00 H new ATOM 0 HB2 GLU A 136 15.641 57.198 -21.741 1.00 0.00 H new ATOM 0 HB3 GLU A 136 16.695 58.533 -21.319 1.00 0.00 H new ATOM 0 HG2 GLU A 136 17.309 57.761 -23.509 1.00 0.00 H new ATOM 0 HG3 GLU A 136 18.605 57.343 -22.406 1.00 0.00 H new ATOM 2172 N ASN A 137 16.296 54.498 -20.699 1.00 0.00 N ATOM 2173 CA ASN A 137 15.506 53.283 -20.551 1.00 0.00 C ATOM 2174 C ASN A 137 15.925 52.534 -19.299 1.00 0.00 C ATOM 2175 O ASN A 137 15.129 51.824 -18.689 1.00 0.00 O ATOM 2176 CB ASN A 137 15.648 52.382 -21.781 1.00 0.00 C ATOM 2177 CG ASN A 137 14.563 52.631 -22.814 1.00 0.00 C ATOM 2178 OD1 ASN A 137 13.505 52.003 -22.780 1.00 0.00 O ATOM 2179 ND2 ASN A 137 14.809 53.547 -23.737 1.00 0.00 N ATOM 0 H ASN A 137 16.981 54.465 -21.454 1.00 0.00 H new ATOM 0 HA ASN A 137 14.458 53.568 -20.459 1.00 0.00 H new ATOM 0 HB2 ASN A 137 16.624 52.547 -22.237 1.00 0.00 H new ATOM 0 HB3 ASN A 137 15.615 51.338 -21.468 1.00 0.00 H new ATOM 0 HD21 ASN A 137 14.110 53.752 -24.451 1.00 0.00 H new ATOM 0 HD22 ASN A 137 15.697 54.048 -23.734 1.00 0.00 H new ATOM 2186 N LEU A 138 17.176 52.726 -18.907 1.00 0.00 N ATOM 2187 CA LEU A 138 17.703 52.120 -17.695 1.00 0.00 C ATOM 2188 C LEU A 138 16.898 52.602 -16.492 1.00 0.00 C ATOM 2189 O LEU A 138 16.466 51.804 -15.662 1.00 0.00 O ATOM 2190 CB LEU A 138 19.192 52.477 -17.551 1.00 0.00 C ATOM 2191 CG LEU A 138 19.992 51.718 -16.479 1.00 0.00 C ATOM 2192 CD1 LEU A 138 19.749 52.300 -15.095 1.00 0.00 C ATOM 2193 CD2 LEU A 138 19.650 50.234 -16.501 1.00 0.00 C ATOM 0 H LEU A 138 17.848 53.301 -19.415 1.00 0.00 H new ATOM 0 HA LEU A 138 17.615 51.035 -17.750 1.00 0.00 H new ATOM 0 HB2 LEU A 138 19.675 52.311 -18.514 1.00 0.00 H new ATOM 0 HB3 LEU A 138 19.265 53.543 -17.337 1.00 0.00 H new ATOM 0 HG LEU A 138 21.051 51.833 -16.711 1.00 0.00 H new ATOM 0 HD11 LEU A 138 20.328 51.742 -14.359 1.00 0.00 H new ATOM 0 HD12 LEU A 138 20.056 53.346 -15.081 1.00 0.00 H new ATOM 0 HD13 LEU A 138 18.689 52.229 -14.852 1.00 0.00 H new ATOM 0 HD21 LEU A 138 20.227 49.716 -15.735 1.00 0.00 H new ATOM 0 HD22 LEU A 138 18.586 50.103 -16.304 1.00 0.00 H new ATOM 0 HD23 LEU A 138 19.892 49.819 -17.480 1.00 0.00 H new ATOM 2205 N TYR A 139 16.684 53.911 -16.424 1.00 0.00 N ATOM 2206 CA TYR A 139 15.880 54.499 -15.360 1.00 0.00 C ATOM 2207 C TYR A 139 14.392 54.242 -15.606 1.00 0.00 C ATOM 2208 O TYR A 139 13.604 54.164 -14.669 1.00 0.00 O ATOM 2209 CB TYR A 139 16.152 56.005 -15.250 1.00 0.00 C ATOM 2210 CG TYR A 139 15.354 56.689 -14.158 1.00 0.00 C ATOM 2211 CD1 TYR A 139 15.734 56.583 -12.825 1.00 0.00 C ATOM 2212 CD2 TYR A 139 14.220 57.432 -14.460 1.00 0.00 C ATOM 2213 CE1 TYR A 139 15.003 57.196 -11.824 1.00 0.00 C ATOM 2214 CE2 TYR A 139 13.487 58.050 -13.465 1.00 0.00 C ATOM 2215 CZ TYR A 139 13.881 57.928 -12.151 1.00 0.00 C ATOM 2216 OH TYR A 139 13.147 58.536 -11.157 1.00 0.00 O ATOM 0 H TYR A 139 17.056 54.585 -17.093 1.00 0.00 H new ATOM 0 HA TYR A 139 16.160 54.027 -14.418 1.00 0.00 H new ATOM 0 HB2 TYR A 139 17.215 56.161 -15.063 1.00 0.00 H new ATOM 0 HB3 TYR A 139 15.923 56.477 -16.205 1.00 0.00 H new ATOM 0 HD1 TYR A 139 16.614 56.013 -12.567 1.00 0.00 H new ATOM 0 HD2 TYR A 139 13.906 57.528 -15.489 1.00 0.00 H new ATOM 0 HE1 TYR A 139 15.309 57.102 -10.792 1.00 0.00 H new ATOM 0 HE2 TYR A 139 12.609 58.626 -13.717 1.00 0.00 H new ATOM 0 HH TYR A 139 12.389 59.013 -11.555 1.00 0.00 H new ATOM 2226 N PHE A 140 14.020 54.103 -16.874 1.00 0.00 N ATOM 2227 CA PHE A 140 12.634 53.826 -17.252 1.00 0.00 C ATOM 2228 C PHE A 140 12.181 52.470 -16.704 1.00 0.00 C ATOM 2229 O PHE A 140 10.992 52.245 -16.482 1.00 0.00 O ATOM 2230 CB PHE A 140 12.494 53.861 -18.779 1.00 0.00 C ATOM 2231 CG PHE A 140 11.097 53.616 -19.280 1.00 0.00 C ATOM 2232 CD1 PHE A 140 10.118 54.588 -19.145 1.00 0.00 C ATOM 2233 CD2 PHE A 140 10.767 52.418 -19.892 1.00 0.00 C ATOM 2234 CE1 PHE A 140 8.836 54.366 -19.610 1.00 0.00 C ATOM 2235 CE2 PHE A 140 9.487 52.191 -20.358 1.00 0.00 C ATOM 2236 CZ PHE A 140 8.519 53.167 -20.216 1.00 0.00 C ATOM 0 H PHE A 140 14.661 54.178 -17.663 1.00 0.00 H new ATOM 0 HA PHE A 140 11.994 54.595 -16.819 1.00 0.00 H new ATOM 0 HB2 PHE A 140 12.832 54.832 -19.141 1.00 0.00 H new ATOM 0 HB3 PHE A 140 13.158 53.112 -19.210 1.00 0.00 H new ATOM 0 HD1 PHE A 140 10.360 55.528 -18.672 1.00 0.00 H new ATOM 0 HD2 PHE A 140 11.520 51.652 -20.006 1.00 0.00 H new ATOM 0 HE1 PHE A 140 8.082 55.131 -19.499 1.00 0.00 H new ATOM 0 HE2 PHE A 140 9.243 51.252 -20.833 1.00 0.00 H new ATOM 0 HZ PHE A 140 7.517 52.992 -20.578 1.00 0.00 H new ATOM 2246 N GLN A 141 13.140 51.578 -16.486 1.00 0.00 N ATOM 2247 CA GLN A 141 12.856 50.258 -15.929 1.00 0.00 C ATOM 2248 C GLN A 141 12.666 50.316 -14.413 1.00 0.00 C ATOM 2249 O GLN A 141 12.287 49.324 -13.793 1.00 0.00 O ATOM 2250 CB GLN A 141 13.996 49.294 -16.256 1.00 0.00 C ATOM 2251 CG GLN A 141 14.193 49.048 -17.741 1.00 0.00 C ATOM 2252 CD GLN A 141 15.462 48.270 -18.034 1.00 0.00 C ATOM 2253 OE1 GLN A 141 16.474 48.451 -17.199 1.00 0.00 O flip ATOM 2254 NE2 GLN A 141 15.537 47.519 -19.003 1.00 0.00 N flip ATOM 0 H GLN A 141 14.126 51.745 -16.687 1.00 0.00 H new ATOM 0 HA GLN A 141 11.928 49.905 -16.379 1.00 0.00 H new ATOM 0 HB2 GLN A 141 14.922 49.688 -15.838 1.00 0.00 H new ATOM 0 HB3 GLN A 141 13.804 48.341 -15.763 1.00 0.00 H new ATOM 0 HG2 GLN A 141 13.336 48.501 -18.133 1.00 0.00 H new ATOM 0 HG3 GLN A 141 14.227 50.004 -18.264 1.00 0.00 H new ATOM 0 HE21 GLN A 141 14.736 47.406 -19.624 1.00 0.00 H new ATOM 0 HE22 GLN A 141 16.401 47.009 -19.187 1.00 0.00 H new ATOM 2263 N SER A 142 12.954 51.470 -13.822 1.00 0.00 N ATOM 2264 CA SER A 142 12.863 51.632 -12.379 1.00 0.00 C ATOM 2265 C SER A 142 11.518 52.247 -11.983 1.00 0.00 C ATOM 2266 O SER A 142 11.465 53.473 -11.742 1.00 0.00 O ATOM 2267 CB SER A 142 14.028 52.495 -11.879 1.00 0.00 C ATOM 2268 OG SER A 142 13.975 52.671 -10.475 1.00 0.00 O ATOM 0 H SER A 142 13.253 52.307 -14.322 1.00 0.00 H new ATOM 0 HA SER A 142 12.928 50.650 -11.910 1.00 0.00 H new ATOM 0 HB2 SER A 142 14.973 52.027 -12.153 1.00 0.00 H new ATOM 0 HB3 SER A 142 14.000 53.467 -12.370 1.00 0.00 H new ATOM 0 HG SER A 142 14.731 53.224 -10.186 1.00 0.00 H new