USER MOD reduce.3.24.130724 H: found=0, std=0, add=1006, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1000 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 Single : A 1 GLY N :NH3+ -116:sc= 0.0638 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= -0.0752 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 10 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 GLN : amide:sc= -1.79 K(o=-1.8,f=-3.7!) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 HIS : no HE2:sc= -0.554 K(o=-0.55,f=-1.5) USER MOD Single : A 17 TYR OH : rot 180:sc= -0.657 USER MOD Single : A 18 CYS SG : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot -53:sc= -3.14! USER MOD Single : A 23 CYS SG : rot 180:sc= -0.531 USER MOD Single : A 24 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0.0573 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 98:sc= -1.61 USER MOD Single : A 39 ASN : amide:sc= -1.16 K(o=-1.2,f=-5.1!) USER MOD Single : A 40 HIS : no HD1:sc= -0.405 X(o=-0.41,f=-0.11) USER MOD Single : A 44 CYS SG : rot -134:sc= -0.0559 USER MOD Single : A 46 CYS SG : rot 18:sc= 0.0715 USER MOD Single : A 47 TYR OH : rot 180:sc= -0.215 USER MOD Single : A 49 GLN : amide:sc= -2.03 K(o=-2,f=-6.5!) USER MOD Single : A 51 SER OG : rot 180:sc= -1.08 USER MOD Single : A 54 ASN : amide:sc= -8.39! C(o=-8.4!,f=-19!) USER MOD Single : A 56 THR OG1 : rot -99:sc= 0.857 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=-0.093) USER MOD Single : A 63 THR OG1 : rot 124:sc= 0.249 USER MOD Single : A 66 LYS NZ :NH3+ -121:sc= 0.583 (180deg=-0.17) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 GLN : amide:sc= -0.195 K(o=-0.19,f=-0.72) USER MOD Single : A 71 HIS : no HE2:sc= -0.718 K(o=-0.72,f=-2.3!) USER MOD Single : A 72 THR OG1 : rot -153:sc= 0.613 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0.018 USER MOD Single : A 89 THR OG1 : rot -168:sc= -1.58 USER MOD Single : A 91 THR OG1 : rot 180:sc= -0.24 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 THR OG1 : rot 180:sc= -0.224 USER MOD Single : A 98 THR OG1 : rot 44:sc= 0.144 USER MOD Single : A 99 CYS SG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 105 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 106 SER OG : rot 128:sc= 0.00578 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 126 GLN : amide:sc= -5.37 K(o=-5.4,f=-8.4!) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 THR OG1 : rot -8:sc= 0.953 USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 12.429 7.505 23.957 1.00 0.00 N ATOM 2 CA GLY A 1 13.344 8.375 23.237 1.00 0.00 C ATOM 3 C GLY A 1 12.710 9.743 22.978 1.00 0.00 C ATOM 4 O GLY A 1 11.487 9.878 22.999 1.00 0.00 O ATOM 0 H1 GLY A 1 12.827 7.279 24.891 1.00 0.00 H new ATOM 0 H2 GLY A 1 11.515 7.986 24.078 1.00 0.00 H new ATOM 0 H3 GLY A 1 12.289 6.627 23.418 1.00 0.00 H new ATOM 0 HA2 GLY A 1 14.262 8.499 23.812 1.00 0.00 H new ATOM 0 HA3 GLY A 1 13.621 7.913 22.289 1.00 0.00 H new ATOM 8 N SER A 2 13.570 10.722 22.739 1.00 0.00 N ATOM 9 CA SER A 2 13.109 12.075 22.476 1.00 0.00 C ATOM 10 C SER A 2 13.980 12.724 21.398 1.00 0.00 C ATOM 11 O SER A 2 15.119 12.312 21.185 1.00 0.00 O ATOM 12 CB SER A 2 13.124 12.920 23.751 1.00 0.00 C ATOM 13 OG SER A 2 11.902 12.813 24.476 1.00 0.00 O ATOM 0 H SER A 2 14.583 10.606 22.722 1.00 0.00 H new ATOM 0 HA SER A 2 12.080 12.023 22.120 1.00 0.00 H new ATOM 0 HB2 SER A 2 13.951 12.603 24.386 1.00 0.00 H new ATOM 0 HB3 SER A 2 13.302 13.964 23.492 1.00 0.00 H new ATOM 0 HG SER A 2 11.952 13.365 25.284 1.00 0.00 H new ATOM 19 N SER A 3 13.411 13.728 20.748 1.00 0.00 N ATOM 20 CA SER A 3 14.122 14.438 19.698 1.00 0.00 C ATOM 21 C SER A 3 14.370 13.506 18.511 1.00 0.00 C ATOM 22 O SER A 3 14.181 12.295 18.618 1.00 0.00 O ATOM 23 CB SER A 3 15.446 15.004 20.215 1.00 0.00 C ATOM 24 OG SER A 3 16.075 15.851 19.257 1.00 0.00 O ATOM 0 H SER A 3 12.466 14.067 20.928 1.00 0.00 H new ATOM 0 HA SER A 3 13.504 15.274 19.371 1.00 0.00 H new ATOM 0 HB2 SER A 3 15.267 15.565 21.132 1.00 0.00 H new ATOM 0 HB3 SER A 3 16.117 14.183 20.469 1.00 0.00 H new ATOM 0 HG SER A 3 16.916 16.194 19.625 1.00 0.00 H new ATOM 30 N GLY A 4 14.789 14.105 17.406 1.00 0.00 N ATOM 31 CA GLY A 4 15.065 13.343 16.200 1.00 0.00 C ATOM 32 C GLY A 4 16.169 14.005 15.374 1.00 0.00 C ATOM 33 O GLY A 4 17.068 14.639 15.926 1.00 0.00 O ATOM 0 H GLY A 4 14.944 15.110 17.321 1.00 0.00 H new ATOM 0 HA2 GLY A 4 15.364 12.329 16.467 1.00 0.00 H new ATOM 0 HA3 GLY A 4 14.158 13.261 15.602 1.00 0.00 H new ATOM 37 N SER A 5 16.066 13.837 14.064 1.00 0.00 N ATOM 38 CA SER A 5 17.045 14.410 13.156 1.00 0.00 C ATOM 39 C SER A 5 16.370 14.805 11.841 1.00 0.00 C ATOM 40 O SER A 5 15.230 14.421 11.584 1.00 0.00 O ATOM 41 CB SER A 5 18.191 13.432 12.892 1.00 0.00 C ATOM 42 OG SER A 5 19.448 13.955 13.313 1.00 0.00 O ATOM 0 H SER A 5 15.319 13.312 13.609 1.00 0.00 H new ATOM 0 HA SER A 5 17.465 15.301 13.624 1.00 0.00 H new ATOM 0 HB2 SER A 5 17.995 12.495 13.414 1.00 0.00 H new ATOM 0 HB3 SER A 5 18.233 13.201 11.827 1.00 0.00 H new ATOM 0 HG SER A 5 20.153 13.300 13.129 1.00 0.00 H new ATOM 48 N SER A 6 17.103 15.567 11.042 1.00 0.00 N ATOM 49 CA SER A 6 16.590 16.018 9.760 1.00 0.00 C ATOM 50 C SER A 6 17.448 15.454 8.625 1.00 0.00 C ATOM 51 O SER A 6 18.500 14.866 8.871 1.00 0.00 O ATOM 52 CB SER A 6 16.553 17.546 9.688 1.00 0.00 C ATOM 53 OG SER A 6 15.470 18.017 8.891 1.00 0.00 O ATOM 0 H SER A 6 18.048 15.883 11.258 1.00 0.00 H new ATOM 0 HA SER A 6 15.569 15.651 9.652 1.00 0.00 H new ATOM 0 HB2 SER A 6 16.466 17.954 10.695 1.00 0.00 H new ATOM 0 HB3 SER A 6 17.493 17.912 9.275 1.00 0.00 H new ATOM 0 HG SER A 6 15.480 18.997 8.871 1.00 0.00 H new ATOM 59 N GLY A 7 16.966 15.653 7.407 1.00 0.00 N ATOM 60 CA GLY A 7 17.675 15.171 6.234 1.00 0.00 C ATOM 61 C GLY A 7 17.655 16.214 5.114 1.00 0.00 C ATOM 62 O GLY A 7 18.544 17.060 5.033 1.00 0.00 O ATOM 0 H GLY A 7 16.093 16.141 7.207 1.00 0.00 H new ATOM 0 HA2 GLY A 7 18.706 14.936 6.499 1.00 0.00 H new ATOM 0 HA3 GLY A 7 17.218 14.246 5.883 1.00 0.00 H new ATOM 66 N SER A 8 16.631 16.119 4.280 1.00 0.00 N ATOM 67 CA SER A 8 16.483 17.044 3.169 1.00 0.00 C ATOM 68 C SER A 8 17.630 16.855 2.174 1.00 0.00 C ATOM 69 O SER A 8 18.798 16.874 2.557 1.00 0.00 O ATOM 70 CB SER A 8 16.440 18.493 3.659 1.00 0.00 C ATOM 71 OG SER A 8 15.915 19.375 2.672 1.00 0.00 O ATOM 0 H SER A 8 15.895 15.416 4.351 1.00 0.00 H new ATOM 0 HA SER A 8 15.538 16.829 2.670 1.00 0.00 H new ATOM 0 HB2 SER A 8 15.830 18.553 4.560 1.00 0.00 H new ATOM 0 HB3 SER A 8 17.445 18.813 3.933 1.00 0.00 H new ATOM 0 HG SER A 8 15.903 20.290 3.024 1.00 0.00 H new ATOM 77 N TRP A 9 17.256 16.675 0.916 1.00 0.00 N ATOM 78 CA TRP A 9 18.239 16.482 -0.137 1.00 0.00 C ATOM 79 C TRP A 9 17.598 16.895 -1.464 1.00 0.00 C ATOM 80 O TRP A 9 16.408 16.669 -1.680 1.00 0.00 O ATOM 81 CB TRP A 9 18.757 15.042 -0.146 1.00 0.00 C ATOM 82 CG TRP A 9 20.215 14.909 -0.591 1.00 0.00 C ATOM 83 CD1 TRP A 9 20.752 15.251 -1.770 1.00 0.00 C ATOM 84 CD2 TRP A 9 21.306 14.378 0.190 1.00 0.00 C ATOM 85 NE1 TRP A 9 22.105 14.981 -1.806 1.00 0.00 N ATOM 86 CE2 TRP A 9 22.453 14.434 -0.577 1.00 0.00 C ATOM 87 CE3 TRP A 9 21.325 13.869 1.500 1.00 0.00 C ATOM 88 CZ2 TRP A 9 23.702 13.996 -0.120 1.00 0.00 C ATOM 89 CZ3 TRP A 9 22.581 13.435 1.941 1.00 0.00 C ATOM 90 CH2 TRP A 9 23.744 13.484 1.182 1.00 0.00 C ATOM 0 H TRP A 9 16.286 16.659 0.602 1.00 0.00 H new ATOM 0 HA TRP A 9 19.116 17.106 0.035 1.00 0.00 H new ATOM 0 HB2 TRP A 9 18.653 14.623 0.855 1.00 0.00 H new ATOM 0 HB3 TRP A 9 18.130 14.445 -0.808 1.00 0.00 H new ATOM 0 HD1 TRP A 9 20.196 15.683 -2.589 1.00 0.00 H new ATOM 0 HE1 TRP A 9 22.734 15.152 -2.591 1.00 0.00 H new ATOM 0 HE3 TRP A 9 20.441 13.817 2.118 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 24.585 14.050 -0.739 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 22.651 13.034 2.941 1.00 0.00 H new ATOM 0 HH2 TRP A 9 24.676 13.128 1.595 1.00 0.00 H new ATOM 101 N ASN A 10 18.415 17.494 -2.318 1.00 0.00 N ATOM 102 CA ASN A 10 17.943 17.941 -3.617 1.00 0.00 C ATOM 103 C ASN A 10 17.032 16.870 -4.220 1.00 0.00 C ATOM 104 O ASN A 10 17.088 15.706 -3.824 1.00 0.00 O ATOM 105 CB ASN A 10 19.111 18.164 -4.580 1.00 0.00 C ATOM 106 CG ASN A 10 19.798 19.503 -4.307 1.00 0.00 C ATOM 107 OD1 ASN A 10 19.382 20.551 -4.775 1.00 0.00 O ATOM 108 ND2 ASN A 10 20.871 19.412 -3.527 1.00 0.00 N ATOM 0 H ASN A 10 19.401 17.680 -2.135 1.00 0.00 H new ATOM 0 HA ASN A 10 17.407 18.879 -3.476 1.00 0.00 H new ATOM 0 HB2 ASN A 10 19.832 17.353 -4.477 1.00 0.00 H new ATOM 0 HB3 ASN A 10 18.749 18.140 -5.608 1.00 0.00 H new ATOM 0 HD21 ASN A 10 21.400 20.251 -3.287 1.00 0.00 H new ATOM 0 HD22 ASN A 10 21.165 18.504 -3.169 1.00 0.00 H new ATOM 115 N GLN A 11 16.212 17.300 -5.168 1.00 0.00 N ATOM 116 CA GLN A 11 15.290 16.393 -5.829 1.00 0.00 C ATOM 117 C GLN A 11 14.622 15.475 -4.803 1.00 0.00 C ATOM 118 O GLN A 11 15.069 14.349 -4.589 1.00 0.00 O ATOM 119 CB GLN A 11 16.002 15.580 -6.911 1.00 0.00 C ATOM 120 CG GLN A 11 16.382 16.464 -8.101 1.00 0.00 C ATOM 121 CD GLN A 11 17.690 17.211 -7.833 1.00 0.00 C ATOM 122 OE1 GLN A 11 18.630 16.684 -7.263 1.00 0.00 O ATOM 123 NE2 GLN A 11 17.697 18.465 -8.276 1.00 0.00 N ATOM 0 H GLN A 11 16.167 18.265 -5.494 1.00 0.00 H new ATOM 0 HA GLN A 11 14.515 16.985 -6.317 1.00 0.00 H new ATOM 0 HB2 GLN A 11 16.898 15.120 -6.495 1.00 0.00 H new ATOM 0 HB3 GLN A 11 15.355 14.770 -7.247 1.00 0.00 H new ATOM 0 HG2 GLN A 11 16.486 15.850 -8.996 1.00 0.00 H new ATOM 0 HG3 GLN A 11 15.584 17.180 -8.297 1.00 0.00 H new ATOM 0 HE21 GLN A 11 16.875 18.845 -8.746 1.00 0.00 H new ATOM 0 HE22 GLN A 11 18.524 19.047 -8.146 1.00 0.00 H new ATOM 132 N ALA A 12 13.563 15.990 -4.196 1.00 0.00 N ATOM 133 CA ALA A 12 12.829 15.230 -3.198 1.00 0.00 C ATOM 134 C ALA A 12 12.227 13.985 -3.853 1.00 0.00 C ATOM 135 O ALA A 12 12.028 13.952 -5.066 1.00 0.00 O ATOM 136 CB ALA A 12 11.767 16.123 -2.556 1.00 0.00 C ATOM 0 H ALA A 12 13.196 16.924 -4.376 1.00 0.00 H new ATOM 0 HA ALA A 12 13.496 14.895 -2.404 1.00 0.00 H new ATOM 0 HB1 ALA A 12 11.216 15.553 -1.808 1.00 0.00 H new ATOM 0 HB2 ALA A 12 12.249 16.977 -2.080 1.00 0.00 H new ATOM 0 HB3 ALA A 12 11.077 16.477 -3.322 1.00 0.00 H new ATOM 142 N PRO A 13 11.946 12.965 -2.998 1.00 0.00 N ATOM 143 CA PRO A 13 11.369 11.722 -3.480 1.00 0.00 C ATOM 144 C PRO A 13 9.886 11.897 -3.813 1.00 0.00 C ATOM 145 O PRO A 13 9.102 12.319 -2.965 1.00 0.00 O ATOM 146 CB PRO A 13 11.613 10.717 -2.366 1.00 0.00 C ATOM 147 CG PRO A 13 11.898 11.538 -1.119 1.00 0.00 C ATOM 148 CD PRO A 13 12.168 12.969 -1.555 1.00 0.00 C ATOM 0 HA PRO A 13 11.822 11.382 -4.412 1.00 0.00 H new ATOM 0 HB2 PRO A 13 10.744 10.076 -2.221 1.00 0.00 H new ATOM 0 HB3 PRO A 13 12.453 10.065 -2.605 1.00 0.00 H new ATOM 0 HG2 PRO A 13 11.050 11.501 -0.435 1.00 0.00 H new ATOM 0 HG3 PRO A 13 12.757 11.133 -0.584 1.00 0.00 H new ATOM 0 HD2 PRO A 13 11.499 13.669 -1.053 1.00 0.00 H new ATOM 0 HD3 PRO A 13 13.187 13.272 -1.312 1.00 0.00 H new ATOM 156 N LYS A 14 9.547 11.565 -5.050 1.00 0.00 N ATOM 157 CA LYS A 14 8.172 11.680 -5.506 1.00 0.00 C ATOM 158 C LYS A 14 7.565 10.282 -5.640 1.00 0.00 C ATOM 159 O LYS A 14 8.260 9.330 -5.990 1.00 0.00 O ATOM 160 CB LYS A 14 8.101 12.507 -6.791 1.00 0.00 C ATOM 161 CG LYS A 14 6.703 12.441 -7.409 1.00 0.00 C ATOM 162 CD LYS A 14 6.328 13.774 -8.059 1.00 0.00 C ATOM 163 CE LYS A 14 7.276 14.109 -9.212 1.00 0.00 C ATOM 164 NZ LYS A 14 6.946 15.431 -9.788 1.00 0.00 N ATOM 0 H LYS A 14 10.201 11.216 -5.751 1.00 0.00 H new ATOM 0 HA LYS A 14 7.572 12.220 -4.774 1.00 0.00 H new ATOM 0 HB2 LYS A 14 8.358 13.544 -6.575 1.00 0.00 H new ATOM 0 HB3 LYS A 14 8.836 12.138 -7.506 1.00 0.00 H new ATOM 0 HG2 LYS A 14 6.668 11.646 -8.154 1.00 0.00 H new ATOM 0 HG3 LYS A 14 5.973 12.189 -6.640 1.00 0.00 H new ATOM 0 HD2 LYS A 14 5.303 13.727 -8.428 1.00 0.00 H new ATOM 0 HD3 LYS A 14 6.362 14.568 -7.313 1.00 0.00 H new ATOM 0 HE2 LYS A 14 8.306 14.108 -8.855 1.00 0.00 H new ATOM 0 HE3 LYS A 14 7.205 13.342 -9.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 7.599 15.642 -10.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 5.970 15.420 -10.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 7.037 16.162 -9.054 1.00 0.00 H new ATOM 178 N LEU A 15 6.273 10.203 -5.353 1.00 0.00 N ATOM 179 CA LEU A 15 5.564 8.938 -5.437 1.00 0.00 C ATOM 180 C LEU A 15 4.154 9.183 -5.977 1.00 0.00 C ATOM 181 O LEU A 15 3.464 10.098 -5.528 1.00 0.00 O ATOM 182 CB LEU A 15 5.590 8.218 -4.087 1.00 0.00 C ATOM 183 CG LEU A 15 4.504 7.163 -3.869 1.00 0.00 C ATOM 184 CD1 LEU A 15 4.554 6.091 -4.959 1.00 0.00 C ATOM 185 CD2 LEU A 15 4.601 6.559 -2.467 1.00 0.00 C ATOM 0 H LEU A 15 5.700 10.995 -5.062 1.00 0.00 H new ATOM 0 HA LEU A 15 6.062 8.268 -6.138 1.00 0.00 H new ATOM 0 HB2 LEU A 15 6.562 7.739 -3.972 1.00 0.00 H new ATOM 0 HB3 LEU A 15 5.507 8.965 -3.298 1.00 0.00 H new ATOM 0 HG LEU A 15 3.533 7.652 -3.943 1.00 0.00 H new ATOM 0 HD11 LEU A 15 3.772 5.353 -4.780 1.00 0.00 H new ATOM 0 HD12 LEU A 15 4.399 6.555 -5.933 1.00 0.00 H new ATOM 0 HD13 LEU A 15 5.527 5.599 -4.942 1.00 0.00 H new ATOM 0 HD21 LEU A 15 3.818 5.812 -2.338 1.00 0.00 H new ATOM 0 HD22 LEU A 15 5.576 6.088 -2.340 1.00 0.00 H new ATOM 0 HD23 LEU A 15 4.478 7.346 -1.723 1.00 0.00 H new ATOM 197 N HIS A 16 3.766 8.351 -6.932 1.00 0.00 N ATOM 198 CA HIS A 16 2.450 8.466 -7.537 1.00 0.00 C ATOM 199 C HIS A 16 1.521 7.401 -6.951 1.00 0.00 C ATOM 200 O HIS A 16 1.954 6.287 -6.660 1.00 0.00 O ATOM 201 CB HIS A 16 2.546 8.396 -9.062 1.00 0.00 C ATOM 202 CG HIS A 16 1.264 8.755 -9.775 1.00 0.00 C ATOM 203 ND1 HIS A 16 0.628 7.896 -10.654 1.00 0.00 N ATOM 204 CD2 HIS A 16 0.505 9.888 -9.728 1.00 0.00 C ATOM 205 CE1 HIS A 16 -0.461 8.495 -11.111 1.00 0.00 C ATOM 206 NE2 HIS A 16 -0.536 9.730 -10.536 1.00 0.00 N ATOM 0 H HIS A 16 4.340 7.594 -7.302 1.00 0.00 H new ATOM 0 HA HIS A 16 2.021 9.440 -7.303 1.00 0.00 H new ATOM 0 HB2 HIS A 16 3.337 9.067 -9.397 1.00 0.00 H new ATOM 0 HB3 HIS A 16 2.841 7.387 -9.351 1.00 0.00 H new ATOM 0 HD1 HIS A 16 0.944 6.960 -10.907 1.00 0.00 H new ATOM 0 HD2 HIS A 16 0.716 10.765 -9.134 1.00 0.00 H new ATOM 0 HE1 HIS A 16 -1.166 8.079 -11.815 1.00 0.00 H new ATOM 214 N TYR A 17 0.262 7.781 -6.795 1.00 0.00 N ATOM 215 CA TYR A 17 -0.732 6.872 -6.250 1.00 0.00 C ATOM 216 C TYR A 17 -2.147 7.312 -6.634 1.00 0.00 C ATOM 217 O TYR A 17 -2.477 8.494 -6.554 1.00 0.00 O ATOM 218 CB TYR A 17 -0.583 6.948 -4.729 1.00 0.00 C ATOM 219 CG TYR A 17 -0.497 8.375 -4.183 1.00 0.00 C ATOM 220 CD1 TYR A 17 0.728 9.001 -4.078 1.00 0.00 C ATOM 221 CD2 TYR A 17 -1.645 9.036 -3.795 1.00 0.00 C ATOM 222 CE1 TYR A 17 0.809 10.344 -3.564 1.00 0.00 C ATOM 223 CE2 TYR A 17 -1.564 10.378 -3.281 1.00 0.00 C ATOM 224 CZ TYR A 17 -0.341 10.966 -3.191 1.00 0.00 C ATOM 225 OH TYR A 17 -0.265 12.234 -2.705 1.00 0.00 O ATOM 0 H TYR A 17 -0.093 8.706 -7.036 1.00 0.00 H new ATOM 0 HA TYR A 17 -0.582 5.864 -6.636 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -1.430 6.443 -4.265 1.00 0.00 H new ATOM 0 HB3 TYR A 17 0.313 6.402 -4.434 1.00 0.00 H new ATOM 0 HD1 TYR A 17 1.626 8.484 -4.381 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -2.604 8.546 -3.877 1.00 0.00 H new ATOM 0 HE1 TYR A 17 1.762 10.846 -3.477 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -2.454 10.906 -2.974 1.00 0.00 H new ATOM 0 HH TYR A 17 -1.164 12.552 -2.480 1.00 0.00 H new ATOM 235 N CYS A 18 -2.944 6.336 -7.044 1.00 0.00 N ATOM 236 CA CYS A 18 -4.315 6.607 -7.441 1.00 0.00 C ATOM 237 C CYS A 18 -5.249 5.971 -6.409 1.00 0.00 C ATOM 238 O CYS A 18 -5.459 4.759 -6.420 1.00 0.00 O ATOM 239 CB CYS A 18 -4.603 6.105 -8.857 1.00 0.00 C ATOM 240 SG CYS A 18 -6.410 6.022 -9.136 1.00 0.00 S ATOM 0 H CYS A 18 -2.666 5.357 -7.110 1.00 0.00 H new ATOM 0 HA CYS A 18 -4.483 7.684 -7.466 1.00 0.00 H new ATOM 0 HB2 CYS A 18 -4.144 6.771 -9.588 1.00 0.00 H new ATOM 0 HB3 CYS A 18 -4.159 5.120 -9.000 1.00 0.00 H new ATOM 0 HG CYS A 18 -6.644 5.597 -10.342 1.00 0.00 H new ATOM 246 N LEU A 19 -5.784 6.818 -5.541 1.00 0.00 N ATOM 247 CA LEU A 19 -6.690 6.354 -4.505 1.00 0.00 C ATOM 248 C LEU A 19 -8.068 6.094 -5.117 1.00 0.00 C ATOM 249 O LEU A 19 -8.555 6.889 -5.919 1.00 0.00 O ATOM 250 CB LEU A 19 -6.713 7.339 -3.334 1.00 0.00 C ATOM 251 CG LEU A 19 -5.349 7.750 -2.776 1.00 0.00 C ATOM 252 CD1 LEU A 19 -4.319 6.636 -2.971 1.00 0.00 C ATOM 253 CD2 LEU A 19 -4.884 9.074 -3.385 1.00 0.00 C ATOM 0 H LEU A 19 -5.607 7.823 -5.534 1.00 0.00 H new ATOM 0 HA LEU A 19 -6.342 5.408 -4.090 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -7.239 8.239 -3.652 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -7.296 6.898 -2.526 1.00 0.00 H new ATOM 0 HG LEU A 19 -5.452 7.908 -1.703 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -3.358 6.954 -2.566 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -4.652 5.737 -2.452 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -4.211 6.422 -4.034 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -3.912 9.343 -2.971 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -4.801 8.968 -4.467 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -5.607 9.856 -3.151 1.00 0.00 H new ATOM 265 N ASP A 20 -8.658 4.978 -4.715 1.00 0.00 N ATOM 266 CA ASP A 20 -9.970 4.603 -5.214 1.00 0.00 C ATOM 267 C ASP A 20 -10.642 3.662 -4.212 1.00 0.00 C ATOM 268 O ASP A 20 -10.204 2.527 -4.030 1.00 0.00 O ATOM 269 CB ASP A 20 -9.861 3.869 -6.552 1.00 0.00 C ATOM 270 CG ASP A 20 -11.140 3.164 -7.009 1.00 0.00 C ATOM 271 OD1 ASP A 20 -12.220 3.758 -6.801 1.00 0.00 O ATOM 272 OD2 ASP A 20 -11.009 2.048 -7.555 1.00 0.00 O ATOM 0 H ASP A 20 -8.251 4.321 -4.049 1.00 0.00 H new ATOM 0 HA ASP A 20 -10.553 5.514 -5.349 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -9.565 4.585 -7.319 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -9.063 3.130 -6.480 1.00 0.00 H new ATOM 277 N TYR A 21 -11.695 4.169 -3.588 1.00 0.00 N ATOM 278 CA TYR A 21 -12.432 3.389 -2.609 1.00 0.00 C ATOM 279 C TYR A 21 -13.732 2.845 -3.207 1.00 0.00 C ATOM 280 O TYR A 21 -14.659 3.606 -3.481 1.00 0.00 O ATOM 281 CB TYR A 21 -12.773 4.353 -1.471 1.00 0.00 C ATOM 282 CG TYR A 21 -13.340 3.669 -0.225 1.00 0.00 C ATOM 283 CD1 TYR A 21 -12.496 3.002 0.640 1.00 0.00 C ATOM 284 CD2 TYR A 21 -14.694 3.720 0.034 1.00 0.00 C ATOM 285 CE1 TYR A 21 -13.030 2.359 1.813 1.00 0.00 C ATOM 286 CE2 TYR A 21 -15.228 3.076 1.207 1.00 0.00 C ATOM 287 CZ TYR A 21 -14.369 2.428 2.038 1.00 0.00 C ATOM 288 OH TYR A 21 -14.873 1.820 3.146 1.00 0.00 O ATOM 0 H TYR A 21 -12.055 5.111 -3.742 1.00 0.00 H new ATOM 0 HA TYR A 21 -11.840 2.538 -2.273 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -11.874 4.904 -1.193 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -13.496 5.084 -1.832 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -11.436 2.962 0.437 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -15.354 4.243 -0.643 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -12.381 1.834 2.498 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -16.286 3.107 1.421 1.00 0.00 H new ATOM 0 HH TYR A 21 -14.587 0.883 3.164 1.00 0.00 H new ATOM 298 N ASP A 22 -13.757 1.533 -3.391 1.00 0.00 N ATOM 299 CA ASP A 22 -14.927 0.879 -3.951 1.00 0.00 C ATOM 300 C ASP A 22 -15.884 0.499 -2.820 1.00 0.00 C ATOM 301 O ASP A 22 -15.840 -0.622 -2.315 1.00 0.00 O ATOM 302 CB ASP A 22 -14.540 -0.401 -4.694 1.00 0.00 C ATOM 303 CG ASP A 22 -14.542 -0.290 -6.219 1.00 0.00 C ATOM 304 OD1 ASP A 22 -15.641 -0.061 -6.770 1.00 0.00 O ATOM 305 OD2 ASP A 22 -13.445 -0.436 -6.801 1.00 0.00 O ATOM 0 H ASP A 22 -12.986 0.906 -3.162 1.00 0.00 H new ATOM 0 HA ASP A 22 -15.399 1.571 -4.648 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -13.545 -0.705 -4.368 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -15.228 -1.195 -4.402 1.00 0.00 H new ATOM 310 N CYS A 23 -16.727 1.453 -2.454 1.00 0.00 N ATOM 311 CA CYS A 23 -17.693 1.232 -1.392 1.00 0.00 C ATOM 312 C CYS A 23 -18.305 -0.157 -1.580 1.00 0.00 C ATOM 313 O CYS A 23 -18.640 -0.829 -0.606 1.00 0.00 O ATOM 314 CB CYS A 23 -18.762 2.327 -1.362 1.00 0.00 C ATOM 315 SG CYS A 23 -20.010 2.019 -2.665 1.00 0.00 S ATOM 0 H CYS A 23 -16.761 2.382 -2.875 1.00 0.00 H new ATOM 0 HA CYS A 23 -17.191 1.279 -0.426 1.00 0.00 H new ATOM 0 HB2 CYS A 23 -19.243 2.350 -0.384 1.00 0.00 H new ATOM 0 HB3 CYS A 23 -18.300 3.302 -1.513 1.00 0.00 H new ATOM 0 HG CYS A 23 -20.914 2.953 -2.629 1.00 0.00 H new ATOM 321 N GLN A 24 -18.432 -0.547 -2.840 1.00 0.00 N ATOM 322 CA GLN A 24 -18.997 -1.845 -3.169 1.00 0.00 C ATOM 323 C GLN A 24 -18.238 -2.955 -2.439 1.00 0.00 C ATOM 324 O GLN A 24 -18.847 -3.821 -1.813 1.00 0.00 O ATOM 325 CB GLN A 24 -18.992 -2.078 -4.681 1.00 0.00 C ATOM 326 CG GLN A 24 -19.406 -0.812 -5.433 1.00 0.00 C ATOM 327 CD GLN A 24 -20.480 -1.122 -6.478 1.00 0.00 C ATOM 328 OE1 GLN A 24 -21.643 -1.322 -6.171 1.00 0.00 O ATOM 329 NE2 GLN A 24 -20.025 -1.150 -7.728 1.00 0.00 N ATOM 0 H GLN A 24 -18.153 0.013 -3.646 1.00 0.00 H new ATOM 0 HA GLN A 24 -20.035 -1.863 -2.836 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -17.997 -2.386 -5.002 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -19.673 -2.892 -4.929 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -19.783 -0.072 -4.727 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -18.535 -0.373 -5.920 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -19.038 -0.973 -7.916 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -20.663 -1.348 -8.499 1.00 0.00 H new ATOM 338 N LYS A 25 -16.918 -2.893 -2.545 1.00 0.00 N ATOM 339 CA LYS A 25 -16.069 -3.883 -1.904 1.00 0.00 C ATOM 340 C LYS A 25 -15.684 -3.390 -0.508 1.00 0.00 C ATOM 341 O LYS A 25 -15.381 -4.190 0.376 1.00 0.00 O ATOM 342 CB LYS A 25 -14.868 -4.214 -2.792 1.00 0.00 C ATOM 343 CG LYS A 25 -15.274 -4.270 -4.266 1.00 0.00 C ATOM 344 CD LYS A 25 -14.417 -5.279 -5.033 1.00 0.00 C ATOM 345 CE LYS A 25 -15.248 -6.021 -6.081 1.00 0.00 C ATOM 346 NZ LYS A 25 -14.465 -6.216 -7.321 1.00 0.00 N ATOM 0 H LYS A 25 -16.416 -2.173 -3.065 1.00 0.00 H new ATOM 0 HA LYS A 25 -16.608 -4.821 -1.774 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -14.091 -3.462 -2.654 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -14.442 -5.172 -2.492 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -16.326 -4.545 -4.347 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -15.167 -3.282 -4.714 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -13.589 -4.763 -5.519 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -13.981 -5.995 -4.336 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -15.562 -6.987 -5.687 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -16.154 -5.457 -6.301 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -15.044 -6.721 -8.022 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -14.186 -5.290 -7.705 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -13.613 -6.774 -7.109 1.00 0.00 H new ATOM 360 N ALA A 26 -15.709 -2.074 -0.352 1.00 0.00 N ATOM 361 CA ALA A 26 -15.366 -1.465 0.922 1.00 0.00 C ATOM 362 C ALA A 26 -13.875 -1.668 1.195 1.00 0.00 C ATOM 363 O ALA A 26 -13.476 -1.915 2.332 1.00 0.00 O ATOM 364 CB ALA A 26 -16.246 -2.057 2.025 1.00 0.00 C ATOM 0 H ALA A 26 -15.961 -1.413 -1.087 1.00 0.00 H new ATOM 0 HA ALA A 26 -15.553 -0.392 0.896 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -15.988 -1.600 2.980 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -17.294 -1.860 1.799 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -16.083 -3.133 2.082 1.00 0.00 H new ATOM 370 N GLU A 27 -13.091 -1.556 0.132 1.00 0.00 N ATOM 371 CA GLU A 27 -11.652 -1.724 0.243 1.00 0.00 C ATOM 372 C GLU A 27 -10.927 -0.600 -0.501 1.00 0.00 C ATOM 373 O GLU A 27 -11.217 -0.335 -1.666 1.00 0.00 O ATOM 374 CB GLU A 27 -11.218 -3.095 -0.279 1.00 0.00 C ATOM 375 CG GLU A 27 -12.093 -4.206 0.305 1.00 0.00 C ATOM 376 CD GLU A 27 -12.776 -5.008 -0.806 1.00 0.00 C ATOM 377 OE1 GLU A 27 -12.305 -4.894 -1.958 1.00 0.00 O ATOM 378 OE2 GLU A 27 -13.752 -5.715 -0.477 1.00 0.00 O ATOM 0 H GLU A 27 -13.425 -1.351 -0.810 1.00 0.00 H new ATOM 0 HA GLU A 27 -11.380 -1.670 1.297 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -11.282 -3.111 -1.367 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -10.175 -3.274 -0.018 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -11.483 -4.871 0.916 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -12.847 -3.772 0.962 1.00 0.00 H new ATOM 385 N LEU A 28 -10.000 0.031 0.204 1.00 0.00 N ATOM 386 CA LEU A 28 -9.232 1.120 -0.374 1.00 0.00 C ATOM 387 C LEU A 28 -8.212 0.551 -1.362 1.00 0.00 C ATOM 388 O LEU A 28 -7.652 -0.520 -1.134 1.00 0.00 O ATOM 389 CB LEU A 28 -8.608 1.980 0.727 1.00 0.00 C ATOM 390 CG LEU A 28 -8.042 3.330 0.284 1.00 0.00 C ATOM 391 CD1 LEU A 28 -6.753 3.148 -0.520 1.00 0.00 C ATOM 392 CD2 LEU A 28 -9.089 4.137 -0.487 1.00 0.00 C ATOM 0 H LEU A 28 -9.763 -0.191 1.171 1.00 0.00 H new ATOM 0 HA LEU A 28 -9.884 1.788 -0.937 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -9.363 2.159 1.493 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -7.807 1.409 1.196 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.787 3.902 1.176 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -6.372 4.123 -0.822 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -6.009 2.643 0.095 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -6.959 2.548 -1.407 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -8.661 5.092 -0.790 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -9.398 3.581 -1.372 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -9.955 4.314 0.151 1.00 0.00 H new ATOM 404 N PHE A 29 -8.002 1.292 -2.440 1.00 0.00 N ATOM 405 CA PHE A 29 -7.059 0.875 -3.464 1.00 0.00 C ATOM 406 C PHE A 29 -6.010 1.959 -3.718 1.00 0.00 C ATOM 407 O PHE A 29 -6.318 3.149 -3.670 1.00 0.00 O ATOM 408 CB PHE A 29 -7.862 0.648 -4.746 1.00 0.00 C ATOM 409 CG PHE A 29 -8.789 -0.569 -4.693 1.00 0.00 C ATOM 410 CD1 PHE A 29 -9.954 -0.506 -3.994 1.00 0.00 C ATOM 411 CD2 PHE A 29 -8.447 -1.712 -5.345 1.00 0.00 C ATOM 412 CE1 PHE A 29 -10.814 -1.635 -3.945 1.00 0.00 C ATOM 413 CE2 PHE A 29 -9.307 -2.841 -5.295 1.00 0.00 C ATOM 414 CZ PHE A 29 -10.472 -2.779 -4.597 1.00 0.00 C ATOM 0 H PHE A 29 -8.469 2.179 -2.627 1.00 0.00 H new ATOM 0 HA PHE A 29 -6.539 -0.028 -3.145 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -8.458 1.537 -4.951 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -7.170 0.529 -5.580 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -10.225 0.402 -3.476 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -7.522 -1.761 -5.900 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -11.739 -1.585 -3.390 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -9.035 -3.750 -5.812 1.00 0.00 H new ATOM 0 HZ PHE A 29 -11.126 -3.638 -4.560 1.00 0.00 H new ATOM 424 N VAL A 30 -4.792 1.509 -3.984 1.00 0.00 N ATOM 425 CA VAL A 30 -3.696 2.426 -4.246 1.00 0.00 C ATOM 426 C VAL A 30 -2.984 2.007 -5.533 1.00 0.00 C ATOM 427 O VAL A 30 -1.872 1.481 -5.489 1.00 0.00 O ATOM 428 CB VAL A 30 -2.761 2.483 -3.036 1.00 0.00 C ATOM 429 CG1 VAL A 30 -1.753 3.625 -3.177 1.00 0.00 C ATOM 430 CG2 VAL A 30 -3.555 2.609 -1.735 1.00 0.00 C ATOM 0 H VAL A 30 -4.540 0.521 -4.024 1.00 0.00 H new ATOM 0 HA VAL A 30 -4.072 3.438 -4.397 1.00 0.00 H new ATOM 0 HB VAL A 30 -2.204 1.547 -2.998 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -1.100 3.644 -2.304 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -1.154 3.473 -4.075 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -2.285 4.573 -3.252 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -2.867 2.647 -0.891 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -4.151 3.521 -1.759 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -4.214 1.748 -1.626 1.00 0.00 H new ATOM 440 N THR A 31 -3.652 2.255 -6.650 1.00 0.00 N ATOM 441 CA THR A 31 -3.097 1.910 -7.947 1.00 0.00 C ATOM 442 C THR A 31 -2.309 3.090 -8.521 1.00 0.00 C ATOM 443 O THR A 31 -2.172 4.124 -7.870 1.00 0.00 O ATOM 444 CB THR A 31 -4.246 1.452 -8.847 1.00 0.00 C ATOM 445 OG1 THR A 31 -5.218 2.487 -8.722 1.00 0.00 O ATOM 446 CG2 THR A 31 -4.954 0.208 -8.306 1.00 0.00 C ATOM 0 H THR A 31 -4.573 2.691 -6.683 1.00 0.00 H new ATOM 0 HA THR A 31 -2.383 1.091 -7.866 1.00 0.00 H new ATOM 0 HB THR A 31 -3.864 1.246 -9.847 1.00 0.00 H new ATOM 0 HG1 THR A 31 -5.998 2.272 -9.275 1.00 0.00 H new ATOM 0 HG21 THR A 31 -5.761 -0.075 -8.982 1.00 0.00 H new ATOM 0 HG22 THR A 31 -4.240 -0.612 -8.230 1.00 0.00 H new ATOM 0 HG23 THR A 31 -5.366 0.424 -7.320 1.00 0.00 H new ATOM 454 N ARG A 32 -1.812 2.894 -9.733 1.00 0.00 N ATOM 455 CA ARG A 32 -1.041 3.929 -10.402 1.00 0.00 C ATOM 456 C ARG A 32 0.184 4.303 -9.565 1.00 0.00 C ATOM 457 O ARG A 32 0.427 5.481 -9.306 1.00 0.00 O ATOM 458 CB ARG A 32 -1.889 5.180 -10.640 1.00 0.00 C ATOM 459 CG ARG A 32 -3.136 4.849 -11.462 1.00 0.00 C ATOM 460 CD ARG A 32 -2.826 4.872 -12.961 1.00 0.00 C ATOM 461 NE ARG A 32 -4.080 4.764 -13.739 1.00 0.00 N ATOM 462 CZ ARG A 32 -4.128 4.543 -15.059 1.00 0.00 C ATOM 463 NH1 ARG A 32 -2.993 4.404 -15.757 1.00 0.00 N ATOM 464 NH2 ARG A 32 -5.312 4.460 -15.682 1.00 0.00 N ATOM 0 H ARG A 32 -1.928 2.034 -10.269 1.00 0.00 H new ATOM 0 HA ARG A 32 -0.720 3.533 -11.365 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -2.184 5.611 -9.683 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -1.296 5.932 -11.160 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -3.512 3.866 -11.180 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -3.925 5.568 -11.239 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -2.307 5.795 -13.219 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -2.159 4.049 -13.215 1.00 0.00 H new ATOM 0 HE ARG A 32 -4.963 4.864 -13.239 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -2.092 4.466 -15.283 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -3.030 4.236 -16.762 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -6.176 4.565 -15.151 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -5.349 4.292 -16.687 1.00 0.00 H new ATOM 478 N LEU A 33 0.922 3.279 -9.164 1.00 0.00 N ATOM 479 CA LEU A 33 2.116 3.485 -8.361 1.00 0.00 C ATOM 480 C LEU A 33 3.301 3.778 -9.283 1.00 0.00 C ATOM 481 O LEU A 33 3.597 2.997 -10.187 1.00 0.00 O ATOM 482 CB LEU A 33 2.344 2.297 -7.425 1.00 0.00 C ATOM 483 CG LEU A 33 1.471 2.255 -6.169 1.00 0.00 C ATOM 484 CD1 LEU A 33 1.490 0.863 -5.534 1.00 0.00 C ATOM 485 CD2 LEU A 33 1.885 3.343 -5.177 1.00 0.00 C ATOM 0 H LEU A 33 0.717 2.304 -9.380 1.00 0.00 H new ATOM 0 HA LEU A 33 1.994 4.353 -7.713 1.00 0.00 H new ATOM 0 HB2 LEU A 33 2.179 1.379 -7.989 1.00 0.00 H new ATOM 0 HB3 LEU A 33 3.390 2.298 -7.117 1.00 0.00 H new ATOM 0 HG LEU A 33 0.441 2.461 -6.462 1.00 0.00 H new ATOM 0 HD11 LEU A 33 0.862 0.861 -4.643 1.00 0.00 H new ATOM 0 HD12 LEU A 33 1.110 0.132 -6.248 1.00 0.00 H new ATOM 0 HD13 LEU A 33 2.512 0.603 -5.258 1.00 0.00 H new ATOM 0 HD21 LEU A 33 1.249 3.291 -4.293 1.00 0.00 H new ATOM 0 HD22 LEU A 33 2.924 3.193 -4.885 1.00 0.00 H new ATOM 0 HD23 LEU A 33 1.777 4.322 -5.645 1.00 0.00 H new ATOM 497 N GLU A 34 3.947 4.905 -9.024 1.00 0.00 N ATOM 498 CA GLU A 34 5.094 5.310 -9.820 1.00 0.00 C ATOM 499 C GLU A 34 6.066 6.130 -8.970 1.00 0.00 C ATOM 500 O GLU A 34 5.896 7.339 -8.817 1.00 0.00 O ATOM 501 CB GLU A 34 4.652 6.094 -11.057 1.00 0.00 C ATOM 502 CG GLU A 34 3.482 5.400 -11.757 1.00 0.00 C ATOM 503 CD GLU A 34 3.100 6.133 -13.045 1.00 0.00 C ATOM 504 OE1 GLU A 34 2.890 7.362 -12.956 1.00 0.00 O ATOM 505 OE2 GLU A 34 3.027 5.448 -14.088 1.00 0.00 O ATOM 0 H GLU A 34 3.698 5.551 -8.274 1.00 0.00 H new ATOM 0 HA GLU A 34 5.609 4.413 -10.163 1.00 0.00 H new ATOM 0 HB2 GLU A 34 4.360 7.103 -10.767 1.00 0.00 H new ATOM 0 HB3 GLU A 34 5.489 6.191 -11.749 1.00 0.00 H new ATOM 0 HG2 GLU A 34 3.751 4.369 -11.987 1.00 0.00 H new ATOM 0 HG3 GLU A 34 2.623 5.363 -11.087 1.00 0.00 H new ATOM 512 N ALA A 35 7.065 5.440 -8.439 1.00 0.00 N ATOM 513 CA ALA A 35 8.065 6.090 -7.608 1.00 0.00 C ATOM 514 C ALA A 35 8.982 6.938 -8.491 1.00 0.00 C ATOM 515 O ALA A 35 9.213 6.606 -9.653 1.00 0.00 O ATOM 516 CB ALA A 35 8.835 5.032 -6.815 1.00 0.00 C ATOM 0 H ALA A 35 7.203 4.438 -8.568 1.00 0.00 H new ATOM 0 HA ALA A 35 7.591 6.757 -6.888 1.00 0.00 H new ATOM 0 HB1 ALA A 35 9.585 5.519 -6.192 1.00 0.00 H new ATOM 0 HB2 ALA A 35 8.143 4.476 -6.183 1.00 0.00 H new ATOM 0 HB3 ALA A 35 9.326 4.346 -7.505 1.00 0.00 H new ATOM 522 N VAL A 36 9.480 8.018 -7.907 1.00 0.00 N ATOM 523 CA VAL A 36 10.367 8.917 -8.626 1.00 0.00 C ATOM 524 C VAL A 36 11.465 9.408 -7.680 1.00 0.00 C ATOM 525 O VAL A 36 11.395 10.524 -7.169 1.00 0.00 O ATOM 526 CB VAL A 36 9.561 10.058 -9.250 1.00 0.00 C ATOM 527 CG1 VAL A 36 10.476 11.211 -9.667 1.00 0.00 C ATOM 528 CG2 VAL A 36 8.732 9.560 -10.436 1.00 0.00 C ATOM 0 H VAL A 36 9.286 8.291 -6.944 1.00 0.00 H new ATOM 0 HA VAL A 36 10.856 8.395 -9.448 1.00 0.00 H new ATOM 0 HB VAL A 36 8.872 10.433 -8.494 1.00 0.00 H new ATOM 0 HG11 VAL A 36 9.878 12.009 -10.108 1.00 0.00 H new ATOM 0 HG12 VAL A 36 11.002 11.593 -8.792 1.00 0.00 H new ATOM 0 HG13 VAL A 36 11.201 10.854 -10.399 1.00 0.00 H new ATOM 0 HG21 VAL A 36 8.169 10.391 -10.861 1.00 0.00 H new ATOM 0 HG22 VAL A 36 9.395 9.145 -11.195 1.00 0.00 H new ATOM 0 HG23 VAL A 36 8.040 8.788 -10.098 1.00 0.00 H new ATOM 538 N THR A 37 12.453 8.550 -7.477 1.00 0.00 N ATOM 539 CA THR A 37 13.565 8.882 -6.602 1.00 0.00 C ATOM 540 C THR A 37 14.820 9.179 -7.424 1.00 0.00 C ATOM 541 O THR A 37 15.090 8.507 -8.418 1.00 0.00 O ATOM 542 CB THR A 37 13.746 7.731 -5.610 1.00 0.00 C ATOM 543 OG1 THR A 37 14.456 6.743 -6.351 1.00 0.00 O ATOM 544 CG2 THR A 37 12.423 7.051 -5.254 1.00 0.00 C ATOM 0 H THR A 37 12.507 7.625 -7.903 1.00 0.00 H new ATOM 0 HA THR A 37 13.364 9.791 -6.034 1.00 0.00 H new ATOM 0 HB THR A 37 14.217 8.106 -4.701 1.00 0.00 H new ATOM 0 HG1 THR A 37 14.618 5.961 -5.783 1.00 0.00 H new ATOM 0 HG21 THR A 37 12.608 6.242 -4.547 1.00 0.00 H new ATOM 0 HG22 THR A 37 11.749 7.780 -4.803 1.00 0.00 H new ATOM 0 HG23 THR A 37 11.967 6.646 -6.158 1.00 0.00 H new ATOM 552 N SER A 38 15.555 10.188 -6.978 1.00 0.00 N ATOM 553 CA SER A 38 16.776 10.583 -7.660 1.00 0.00 C ATOM 554 C SER A 38 17.993 10.221 -6.806 1.00 0.00 C ATOM 555 O SER A 38 18.967 9.666 -7.312 1.00 0.00 O ATOM 556 CB SER A 38 16.773 12.081 -7.972 1.00 0.00 C ATOM 557 OG SER A 38 16.734 12.872 -6.788 1.00 0.00 O ATOM 0 H SER A 38 15.328 10.743 -6.153 1.00 0.00 H new ATOM 0 HA SER A 38 16.830 10.043 -8.605 1.00 0.00 H new ATOM 0 HB2 SER A 38 17.664 12.333 -8.548 1.00 0.00 H new ATOM 0 HB3 SER A 38 15.912 12.320 -8.596 1.00 0.00 H new ATOM 0 HG SER A 38 17.641 13.166 -6.561 1.00 0.00 H new ATOM 563 N ASN A 39 17.897 10.549 -5.526 1.00 0.00 N ATOM 564 CA ASN A 39 18.977 10.266 -4.598 1.00 0.00 C ATOM 565 C ASN A 39 19.559 8.884 -4.905 1.00 0.00 C ATOM 566 O ASN A 39 18.893 7.869 -4.709 1.00 0.00 O ATOM 567 CB ASN A 39 18.474 10.256 -3.153 1.00 0.00 C ATOM 568 CG ASN A 39 17.333 9.252 -2.977 1.00 0.00 C ATOM 569 OD1 ASN A 39 16.423 9.158 -3.785 1.00 0.00 O ATOM 570 ND2 ASN A 39 17.431 8.509 -1.878 1.00 0.00 N ATOM 0 H ASN A 39 17.087 11.008 -5.110 1.00 0.00 H new ATOM 0 HA ASN A 39 19.731 11.044 -4.712 1.00 0.00 H new ATOM 0 HB2 ASN A 39 19.293 10.002 -2.481 1.00 0.00 H new ATOM 0 HB3 ASN A 39 18.132 11.253 -2.876 1.00 0.00 H new ATOM 0 HD21 ASN A 39 16.718 7.810 -1.670 1.00 0.00 H new ATOM 0 HD22 ASN A 39 18.219 8.639 -1.243 1.00 0.00 H new ATOM 577 N HIS A 40 20.795 8.891 -5.383 1.00 0.00 N ATOM 578 CA HIS A 40 21.473 7.651 -5.719 1.00 0.00 C ATOM 579 C HIS A 40 21.443 6.706 -4.516 1.00 0.00 C ATOM 580 O HIS A 40 21.290 7.149 -3.379 1.00 0.00 O ATOM 581 CB HIS A 40 22.892 7.927 -6.221 1.00 0.00 C ATOM 582 CG HIS A 40 23.192 7.329 -7.575 1.00 0.00 C ATOM 583 ND1 HIS A 40 24.136 7.860 -8.437 1.00 0.00 N ATOM 584 CD2 HIS A 40 22.663 6.242 -8.206 1.00 0.00 C ATOM 585 CE1 HIS A 40 24.165 7.118 -9.534 1.00 0.00 C ATOM 586 NE2 HIS A 40 23.251 6.116 -9.389 1.00 0.00 N ATOM 0 H HIS A 40 21.344 9.735 -5.545 1.00 0.00 H new ATOM 0 HA HIS A 40 20.950 7.157 -6.537 1.00 0.00 H new ATOM 0 HB2 HIS A 40 23.046 9.005 -6.269 1.00 0.00 H new ATOM 0 HB3 HIS A 40 23.605 7.535 -5.496 1.00 0.00 H new ATOM 0 HD2 HIS A 40 21.895 5.593 -7.810 1.00 0.00 H new ATOM 0 HE1 HIS A 40 24.801 7.278 -10.392 1.00 0.00 H new ATOM 0 HE2 HIS A 40 23.052 5.389 -10.077 1.00 0.00 H new ATOM 594 N ASP A 41 21.592 5.423 -4.808 1.00 0.00 N ATOM 595 CA ASP A 41 21.584 4.412 -3.764 1.00 0.00 C ATOM 596 C ASP A 41 22.234 3.132 -4.294 1.00 0.00 C ATOM 597 O ASP A 41 22.421 2.980 -5.501 1.00 0.00 O ATOM 598 CB ASP A 41 20.155 4.074 -3.336 1.00 0.00 C ATOM 599 CG ASP A 41 19.496 5.103 -2.415 1.00 0.00 C ATOM 600 OD1 ASP A 41 20.196 5.567 -1.489 1.00 0.00 O ATOM 601 OD2 ASP A 41 18.307 5.402 -2.658 1.00 0.00 O ATOM 0 H ASP A 41 21.719 5.060 -5.753 1.00 0.00 H new ATOM 0 HA ASP A 41 22.133 4.806 -2.909 1.00 0.00 H new ATOM 0 HB2 ASP A 41 19.541 3.962 -4.230 1.00 0.00 H new ATOM 0 HB3 ASP A 41 20.162 3.108 -2.831 1.00 0.00 H new ATOM 606 N GLY A 42 22.561 2.244 -3.367 1.00 0.00 N ATOM 607 CA GLY A 42 23.186 0.982 -3.726 1.00 0.00 C ATOM 608 C GLY A 42 22.397 0.274 -4.829 1.00 0.00 C ATOM 609 O GLY A 42 22.698 0.432 -6.011 1.00 0.00 O ATOM 0 H GLY A 42 22.405 2.373 -2.367 1.00 0.00 H new ATOM 0 HA2 GLY A 42 24.207 1.160 -4.062 1.00 0.00 H new ATOM 0 HA3 GLY A 42 23.247 0.339 -2.848 1.00 0.00 H new ATOM 613 N GLY A 43 21.403 -0.491 -4.404 1.00 0.00 N ATOM 614 CA GLY A 43 20.568 -1.224 -5.341 1.00 0.00 C ATOM 615 C GLY A 43 19.397 -1.897 -4.622 1.00 0.00 C ATOM 616 O GLY A 43 18.517 -1.220 -4.094 1.00 0.00 O ATOM 0 H GLY A 43 21.156 -0.620 -3.423 1.00 0.00 H new ATOM 0 HA2 GLY A 43 20.189 -0.544 -6.104 1.00 0.00 H new ATOM 0 HA3 GLY A 43 21.166 -1.977 -5.854 1.00 0.00 H new ATOM 620 N CYS A 44 19.425 -3.222 -4.626 1.00 0.00 N ATOM 621 CA CYS A 44 18.376 -3.994 -3.981 1.00 0.00 C ATOM 622 C CYS A 44 17.065 -3.743 -4.729 1.00 0.00 C ATOM 623 O CYS A 44 17.036 -2.992 -5.703 1.00 0.00 O ATOM 624 CB CYS A 44 18.258 -3.655 -2.493 1.00 0.00 C ATOM 625 SG CYS A 44 19.481 -4.618 -1.532 1.00 0.00 S ATOM 0 H CYS A 44 20.157 -3.780 -5.065 1.00 0.00 H new ATOM 0 HA CYS A 44 18.622 -5.055 -4.027 1.00 0.00 H new ATOM 0 HB2 CYS A 44 18.422 -2.588 -2.341 1.00 0.00 H new ATOM 0 HB3 CYS A 44 17.251 -3.876 -2.140 1.00 0.00 H new ATOM 0 HG CYS A 44 18.904 -5.130 -0.486 1.00 0.00 H new ATOM 631 N ASP A 45 16.013 -4.387 -4.246 1.00 0.00 N ATOM 632 CA ASP A 45 14.703 -4.244 -4.858 1.00 0.00 C ATOM 633 C ASP A 45 13.829 -3.347 -3.977 1.00 0.00 C ATOM 634 O ASP A 45 13.671 -3.607 -2.786 1.00 0.00 O ATOM 635 CB ASP A 45 14.006 -5.599 -4.991 1.00 0.00 C ATOM 636 CG ASP A 45 14.259 -6.329 -6.311 1.00 0.00 C ATOM 637 OD1 ASP A 45 15.107 -5.831 -7.082 1.00 0.00 O ATOM 638 OD2 ASP A 45 13.598 -7.370 -6.520 1.00 0.00 O ATOM 0 H ASP A 45 16.041 -5.009 -3.438 1.00 0.00 H new ATOM 0 HA ASP A 45 14.839 -3.810 -5.849 1.00 0.00 H new ATOM 0 HB2 ASP A 45 14.330 -6.240 -4.171 1.00 0.00 H new ATOM 0 HB3 ASP A 45 12.932 -5.451 -4.875 1.00 0.00 H new ATOM 643 N CYS A 46 13.285 -2.311 -4.599 1.00 0.00 N ATOM 644 CA CYS A 46 12.432 -1.375 -3.887 1.00 0.00 C ATOM 645 C CYS A 46 10.977 -1.679 -4.250 1.00 0.00 C ATOM 646 O CYS A 46 10.698 -2.189 -5.334 1.00 0.00 O ATOM 647 CB CYS A 46 12.806 0.076 -4.193 1.00 0.00 C ATOM 648 SG CYS A 46 12.436 0.462 -5.943 1.00 0.00 S ATOM 0 H CYS A 46 13.418 -2.099 -5.588 1.00 0.00 H new ATOM 0 HA CYS A 46 12.570 -1.498 -2.813 1.00 0.00 H new ATOM 0 HB2 CYS A 46 12.252 0.749 -3.539 1.00 0.00 H new ATOM 0 HB3 CYS A 46 13.865 0.237 -3.993 1.00 0.00 H new ATOM 0 HG CYS A 46 11.607 -0.420 -6.416 1.00 0.00 H new ATOM 654 N TYR A 47 10.089 -1.353 -3.323 1.00 0.00 N ATOM 655 CA TYR A 47 8.670 -1.585 -3.532 1.00 0.00 C ATOM 656 C TYR A 47 7.827 -0.608 -2.709 1.00 0.00 C ATOM 657 O TYR A 47 8.284 -0.098 -1.687 1.00 0.00 O ATOM 658 CB TYR A 47 8.398 -3.010 -3.045 1.00 0.00 C ATOM 659 CG TYR A 47 8.755 -3.244 -1.576 1.00 0.00 C ATOM 660 CD1 TYR A 47 10.046 -3.584 -1.225 1.00 0.00 C ATOM 661 CD2 TYR A 47 7.787 -3.114 -0.602 1.00 0.00 C ATOM 662 CE1 TYR A 47 10.382 -3.804 0.158 1.00 0.00 C ATOM 663 CE2 TYR A 47 8.122 -3.334 0.781 1.00 0.00 C ATOM 664 CZ TYR A 47 9.403 -3.668 1.093 1.00 0.00 C ATOM 665 OH TYR A 47 9.721 -3.876 2.399 1.00 0.00 O ATOM 0 H TYR A 47 10.324 -0.930 -2.425 1.00 0.00 H new ATOM 0 HA TYR A 47 8.410 -1.445 -4.581 1.00 0.00 H new ATOM 0 HB2 TYR A 47 7.342 -3.238 -3.193 1.00 0.00 H new ATOM 0 HB3 TYR A 47 8.964 -3.708 -3.662 1.00 0.00 H new ATOM 0 HD1 TYR A 47 10.804 -3.685 -1.988 1.00 0.00 H new ATOM 0 HD2 TYR A 47 6.777 -2.847 -0.877 1.00 0.00 H new ATOM 0 HE1 TYR A 47 11.388 -4.071 0.446 1.00 0.00 H new ATOM 0 HE2 TYR A 47 7.373 -3.236 1.553 1.00 0.00 H new ATOM 0 HH TYR A 47 8.925 -3.743 2.955 1.00 0.00 H new ATOM 675 N VAL A 48 6.612 -0.378 -3.185 1.00 0.00 N ATOM 676 CA VAL A 48 5.702 0.528 -2.506 1.00 0.00 C ATOM 677 C VAL A 48 4.840 -0.265 -1.521 1.00 0.00 C ATOM 678 O VAL A 48 4.398 -1.371 -1.829 1.00 0.00 O ATOM 679 CB VAL A 48 4.876 1.307 -3.531 1.00 0.00 C ATOM 680 CG1 VAL A 48 3.918 2.280 -2.840 1.00 0.00 C ATOM 681 CG2 VAL A 48 5.783 2.041 -4.522 1.00 0.00 C ATOM 0 H VAL A 48 6.237 -0.804 -4.033 1.00 0.00 H new ATOM 0 HA VAL A 48 6.259 1.267 -1.929 1.00 0.00 H new ATOM 0 HB VAL A 48 4.277 0.590 -4.092 1.00 0.00 H new ATOM 0 HG11 VAL A 48 3.343 2.821 -3.592 1.00 0.00 H new ATOM 0 HG12 VAL A 48 3.238 1.724 -2.194 1.00 0.00 H new ATOM 0 HG13 VAL A 48 4.489 2.989 -2.241 1.00 0.00 H new ATOM 0 HG21 VAL A 48 5.171 2.587 -5.240 1.00 0.00 H new ATOM 0 HG22 VAL A 48 6.420 2.741 -3.982 1.00 0.00 H new ATOM 0 HG23 VAL A 48 6.404 1.318 -5.051 1.00 0.00 H new ATOM 691 N GLN A 49 4.625 0.332 -0.358 1.00 0.00 N ATOM 692 CA GLN A 49 3.824 -0.305 0.673 1.00 0.00 C ATOM 693 C GLN A 49 2.741 0.654 1.171 1.00 0.00 C ATOM 694 O GLN A 49 3.004 1.836 1.385 1.00 0.00 O ATOM 695 CB GLN A 49 4.701 -0.789 1.829 1.00 0.00 C ATOM 696 CG GLN A 49 3.851 -1.407 2.941 1.00 0.00 C ATOM 697 CD GLN A 49 4.666 -1.573 4.226 1.00 0.00 C ATOM 698 OE1 GLN A 49 5.865 -1.799 4.207 1.00 0.00 O ATOM 699 NE2 GLN A 49 3.950 -1.449 5.340 1.00 0.00 N ATOM 0 H GLN A 49 4.992 1.250 -0.107 1.00 0.00 H new ATOM 0 HA GLN A 49 3.338 -1.179 0.239 1.00 0.00 H new ATOM 0 HB2 GLN A 49 5.418 -1.524 1.463 1.00 0.00 H new ATOM 0 HB3 GLN A 49 5.277 0.046 2.228 1.00 0.00 H new ATOM 0 HG2 GLN A 49 2.984 -0.775 3.135 1.00 0.00 H new ATOM 0 HG3 GLN A 49 3.473 -2.377 2.618 1.00 0.00 H new ATOM 0 HE21 GLN A 49 2.949 -1.260 5.285 1.00 0.00 H new ATOM 0 HE22 GLN A 49 4.402 -1.543 6.250 1.00 0.00 H new ATOM 708 N GLY A 50 1.546 0.108 1.342 1.00 0.00 N ATOM 709 CA GLY A 50 0.422 0.901 1.812 1.00 0.00 C ATOM 710 C GLY A 50 -0.214 0.270 3.052 1.00 0.00 C ATOM 711 O GLY A 50 -0.604 -0.896 3.029 1.00 0.00 O ATOM 0 H GLY A 50 1.331 -0.873 1.164 1.00 0.00 H new ATOM 0 HA2 GLY A 50 0.758 1.911 2.045 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -0.323 0.987 1.021 1.00 0.00 H new ATOM 715 N SER A 51 -0.299 1.069 4.106 1.00 0.00 N ATOM 716 CA SER A 51 -0.881 0.603 5.353 1.00 0.00 C ATOM 717 C SER A 51 -2.087 1.469 5.723 1.00 0.00 C ATOM 718 O SER A 51 -2.072 2.682 5.516 1.00 0.00 O ATOM 719 CB SER A 51 0.151 0.620 6.482 1.00 0.00 C ATOM 720 OG SER A 51 -0.299 -0.099 7.628 1.00 0.00 O ATOM 0 H SER A 51 0.025 2.036 4.122 1.00 0.00 H new ATOM 0 HA SER A 51 -1.210 -0.427 5.214 1.00 0.00 H new ATOM 0 HB2 SER A 51 1.085 0.186 6.126 1.00 0.00 H new ATOM 0 HB3 SER A 51 0.365 1.651 6.762 1.00 0.00 H new ATOM 0 HG SER A 51 0.389 -0.066 8.326 1.00 0.00 H new ATOM 726 N VAL A 52 -3.102 0.813 6.265 1.00 0.00 N ATOM 727 CA VAL A 52 -4.314 1.508 6.666 1.00 0.00 C ATOM 728 C VAL A 52 -4.610 1.201 8.136 1.00 0.00 C ATOM 729 O VAL A 52 -4.485 0.058 8.572 1.00 0.00 O ATOM 730 CB VAL A 52 -5.466 1.131 5.733 1.00 0.00 C ATOM 731 CG1 VAL A 52 -6.763 0.924 6.519 1.00 0.00 C ATOM 732 CG2 VAL A 52 -5.651 2.183 4.637 1.00 0.00 C ATOM 0 H VAL A 52 -3.110 -0.193 6.436 1.00 0.00 H new ATOM 0 HA VAL A 52 -4.183 2.587 6.579 1.00 0.00 H new ATOM 0 HB VAL A 52 -5.212 0.187 5.251 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -7.566 0.657 5.832 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -6.625 0.123 7.245 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -7.023 1.845 7.041 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -6.476 1.891 3.988 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -5.872 3.148 5.093 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -4.736 2.261 4.049 1.00 0.00 H new ATOM 742 N ALA A 53 -4.996 2.242 8.858 1.00 0.00 N ATOM 743 CA ALA A 53 -5.311 2.098 10.269 1.00 0.00 C ATOM 744 C ALA A 53 -6.728 2.614 10.527 1.00 0.00 C ATOM 745 O ALA A 53 -6.937 3.816 10.680 1.00 0.00 O ATOM 746 CB ALA A 53 -4.262 2.836 11.104 1.00 0.00 C ATOM 0 H ALA A 53 -5.098 3.189 8.493 1.00 0.00 H new ATOM 0 HA ALA A 53 -5.284 1.049 10.563 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -4.498 2.728 12.163 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -3.277 2.413 10.907 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -4.263 3.893 10.838 1.00 0.00 H new ATOM 752 N ASN A 54 -7.665 1.678 10.566 1.00 0.00 N ATOM 753 CA ASN A 54 -9.057 2.023 10.802 1.00 0.00 C ATOM 754 C ASN A 54 -9.386 1.813 12.281 1.00 0.00 C ATOM 755 O ASN A 54 -8.528 1.398 13.059 1.00 0.00 O ATOM 756 CB ASN A 54 -9.992 1.134 9.979 1.00 0.00 C ATOM 757 CG ASN A 54 -9.276 0.580 8.745 1.00 0.00 C ATOM 758 OD1 ASN A 54 -9.004 1.282 7.786 1.00 0.00 O ATOM 759 ND2 ASN A 54 -8.989 -0.716 8.824 1.00 0.00 N ATOM 0 H ASN A 54 -7.488 0.682 10.438 1.00 0.00 H new ATOM 0 HA ASN A 54 -9.200 3.064 10.512 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -10.352 0.310 10.595 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -10.866 1.707 9.670 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -8.512 -1.181 8.051 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -9.246 -1.245 9.657 1.00 0.00 H new ATOM 766 N ARG A 55 -10.631 2.109 12.626 1.00 0.00 N ATOM 767 CA ARG A 55 -11.084 1.958 13.998 1.00 0.00 C ATOM 768 C ARG A 55 -11.426 0.495 14.286 1.00 0.00 C ATOM 769 O ARG A 55 -11.929 0.172 15.361 1.00 0.00 O ATOM 770 CB ARG A 55 -12.314 2.826 14.270 1.00 0.00 C ATOM 771 CG ARG A 55 -12.056 3.797 15.423 1.00 0.00 C ATOM 772 CD ARG A 55 -13.309 4.613 15.745 1.00 0.00 C ATOM 773 NE ARG A 55 -12.953 6.038 15.928 1.00 0.00 N ATOM 774 CZ ARG A 55 -13.812 6.979 16.344 1.00 0.00 C ATOM 775 NH1 ARG A 55 -15.081 6.653 16.622 1.00 0.00 N ATOM 776 NH2 ARG A 55 -13.400 8.247 16.481 1.00 0.00 N ATOM 0 H ARG A 55 -11.340 2.453 11.978 1.00 0.00 H new ATOM 0 HA ARG A 55 -10.274 2.280 14.652 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -12.575 3.385 13.371 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -13.166 2.190 14.509 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -11.742 3.242 16.307 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -11.238 4.468 15.161 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -14.036 4.512 14.939 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -13.781 4.229 16.649 1.00 0.00 H new ATOM 0 HE ARG A 55 -11.994 6.321 15.725 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -15.394 5.688 16.517 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -15.734 7.370 16.939 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -12.434 8.495 16.269 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -14.053 8.964 16.797 1.00 0.00 H new ATOM 790 N THR A 56 -11.139 -0.350 13.307 1.00 0.00 N ATOM 791 CA THR A 56 -11.411 -1.771 13.442 1.00 0.00 C ATOM 792 C THR A 56 -10.101 -2.561 13.499 1.00 0.00 C ATOM 793 O THR A 56 -10.088 -3.719 13.913 1.00 0.00 O ATOM 794 CB THR A 56 -12.323 -2.190 12.287 1.00 0.00 C ATOM 795 OG1 THR A 56 -11.795 -1.499 11.159 1.00 0.00 O ATOM 796 CG2 THR A 56 -13.742 -1.637 12.433 1.00 0.00 C ATOM 0 H THR A 56 -10.721 -0.078 12.417 1.00 0.00 H new ATOM 0 HA THR A 56 -11.927 -1.988 14.377 1.00 0.00 H new ATOM 0 HB THR A 56 -12.361 -3.278 12.230 1.00 0.00 H new ATOM 0 HG1 THR A 56 -12.324 -0.691 10.993 1.00 0.00 H new ATOM 0 HG21 THR A 56 -14.348 -1.963 11.588 1.00 0.00 H new ATOM 0 HG22 THR A 56 -14.182 -2.005 13.359 1.00 0.00 H new ATOM 0 HG23 THR A 56 -13.707 -0.548 12.456 1.00 0.00 H new ATOM 804 N GLY A 57 -9.032 -1.903 13.076 1.00 0.00 N ATOM 805 CA GLY A 57 -7.721 -2.529 13.074 1.00 0.00 C ATOM 806 C GLY A 57 -6.769 -1.806 12.118 1.00 0.00 C ATOM 807 O GLY A 57 -6.698 -0.578 12.119 1.00 0.00 O ATOM 0 H GLY A 57 -9.047 -0.943 12.732 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -7.307 -2.518 14.082 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -7.814 -3.574 12.779 1.00 0.00 H new ATOM 811 N SER A 58 -6.063 -2.598 11.325 1.00 0.00 N ATOM 812 CA SER A 58 -5.119 -2.048 10.367 1.00 0.00 C ATOM 813 C SER A 58 -4.787 -3.095 9.301 1.00 0.00 C ATOM 814 O SER A 58 -4.663 -4.280 9.607 1.00 0.00 O ATOM 815 CB SER A 58 -3.842 -1.574 11.061 1.00 0.00 C ATOM 816 OG SER A 58 -3.459 -2.441 12.126 1.00 0.00 O ATOM 0 H SER A 58 -6.126 -3.616 11.326 1.00 0.00 H new ATOM 0 HA SER A 58 -5.581 -1.184 9.889 1.00 0.00 H new ATOM 0 HB2 SER A 58 -3.034 -1.516 10.332 1.00 0.00 H new ATOM 0 HB3 SER A 58 -3.993 -0.567 11.450 1.00 0.00 H new ATOM 0 HG SER A 58 -2.638 -2.105 12.543 1.00 0.00 H new ATOM 822 N VAL A 59 -4.651 -2.619 8.072 1.00 0.00 N ATOM 823 CA VAL A 59 -4.335 -3.499 6.960 1.00 0.00 C ATOM 824 C VAL A 59 -3.105 -2.963 6.224 1.00 0.00 C ATOM 825 O VAL A 59 -2.814 -1.769 6.282 1.00 0.00 O ATOM 826 CB VAL A 59 -5.556 -3.651 6.050 1.00 0.00 C ATOM 827 CG1 VAL A 59 -6.428 -4.827 6.495 1.00 0.00 C ATOM 828 CG2 VAL A 59 -6.367 -2.355 5.999 1.00 0.00 C ATOM 0 H VAL A 59 -4.754 -1.635 7.822 1.00 0.00 H new ATOM 0 HA VAL A 59 -4.088 -4.497 7.321 1.00 0.00 H new ATOM 0 HB VAL A 59 -5.199 -3.862 5.042 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -7.289 -4.913 5.832 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -5.846 -5.747 6.455 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -6.772 -4.659 7.516 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -7.229 -2.491 5.345 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -6.709 -2.100 7.002 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -5.742 -1.550 5.613 1.00 0.00 H new ATOM 838 N GLU A 60 -2.416 -3.871 5.550 1.00 0.00 N ATOM 839 CA GLU A 60 -1.224 -3.504 4.804 1.00 0.00 C ATOM 840 C GLU A 60 -1.194 -4.233 3.459 1.00 0.00 C ATOM 841 O GLU A 60 -1.968 -5.162 3.235 1.00 0.00 O ATOM 842 CB GLU A 60 0.041 -3.797 5.614 1.00 0.00 C ATOM 843 CG GLU A 60 0.358 -2.645 6.571 1.00 0.00 C ATOM 844 CD GLU A 60 1.463 -3.037 7.553 1.00 0.00 C ATOM 845 OE1 GLU A 60 1.226 -3.993 8.323 1.00 0.00 O ATOM 846 OE2 GLU A 60 2.521 -2.372 7.513 1.00 0.00 O ATOM 0 H GLU A 60 -2.660 -4.860 5.505 1.00 0.00 H new ATOM 0 HA GLU A 60 -1.254 -2.431 4.613 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -0.091 -4.719 6.180 1.00 0.00 H new ATOM 0 HB3 GLU A 60 0.882 -3.955 4.938 1.00 0.00 H new ATOM 0 HG2 GLU A 60 0.667 -1.769 6.001 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -0.541 -2.367 7.121 1.00 0.00 H new ATOM 853 N ALA A 61 -0.292 -3.783 2.599 1.00 0.00 N ATOM 854 CA ALA A 61 -0.152 -4.381 1.282 1.00 0.00 C ATOM 855 C ALA A 61 1.079 -3.793 0.589 1.00 0.00 C ATOM 856 O ALA A 61 1.436 -2.640 0.823 1.00 0.00 O ATOM 857 CB ALA A 61 -1.435 -4.156 0.479 1.00 0.00 C ATOM 0 H ALA A 61 0.349 -3.012 2.788 1.00 0.00 H new ATOM 0 HA ALA A 61 -0.003 -5.458 1.364 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -1.329 -4.605 -0.509 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -2.275 -4.617 0.999 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -1.616 -3.086 0.374 1.00 0.00 H new ATOM 863 N GLN A 62 1.694 -4.614 -0.251 1.00 0.00 N ATOM 864 CA GLN A 62 2.878 -4.189 -0.979 1.00 0.00 C ATOM 865 C GLN A 62 2.797 -4.650 -2.436 1.00 0.00 C ATOM 866 O GLN A 62 1.989 -5.513 -2.774 1.00 0.00 O ATOM 867 CB GLN A 62 4.150 -4.711 -0.309 1.00 0.00 C ATOM 868 CG GLN A 62 4.205 -4.296 1.163 1.00 0.00 C ATOM 869 CD GLN A 62 4.725 -5.439 2.036 1.00 0.00 C ATOM 870 OE1 GLN A 62 5.855 -5.437 2.498 1.00 0.00 O ATOM 871 NE2 GLN A 62 3.842 -6.413 2.236 1.00 0.00 N ATOM 0 H GLN A 62 1.395 -5.570 -0.443 1.00 0.00 H new ATOM 0 HA GLN A 62 2.920 -3.100 -0.964 1.00 0.00 H new ATOM 0 HB2 GLN A 62 4.186 -5.798 -0.386 1.00 0.00 H new ATOM 0 HB3 GLN A 62 5.025 -4.326 -0.832 1.00 0.00 H new ATOM 0 HG2 GLN A 62 4.851 -3.425 1.275 1.00 0.00 H new ATOM 0 HG3 GLN A 62 3.211 -4.001 1.499 1.00 0.00 H new ATOM 0 HE21 GLN A 62 2.913 -6.352 1.820 1.00 0.00 H new ATOM 0 HE22 GLN A 62 4.094 -7.221 2.805 1.00 0.00 H new ATOM 880 N THR A 63 3.646 -4.052 -3.260 1.00 0.00 N ATOM 881 CA THR A 63 3.682 -4.390 -4.672 1.00 0.00 C ATOM 882 C THR A 63 4.837 -5.349 -4.963 1.00 0.00 C ATOM 883 O THR A 63 5.622 -5.670 -4.071 1.00 0.00 O ATOM 884 CB THR A 63 3.760 -3.086 -5.468 1.00 0.00 C ATOM 885 OG1 THR A 63 4.953 -2.464 -4.999 1.00 0.00 O ATOM 886 CG2 THR A 63 2.652 -2.101 -5.089 1.00 0.00 C ATOM 0 H THR A 63 4.314 -3.335 -2.976 1.00 0.00 H new ATOM 0 HA THR A 63 2.779 -4.920 -4.974 1.00 0.00 H new ATOM 0 HB THR A 63 3.700 -3.307 -6.534 1.00 0.00 H new ATOM 0 HG1 THR A 63 5.546 -2.281 -5.757 1.00 0.00 H new ATOM 0 HG21 THR A 63 2.754 -1.193 -5.683 1.00 0.00 H new ATOM 0 HG22 THR A 63 1.680 -2.555 -5.283 1.00 0.00 H new ATOM 0 HG23 THR A 63 2.732 -1.853 -4.031 1.00 0.00 H new ATOM 894 N ALA A 64 4.906 -5.781 -6.213 1.00 0.00 N ATOM 895 CA ALA A 64 5.952 -6.698 -6.633 1.00 0.00 C ATOM 896 C ALA A 64 7.281 -5.943 -6.719 1.00 0.00 C ATOM 897 O ALA A 64 7.343 -4.853 -7.285 1.00 0.00 O ATOM 898 CB ALA A 64 5.562 -7.345 -7.963 1.00 0.00 C ATOM 0 H ALA A 64 4.254 -5.513 -6.950 1.00 0.00 H new ATOM 0 HA ALA A 64 6.074 -7.500 -5.905 1.00 0.00 H new ATOM 0 HB1 ALA A 64 6.347 -8.033 -8.277 1.00 0.00 H new ATOM 0 HB2 ALA A 64 4.628 -7.893 -7.841 1.00 0.00 H new ATOM 0 HB3 ALA A 64 5.433 -6.571 -8.720 1.00 0.00 H new ATOM 904 N LEU A 65 8.309 -6.553 -6.149 1.00 0.00 N ATOM 905 CA LEU A 65 9.632 -5.952 -6.154 1.00 0.00 C ATOM 906 C LEU A 65 9.999 -5.549 -7.584 1.00 0.00 C ATOM 907 O LEU A 65 9.595 -6.208 -8.541 1.00 0.00 O ATOM 908 CB LEU A 65 10.649 -6.890 -5.500 1.00 0.00 C ATOM 909 CG LEU A 65 10.654 -6.911 -3.970 1.00 0.00 C ATOM 910 CD1 LEU A 65 10.809 -5.498 -3.403 1.00 0.00 C ATOM 911 CD2 LEU A 65 9.408 -7.614 -3.428 1.00 0.00 C ATOM 0 H LEU A 65 8.253 -7.457 -5.680 1.00 0.00 H new ATOM 0 HA LEU A 65 9.639 -5.042 -5.554 1.00 0.00 H new ATOM 0 HB2 LEU A 65 10.462 -7.903 -5.857 1.00 0.00 H new ATOM 0 HB3 LEU A 65 11.645 -6.610 -5.843 1.00 0.00 H new ATOM 0 HG LEU A 65 11.518 -7.487 -3.638 1.00 0.00 H new ATOM 0 HD11 LEU A 65 10.810 -5.541 -2.314 1.00 0.00 H new ATOM 0 HD12 LEU A 65 11.749 -5.068 -3.750 1.00 0.00 H new ATOM 0 HD13 LEU A 65 9.979 -4.877 -3.741 1.00 0.00 H new ATOM 0 HD21 LEU A 65 9.436 -7.615 -2.338 1.00 0.00 H new ATOM 0 HD22 LEU A 65 8.516 -7.087 -3.767 1.00 0.00 H new ATOM 0 HD23 LEU A 65 9.383 -8.641 -3.792 1.00 0.00 H new ATOM 923 N LYS A 66 10.760 -4.469 -7.684 1.00 0.00 N ATOM 924 CA LYS A 66 11.185 -3.970 -8.981 1.00 0.00 C ATOM 925 C LYS A 66 12.591 -3.380 -8.859 1.00 0.00 C ATOM 926 O LYS A 66 13.060 -3.107 -7.755 1.00 0.00 O ATOM 927 CB LYS A 66 10.153 -2.990 -9.542 1.00 0.00 C ATOM 928 CG LYS A 66 9.001 -3.735 -10.220 1.00 0.00 C ATOM 929 CD LYS A 66 8.842 -3.290 -11.676 1.00 0.00 C ATOM 930 CE LYS A 66 7.368 -3.068 -12.023 1.00 0.00 C ATOM 931 NZ LYS A 66 7.171 -3.098 -13.489 1.00 0.00 N ATOM 0 H LYS A 66 11.093 -3.925 -6.888 1.00 0.00 H new ATOM 0 HA LYS A 66 11.242 -4.784 -9.703 1.00 0.00 H new ATOM 0 HB2 LYS A 66 9.764 -2.366 -8.737 1.00 0.00 H new ATOM 0 HB3 LYS A 66 10.632 -2.323 -10.259 1.00 0.00 H new ATOM 0 HG2 LYS A 66 9.185 -4.809 -10.182 1.00 0.00 H new ATOM 0 HG3 LYS A 66 8.074 -3.551 -9.676 1.00 0.00 H new ATOM 0 HD2 LYS A 66 9.401 -2.369 -11.842 1.00 0.00 H new ATOM 0 HD3 LYS A 66 9.266 -4.044 -12.339 1.00 0.00 H new ATOM 0 HE2 LYS A 66 6.757 -3.838 -11.552 1.00 0.00 H new ATOM 0 HE3 LYS A 66 7.035 -2.110 -11.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 6.764 -2.194 -13.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 8.086 -3.248 -13.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 6.524 -3.874 -13.737 1.00 0.00 H new ATOM 945 N LYS A 67 13.225 -3.201 -10.009 1.00 0.00 N ATOM 946 CA LYS A 67 14.568 -2.649 -10.045 1.00 0.00 C ATOM 947 C LYS A 67 14.506 -1.148 -9.753 1.00 0.00 C ATOM 948 O LYS A 67 13.708 -0.428 -10.351 1.00 0.00 O ATOM 949 CB LYS A 67 15.252 -2.989 -11.371 1.00 0.00 C ATOM 950 CG LYS A 67 16.480 -2.105 -11.598 1.00 0.00 C ATOM 951 CD LYS A 67 17.755 -2.946 -11.672 1.00 0.00 C ATOM 952 CE LYS A 67 18.170 -3.437 -10.284 1.00 0.00 C ATOM 953 NZ LYS A 67 19.238 -4.456 -10.392 1.00 0.00 N ATOM 0 H LYS A 67 12.833 -3.429 -10.923 1.00 0.00 H new ATOM 0 HA LYS A 67 15.186 -3.100 -9.269 1.00 0.00 H new ATOM 0 HB2 LYS A 67 15.549 -4.038 -11.372 1.00 0.00 H new ATOM 0 HB3 LYS A 67 14.547 -2.856 -12.192 1.00 0.00 H new ATOM 0 HG2 LYS A 67 16.359 -1.539 -12.522 1.00 0.00 H new ATOM 0 HG3 LYS A 67 16.565 -1.380 -10.789 1.00 0.00 H new ATOM 0 HD2 LYS A 67 17.594 -3.800 -12.330 1.00 0.00 H new ATOM 0 HD3 LYS A 67 18.560 -2.355 -12.108 1.00 0.00 H new ATOM 0 HE2 LYS A 67 18.520 -2.597 -9.684 1.00 0.00 H new ATOM 0 HE3 LYS A 67 17.307 -3.859 -9.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 19.508 -4.778 -9.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 18.891 -5.265 -10.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 20.066 -4.042 -10.865 1.00 0.00 H new ATOM 967 N ARG A 68 15.358 -0.721 -8.833 1.00 0.00 N ATOM 968 CA ARG A 68 15.410 0.681 -8.454 1.00 0.00 C ATOM 969 C ARG A 68 15.901 1.530 -9.628 1.00 0.00 C ATOM 970 O ARG A 68 17.072 1.467 -9.997 1.00 0.00 O ATOM 971 CB ARG A 68 16.337 0.893 -7.256 1.00 0.00 C ATOM 972 CG ARG A 68 16.296 2.347 -6.782 1.00 0.00 C ATOM 973 CD ARG A 68 17.697 2.848 -6.426 1.00 0.00 C ATOM 974 NE ARG A 68 18.233 3.679 -7.527 1.00 0.00 N ATOM 975 CZ ARG A 68 17.996 4.991 -7.662 1.00 0.00 C ATOM 976 NH1 ARG A 68 17.232 5.629 -6.766 1.00 0.00 N ATOM 977 NH2 ARG A 68 18.524 5.664 -8.693 1.00 0.00 N ATOM 0 H ARG A 68 16.018 -1.321 -8.339 1.00 0.00 H new ATOM 0 HA ARG A 68 14.401 0.988 -8.177 1.00 0.00 H new ATOM 0 HB2 ARG A 68 16.041 0.233 -6.441 1.00 0.00 H new ATOM 0 HB3 ARG A 68 17.357 0.624 -7.529 1.00 0.00 H new ATOM 0 HG2 ARG A 68 15.869 2.976 -7.563 1.00 0.00 H new ATOM 0 HG3 ARG A 68 15.644 2.431 -5.913 1.00 0.00 H new ATOM 0 HD2 ARG A 68 17.661 3.430 -5.505 1.00 0.00 H new ATOM 0 HD3 ARG A 68 18.359 2.002 -6.243 1.00 0.00 H new ATOM 0 HE ARG A 68 18.820 3.225 -8.227 1.00 0.00 H new ATOM 0 HH11 ARG A 68 16.831 5.116 -5.981 1.00 0.00 H new ATOM 0 HH12 ARG A 68 17.052 6.628 -6.869 1.00 0.00 H new ATOM 0 HH21 ARG A 68 19.106 5.178 -9.375 1.00 0.00 H new ATOM 0 HH22 ARG A 68 18.344 6.663 -8.796 1.00 0.00 H new ATOM 991 N GLN A 69 14.980 2.306 -10.181 1.00 0.00 N ATOM 992 CA GLN A 69 15.305 3.167 -11.306 1.00 0.00 C ATOM 993 C GLN A 69 14.867 4.604 -11.017 1.00 0.00 C ATOM 994 O GLN A 69 14.360 4.897 -9.936 1.00 0.00 O ATOM 995 CB GLN A 69 14.668 2.648 -12.596 1.00 0.00 C ATOM 996 CG GLN A 69 14.958 1.158 -12.790 1.00 0.00 C ATOM 997 CD GLN A 69 16.014 0.942 -13.876 1.00 0.00 C ATOM 998 OE1 GLN A 69 17.123 0.502 -13.620 1.00 0.00 O ATOM 999 NE2 GLN A 69 15.609 1.275 -15.098 1.00 0.00 N ATOM 0 H GLN A 69 14.009 2.357 -9.871 1.00 0.00 H new ATOM 0 HA GLN A 69 16.386 3.158 -11.445 1.00 0.00 H new ATOM 0 HB2 GLN A 69 13.591 2.811 -12.565 1.00 0.00 H new ATOM 0 HB3 GLN A 69 15.052 3.211 -13.447 1.00 0.00 H new ATOM 0 HG2 GLN A 69 15.303 0.726 -11.851 1.00 0.00 H new ATOM 0 HG3 GLN A 69 14.040 0.637 -13.062 1.00 0.00 H new ATOM 0 HE21 GLN A 69 14.667 1.638 -15.242 1.00 0.00 H new ATOM 0 HE22 GLN A 69 16.241 1.168 -15.892 1.00 0.00 H new ATOM 1008 N LEU A 70 15.078 5.462 -12.004 1.00 0.00 N ATOM 1009 CA LEU A 70 14.711 6.862 -11.870 1.00 0.00 C ATOM 1010 C LEU A 70 13.191 6.999 -11.979 1.00 0.00 C ATOM 1011 O LEU A 70 12.639 8.063 -11.706 1.00 0.00 O ATOM 1012 CB LEU A 70 15.479 7.716 -12.880 1.00 0.00 C ATOM 1013 CG LEU A 70 16.868 8.186 -12.443 1.00 0.00 C ATOM 1014 CD1 LEU A 70 16.794 8.975 -11.134 1.00 0.00 C ATOM 1015 CD2 LEU A 70 17.840 7.008 -12.347 1.00 0.00 C ATOM 0 H LEU A 70 15.498 5.215 -12.900 1.00 0.00 H new ATOM 0 HA LEU A 70 14.996 7.238 -10.887 1.00 0.00 H new ATOM 0 HB2 LEU A 70 15.584 7.145 -13.803 1.00 0.00 H new ATOM 0 HB3 LEU A 70 14.877 8.594 -13.115 1.00 0.00 H new ATOM 0 HG LEU A 70 17.255 8.862 -13.205 1.00 0.00 H new ATOM 0 HD11 LEU A 70 17.795 9.297 -10.846 1.00 0.00 H new ATOM 0 HD12 LEU A 70 16.157 9.849 -11.271 1.00 0.00 H new ATOM 0 HD13 LEU A 70 16.377 8.342 -10.351 1.00 0.00 H new ATOM 0 HD21 LEU A 70 18.820 7.369 -12.035 1.00 0.00 H new ATOM 0 HD22 LEU A 70 17.469 6.289 -11.617 1.00 0.00 H new ATOM 0 HD23 LEU A 70 17.925 6.526 -13.321 1.00 0.00 H new ATOM 1027 N HIS A 71 12.558 5.906 -12.380 1.00 0.00 N ATOM 1028 CA HIS A 71 11.112 5.891 -12.528 1.00 0.00 C ATOM 1029 C HIS A 71 10.625 4.446 -12.654 1.00 0.00 C ATOM 1030 O HIS A 71 10.623 3.881 -13.746 1.00 0.00 O ATOM 1031 CB HIS A 71 10.678 6.768 -13.704 1.00 0.00 C ATOM 1032 CG HIS A 71 9.191 7.026 -13.762 1.00 0.00 C ATOM 1033 ND1 HIS A 71 8.549 7.459 -14.909 1.00 0.00 N ATOM 1034 CD2 HIS A 71 8.228 6.905 -12.803 1.00 0.00 C ATOM 1035 CE1 HIS A 71 7.258 7.591 -14.641 1.00 0.00 C ATOM 1036 NE2 HIS A 71 7.061 7.248 -13.335 1.00 0.00 N ATOM 0 H HIS A 71 13.019 5.025 -12.607 1.00 0.00 H new ATOM 0 HA HIS A 71 10.646 6.319 -11.640 1.00 0.00 H new ATOM 0 HB2 HIS A 71 11.200 7.723 -13.644 1.00 0.00 H new ATOM 0 HB3 HIS A 71 10.990 6.292 -14.634 1.00 0.00 H new ATOM 0 HD1 HIS A 71 8.994 7.645 -15.808 1.00 0.00 H new ATOM 0 HD2 HIS A 71 8.388 6.585 -11.784 1.00 0.00 H new ATOM 0 HE1 HIS A 71 6.495 7.913 -15.335 1.00 0.00 H new ATOM 1044 N THR A 72 10.223 3.890 -11.520 1.00 0.00 N ATOM 1045 CA THR A 72 9.734 2.523 -11.490 1.00 0.00 C ATOM 1046 C THR A 72 8.209 2.504 -11.367 1.00 0.00 C ATOM 1047 O THR A 72 7.656 2.997 -10.385 1.00 0.00 O ATOM 1048 CB THR A 72 10.444 1.792 -10.349 1.00 0.00 C ATOM 1049 OG1 THR A 72 11.752 1.541 -10.859 1.00 0.00 O ATOM 1050 CG2 THR A 72 9.869 0.396 -10.099 1.00 0.00 C ATOM 0 H THR A 72 10.226 4.362 -10.616 1.00 0.00 H new ATOM 0 HA THR A 72 9.960 2.002 -12.420 1.00 0.00 H new ATOM 0 HB THR A 72 10.369 2.384 -9.437 1.00 0.00 H new ATOM 0 HG1 THR A 72 12.125 0.745 -10.425 1.00 0.00 H new ATOM 0 HG21 THR A 72 10.409 -0.078 -9.280 1.00 0.00 H new ATOM 0 HG22 THR A 72 8.814 0.478 -9.839 1.00 0.00 H new ATOM 0 HG23 THR A 72 9.974 -0.208 -11.000 1.00 0.00 H new ATOM 1058 N THR A 73 7.572 1.930 -12.377 1.00 0.00 N ATOM 1059 CA THR A 73 6.122 1.840 -12.394 1.00 0.00 C ATOM 1060 C THR A 73 5.676 0.381 -12.286 1.00 0.00 C ATOM 1061 O THR A 73 6.231 -0.492 -12.953 1.00 0.00 O ATOM 1062 CB THR A 73 5.620 2.537 -13.660 1.00 0.00 C ATOM 1063 OG1 THR A 73 6.467 2.036 -14.691 1.00 0.00 O ATOM 1064 CG2 THR A 73 5.897 4.042 -13.650 1.00 0.00 C ATOM 0 H THR A 73 8.034 1.522 -13.190 1.00 0.00 H new ATOM 0 HA THR A 73 5.685 2.345 -11.532 1.00 0.00 H new ATOM 0 HB THR A 73 4.549 2.366 -13.767 1.00 0.00 H new ATOM 0 HG1 THR A 73 6.210 2.435 -15.548 1.00 0.00 H new ATOM 0 HG21 THR A 73 5.521 4.487 -14.571 1.00 0.00 H new ATOM 0 HG22 THR A 73 5.397 4.498 -12.796 1.00 0.00 H new ATOM 0 HG23 THR A 73 6.971 4.214 -13.576 1.00 0.00 H new ATOM 1072 N TRP A 74 4.679 0.161 -11.442 1.00 0.00 N ATOM 1073 CA TRP A 74 4.153 -1.178 -11.238 1.00 0.00 C ATOM 1074 C TRP A 74 2.923 -1.344 -12.133 1.00 0.00 C ATOM 1075 O TRP A 74 2.447 -0.376 -12.725 1.00 0.00 O ATOM 1076 CB TRP A 74 3.855 -1.431 -9.759 1.00 0.00 C ATOM 1077 CG TRP A 74 5.102 -1.495 -8.875 1.00 0.00 C ATOM 1078 CD1 TRP A 74 5.769 -2.583 -8.468 1.00 0.00 C ATOM 1079 CD2 TRP A 74 5.808 -0.375 -8.302 1.00 0.00 C ATOM 1080 NE1 TRP A 74 6.849 -2.248 -7.677 1.00 0.00 N ATOM 1081 CE2 TRP A 74 6.873 -0.862 -7.573 1.00 0.00 C ATOM 1082 CE3 TRP A 74 5.554 1.005 -8.396 1.00 0.00 C ATOM 1083 CZ2 TRP A 74 7.770 -0.038 -6.882 1.00 0.00 C ATOM 1084 CZ3 TRP A 74 6.459 1.815 -7.700 1.00 0.00 C ATOM 1085 CH2 TRP A 74 7.537 1.340 -6.962 1.00 0.00 C ATOM 0 H TRP A 74 4.221 0.888 -10.891 1.00 0.00 H new ATOM 0 HA TRP A 74 4.891 -1.929 -11.518 1.00 0.00 H new ATOM 0 HB2 TRP A 74 3.201 -0.641 -9.390 1.00 0.00 H new ATOM 0 HB3 TRP A 74 3.307 -2.368 -9.665 1.00 0.00 H new ATOM 0 HD1 TRP A 74 5.496 -3.595 -8.726 1.00 0.00 H new ATOM 0 HE1 TRP A 74 7.508 -2.898 -7.248 1.00 0.00 H new ATOM 0 HE3 TRP A 74 4.726 1.408 -8.961 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 8.597 -0.444 -6.318 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 6.309 2.884 -7.739 1.00 0.00 H new ATOM 0 HH2 TRP A 74 8.192 2.031 -6.452 1.00 0.00 H new ATOM 1096 N GLU A 75 2.443 -2.577 -12.203 1.00 0.00 N ATOM 1097 CA GLU A 75 1.278 -2.882 -13.015 1.00 0.00 C ATOM 1098 C GLU A 75 0.040 -3.037 -12.130 1.00 0.00 C ATOM 1099 O GLU A 75 -1.086 -2.860 -12.594 1.00 0.00 O ATOM 1100 CB GLU A 75 1.510 -4.137 -13.859 1.00 0.00 C ATOM 1101 CG GLU A 75 1.016 -3.933 -15.292 1.00 0.00 C ATOM 1102 CD GLU A 75 2.092 -4.332 -16.305 1.00 0.00 C ATOM 1103 OE1 GLU A 75 2.898 -3.444 -16.656 1.00 0.00 O ATOM 1104 OE2 GLU A 75 2.084 -5.516 -16.705 1.00 0.00 O ATOM 0 H GLU A 75 2.840 -3.377 -11.710 1.00 0.00 H new ATOM 0 HA GLU A 75 1.109 -2.051 -13.700 1.00 0.00 H new ATOM 0 HB2 GLU A 75 2.572 -4.382 -13.868 1.00 0.00 H new ATOM 0 HB3 GLU A 75 0.991 -4.983 -13.409 1.00 0.00 H new ATOM 0 HG2 GLU A 75 0.117 -4.526 -15.458 1.00 0.00 H new ATOM 0 HG3 GLU A 75 0.741 -2.889 -15.441 1.00 0.00 H new ATOM 1111 N GLU A 76 0.289 -3.366 -10.871 1.00 0.00 N ATOM 1112 CA GLU A 76 -0.792 -3.548 -9.917 1.00 0.00 C ATOM 1113 C GLU A 76 -0.748 -2.451 -8.851 1.00 0.00 C ATOM 1114 O GLU A 76 0.205 -1.675 -8.792 1.00 0.00 O ATOM 1115 CB GLU A 76 -0.731 -4.936 -9.277 1.00 0.00 C ATOM 1116 CG GLU A 76 0.570 -5.123 -8.495 1.00 0.00 C ATOM 1117 CD GLU A 76 0.669 -6.540 -7.926 1.00 0.00 C ATOM 1118 OE1 GLU A 76 0.166 -6.735 -6.799 1.00 0.00 O ATOM 1119 OE2 GLU A 76 1.246 -7.396 -8.631 1.00 0.00 O ATOM 0 H GLU A 76 1.224 -3.511 -10.489 1.00 0.00 H new ATOM 0 HA GLU A 76 -1.739 -3.472 -10.451 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -1.583 -5.071 -8.610 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -0.808 -5.700 -10.050 1.00 0.00 H new ATOM 0 HG2 GLU A 76 1.422 -4.929 -9.147 1.00 0.00 H new ATOM 0 HG3 GLU A 76 0.618 -4.397 -7.683 1.00 0.00 H new ATOM 1126 N GLY A 77 -1.792 -2.421 -8.036 1.00 0.00 N ATOM 1127 CA GLY A 77 -1.885 -1.432 -6.975 1.00 0.00 C ATOM 1128 C GLY A 77 -1.955 -2.104 -5.603 1.00 0.00 C ATOM 1129 O GLY A 77 -1.635 -3.285 -5.469 1.00 0.00 O ATOM 0 H GLY A 77 -2.581 -3.065 -8.089 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -1.021 -0.768 -7.015 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -2.770 -0.813 -7.126 1.00 0.00 H new ATOM 1133 N LEU A 78 -2.375 -1.325 -4.618 1.00 0.00 N ATOM 1134 CA LEU A 78 -2.491 -1.830 -3.260 1.00 0.00 C ATOM 1135 C LEU A 78 -3.922 -1.618 -2.762 1.00 0.00 C ATOM 1136 O LEU A 78 -4.378 -0.483 -2.637 1.00 0.00 O ATOM 1137 CB LEU A 78 -1.427 -1.198 -2.361 1.00 0.00 C ATOM 1138 CG LEU A 78 0.009 -1.243 -2.887 1.00 0.00 C ATOM 1139 CD1 LEU A 78 0.901 -0.258 -2.129 1.00 0.00 C ATOM 1140 CD2 LEU A 78 0.564 -2.668 -2.845 1.00 0.00 C ATOM 0 H LEU A 78 -2.640 -0.347 -4.733 1.00 0.00 H new ATOM 0 HA LEU A 78 -2.300 -2.903 -3.235 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -1.697 -0.156 -2.189 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -1.454 -1.698 -1.393 1.00 0.00 H new ATOM 0 HG LEU A 78 0.000 -0.932 -3.932 1.00 0.00 H new ATOM 0 HD11 LEU A 78 1.916 -0.310 -2.522 1.00 0.00 H new ATOM 0 HD12 LEU A 78 0.514 0.753 -2.254 1.00 0.00 H new ATOM 0 HD13 LEU A 78 0.909 -0.515 -1.070 1.00 0.00 H new ATOM 0 HD21 LEU A 78 1.586 -2.672 -3.224 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.557 -3.031 -1.817 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.055 -3.318 -3.464 1.00 0.00 H new ATOM 1152 N VAL A 79 -4.592 -2.729 -2.492 1.00 0.00 N ATOM 1153 CA VAL A 79 -5.961 -2.680 -2.011 1.00 0.00 C ATOM 1154 C VAL A 79 -6.001 -3.132 -0.550 1.00 0.00 C ATOM 1155 O VAL A 79 -5.480 -4.194 -0.210 1.00 0.00 O ATOM 1156 CB VAL A 79 -6.866 -3.514 -2.919 1.00 0.00 C ATOM 1157 CG1 VAL A 79 -6.039 -4.430 -3.824 1.00 0.00 C ATOM 1158 CG2 VAL A 79 -7.875 -4.320 -2.098 1.00 0.00 C ATOM 0 H VAL A 79 -4.211 -3.669 -2.598 1.00 0.00 H new ATOM 0 HA VAL A 79 -6.341 -1.659 -2.046 1.00 0.00 H new ATOM 0 HB VAL A 79 -7.425 -2.828 -3.556 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -6.706 -5.012 -4.460 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -5.379 -3.826 -4.447 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -5.442 -5.105 -3.211 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -8.506 -4.904 -2.768 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -7.342 -4.991 -1.424 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -8.496 -3.640 -1.516 1.00 0.00 H new ATOM 1168 N LEU A 80 -6.624 -2.304 0.276 1.00 0.00 N ATOM 1169 CA LEU A 80 -6.738 -2.606 1.693 1.00 0.00 C ATOM 1170 C LEU A 80 -8.208 -2.529 2.110 1.00 0.00 C ATOM 1171 O LEU A 80 -8.943 -1.658 1.646 1.00 0.00 O ATOM 1172 CB LEU A 80 -5.818 -1.697 2.510 1.00 0.00 C ATOM 1173 CG LEU A 80 -4.373 -1.591 2.021 1.00 0.00 C ATOM 1174 CD1 LEU A 80 -3.880 -0.143 2.075 1.00 0.00 C ATOM 1175 CD2 LEU A 80 -3.458 -2.536 2.803 1.00 0.00 C ATOM 0 H LEU A 80 -7.055 -1.424 -0.009 1.00 0.00 H new ATOM 0 HA LEU A 80 -6.403 -3.623 1.894 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -6.250 -0.696 2.526 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -5.807 -2.055 3.539 1.00 0.00 H new ATOM 0 HG LEU A 80 -4.343 -1.903 0.977 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -2.850 -0.096 1.722 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -4.510 0.480 1.440 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -3.929 0.220 3.102 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -2.436 -2.441 2.435 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -3.488 -2.278 3.862 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -3.797 -3.563 2.670 1.00 0.00 H new ATOM 1187 N PRO A 81 -8.603 -3.475 3.003 1.00 0.00 N ATOM 1188 CA PRO A 81 -9.972 -3.522 3.488 1.00 0.00 C ATOM 1189 C PRO A 81 -10.233 -2.406 4.501 1.00 0.00 C ATOM 1190 O PRO A 81 -9.540 -2.307 5.513 1.00 0.00 O ATOM 1191 CB PRO A 81 -10.132 -4.913 4.080 1.00 0.00 C ATOM 1192 CG PRO A 81 -8.722 -5.426 4.325 1.00 0.00 C ATOM 1193 CD PRO A 81 -7.760 -4.521 3.574 1.00 0.00 C ATOM 0 HA PRO A 81 -10.705 -3.354 2.699 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -10.702 -4.879 5.008 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -10.673 -5.568 3.397 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -8.495 -5.424 5.391 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -8.625 -6.456 3.981 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -7.007 -4.102 4.242 1.00 0.00 H new ATOM 0 HD3 PRO A 81 -7.227 -5.068 2.797 1.00 0.00 H new ATOM 1201 N LEU A 82 -11.236 -1.596 4.196 1.00 0.00 N ATOM 1202 CA LEU A 82 -11.597 -0.491 5.068 1.00 0.00 C ATOM 1203 C LEU A 82 -13.088 -0.187 4.906 1.00 0.00 C ATOM 1204 O LEU A 82 -13.582 -0.063 3.787 1.00 0.00 O ATOM 1205 CB LEU A 82 -10.692 0.715 4.808 1.00 0.00 C ATOM 1206 CG LEU A 82 -11.091 2.016 5.508 1.00 0.00 C ATOM 1207 CD1 LEU A 82 -12.067 2.823 4.649 1.00 0.00 C ATOM 1208 CD2 LEU A 82 -11.651 1.738 6.904 1.00 0.00 C ATOM 0 H LEU A 82 -11.810 -1.683 3.357 1.00 0.00 H new ATOM 0 HA LEU A 82 -11.437 -0.761 6.112 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -9.679 0.457 5.115 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -10.663 0.898 3.734 1.00 0.00 H new ATOM 0 HG LEU A 82 -10.195 2.624 5.636 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -12.335 3.743 5.169 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -11.597 3.068 3.697 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -12.966 2.233 4.468 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -11.927 2.679 7.380 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -12.532 1.101 6.823 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -10.894 1.235 7.506 1.00 0.00 H new ATOM 1220 N ALA A 83 -13.763 -0.075 6.041 1.00 0.00 N ATOM 1221 CA ALA A 83 -15.187 0.213 6.040 1.00 0.00 C ATOM 1222 C ALA A 83 -15.403 1.695 5.726 1.00 0.00 C ATOM 1223 O ALA A 83 -14.573 2.534 6.072 1.00 0.00 O ATOM 1224 CB ALA A 83 -15.791 -0.192 7.386 1.00 0.00 C ATOM 0 H ALA A 83 -13.350 -0.179 6.968 1.00 0.00 H new ATOM 0 HA ALA A 83 -15.695 -0.365 5.268 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -16.859 0.024 7.385 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -15.637 -1.259 7.548 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -15.308 0.370 8.185 1.00 0.00 H new ATOM 1230 N GLU A 84 -16.523 1.971 5.074 1.00 0.00 N ATOM 1231 CA GLU A 84 -16.859 3.337 4.709 1.00 0.00 C ATOM 1232 C GLU A 84 -17.162 4.161 5.962 1.00 0.00 C ATOM 1233 O GLU A 84 -17.098 5.389 5.932 1.00 0.00 O ATOM 1234 CB GLU A 84 -18.037 3.370 3.733 1.00 0.00 C ATOM 1235 CG GLU A 84 -18.126 4.725 3.028 1.00 0.00 C ATOM 1236 CD GLU A 84 -19.584 5.142 2.826 1.00 0.00 C ATOM 1237 OE1 GLU A 84 -20.357 4.289 2.339 1.00 0.00 O ATOM 1238 OE2 GLU A 84 -19.894 6.305 3.163 1.00 0.00 O ATOM 0 H GLU A 84 -17.209 1.272 4.789 1.00 0.00 H new ATOM 0 HA GLU A 84 -16.000 3.780 4.205 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -17.923 2.578 2.993 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -18.965 3.174 4.270 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -17.606 5.480 3.617 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -17.622 4.671 2.063 1.00 0.00 H new ATOM 1245 N GLU A 85 -17.486 3.453 7.034 1.00 0.00 N ATOM 1246 CA GLU A 85 -17.799 4.104 8.295 1.00 0.00 C ATOM 1247 C GLU A 85 -16.513 4.451 9.047 1.00 0.00 C ATOM 1248 O GLU A 85 -16.548 5.163 10.049 1.00 0.00 O ATOM 1249 CB GLU A 85 -18.716 3.228 9.151 1.00 0.00 C ATOM 1250 CG GLU A 85 -18.064 1.875 9.445 1.00 0.00 C ATOM 1251 CD GLU A 85 -18.615 1.270 10.738 1.00 0.00 C ATOM 1252 OE1 GLU A 85 -18.942 2.067 11.643 1.00 0.00 O ATOM 1253 OE2 GLU A 85 -18.697 0.024 10.791 1.00 0.00 O ATOM 0 H GLU A 85 -17.539 2.435 7.055 1.00 0.00 H new ATOM 0 HA GLU A 85 -18.332 5.030 8.081 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -18.942 3.738 10.087 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -19.664 3.075 8.635 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -18.244 1.192 8.614 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -16.984 1.998 9.528 1.00 0.00 H new ATOM 1260 N GLU A 86 -15.407 3.931 8.534 1.00 0.00 N ATOM 1261 CA GLU A 86 -14.112 4.177 9.145 1.00 0.00 C ATOM 1262 C GLU A 86 -13.259 5.068 8.240 1.00 0.00 C ATOM 1263 O GLU A 86 -12.166 5.482 8.622 1.00 0.00 O ATOM 1264 CB GLU A 86 -13.393 2.862 9.455 1.00 0.00 C ATOM 1265 CG GLU A 86 -14.270 1.946 10.311 1.00 0.00 C ATOM 1266 CD GLU A 86 -13.490 1.404 11.510 1.00 0.00 C ATOM 1267 OE1 GLU A 86 -12.362 0.917 11.280 1.00 0.00 O ATOM 1268 OE2 GLU A 86 -14.039 1.490 12.630 1.00 0.00 O ATOM 0 H GLU A 86 -15.381 3.341 7.703 1.00 0.00 H new ATOM 0 HA GLU A 86 -14.271 4.697 10.089 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -13.133 2.357 8.524 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -12.459 3.069 9.977 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -15.144 2.496 10.660 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -14.636 1.117 9.705 1.00 0.00 H new ATOM 1275 N LEU A 87 -13.791 5.337 7.056 1.00 0.00 N ATOM 1276 CA LEU A 87 -13.092 6.171 6.094 1.00 0.00 C ATOM 1277 C LEU A 87 -12.499 7.385 6.813 1.00 0.00 C ATOM 1278 O LEU A 87 -11.318 7.690 6.652 1.00 0.00 O ATOM 1279 CB LEU A 87 -14.017 6.537 4.931 1.00 0.00 C ATOM 1280 CG LEU A 87 -14.040 5.556 3.758 1.00 0.00 C ATOM 1281 CD1 LEU A 87 -15.227 5.833 2.834 1.00 0.00 C ATOM 1282 CD2 LEU A 87 -12.709 5.574 3.002 1.00 0.00 C ATOM 0 H LEU A 87 -14.698 4.992 6.742 1.00 0.00 H new ATOM 0 HA LEU A 87 -12.260 5.625 5.650 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -15.032 6.635 5.317 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -13.723 7.517 4.554 1.00 0.00 H new ATOM 0 HG LEU A 87 -14.171 4.550 4.157 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -15.219 5.121 2.009 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -16.156 5.729 3.394 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -15.153 6.847 2.440 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -12.752 4.868 2.173 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -12.524 6.576 2.616 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -11.903 5.291 3.678 1.00 0.00 H new ATOM 1294 N PRO A 88 -13.367 8.061 7.611 1.00 0.00 N ATOM 1295 CA PRO A 88 -12.941 9.234 8.356 1.00 0.00 C ATOM 1296 C PRO A 88 -12.087 8.838 9.562 1.00 0.00 C ATOM 1297 O PRO A 88 -11.328 9.653 10.083 1.00 0.00 O ATOM 1298 CB PRO A 88 -14.229 9.941 8.746 1.00 0.00 C ATOM 1299 CG PRO A 88 -15.331 8.904 8.611 1.00 0.00 C ATOM 1300 CD PRO A 88 -14.772 7.729 7.826 1.00 0.00 C ATOM 0 HA PRO A 88 -12.301 9.894 7.771 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -14.173 10.320 9.766 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -14.417 10.797 8.098 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -15.672 8.579 9.594 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -16.194 9.329 8.099 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -14.878 6.796 8.380 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -15.297 7.599 6.880 1.00 0.00 H new ATOM 1308 N THR A 89 -12.240 7.587 9.969 1.00 0.00 N ATOM 1309 CA THR A 89 -11.493 7.072 11.104 1.00 0.00 C ATOM 1310 C THR A 89 -10.368 6.151 10.628 1.00 0.00 C ATOM 1311 O THR A 89 -9.884 5.313 11.388 1.00 0.00 O ATOM 1312 CB THR A 89 -12.481 6.387 12.050 1.00 0.00 C ATOM 1313 OG1 THR A 89 -12.663 5.092 11.483 1.00 0.00 O ATOM 1314 CG2 THR A 89 -13.875 7.016 11.997 1.00 0.00 C ATOM 0 H THR A 89 -12.871 6.914 9.533 1.00 0.00 H new ATOM 0 HA THR A 89 -11.002 7.876 11.652 1.00 0.00 H new ATOM 0 HB THR A 89 -12.100 6.435 13.070 1.00 0.00 H new ATOM 0 HG1 THR A 89 -13.423 4.649 11.915 1.00 0.00 H new ATOM 0 HG21 THR A 89 -14.537 6.492 12.687 1.00 0.00 H new ATOM 0 HG22 THR A 89 -13.811 8.066 12.282 1.00 0.00 H new ATOM 0 HG23 THR A 89 -14.271 6.938 10.985 1.00 0.00 H new ATOM 1322 N ALA A 90 -9.985 6.336 9.374 1.00 0.00 N ATOM 1323 CA ALA A 90 -8.926 5.532 8.788 1.00 0.00 C ATOM 1324 C ALA A 90 -7.992 6.436 7.982 1.00 0.00 C ATOM 1325 O ALA A 90 -8.417 7.462 7.454 1.00 0.00 O ATOM 1326 CB ALA A 90 -9.542 4.421 7.935 1.00 0.00 C ATOM 0 H ALA A 90 -10.389 7.031 8.747 1.00 0.00 H new ATOM 0 HA ALA A 90 -8.331 5.054 9.566 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -8.748 3.817 7.495 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -10.173 3.790 8.560 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -10.144 4.863 7.141 1.00 0.00 H new ATOM 1332 N THR A 91 -6.735 6.022 7.912 1.00 0.00 N ATOM 1333 CA THR A 91 -5.737 6.781 7.179 1.00 0.00 C ATOM 1334 C THR A 91 -4.856 5.844 6.349 1.00 0.00 C ATOM 1335 O THR A 91 -4.567 4.725 6.769 1.00 0.00 O ATOM 1336 CB THR A 91 -4.949 7.622 8.185 1.00 0.00 C ATOM 1337 OG1 THR A 91 -5.946 8.134 9.065 1.00 0.00 O ATOM 1338 CG2 THR A 91 -4.334 8.871 7.551 1.00 0.00 C ATOM 0 H THR A 91 -6.385 5.170 8.351 1.00 0.00 H new ATOM 0 HA THR A 91 -6.203 7.457 6.462 1.00 0.00 H new ATOM 0 HB THR A 91 -4.159 7.014 8.627 1.00 0.00 H new ATOM 0 HG1 THR A 91 -5.522 8.691 9.751 1.00 0.00 H new ATOM 0 HG21 THR A 91 -3.786 9.431 8.309 1.00 0.00 H new ATOM 0 HG22 THR A 91 -3.652 8.576 6.754 1.00 0.00 H new ATOM 0 HG23 THR A 91 -5.125 9.497 7.138 1.00 0.00 H new ATOM 1346 N LEU A 92 -4.455 6.336 5.186 1.00 0.00 N ATOM 1347 CA LEU A 92 -3.614 5.557 4.294 1.00 0.00 C ATOM 1348 C LEU A 92 -2.208 6.160 4.269 1.00 0.00 C ATOM 1349 O LEU A 92 -2.016 7.273 3.781 1.00 0.00 O ATOM 1350 CB LEU A 92 -4.260 5.443 2.912 1.00 0.00 C ATOM 1351 CG LEU A 92 -3.655 4.397 1.973 1.00 0.00 C ATOM 1352 CD1 LEU A 92 -3.433 4.978 0.575 1.00 0.00 C ATOM 1353 CD2 LEU A 92 -2.370 3.810 2.561 1.00 0.00 C ATOM 0 H LEU A 92 -4.697 7.265 4.841 1.00 0.00 H new ATOM 0 HA LEU A 92 -3.516 4.535 4.659 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -5.318 5.215 3.045 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -4.203 6.416 2.425 1.00 0.00 H new ATOM 0 HG LEU A 92 -4.366 3.577 1.871 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -3.002 4.214 -0.072 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -4.386 5.308 0.162 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -2.752 5.827 0.638 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -1.961 3.069 1.874 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -1.642 4.607 2.712 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -2.591 3.335 3.517 1.00 0.00 H new ATOM 1365 N THR A 93 -1.262 5.400 4.800 1.00 0.00 N ATOM 1366 CA THR A 93 0.120 5.846 4.844 1.00 0.00 C ATOM 1367 C THR A 93 0.992 4.968 3.945 1.00 0.00 C ATOM 1368 O THR A 93 1.201 3.791 4.235 1.00 0.00 O ATOM 1369 CB THR A 93 0.568 5.852 6.307 1.00 0.00 C ATOM 1370 OG1 THR A 93 0.094 7.099 6.810 1.00 0.00 O ATOM 1371 CG2 THR A 93 2.088 5.945 6.453 1.00 0.00 C ATOM 0 H THR A 93 -1.425 4.478 5.204 1.00 0.00 H new ATOM 0 HA THR A 93 0.222 6.859 4.454 1.00 0.00 H new ATOM 0 HB THR A 93 0.211 4.948 6.800 1.00 0.00 H new ATOM 0 HG1 THR A 93 0.340 7.185 7.755 1.00 0.00 H new ATOM 0 HG21 THR A 93 2.353 5.946 7.510 1.00 0.00 H new ATOM 0 HG22 THR A 93 2.554 5.090 5.963 1.00 0.00 H new ATOM 0 HG23 THR A 93 2.442 6.866 5.990 1.00 0.00 H new ATOM 1379 N LEU A 94 1.479 5.574 2.872 1.00 0.00 N ATOM 1380 CA LEU A 94 2.324 4.862 1.929 1.00 0.00 C ATOM 1381 C LEU A 94 3.751 4.799 2.477 1.00 0.00 C ATOM 1382 O LEU A 94 4.182 5.694 3.202 1.00 0.00 O ATOM 1383 CB LEU A 94 2.227 5.495 0.539 1.00 0.00 C ATOM 1384 CG LEU A 94 1.113 4.963 -0.364 1.00 0.00 C ATOM 1385 CD1 LEU A 94 0.035 4.251 0.457 1.00 0.00 C ATOM 1386 CD2 LEU A 94 0.529 6.080 -1.231 1.00 0.00 C ATOM 0 H LEU A 94 1.304 6.551 2.635 1.00 0.00 H new ATOM 0 HA LEU A 94 1.981 3.834 1.811 1.00 0.00 H new ATOM 0 HB2 LEU A 94 2.088 6.569 0.660 1.00 0.00 H new ATOM 0 HB3 LEU A 94 3.180 5.352 0.029 1.00 0.00 H new ATOM 0 HG LEU A 94 1.544 4.224 -1.039 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -0.745 3.882 -0.209 1.00 0.00 H new ATOM 0 HD12 LEU A 94 0.480 3.413 0.993 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -0.399 4.950 1.172 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -0.261 5.675 -1.863 1.00 0.00 H new ATOM 0 HD22 LEU A 94 0.117 6.860 -0.591 1.00 0.00 H new ATOM 0 HD23 LEU A 94 1.314 6.503 -1.858 1.00 0.00 H new ATOM 1398 N THR A 95 4.445 3.731 2.111 1.00 0.00 N ATOM 1399 CA THR A 95 5.814 3.538 2.557 1.00 0.00 C ATOM 1400 C THR A 95 6.630 2.819 1.480 1.00 0.00 C ATOM 1401 O THR A 95 6.147 1.875 0.858 1.00 0.00 O ATOM 1402 CB THR A 95 5.776 2.791 3.891 1.00 0.00 C ATOM 1403 OG1 THR A 95 4.388 2.697 4.197 1.00 0.00 O ATOM 1404 CG2 THR A 95 6.356 3.616 5.041 1.00 0.00 C ATOM 0 H THR A 95 4.084 2.990 1.510 1.00 0.00 H new ATOM 0 HA THR A 95 6.316 4.492 2.717 1.00 0.00 H new ATOM 0 HB THR A 95 6.330 1.857 3.799 1.00 0.00 H new ATOM 0 HG1 THR A 95 4.272 2.224 5.048 1.00 0.00 H new ATOM 0 HG21 THR A 95 6.305 3.039 5.964 1.00 0.00 H new ATOM 0 HG22 THR A 95 7.395 3.862 4.824 1.00 0.00 H new ATOM 0 HG23 THR A 95 5.782 4.535 5.155 1.00 0.00 H new ATOM 1412 N LEU A 96 7.853 3.294 1.294 1.00 0.00 N ATOM 1413 CA LEU A 96 8.740 2.708 0.304 1.00 0.00 C ATOM 1414 C LEU A 96 9.964 2.119 1.007 1.00 0.00 C ATOM 1415 O LEU A 96 10.896 2.844 1.351 1.00 0.00 O ATOM 1416 CB LEU A 96 9.086 3.733 -0.778 1.00 0.00 C ATOM 1417 CG LEU A 96 8.733 3.339 -2.214 1.00 0.00 C ATOM 1418 CD1 LEU A 96 8.536 4.578 -3.090 1.00 0.00 C ATOM 1419 CD2 LEU A 96 9.781 2.387 -2.794 1.00 0.00 C ATOM 0 H LEU A 96 8.250 4.078 1.812 1.00 0.00 H new ATOM 0 HA LEU A 96 8.244 1.887 -0.214 1.00 0.00 H new ATOM 0 HB2 LEU A 96 8.575 4.667 -0.543 1.00 0.00 H new ATOM 0 HB3 LEU A 96 10.156 3.935 -0.730 1.00 0.00 H new ATOM 0 HG LEU A 96 7.784 2.803 -2.198 1.00 0.00 H new ATOM 0 HD11 LEU A 96 8.286 4.270 -4.105 1.00 0.00 H new ATOM 0 HD12 LEU A 96 7.726 5.185 -2.685 1.00 0.00 H new ATOM 0 HD13 LEU A 96 9.455 5.163 -3.104 1.00 0.00 H new ATOM 0 HD21 LEU A 96 9.507 2.122 -3.815 1.00 0.00 H new ATOM 0 HD22 LEU A 96 10.755 2.876 -2.795 1.00 0.00 H new ATOM 0 HD23 LEU A 96 9.829 1.484 -2.185 1.00 0.00 H new ATOM 1431 N ARG A 97 9.922 0.808 1.199 1.00 0.00 N ATOM 1432 CA ARG A 97 11.016 0.113 1.856 1.00 0.00 C ATOM 1433 C ARG A 97 11.983 -0.457 0.815 1.00 0.00 C ATOM 1434 O ARG A 97 11.616 -0.638 -0.345 1.00 0.00 O ATOM 1435 CB ARG A 97 10.496 -1.025 2.737 1.00 0.00 C ATOM 1436 CG ARG A 97 10.290 -0.552 4.177 1.00 0.00 C ATOM 1437 CD ARG A 97 8.846 -0.781 4.627 1.00 0.00 C ATOM 1438 NE ARG A 97 8.730 -0.562 6.086 1.00 0.00 N ATOM 1439 CZ ARG A 97 7.585 -0.253 6.711 1.00 0.00 C ATOM 1440 NH1 ARG A 97 6.452 -0.125 6.008 1.00 0.00 N ATOM 1441 NH2 ARG A 97 7.574 -0.072 8.039 1.00 0.00 N ATOM 0 H ARG A 97 9.148 0.209 0.911 1.00 0.00 H new ATOM 0 HA ARG A 97 11.537 0.834 2.485 1.00 0.00 H new ATOM 0 HB2 ARG A 97 9.555 -1.400 2.335 1.00 0.00 H new ATOM 0 HB3 ARG A 97 11.203 -1.855 2.720 1.00 0.00 H new ATOM 0 HG2 ARG A 97 10.971 -1.086 4.840 1.00 0.00 H new ATOM 0 HG3 ARG A 97 10.535 0.507 4.254 1.00 0.00 H new ATOM 0 HD2 ARG A 97 8.179 -0.103 4.095 1.00 0.00 H new ATOM 0 HD3 ARG A 97 8.535 -1.795 4.377 1.00 0.00 H new ATOM 0 HE ARG A 97 9.574 -0.652 6.651 1.00 0.00 H new ATOM 0 HH11 ARG A 97 6.461 -0.263 4.997 1.00 0.00 H new ATOM 0 HH12 ARG A 97 5.581 0.110 6.483 1.00 0.00 H new ATOM 0 HH21 ARG A 97 8.437 -0.169 8.574 1.00 0.00 H new ATOM 0 HH22 ARG A 97 6.703 0.163 8.514 1.00 0.00 H new ATOM 1455 N THR A 98 13.199 -0.725 1.268 1.00 0.00 N ATOM 1456 CA THR A 98 14.220 -1.271 0.391 1.00 0.00 C ATOM 1457 C THR A 98 14.545 -2.713 0.784 1.00 0.00 C ATOM 1458 O THR A 98 15.038 -2.966 1.882 1.00 0.00 O ATOM 1459 CB THR A 98 15.434 -0.340 0.442 1.00 0.00 C ATOM 1460 OG1 THR A 98 15.582 -0.037 1.826 1.00 0.00 O ATOM 1461 CG2 THR A 98 15.158 1.017 -0.209 1.00 0.00 C ATOM 0 H THR A 98 13.500 -0.574 2.231 1.00 0.00 H new ATOM 0 HA THR A 98 13.871 -1.319 -0.640 1.00 0.00 H new ATOM 0 HB THR A 98 16.278 -0.817 -0.056 1.00 0.00 H new ATOM 0 HG1 THR A 98 15.478 -0.857 2.353 1.00 0.00 H new ATOM 0 HG21 THR A 98 16.051 1.639 -0.146 1.00 0.00 H new ATOM 0 HG22 THR A 98 14.891 0.871 -1.256 1.00 0.00 H new ATOM 0 HG23 THR A 98 14.336 1.509 0.310 1.00 0.00 H new ATOM 1469 N CYS A 99 14.255 -3.622 -0.136 1.00 0.00 N ATOM 1470 CA CYS A 99 14.510 -5.033 0.100 1.00 0.00 C ATOM 1471 C CYS A 99 15.944 -5.184 0.611 1.00 0.00 C ATOM 1472 O CYS A 99 16.897 -4.877 -0.104 1.00 0.00 O ATOM 1473 CB CYS A 99 14.260 -5.871 -1.155 1.00 0.00 C ATOM 1474 SG CYS A 99 14.243 -7.650 -0.728 1.00 0.00 S ATOM 0 H CYS A 99 13.846 -3.409 -1.046 1.00 0.00 H new ATOM 0 HA CYS A 99 13.816 -5.409 0.852 1.00 0.00 H new ATOM 0 HB2 CYS A 99 13.309 -5.588 -1.607 1.00 0.00 H new ATOM 0 HB3 CYS A 99 15.036 -5.674 -1.894 1.00 0.00 H new ATOM 0 HG CYS A 99 14.028 -8.352 -1.801 1.00 0.00 H new ATOM 1480 N ASP A 100 16.052 -5.655 1.845 1.00 0.00 N ATOM 1481 CA ASP A 100 17.354 -5.850 2.460 1.00 0.00 C ATOM 1482 C ASP A 100 17.219 -6.823 3.633 1.00 0.00 C ATOM 1483 O ASP A 100 16.118 -7.047 4.134 1.00 0.00 O ATOM 1484 CB ASP A 100 17.911 -4.531 3.000 1.00 0.00 C ATOM 1485 CG ASP A 100 17.358 -4.106 4.362 1.00 0.00 C ATOM 1486 OD1 ASP A 100 16.169 -4.402 4.609 1.00 0.00 O ATOM 1487 OD2 ASP A 100 18.137 -3.494 5.124 1.00 0.00 O ATOM 0 H ASP A 100 15.259 -5.907 2.435 1.00 0.00 H new ATOM 0 HA ASP A 100 18.030 -6.243 1.701 1.00 0.00 H new ATOM 0 HB2 ASP A 100 18.995 -4.615 3.075 1.00 0.00 H new ATOM 0 HB3 ASP A 100 17.702 -3.742 2.277 1.00 0.00 H new ATOM 1492 N ARG A 101 18.354 -7.373 4.038 1.00 0.00 N ATOM 1493 CA ARG A 101 18.376 -8.316 5.143 1.00 0.00 C ATOM 1494 C ARG A 101 17.462 -7.833 6.271 1.00 0.00 C ATOM 1495 O ARG A 101 16.568 -8.558 6.703 1.00 0.00 O ATOM 1496 CB ARG A 101 19.795 -8.495 5.686 1.00 0.00 C ATOM 1497 CG ARG A 101 19.922 -9.805 6.467 1.00 0.00 C ATOM 1498 CD ARG A 101 21.289 -9.906 7.148 1.00 0.00 C ATOM 1499 NE ARG A 101 22.200 -10.739 6.332 1.00 0.00 N ATOM 1500 CZ ARG A 101 23.498 -10.925 6.609 1.00 0.00 C ATOM 1501 NH1 ARG A 101 24.045 -10.338 7.682 1.00 0.00 N ATOM 1502 NH2 ARG A 101 24.249 -11.697 5.812 1.00 0.00 N ATOM 0 H ARG A 101 19.265 -7.184 3.621 1.00 0.00 H new ATOM 0 HA ARG A 101 18.020 -9.275 4.768 1.00 0.00 H new ATOM 0 HB2 ARG A 101 20.507 -8.489 4.861 1.00 0.00 H new ATOM 0 HB3 ARG A 101 20.049 -7.656 6.333 1.00 0.00 H new ATOM 0 HG2 ARG A 101 19.133 -9.864 7.217 1.00 0.00 H new ATOM 0 HG3 ARG A 101 19.784 -10.650 5.792 1.00 0.00 H new ATOM 0 HD2 ARG A 101 21.713 -8.911 7.280 1.00 0.00 H new ATOM 0 HD3 ARG A 101 21.178 -10.340 8.142 1.00 0.00 H new ATOM 0 HE ARG A 101 21.816 -11.200 5.507 1.00 0.00 H new ATOM 0 HH11 ARG A 101 23.474 -9.749 8.288 1.00 0.00 H new ATOM 0 HH12 ARG A 101 25.033 -10.480 7.893 1.00 0.00 H new ATOM 0 HH21 ARG A 101 23.833 -12.143 4.995 1.00 0.00 H new ATOM 0 HH22 ARG A 101 25.237 -11.839 6.023 1.00 0.00 H new ATOM 1516 N PHE A 102 17.719 -6.612 6.716 1.00 0.00 N ATOM 1517 CA PHE A 102 16.931 -6.024 7.785 1.00 0.00 C ATOM 1518 C PHE A 102 16.959 -4.496 7.710 1.00 0.00 C ATOM 1519 O PHE A 102 17.918 -3.866 8.153 1.00 0.00 O ATOM 1520 CB PHE A 102 17.564 -6.469 9.105 1.00 0.00 C ATOM 1521 CG PHE A 102 17.655 -7.988 9.270 1.00 0.00 C ATOM 1522 CD1 PHE A 102 16.523 -8.742 9.258 1.00 0.00 C ATOM 1523 CD2 PHE A 102 18.868 -8.583 9.428 1.00 0.00 C ATOM 1524 CE1 PHE A 102 16.608 -10.151 9.411 1.00 0.00 C ATOM 1525 CE2 PHE A 102 18.952 -9.992 9.582 1.00 0.00 C ATOM 1526 CZ PHE A 102 17.820 -10.746 9.570 1.00 0.00 C ATOM 0 H PHE A 102 18.462 -6.014 6.355 1.00 0.00 H new ATOM 0 HA PHE A 102 15.893 -6.347 7.702 1.00 0.00 H new ATOM 0 HB2 PHE A 102 18.566 -6.045 9.177 1.00 0.00 H new ATOM 0 HB3 PHE A 102 16.984 -6.058 9.931 1.00 0.00 H new ATOM 0 HD1 PHE A 102 15.560 -8.269 9.132 1.00 0.00 H new ATOM 0 HD2 PHE A 102 19.767 -7.984 9.436 1.00 0.00 H new ATOM 0 HE1 PHE A 102 15.710 -10.750 9.401 1.00 0.00 H new ATOM 0 HE2 PHE A 102 19.915 -10.465 9.709 1.00 0.00 H new ATOM 0 HZ PHE A 102 17.884 -11.818 9.687 1.00 0.00 H new ATOM 1536 N SER A 103 15.895 -3.943 7.145 1.00 0.00 N ATOM 1537 CA SER A 103 15.786 -2.501 7.007 1.00 0.00 C ATOM 1538 C SER A 103 15.618 -1.854 8.383 1.00 0.00 C ATOM 1539 O SER A 103 14.623 -1.178 8.638 1.00 0.00 O ATOM 1540 CB SER A 103 14.615 -2.123 6.097 1.00 0.00 C ATOM 1541 OG SER A 103 14.906 -0.976 5.302 1.00 0.00 O ATOM 0 H SER A 103 15.101 -4.468 6.778 1.00 0.00 H new ATOM 0 HA SER A 103 16.703 -2.131 6.549 1.00 0.00 H new ATOM 0 HB2 SER A 103 14.375 -2.964 5.446 1.00 0.00 H new ATOM 0 HB3 SER A 103 13.731 -1.928 6.705 1.00 0.00 H new ATOM 0 HG SER A 103 14.135 -0.768 4.734 1.00 0.00 H new ATOM 1547 N ARG A 104 16.607 -2.085 9.234 1.00 0.00 N ATOM 1548 CA ARG A 104 16.582 -1.533 10.578 1.00 0.00 C ATOM 1549 C ARG A 104 16.108 -0.078 10.545 1.00 0.00 C ATOM 1550 O ARG A 104 15.144 0.279 11.221 1.00 0.00 O ATOM 1551 CB ARG A 104 17.967 -1.596 11.225 1.00 0.00 C ATOM 1552 CG ARG A 104 18.527 -3.020 11.184 1.00 0.00 C ATOM 1553 CD ARG A 104 19.916 -3.044 10.543 1.00 0.00 C ATOM 1554 NE ARG A 104 20.948 -3.271 11.580 1.00 0.00 N ATOM 1555 CZ ARG A 104 22.253 -3.426 11.319 1.00 0.00 C ATOM 1556 NH1 ARG A 104 22.694 -3.380 10.055 1.00 0.00 N ATOM 1557 NH2 ARG A 104 23.117 -3.628 12.323 1.00 0.00 N ATOM 0 H ARG A 104 17.431 -2.647 9.019 1.00 0.00 H new ATOM 0 HA ARG A 104 15.889 -2.132 11.170 1.00 0.00 H new ATOM 0 HB2 ARG A 104 18.646 -0.919 10.706 1.00 0.00 H new ATOM 0 HB3 ARG A 104 17.905 -1.255 12.259 1.00 0.00 H new ATOM 0 HG2 ARG A 104 18.582 -3.422 12.196 1.00 0.00 H new ATOM 0 HG3 ARG A 104 17.852 -3.664 10.621 1.00 0.00 H new ATOM 0 HD2 ARG A 104 19.965 -3.831 9.791 1.00 0.00 H new ATOM 0 HD3 ARG A 104 20.105 -2.101 10.030 1.00 0.00 H new ATOM 0 HE ARG A 104 20.647 -3.312 12.554 1.00 0.00 H new ATOM 0 HH11 ARG A 104 22.036 -3.227 9.291 1.00 0.00 H new ATOM 0 HH12 ARG A 104 23.688 -3.498 9.857 1.00 0.00 H new ATOM 0 HH21 ARG A 104 22.781 -3.664 13.285 1.00 0.00 H new ATOM 0 HH22 ARG A 104 24.111 -3.746 12.125 1.00 0.00 H new ATOM 1571 N HIS A 105 16.807 0.721 9.754 1.00 0.00 N ATOM 1572 CA HIS A 105 16.470 2.128 9.624 1.00 0.00 C ATOM 1573 C HIS A 105 15.013 2.268 9.178 1.00 0.00 C ATOM 1574 O HIS A 105 14.328 1.270 8.963 1.00 0.00 O ATOM 1575 CB HIS A 105 17.448 2.838 8.686 1.00 0.00 C ATOM 1576 CG HIS A 105 18.870 2.874 9.193 1.00 0.00 C ATOM 1577 ND1 HIS A 105 19.958 2.555 8.399 1.00 0.00 N ATOM 1578 CD2 HIS A 105 19.370 3.194 10.421 1.00 0.00 C ATOM 1579 CE1 HIS A 105 21.058 2.681 9.127 1.00 0.00 C ATOM 1580 NE2 HIS A 105 20.691 3.076 10.380 1.00 0.00 N ATOM 0 H HIS A 105 17.606 0.421 9.196 1.00 0.00 H new ATOM 0 HA HIS A 105 16.566 2.619 10.593 1.00 0.00 H new ATOM 0 HB2 HIS A 105 17.431 2.340 7.716 1.00 0.00 H new ATOM 0 HB3 HIS A 105 17.104 3.860 8.526 1.00 0.00 H new ATOM 0 HD2 HIS A 105 18.789 3.493 11.281 1.00 0.00 H new ATOM 0 HE1 HIS A 105 22.068 2.502 8.788 1.00 0.00 H new ATOM 0 HE2 HIS A 105 21.327 3.252 11.158 1.00 0.00 H new ATOM 1588 N SER A 106 14.584 3.515 9.052 1.00 0.00 N ATOM 1589 CA SER A 106 13.221 3.798 8.635 1.00 0.00 C ATOM 1590 C SER A 106 13.041 3.444 7.158 1.00 0.00 C ATOM 1591 O SER A 106 13.945 2.891 6.534 1.00 0.00 O ATOM 1592 CB SER A 106 12.865 5.267 8.876 1.00 0.00 C ATOM 1593 OG SER A 106 13.022 5.637 10.243 1.00 0.00 O ATOM 0 H SER A 106 15.156 4.341 9.231 1.00 0.00 H new ATOM 0 HA SER A 106 12.546 3.186 9.233 1.00 0.00 H new ATOM 0 HB2 SER A 106 13.498 5.900 8.254 1.00 0.00 H new ATOM 0 HB3 SER A 106 11.835 5.446 8.568 1.00 0.00 H new ATOM 0 HG SER A 106 13.577 6.442 10.302 1.00 0.00 H new ATOM 1599 N VAL A 107 11.867 3.776 6.641 1.00 0.00 N ATOM 1600 CA VAL A 107 11.557 3.499 5.249 1.00 0.00 C ATOM 1601 C VAL A 107 12.189 4.577 4.366 1.00 0.00 C ATOM 1602 O VAL A 107 12.498 5.670 4.840 1.00 0.00 O ATOM 1603 CB VAL A 107 10.043 3.386 5.062 1.00 0.00 C ATOM 1604 CG1 VAL A 107 9.426 2.471 6.123 1.00 0.00 C ATOM 1605 CG2 VAL A 107 9.383 4.767 5.079 1.00 0.00 C ATOM 0 H VAL A 107 11.119 4.234 7.161 1.00 0.00 H new ATOM 0 HA VAL A 107 11.981 2.541 4.947 1.00 0.00 H new ATOM 0 HB VAL A 107 9.859 2.939 4.085 1.00 0.00 H new ATOM 0 HG11 VAL A 107 8.349 2.408 5.967 1.00 0.00 H new ATOM 0 HG12 VAL A 107 9.863 1.476 6.044 1.00 0.00 H new ATOM 0 HG13 VAL A 107 9.626 2.877 7.115 1.00 0.00 H new ATOM 0 HG21 VAL A 107 8.307 4.658 4.944 1.00 0.00 H new ATOM 0 HG22 VAL A 107 9.581 5.253 6.034 1.00 0.00 H new ATOM 0 HG23 VAL A 107 9.790 5.375 4.271 1.00 0.00 H new ATOM 1615 N ALA A 108 12.362 4.233 3.099 1.00 0.00 N ATOM 1616 CA ALA A 108 12.952 5.158 2.146 1.00 0.00 C ATOM 1617 C ALA A 108 12.130 6.448 2.119 1.00 0.00 C ATOM 1618 O ALA A 108 12.643 7.507 1.758 1.00 0.00 O ATOM 1619 CB ALA A 108 13.035 4.491 0.771 1.00 0.00 C ATOM 0 H ALA A 108 12.104 3.326 2.710 1.00 0.00 H new ATOM 0 HA ALA A 108 13.967 5.420 2.443 1.00 0.00 H new ATOM 0 HB1 ALA A 108 13.477 5.185 0.056 1.00 0.00 H new ATOM 0 HB2 ALA A 108 13.653 3.596 0.838 1.00 0.00 H new ATOM 0 HB3 ALA A 108 12.034 4.217 0.438 1.00 0.00 H new ATOM 1625 N GLY A 109 10.870 6.318 2.504 1.00 0.00 N ATOM 1626 CA GLY A 109 9.972 7.460 2.529 1.00 0.00 C ATOM 1627 C GLY A 109 8.535 7.023 2.820 1.00 0.00 C ATOM 1628 O GLY A 109 8.183 5.861 2.619 1.00 0.00 O ATOM 0 H GLY A 109 10.449 5.438 2.802 1.00 0.00 H new ATOM 0 HA2 GLY A 109 10.301 8.169 3.289 1.00 0.00 H new ATOM 0 HA3 GLY A 109 10.011 7.979 1.571 1.00 0.00 H new ATOM 1632 N GLU A 110 7.744 7.976 3.290 1.00 0.00 N ATOM 1633 CA GLU A 110 6.353 7.704 3.611 1.00 0.00 C ATOM 1634 C GLU A 110 5.450 8.786 3.016 1.00 0.00 C ATOM 1635 O GLU A 110 5.714 9.977 3.175 1.00 0.00 O ATOM 1636 CB GLU A 110 6.152 7.591 5.123 1.00 0.00 C ATOM 1637 CG GLU A 110 4.824 8.222 5.548 1.00 0.00 C ATOM 1638 CD GLU A 110 5.008 9.698 5.907 1.00 0.00 C ATOM 1639 OE1 GLU A 110 5.811 9.962 6.828 1.00 0.00 O ATOM 1640 OE2 GLU A 110 4.342 10.529 5.252 1.00 0.00 O ATOM 0 H GLU A 110 8.040 8.938 3.456 1.00 0.00 H new ATOM 0 HA GLU A 110 6.078 6.746 3.169 1.00 0.00 H new ATOM 0 HB2 GLU A 110 6.172 6.542 5.419 1.00 0.00 H new ATOM 0 HB3 GLU A 110 6.975 8.084 5.641 1.00 0.00 H new ATOM 0 HG2 GLU A 110 4.098 8.128 4.740 1.00 0.00 H new ATOM 0 HG3 GLU A 110 4.419 7.683 6.405 1.00 0.00 H new ATOM 1647 N LEU A 111 4.401 8.333 2.344 1.00 0.00 N ATOM 1648 CA LEU A 111 3.457 9.248 1.725 1.00 0.00 C ATOM 1649 C LEU A 111 2.126 9.186 2.477 1.00 0.00 C ATOM 1650 O LEU A 111 1.383 8.213 2.352 1.00 0.00 O ATOM 1651 CB LEU A 111 3.332 8.957 0.228 1.00 0.00 C ATOM 1652 CG LEU A 111 3.235 10.180 -0.686 1.00 0.00 C ATOM 1653 CD1 LEU A 111 2.346 11.259 -0.066 1.00 0.00 C ATOM 1654 CD2 LEU A 111 4.625 10.714 -1.038 1.00 0.00 C ATOM 0 H LEU A 111 4.184 7.345 2.215 1.00 0.00 H new ATOM 0 HA LEU A 111 3.817 10.274 1.798 1.00 0.00 H new ATOM 0 HB2 LEU A 111 4.194 8.365 -0.080 1.00 0.00 H new ATOM 0 HB3 LEU A 111 2.448 8.339 0.071 1.00 0.00 H new ATOM 0 HG LEU A 111 2.763 9.872 -1.619 1.00 0.00 H new ATOM 0 HD11 LEU A 111 2.294 12.117 -0.736 1.00 0.00 H new ATOM 0 HD12 LEU A 111 1.344 10.859 0.090 1.00 0.00 H new ATOM 0 HD13 LEU A 111 2.765 11.571 0.891 1.00 0.00 H new ATOM 0 HD21 LEU A 111 4.527 11.583 -1.689 1.00 0.00 H new ATOM 0 HD22 LEU A 111 5.146 11.001 -0.125 1.00 0.00 H new ATOM 0 HD23 LEU A 111 5.193 9.939 -1.552 1.00 0.00 H new ATOM 1666 N ARG A 112 1.865 10.236 3.242 1.00 0.00 N ATOM 1667 CA ARG A 112 0.636 10.313 4.013 1.00 0.00 C ATOM 1668 C ARG A 112 -0.530 10.727 3.114 1.00 0.00 C ATOM 1669 O ARG A 112 -0.442 11.721 2.396 1.00 0.00 O ATOM 1670 CB ARG A 112 0.768 11.316 5.161 1.00 0.00 C ATOM 1671 CG ARG A 112 -0.608 11.754 5.667 1.00 0.00 C ATOM 1672 CD ARG A 112 -1.393 10.562 6.219 1.00 0.00 C ATOM 1673 NE ARG A 112 -1.804 10.830 7.615 1.00 0.00 N ATOM 1674 CZ ARG A 112 -1.025 10.609 8.683 1.00 0.00 C ATOM 1675 NH1 ARG A 112 0.210 10.116 8.521 1.00 0.00 N ATOM 1676 NH2 ARG A 112 -1.481 10.882 9.913 1.00 0.00 N ATOM 0 H ARG A 112 2.484 11.040 3.344 1.00 0.00 H new ATOM 0 HA ARG A 112 0.444 9.324 4.430 1.00 0.00 H new ATOM 0 HB2 ARG A 112 1.334 10.867 5.977 1.00 0.00 H new ATOM 0 HB3 ARG A 112 1.330 12.187 4.825 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -0.490 12.508 6.445 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -1.168 12.218 4.855 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -2.272 10.377 5.601 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -0.780 9.662 6.178 1.00 0.00 H new ATOM 0 HE ARG A 112 -2.738 11.206 7.774 1.00 0.00 H new ATOM 0 HH11 ARG A 112 0.558 9.909 7.585 1.00 0.00 H new ATOM 0 HH12 ARG A 112 0.803 9.948 9.334 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -2.421 11.258 10.037 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -0.888 10.714 10.726 1.00 0.00 H new ATOM 1690 N LEU A 113 -1.597 9.944 3.184 1.00 0.00 N ATOM 1691 CA LEU A 113 -2.779 10.217 2.385 1.00 0.00 C ATOM 1692 C LEU A 113 -4.027 10.039 3.252 1.00 0.00 C ATOM 1693 O LEU A 113 -3.935 9.592 4.394 1.00 0.00 O ATOM 1694 CB LEU A 113 -2.782 9.356 1.120 1.00 0.00 C ATOM 1695 CG LEU A 113 -1.568 9.511 0.201 1.00 0.00 C ATOM 1696 CD1 LEU A 113 -1.611 8.493 -0.940 1.00 0.00 C ATOM 1697 CD2 LEU A 113 -1.452 10.947 -0.317 1.00 0.00 C ATOM 0 H LEU A 113 -1.667 9.121 3.782 1.00 0.00 H new ATOM 0 HA LEU A 113 -2.774 11.251 2.039 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -2.857 8.310 1.416 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -3.679 9.590 0.547 1.00 0.00 H new ATOM 0 HG LEU A 113 -0.670 9.305 0.784 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -0.737 8.625 -1.578 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -1.610 7.484 -0.528 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -2.516 8.644 -1.528 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -0.581 11.030 -0.968 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -2.350 11.205 -0.878 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -1.342 11.630 0.525 1.00 0.00 H new ATOM 1709 N GLY A 114 -5.165 10.398 2.676 1.00 0.00 N ATOM 1710 CA GLY A 114 -6.430 10.284 3.382 1.00 0.00 C ATOM 1711 C GLY A 114 -7.479 9.582 2.517 1.00 0.00 C ATOM 1712 O GLY A 114 -7.395 9.606 1.290 1.00 0.00 O ATOM 0 H GLY A 114 -5.237 10.768 1.728 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -6.285 9.727 4.308 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -6.787 11.276 3.659 1.00 0.00 H new ATOM 1716 N LEU A 115 -8.443 8.972 3.191 1.00 0.00 N ATOM 1717 CA LEU A 115 -9.508 8.264 2.500 1.00 0.00 C ATOM 1718 C LEU A 115 -10.831 8.999 2.722 1.00 0.00 C ATOM 1719 O LEU A 115 -11.698 9.001 1.849 1.00 0.00 O ATOM 1720 CB LEU A 115 -9.540 6.796 2.927 1.00 0.00 C ATOM 1721 CG LEU A 115 -8.190 6.172 3.287 1.00 0.00 C ATOM 1722 CD1 LEU A 115 -7.104 6.609 2.302 1.00 0.00 C ATOM 1723 CD2 LEU A 115 -7.810 6.485 4.736 1.00 0.00 C ATOM 0 H LEU A 115 -8.509 8.953 4.209 1.00 0.00 H new ATOM 0 HA LEU A 115 -9.325 8.255 1.425 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -10.202 6.703 3.788 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -9.983 6.213 2.120 1.00 0.00 H new ATOM 0 HG LEU A 115 -8.282 5.089 3.205 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -6.155 6.152 2.581 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -7.377 6.293 1.295 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -7.005 7.694 2.327 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -6.847 6.030 4.966 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -7.742 7.565 4.869 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -8.570 6.084 5.406 1.00 0.00 H new ATOM 1735 N ASP A 116 -10.945 9.606 3.894 1.00 0.00 N ATOM 1736 CA ASP A 116 -12.148 10.342 4.242 1.00 0.00 C ATOM 1737 C ASP A 116 -12.588 11.187 3.045 1.00 0.00 C ATOM 1738 O ASP A 116 -13.771 11.484 2.891 1.00 0.00 O ATOM 1739 CB ASP A 116 -11.895 11.286 5.419 1.00 0.00 C ATOM 1740 CG ASP A 116 -13.141 11.984 5.968 1.00 0.00 C ATOM 1741 OD1 ASP A 116 -14.247 11.595 5.535 1.00 0.00 O ATOM 1742 OD2 ASP A 116 -12.959 12.891 6.810 1.00 0.00 O ATOM 0 H ASP A 116 -10.223 9.603 4.615 1.00 0.00 H new ATOM 0 HA ASP A 116 -12.917 9.620 4.517 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -11.429 10.720 6.226 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -11.178 12.046 5.108 1.00 0.00 H new ATOM 1747 N GLY A 117 -11.610 11.551 2.227 1.00 0.00 N ATOM 1748 CA GLY A 117 -11.882 12.356 1.048 1.00 0.00 C ATOM 1749 C GLY A 117 -11.515 13.822 1.289 1.00 0.00 C ATOM 1750 O GLY A 117 -12.158 14.722 0.751 1.00 0.00 O ATOM 0 H GLY A 117 -10.629 11.303 2.358 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -11.315 11.970 0.201 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -12.937 12.280 0.787 1.00 0.00 H new ATOM 1754 N THR A 118 -10.484 14.015 2.097 1.00 0.00 N ATOM 1755 CA THR A 118 -10.024 15.357 2.416 1.00 0.00 C ATOM 1756 C THR A 118 -8.671 15.628 1.754 1.00 0.00 C ATOM 1757 O THR A 118 -8.611 16.212 0.674 1.00 0.00 O ATOM 1758 CB THR A 118 -9.994 15.497 3.939 1.00 0.00 C ATOM 1759 OG1 THR A 118 -11.354 15.738 4.292 1.00 0.00 O ATOM 1760 CG2 THR A 118 -9.261 16.760 4.397 1.00 0.00 C ATOM 0 H THR A 118 -9.953 13.265 2.541 1.00 0.00 H new ATOM 0 HA THR A 118 -10.702 16.113 2.019 1.00 0.00 H new ATOM 0 HB THR A 118 -9.514 14.621 4.375 1.00 0.00 H new ATOM 0 HG1 THR A 118 -11.427 15.840 5.264 1.00 0.00 H new ATOM 0 HG21 THR A 118 -9.269 16.811 5.486 1.00 0.00 H new ATOM 0 HG22 THR A 118 -8.231 16.731 4.043 1.00 0.00 H new ATOM 0 HG23 THR A 118 -9.761 17.639 3.989 1.00 0.00 H new ATOM 1768 N SER A 119 -7.619 15.190 2.431 1.00 0.00 N ATOM 1769 CA SER A 119 -6.271 15.378 1.923 1.00 0.00 C ATOM 1770 C SER A 119 -6.251 15.179 0.406 1.00 0.00 C ATOM 1771 O SER A 119 -5.890 16.088 -0.339 1.00 0.00 O ATOM 1772 CB SER A 119 -5.289 14.419 2.597 1.00 0.00 C ATOM 1773 OG SER A 119 -4.984 14.817 3.931 1.00 0.00 O ATOM 0 H SER A 119 -7.673 14.706 3.327 1.00 0.00 H new ATOM 0 HA SER A 119 -5.958 16.396 2.154 1.00 0.00 H new ATOM 0 HB2 SER A 119 -5.712 13.414 2.606 1.00 0.00 H new ATOM 0 HB3 SER A 119 -4.370 14.372 2.013 1.00 0.00 H new ATOM 0 HG SER A 119 -4.355 14.178 4.327 1.00 0.00 H new ATOM 1779 N VAL A 120 -6.645 13.982 -0.007 1.00 0.00 N ATOM 1780 CA VAL A 120 -6.677 13.652 -1.421 1.00 0.00 C ATOM 1781 C VAL A 120 -8.006 12.970 -1.751 1.00 0.00 C ATOM 1782 O VAL A 120 -8.487 12.135 -0.986 1.00 0.00 O ATOM 1783 CB VAL A 120 -5.460 12.799 -1.787 1.00 0.00 C ATOM 1784 CG1 VAL A 120 -4.229 13.674 -2.027 1.00 0.00 C ATOM 1785 CG2 VAL A 120 -5.184 11.748 -0.709 1.00 0.00 C ATOM 0 H VAL A 120 -6.944 13.230 0.613 1.00 0.00 H new ATOM 0 HA VAL A 120 -6.617 14.557 -2.026 1.00 0.00 H new ATOM 0 HB VAL A 120 -5.685 12.276 -2.716 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -3.379 13.043 -2.285 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -4.429 14.366 -2.845 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -4.001 14.237 -1.122 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -4.315 11.155 -0.993 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -4.990 12.244 0.242 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -6.051 11.095 -0.607 1.00 0.00 H new ATOM 1795 N PRO A 121 -8.578 13.361 -2.921 1.00 0.00 N ATOM 1796 CA PRO A 121 -9.842 12.797 -3.362 1.00 0.00 C ATOM 1797 C PRO A 121 -9.653 11.373 -3.890 1.00 0.00 C ATOM 1798 O PRO A 121 -8.524 10.908 -4.041 1.00 0.00 O ATOM 1799 CB PRO A 121 -10.355 13.759 -4.421 1.00 0.00 C ATOM 1800 CG PRO A 121 -9.149 14.571 -4.865 1.00 0.00 C ATOM 1801 CD PRO A 121 -8.038 14.347 -3.853 1.00 0.00 C ATOM 0 HA PRO A 121 -10.563 12.697 -2.551 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -10.793 13.219 -5.260 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -11.134 14.406 -4.017 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -8.827 14.263 -5.860 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -9.403 15.629 -4.925 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -7.131 13.981 -4.335 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -7.776 15.273 -3.342 1.00 0.00 H new ATOM 1809 N LEU A 122 -10.775 10.721 -4.157 1.00 0.00 N ATOM 1810 CA LEU A 122 -10.747 9.360 -4.665 1.00 0.00 C ATOM 1811 C LEU A 122 -10.864 9.387 -6.190 1.00 0.00 C ATOM 1812 O LEU A 122 -11.375 10.350 -6.760 1.00 0.00 O ATOM 1813 CB LEU A 122 -11.820 8.511 -3.981 1.00 0.00 C ATOM 1814 CG LEU A 122 -11.562 8.157 -2.515 1.00 0.00 C ATOM 1815 CD1 LEU A 122 -12.832 7.625 -1.847 1.00 0.00 C ATOM 1816 CD2 LEU A 122 -10.393 7.178 -2.385 1.00 0.00 C ATOM 0 H LEU A 122 -11.709 11.110 -4.031 1.00 0.00 H new ATOM 0 HA LEU A 122 -9.796 8.884 -4.426 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -12.770 9.042 -4.044 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -11.935 7.584 -4.543 1.00 0.00 H new ATOM 0 HG LEU A 122 -11.279 9.069 -1.988 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -12.621 7.381 -0.806 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -13.612 8.385 -1.890 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -13.169 6.729 -2.368 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -10.231 6.943 -1.333 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -10.623 6.263 -2.930 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -9.492 7.630 -2.799 1.00 0.00 H new ATOM 1828 N GLY A 123 -10.382 8.318 -6.807 1.00 0.00 N ATOM 1829 CA GLY A 123 -10.426 8.207 -8.256 1.00 0.00 C ATOM 1830 C GLY A 123 -9.751 9.409 -8.918 1.00 0.00 C ATOM 1831 O GLY A 123 -10.025 9.719 -10.077 1.00 0.00 O ATOM 0 H GLY A 123 -9.959 7.521 -6.331 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -9.930 7.288 -8.569 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -11.462 8.139 -8.588 1.00 0.00 H new ATOM 1835 N ALA A 124 -8.881 10.054 -8.155 1.00 0.00 N ATOM 1836 CA ALA A 124 -8.163 11.215 -8.654 1.00 0.00 C ATOM 1837 C ALA A 124 -6.658 10.968 -8.537 1.00 0.00 C ATOM 1838 O ALA A 124 -6.083 11.111 -7.459 1.00 0.00 O ATOM 1839 CB ALA A 124 -8.611 12.460 -7.885 1.00 0.00 C ATOM 0 H ALA A 124 -8.657 9.795 -7.194 1.00 0.00 H new ATOM 0 HA ALA A 124 -8.388 11.383 -9.707 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -8.073 13.331 -8.258 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -9.682 12.608 -8.024 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -8.397 12.329 -6.824 1.00 0.00 H new ATOM 1845 N ALA A 125 -6.062 10.602 -9.663 1.00 0.00 N ATOM 1846 CA ALA A 125 -4.635 10.334 -9.701 1.00 0.00 C ATOM 1847 C ALA A 125 -3.869 11.625 -9.405 1.00 0.00 C ATOM 1848 O ALA A 125 -4.032 12.622 -10.107 1.00 0.00 O ATOM 1849 CB ALA A 125 -4.264 9.734 -11.059 1.00 0.00 C ATOM 0 H ALA A 125 -6.542 10.485 -10.555 1.00 0.00 H new ATOM 0 HA ALA A 125 -4.361 9.606 -8.937 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -3.193 9.533 -11.088 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -4.812 8.804 -11.208 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -4.522 10.438 -11.850 1.00 0.00 H new ATOM 1855 N GLN A 126 -3.051 11.565 -8.365 1.00 0.00 N ATOM 1856 CA GLN A 126 -2.260 12.718 -7.968 1.00 0.00 C ATOM 1857 C GLN A 126 -0.851 12.280 -7.562 1.00 0.00 C ATOM 1858 O GLN A 126 -0.637 11.126 -7.195 1.00 0.00 O ATOM 1859 CB GLN A 126 -2.943 13.487 -6.835 1.00 0.00 C ATOM 1860 CG GLN A 126 -3.450 12.533 -5.752 1.00 0.00 C ATOM 1861 CD GLN A 126 -4.819 12.974 -5.230 1.00 0.00 C ATOM 1862 OE1 GLN A 126 -5.087 14.148 -5.032 1.00 0.00 O ATOM 1863 NE2 GLN A 126 -5.666 11.971 -5.018 1.00 0.00 N ATOM 0 H GLN A 126 -2.919 10.736 -7.785 1.00 0.00 H new ATOM 0 HA GLN A 126 -2.179 13.390 -8.822 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -2.241 14.198 -6.399 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -3.776 14.065 -7.234 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -3.519 11.523 -6.155 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -2.736 12.500 -4.929 1.00 0.00 H new ATOM 0 HE21 GLN A 126 -5.377 11.011 -5.205 1.00 0.00 H new ATOM 0 HE22 GLN A 126 -6.605 12.162 -4.669 1.00 0.00 H new ATOM 1872 N TRP A 127 0.074 13.226 -7.643 1.00 0.00 N ATOM 1873 CA TRP A 127 1.456 12.952 -7.289 1.00 0.00 C ATOM 1874 C TRP A 127 1.676 13.416 -5.848 1.00 0.00 C ATOM 1875 O TRP A 127 0.889 14.198 -5.317 1.00 0.00 O ATOM 1876 CB TRP A 127 2.417 13.610 -8.282 1.00 0.00 C ATOM 1877 CG TRP A 127 2.571 12.846 -9.598 1.00 0.00 C ATOM 1878 CD1 TRP A 127 1.845 12.974 -10.717 1.00 0.00 C ATOM 1879 CD2 TRP A 127 3.547 11.823 -9.889 1.00 0.00 C ATOM 1880 NE1 TRP A 127 2.279 12.113 -11.704 1.00 0.00 N ATOM 1881 CE2 TRP A 127 3.347 11.390 -11.184 1.00 0.00 C ATOM 1882 CE3 TRP A 127 4.565 11.281 -9.085 1.00 0.00 C ATOM 1883 CZ2 TRP A 127 4.125 10.397 -11.790 1.00 0.00 C ATOM 1884 CZ3 TRP A 127 5.334 10.289 -9.704 1.00 0.00 C ATOM 1885 CH2 TRP A 127 5.145 9.843 -11.007 1.00 0.00 C ATOM 0 H TRP A 127 -0.107 14.182 -7.948 1.00 0.00 H new ATOM 0 HA TRP A 127 1.664 11.884 -7.346 1.00 0.00 H new ATOM 0 HB2 TRP A 127 2.065 14.619 -8.498 1.00 0.00 H new ATOM 0 HB3 TRP A 127 3.396 13.708 -7.814 1.00 0.00 H new ATOM 0 HD1 TRP A 127 1.023 13.665 -10.832 1.00 0.00 H new ATOM 0 HE1 TRP A 127 1.888 12.023 -12.642 1.00 0.00 H new ATOM 0 HE3 TRP A 127 4.740 11.605 -8.070 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 3.948 10.076 -12.806 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 6.130 9.839 -9.129 1.00 0.00 H new ATOM 0 HH2 TRP A 127 5.783 9.072 -11.414 1.00 0.00 H new ATOM 1896 N GLY A 128 2.750 12.914 -5.255 1.00 0.00 N ATOM 1897 CA GLY A 128 3.083 13.268 -3.886 1.00 0.00 C ATOM 1898 C GLY A 128 4.564 13.014 -3.599 1.00 0.00 C ATOM 1899 O GLY A 128 5.174 12.132 -4.202 1.00 0.00 O ATOM 0 H GLY A 128 3.400 12.265 -5.698 1.00 0.00 H new ATOM 0 HA2 GLY A 128 2.850 14.318 -3.711 1.00 0.00 H new ATOM 0 HA3 GLY A 128 2.470 12.687 -3.197 1.00 0.00 H new ATOM 1903 N GLU A 129 5.099 13.802 -2.678 1.00 0.00 N ATOM 1904 CA GLU A 129 6.497 13.674 -2.304 1.00 0.00 C ATOM 1905 C GLU A 129 6.627 12.879 -1.003 1.00 0.00 C ATOM 1906 O GLU A 129 6.015 13.228 0.005 1.00 0.00 O ATOM 1907 CB GLU A 129 7.159 15.047 -2.176 1.00 0.00 C ATOM 1908 CG GLU A 129 8.006 15.364 -3.410 1.00 0.00 C ATOM 1909 CD GLU A 129 7.586 16.696 -4.036 1.00 0.00 C ATOM 1910 OE1 GLU A 129 6.516 16.708 -4.682 1.00 0.00 O ATOM 1911 OE2 GLU A 129 8.345 17.673 -3.854 1.00 0.00 O ATOM 0 H GLU A 129 4.589 14.532 -2.180 1.00 0.00 H new ATOM 0 HA GLU A 129 7.016 13.130 -3.093 1.00 0.00 H new ATOM 0 HB2 GLU A 129 6.394 15.813 -2.049 1.00 0.00 H new ATOM 0 HB3 GLU A 129 7.786 15.071 -1.284 1.00 0.00 H new ATOM 0 HG2 GLU A 129 9.059 15.405 -3.132 1.00 0.00 H new ATOM 0 HG3 GLU A 129 7.901 14.564 -4.143 1.00 0.00 H new ATOM 1918 N LEU A 130 7.430 11.827 -1.068 1.00 0.00 N ATOM 1919 CA LEU A 130 7.648 10.980 0.093 1.00 0.00 C ATOM 1920 C LEU A 130 8.131 11.840 1.263 1.00 0.00 C ATOM 1921 O LEU A 130 9.037 12.657 1.105 1.00 0.00 O ATOM 1922 CB LEU A 130 8.593 9.828 -0.255 1.00 0.00 C ATOM 1923 CG LEU A 130 8.058 8.800 -1.253 1.00 0.00 C ATOM 1924 CD1 LEU A 130 9.203 8.032 -1.916 1.00 0.00 C ATOM 1925 CD2 LEU A 130 7.049 7.863 -0.588 1.00 0.00 C ATOM 0 H LEU A 130 7.937 11.542 -1.906 1.00 0.00 H new ATOM 0 HA LEU A 130 6.714 10.513 0.405 1.00 0.00 H new ATOM 0 HB2 LEU A 130 9.515 10.249 -0.656 1.00 0.00 H new ATOM 0 HB3 LEU A 130 8.855 9.308 0.667 1.00 0.00 H new ATOM 0 HG LEU A 130 7.529 9.334 -2.042 1.00 0.00 H new ATOM 0 HD11 LEU A 130 8.795 7.308 -2.621 1.00 0.00 H new ATOM 0 HD12 LEU A 130 9.850 8.730 -2.447 1.00 0.00 H new ATOM 0 HD13 LEU A 130 9.781 7.510 -1.153 1.00 0.00 H new ATOM 0 HD21 LEU A 130 6.685 7.142 -1.320 1.00 0.00 H new ATOM 0 HD22 LEU A 130 7.531 7.333 0.234 1.00 0.00 H new ATOM 0 HD23 LEU A 130 6.211 8.444 -0.203 1.00 0.00 H new ATOM 1937 N LYS A 131 7.504 11.627 2.410 1.00 0.00 N ATOM 1938 CA LYS A 131 7.859 12.373 3.606 1.00 0.00 C ATOM 1939 C LYS A 131 8.923 11.599 4.387 1.00 0.00 C ATOM 1940 O LYS A 131 8.643 11.060 5.457 1.00 0.00 O ATOM 1941 CB LYS A 131 6.608 12.697 4.426 1.00 0.00 C ATOM 1942 CG LYS A 131 5.720 13.706 3.695 1.00 0.00 C ATOM 1943 CD LYS A 131 4.604 12.997 2.925 1.00 0.00 C ATOM 1944 CE LYS A 131 4.028 13.904 1.836 1.00 0.00 C ATOM 1945 NZ LYS A 131 2.657 14.334 2.191 1.00 0.00 N ATOM 0 H LYS A 131 6.753 10.949 2.537 1.00 0.00 H new ATOM 0 HA LYS A 131 8.296 13.336 3.340 1.00 0.00 H new ATOM 0 HB2 LYS A 131 6.046 11.783 4.615 1.00 0.00 H new ATOM 0 HB3 LYS A 131 6.899 13.099 5.396 1.00 0.00 H new ATOM 0 HG2 LYS A 131 5.286 14.401 4.413 1.00 0.00 H new ATOM 0 HG3 LYS A 131 6.324 14.296 3.006 1.00 0.00 H new ATOM 0 HD2 LYS A 131 4.992 12.083 2.475 1.00 0.00 H new ATOM 0 HD3 LYS A 131 3.813 12.702 3.614 1.00 0.00 H new ATOM 0 HE2 LYS A 131 4.667 14.777 1.706 1.00 0.00 H new ATOM 0 HE3 LYS A 131 4.014 13.375 0.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 2.281 14.949 1.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 2.046 13.498 2.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 2.679 14.857 3.089 1.00 0.00 H new ATOM 1959 N THR A 132 10.121 11.570 3.823 1.00 0.00 N ATOM 1960 CA THR A 132 11.228 10.871 4.453 1.00 0.00 C ATOM 1961 C THR A 132 11.780 11.690 5.621 1.00 0.00 C ATOM 1962 O THR A 132 12.413 12.724 5.415 1.00 0.00 O ATOM 1963 CB THR A 132 12.272 10.570 3.376 1.00 0.00 C ATOM 1964 OG1 THR A 132 12.960 11.806 3.203 1.00 0.00 O ATOM 1965 CG2 THR A 132 11.641 10.301 2.008 1.00 0.00 C ATOM 0 H THR A 132 10.350 12.019 2.936 1.00 0.00 H new ATOM 0 HA THR A 132 10.903 9.924 4.885 1.00 0.00 H new ATOM 0 HB THR A 132 12.866 9.708 3.678 1.00 0.00 H new ATOM 0 HG1 THR A 132 12.503 12.509 3.711 1.00 0.00 H new ATOM 0 HG21 THR A 132 12.425 10.093 1.280 1.00 0.00 H new ATOM 0 HG22 THR A 132 10.974 9.442 2.078 1.00 0.00 H new ATOM 0 HG23 THR A 132 11.074 11.176 1.690 1.00 0.00 H new ATOM 1973 N SER A 133 11.519 11.198 6.823 1.00 0.00 N ATOM 1974 CA SER A 133 11.981 11.871 8.025 1.00 0.00 C ATOM 1975 C SER A 133 13.503 11.755 8.137 1.00 0.00 C ATOM 1976 O SER A 133 14.206 12.764 8.158 1.00 0.00 O ATOM 1977 CB SER A 133 11.311 11.293 9.273 1.00 0.00 C ATOM 1978 OG SER A 133 11.908 11.778 10.472 1.00 0.00 O ATOM 0 H SER A 133 10.993 10.340 6.990 1.00 0.00 H new ATOM 0 HA SER A 133 11.707 12.924 7.954 1.00 0.00 H new ATOM 0 HB2 SER A 133 10.251 11.548 9.267 1.00 0.00 H new ATOM 0 HB3 SER A 133 11.377 10.205 9.249 1.00 0.00 H new ATOM 0 HG SER A 133 11.451 11.387 11.246 1.00 0.00 H new ATOM 1984 N GLY A 134 13.966 10.515 8.206 1.00 0.00 N ATOM 1985 CA GLY A 134 15.391 10.254 8.316 1.00 0.00 C ATOM 1986 C GLY A 134 15.657 8.774 8.598 1.00 0.00 C ATOM 1987 O GLY A 134 14.790 8.072 9.116 1.00 0.00 O ATOM 0 H GLY A 134 13.380 9.681 8.188 1.00 0.00 H new ATOM 0 HA2 GLY A 134 15.890 10.547 7.393 1.00 0.00 H new ATOM 0 HA3 GLY A 134 15.815 10.862 9.115 1.00 0.00 H new ATOM 1991 N PRO A 135 16.892 8.333 8.237 1.00 0.00 N ATOM 1992 CA PRO A 135 17.283 6.949 8.445 1.00 0.00 C ATOM 1993 C PRO A 135 17.582 6.681 9.922 1.00 0.00 C ATOM 1994 O PRO A 135 18.672 6.226 10.265 1.00 0.00 O ATOM 1995 CB PRO A 135 18.492 6.743 7.547 1.00 0.00 C ATOM 1996 CG PRO A 135 19.014 8.133 7.225 1.00 0.00 C ATOM 1997 CD PRO A 135 17.944 9.137 7.621 1.00 0.00 C ATOM 0 HA PRO A 135 16.491 6.245 8.191 1.00 0.00 H new ATOM 0 HB2 PRO A 135 19.254 6.146 8.049 1.00 0.00 H new ATOM 0 HB3 PRO A 135 18.216 6.209 6.638 1.00 0.00 H new ATOM 0 HG2 PRO A 135 19.939 8.328 7.767 1.00 0.00 H new ATOM 0 HG3 PRO A 135 19.243 8.218 6.163 1.00 0.00 H new ATOM 0 HD2 PRO A 135 18.335 9.879 8.318 1.00 0.00 H new ATOM 0 HD3 PRO A 135 17.570 9.681 6.753 1.00 0.00 H new ATOM 2005 N SER A 136 16.594 6.974 10.755 1.00 0.00 N ATOM 2006 CA SER A 136 16.738 6.770 12.187 1.00 0.00 C ATOM 2007 C SER A 136 15.594 5.897 12.708 1.00 0.00 C ATOM 2008 O SER A 136 14.469 6.369 12.861 1.00 0.00 O ATOM 2009 CB SER A 136 16.769 8.105 12.933 1.00 0.00 C ATOM 2010 OG SER A 136 17.985 8.284 13.655 1.00 0.00 O ATOM 0 H SER A 136 15.691 7.351 10.466 1.00 0.00 H new ATOM 0 HA SER A 136 17.686 6.262 12.367 1.00 0.00 H new ATOM 0 HB2 SER A 136 16.646 8.921 12.221 1.00 0.00 H new ATOM 0 HB3 SER A 136 15.927 8.155 13.623 1.00 0.00 H new ATOM 0 HG SER A 136 17.967 9.148 14.116 1.00 0.00 H new ATOM 2016 N SER A 137 15.922 4.640 12.967 1.00 0.00 N ATOM 2017 CA SER A 137 14.937 3.697 13.468 1.00 0.00 C ATOM 2018 C SER A 137 14.040 4.378 14.503 1.00 0.00 C ATOM 2019 O SER A 137 14.451 5.342 15.148 1.00 0.00 O ATOM 2020 CB SER A 137 15.612 2.467 14.078 1.00 0.00 C ATOM 2021 OG SER A 137 14.662 1.506 14.530 1.00 0.00 O ATOM 0 H SER A 137 16.857 4.252 12.839 1.00 0.00 H new ATOM 0 HA SER A 137 14.325 3.364 12.630 1.00 0.00 H new ATOM 0 HB2 SER A 137 16.267 2.008 13.337 1.00 0.00 H new ATOM 0 HB3 SER A 137 16.241 2.775 14.913 1.00 0.00 H new ATOM 0 HG SER A 137 15.132 0.735 14.911 1.00 0.00 H new ATOM 2027 N GLY A 138 12.831 3.851 14.631 1.00 0.00 N ATOM 2028 CA GLY A 138 11.873 4.397 15.577 1.00 0.00 C ATOM 2029 C GLY A 138 10.679 3.456 15.752 1.00 0.00 C ATOM 2030 O GLY A 138 9.529 3.890 15.705 1.00 0.00 O ATOM 0 H GLY A 138 12.493 3.052 14.095 1.00 0.00 H new ATOM 0 HA2 GLY A 138 12.358 4.558 16.540 1.00 0.00 H new ATOM 0 HA3 GLY A 138 11.526 5.370 15.228 1.00 0.00 H new TER 2034 GLY A 138