USER MOD reduce.3.24.130724 H: found=0, std=0, add=1033, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1033 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 114 MET CE :methyl 170:sc= -0.0281 (180deg=-0.0868) USER MOD Set 1.2: A 115 GLN : amide:sc= -0.229 K(o=-0.26,f=-9.1!) USER MOD Set 2.1: A 104 SER OG : rot -29:sc= 0.846 USER MOD Set 2.2: A 108 SER OG : rot -155:sc= -0.282 USER MOD Set 3.1: A 82 CYS SG : rot -90:sc= -2.46! USER MOD Set 3.2: A 102 THR OG1 : rot 180:sc= 0.0449 USER MOD Set 4.1: A 59 ASN : amide:sc= 0.855 K(o=1,f=-6.6!) USER MOD Set 4.2: A 60 THR OG1 : rot 140:sc= 0.175 USER MOD Set 5.1: A 9 GLN : amide:sc= 0.19 X(o=0.64,f=0.45) USER MOD Set 5.2: A 11 GLN : amide:sc= 0.446 K(o=0.64,f=-3.5!) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 HIS : no HD1:sc= -1.25 X(o=-1.2,f=-0.81) USER MOD Single : A 16 HIS : no HD1:sc= 0.186 K(o=0.19,f=-1.7) USER MOD Single : A 17 ASN : amide:sc= -0.355 X(o=-0.35,f=-0.73) USER MOD Single : A 25 LYS NZ :NH3+ 167:sc= -0.0118 (180deg=-0.184) USER MOD Single : A 28 LYS NZ :NH3+ -171:sc= -0.0143 (180deg=-0.138) USER MOD Single : A 29 THR OG1 : rot 82:sc= 1.24 USER MOD Single : A 32 SER OG : rot 71:sc= 1.23 USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 123:sc= 1.75 USER MOD Single : A 40 TYR OH : rot -163:sc= 1.2 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot -76:sc= 0.799 USER MOD Single : A 51 ASN : amide:sc= -0.616 K(o=-0.62,f=-2.6!) USER MOD Single : A 54 THR OG1 : rot -74:sc= 1.73 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot -9:sc= 0.911 USER MOD Single : A 71 HIS : no HE2:sc= -0.111! C(o=-0.11!,f=-5.3!) USER MOD Single : A 75 LYS NZ :NH3+ 153:sc= 1.89 (180deg=0.468) USER MOD Single : A 76 SER OG : rot -94:sc= 1.24 USER MOD Single : A 81 ASN : amide:sc= -2.39! C(o=-2.4!,f=-2.9!) USER MOD Single : A 85 THR OG1 : rot -80:sc= 0.504 USER MOD Single : A 87 LYS NZ :NH3+ -119:sc= 1.02 (180deg=-2.68!) USER MOD Single : A 89 ASN : amide:sc= -6.36! C(o=-6.4!,f=-9.7!) USER MOD Single : A 90 GLN : amide:sc= 1.09 K(o=1.1,f=-0.42) USER MOD Single : A 91 GLN : amide:sc= -0.112 X(o=-0.11,f=-0.052) USER MOD Single : A 94 ASN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 100 MET CE :methyl -127:sc= 0 (180deg=-3.44!) USER MOD Single : A 106 ASN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 107 TYR OH : rot 106:sc= 0.102 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 GLN :FLIP amide:sc= -3.57! C(o=-5.5!,f=-3.6!) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= 0.356 X(o=0.36,f=-0.027) USER MOD Single : A 125 GLN :FLIP amide:sc= -0.239 F(o=-1.2!,f=-0.24) USER MOD Single : A 129 THR OG1 : rot -130:sc= -0.18 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ 160:sc= 1.98 (180deg=0.665) USER MOD Single : A 138 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.101) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 3.291 8.438 2.749 1.00 0.00 N ATOM 2 CA PRO A 1 4.017 7.905 1.612 1.00 0.00 C ATOM 3 C PRO A 1 5.476 8.279 1.737 1.00 0.00 C ATOM 4 O PRO A 1 5.829 9.100 2.543 1.00 0.00 O ATOM 5 CB PRO A 1 3.434 8.501 0.348 1.00 0.00 C ATOM 6 CG PRO A 1 2.595 9.630 0.848 1.00 0.00 C ATOM 7 CD PRO A 1 2.199 9.277 2.267 1.00 0.00 C ATOM 0 H2 PRO A 1 3.917 8.982 3.343 1.00 0.00 H new ATOM 0 H3 PRO A 1 2.924 7.677 3.321 1.00 0.00 H new ATOM 0 HA PRO A 1 3.931 6.819 1.578 1.00 0.00 H new ATOM 0 HB2 PRO A 1 4.215 8.850 -0.328 1.00 0.00 H new ATOM 0 HB3 PRO A 1 2.839 7.772 -0.202 1.00 0.00 H new ATOM 0 HG2 PRO A 1 3.151 10.567 0.822 1.00 0.00 H new ATOM 0 HG3 PRO A 1 1.713 9.765 0.222 1.00 0.00 H new ATOM 0 HD2 PRO A 1 2.083 10.170 2.881 1.00 0.00 H new ATOM 0 HD3 PRO A 1 1.248 8.746 2.294 1.00 0.00 H new ATOM 17 N VAL A 2 6.297 7.689 0.955 1.00 0.00 N ATOM 18 CA VAL A 2 7.710 7.953 0.961 1.00 0.00 C ATOM 19 C VAL A 2 8.078 8.665 -0.326 1.00 0.00 C ATOM 20 O VAL A 2 7.597 8.305 -1.395 1.00 0.00 O ATOM 21 CB VAL A 2 8.534 6.632 1.073 1.00 0.00 C ATOM 22 CG1 VAL A 2 10.029 6.914 1.079 1.00 0.00 C ATOM 23 CG2 VAL A 2 8.140 5.849 2.322 1.00 0.00 C ATOM 0 H VAL A 2 6.012 6.989 0.270 1.00 0.00 H new ATOM 0 HA VAL A 2 7.945 8.573 1.826 1.00 0.00 H new ATOM 0 HB VAL A 2 8.304 6.026 0.196 1.00 0.00 H new ATOM 0 HG11 VAL A 2 10.576 5.975 1.158 1.00 0.00 H new ATOM 0 HG12 VAL A 2 10.308 7.420 0.154 1.00 0.00 H new ATOM 0 HG13 VAL A 2 10.276 7.550 1.929 1.00 0.00 H new ATOM 0 HG21 VAL A 2 8.728 4.933 2.378 1.00 0.00 H new ATOM 0 HG22 VAL A 2 8.330 6.456 3.207 1.00 0.00 H new ATOM 0 HG23 VAL A 2 7.080 5.598 2.275 1.00 0.00 H new ATOM 33 N THR A 3 8.874 9.678 -0.215 1.00 0.00 N ATOM 34 CA THR A 3 9.332 10.402 -1.352 1.00 0.00 C ATOM 35 C THR A 3 10.856 10.336 -1.355 1.00 0.00 C ATOM 36 O THR A 3 11.494 10.318 -0.280 1.00 0.00 O ATOM 37 CB THR A 3 8.815 11.873 -1.322 1.00 0.00 C ATOM 38 OG1 THR A 3 9.231 12.596 -2.498 1.00 0.00 O ATOM 39 CG2 THR A 3 9.306 12.596 -0.076 1.00 0.00 C ATOM 0 H THR A 3 9.227 10.028 0.676 1.00 0.00 H new ATOM 0 HA THR A 3 8.943 9.962 -2.270 1.00 0.00 H new ATOM 0 HB THR A 3 7.726 11.835 -1.303 1.00 0.00 H new ATOM 0 HG1 THR A 3 8.892 13.514 -2.454 1.00 0.00 H new ATOM 0 HG21 THR A 3 8.932 13.620 -0.078 1.00 0.00 H new ATOM 0 HG22 THR A 3 8.942 12.079 0.812 1.00 0.00 H new ATOM 0 HG23 THR A 3 10.396 12.608 -0.068 1.00 0.00 H new ATOM 47 N GLU A 4 11.441 10.231 -2.506 1.00 0.00 N ATOM 48 CA GLU A 4 12.851 10.110 -2.592 1.00 0.00 C ATOM 49 C GLU A 4 13.498 11.402 -3.023 1.00 0.00 C ATOM 50 O GLU A 4 12.937 12.187 -3.794 1.00 0.00 O ATOM 51 CB GLU A 4 13.278 8.980 -3.519 1.00 0.00 C ATOM 52 CG GLU A 4 13.039 9.220 -5.005 1.00 0.00 C ATOM 53 CD GLU A 4 11.586 9.101 -5.476 1.00 0.00 C ATOM 54 OE1 GLU A 4 10.738 9.931 -5.073 1.00 0.00 O ATOM 55 OE2 GLU A 4 11.285 8.210 -6.311 1.00 0.00 O ATOM 0 H GLU A 4 10.954 10.227 -3.402 1.00 0.00 H new ATOM 0 HA GLU A 4 13.195 9.869 -1.586 1.00 0.00 H new ATOM 0 HB2 GLU A 4 14.341 8.791 -3.366 1.00 0.00 H new ATOM 0 HB3 GLU A 4 12.748 8.074 -3.226 1.00 0.00 H new ATOM 0 HG2 GLU A 4 13.401 10.217 -5.255 1.00 0.00 H new ATOM 0 HG3 GLU A 4 13.643 8.510 -5.570 1.00 0.00 H new ATOM 62 N THR A 5 14.619 11.621 -2.478 1.00 0.00 N ATOM 63 CA THR A 5 15.412 12.754 -2.757 1.00 0.00 C ATOM 64 C THR A 5 16.840 12.280 -3.035 1.00 0.00 C ATOM 65 O THR A 5 17.334 11.392 -2.360 1.00 0.00 O ATOM 66 CB THR A 5 15.333 13.749 -1.563 1.00 0.00 C ATOM 67 OG1 THR A 5 16.276 14.812 -1.696 1.00 0.00 O ATOM 68 CG2 THR A 5 15.519 13.038 -0.227 1.00 0.00 C ATOM 0 H THR A 5 15.036 10.991 -1.792 1.00 0.00 H new ATOM 0 HA THR A 5 15.052 13.286 -3.637 1.00 0.00 H new ATOM 0 HB THR A 5 14.333 14.182 -1.582 1.00 0.00 H new ATOM 0 HG1 THR A 5 16.197 15.418 -0.930 1.00 0.00 H new ATOM 0 HG21 THR A 5 15.458 13.764 0.583 1.00 0.00 H new ATOM 0 HG22 THR A 5 14.738 12.288 -0.102 1.00 0.00 H new ATOM 0 HG23 THR A 5 16.495 12.552 -0.206 1.00 0.00 H new ATOM 76 N VAL A 6 17.464 12.777 -4.068 1.00 0.00 N ATOM 77 CA VAL A 6 18.813 12.352 -4.373 1.00 0.00 C ATOM 78 C VAL A 6 19.810 13.490 -4.197 1.00 0.00 C ATOM 79 O VAL A 6 19.453 14.672 -4.278 1.00 0.00 O ATOM 80 CB VAL A 6 18.940 11.760 -5.810 1.00 0.00 C ATOM 81 CG1 VAL A 6 18.064 10.525 -5.970 1.00 0.00 C ATOM 82 CG2 VAL A 6 18.577 12.795 -6.863 1.00 0.00 C ATOM 0 H VAL A 6 17.071 13.467 -4.708 1.00 0.00 H new ATOM 0 HA VAL A 6 19.048 11.561 -3.661 1.00 0.00 H new ATOM 0 HB VAL A 6 19.981 11.470 -5.954 1.00 0.00 H new ATOM 0 HG11 VAL A 6 18.171 10.132 -6.981 1.00 0.00 H new ATOM 0 HG12 VAL A 6 18.371 9.766 -5.251 1.00 0.00 H new ATOM 0 HG13 VAL A 6 17.022 10.792 -5.793 1.00 0.00 H new ATOM 0 HG21 VAL A 6 18.675 12.354 -7.855 1.00 0.00 H new ATOM 0 HG22 VAL A 6 17.549 13.123 -6.711 1.00 0.00 H new ATOM 0 HG23 VAL A 6 19.247 13.651 -6.778 1.00 0.00 H new ATOM 92 N ASP A 7 21.038 13.124 -3.915 1.00 0.00 N ATOM 93 CA ASP A 7 22.145 14.073 -3.821 1.00 0.00 C ATOM 94 C ASP A 7 22.992 13.888 -5.069 1.00 0.00 C ATOM 95 O ASP A 7 23.043 12.777 -5.605 1.00 0.00 O ATOM 96 CB ASP A 7 22.984 13.793 -2.550 1.00 0.00 C ATOM 97 CG ASP A 7 24.224 14.671 -2.387 1.00 0.00 C ATOM 98 OD1 ASP A 7 25.218 14.463 -3.095 1.00 0.00 O ATOM 99 OD2 ASP A 7 24.238 15.554 -1.532 1.00 0.00 O ATOM 0 H ASP A 7 21.309 12.156 -3.742 1.00 0.00 H new ATOM 0 HA ASP A 7 21.778 15.097 -3.751 1.00 0.00 H new ATOM 0 HB2 ASP A 7 22.346 13.925 -1.676 1.00 0.00 H new ATOM 0 HB3 ASP A 7 23.296 12.749 -2.562 1.00 0.00 H new ATOM 104 N GLY A 8 23.664 14.940 -5.511 1.00 0.00 N ATOM 105 CA GLY A 8 24.461 14.905 -6.744 1.00 0.00 C ATOM 106 C GLY A 8 25.604 13.882 -6.748 1.00 0.00 C ATOM 107 O GLY A 8 26.185 13.609 -7.800 1.00 0.00 O ATOM 0 H GLY A 8 23.677 15.841 -5.033 1.00 0.00 H new ATOM 0 HA2 GLY A 8 23.798 14.689 -7.582 1.00 0.00 H new ATOM 0 HA3 GLY A 8 24.880 15.896 -6.916 1.00 0.00 H new ATOM 111 N GLN A 9 25.941 13.322 -5.589 1.00 0.00 N ATOM 112 CA GLN A 9 26.975 12.286 -5.525 1.00 0.00 C ATOM 113 C GLN A 9 26.408 10.932 -5.962 1.00 0.00 C ATOM 114 O GLN A 9 27.125 9.940 -6.038 1.00 0.00 O ATOM 115 CB GLN A 9 27.587 12.192 -4.127 1.00 0.00 C ATOM 116 CG GLN A 9 26.619 11.737 -3.061 1.00 0.00 C ATOM 117 CD GLN A 9 27.171 11.898 -1.679 1.00 0.00 C ATOM 118 OE1 GLN A 9 27.790 10.995 -1.131 1.00 0.00 O ATOM 119 NE2 GLN A 9 26.969 13.051 -1.117 1.00 0.00 N ATOM 0 H GLN A 9 25.521 13.562 -4.691 1.00 0.00 H new ATOM 0 HA GLN A 9 27.771 12.567 -6.215 1.00 0.00 H new ATOM 0 HB2 GLN A 9 28.430 11.501 -4.156 1.00 0.00 H new ATOM 0 HB3 GLN A 9 27.984 13.168 -3.849 1.00 0.00 H new ATOM 0 HG2 GLN A 9 25.694 12.307 -3.148 1.00 0.00 H new ATOM 0 HG3 GLN A 9 26.366 10.690 -3.228 1.00 0.00 H new ATOM 0 HE21 GLN A 9 26.447 13.775 -1.611 1.00 0.00 H new ATOM 0 HE22 GLN A 9 27.332 13.233 -0.181 1.00 0.00 H new ATOM 128 N GLY A 10 25.121 10.892 -6.224 1.00 0.00 N ATOM 129 CA GLY A 10 24.517 9.684 -6.715 1.00 0.00 C ATOM 130 C GLY A 10 23.846 8.870 -5.630 1.00 0.00 C ATOM 131 O GLY A 10 23.460 7.730 -5.862 1.00 0.00 O ATOM 0 H GLY A 10 24.481 11.677 -6.105 1.00 0.00 H new ATOM 0 HA2 GLY A 10 23.781 9.937 -7.478 1.00 0.00 H new ATOM 0 HA3 GLY A 10 25.280 9.074 -7.198 1.00 0.00 H new ATOM 135 N GLN A 11 23.716 9.432 -4.446 1.00 0.00 N ATOM 136 CA GLN A 11 23.042 8.718 -3.375 1.00 0.00 C ATOM 137 C GLN A 11 21.575 9.063 -3.383 1.00 0.00 C ATOM 138 O GLN A 11 21.189 10.178 -3.788 1.00 0.00 O ATOM 139 CB GLN A 11 23.609 9.038 -1.993 1.00 0.00 C ATOM 140 CG GLN A 11 23.425 10.482 -1.556 1.00 0.00 C ATOM 141 CD GLN A 11 23.695 10.674 -0.100 1.00 0.00 C ATOM 142 OE1 GLN A 11 24.810 10.948 0.307 1.00 0.00 O ATOM 143 NE2 GLN A 11 22.669 10.522 0.691 1.00 0.00 N ATOM 0 H GLN A 11 24.059 10.361 -4.201 1.00 0.00 H new ATOM 0 HA GLN A 11 23.200 7.656 -3.560 1.00 0.00 H new ATOM 0 HB2 GLN A 11 23.134 8.386 -1.259 1.00 0.00 H new ATOM 0 HB3 GLN A 11 24.673 8.803 -1.987 1.00 0.00 H new ATOM 0 HG2 GLN A 11 24.092 11.122 -2.134 1.00 0.00 H new ATOM 0 HG3 GLN A 11 22.406 10.799 -1.779 1.00 0.00 H new ATOM 0 HE21 GLN A 11 21.755 10.293 0.302 1.00 0.00 H new ATOM 0 HE22 GLN A 11 22.781 10.633 1.699 1.00 0.00 H new ATOM 152 N ALA A 12 20.777 8.155 -2.919 1.00 0.00 N ATOM 153 CA ALA A 12 19.380 8.363 -2.850 1.00 0.00 C ATOM 154 C ALA A 12 18.930 8.197 -1.422 1.00 0.00 C ATOM 155 O ALA A 12 19.252 7.210 -0.761 1.00 0.00 O ATOM 156 CB ALA A 12 18.667 7.431 -3.777 1.00 0.00 C ATOM 0 H ALA A 12 21.086 7.245 -2.577 1.00 0.00 H new ATOM 0 HA ALA A 12 19.136 9.376 -3.171 1.00 0.00 H new ATOM 0 HB1 ALA A 12 17.593 7.604 -3.712 1.00 0.00 H new ATOM 0 HB2 ALA A 12 19.002 7.608 -4.799 1.00 0.00 H new ATOM 0 HB3 ALA A 12 18.886 6.401 -3.497 1.00 0.00 H new ATOM 162 N TRP A 13 18.218 9.151 -0.960 1.00 0.00 N ATOM 163 CA TRP A 13 17.807 9.245 0.408 1.00 0.00 C ATOM 164 C TRP A 13 16.357 9.527 0.428 1.00 0.00 C ATOM 165 O TRP A 13 15.823 10.066 -0.521 1.00 0.00 O ATOM 166 CB TRP A 13 18.679 10.263 1.210 1.00 0.00 C ATOM 167 CG TRP A 13 19.152 11.472 0.450 1.00 0.00 C ATOM 168 CD1 TRP A 13 19.908 11.466 -0.678 1.00 0.00 C ATOM 169 CD2 TRP A 13 18.979 12.849 0.791 1.00 0.00 C ATOM 170 NE1 TRP A 13 20.174 12.719 -1.073 1.00 0.00 N ATOM 171 CE2 TRP A 13 19.631 13.589 -0.203 1.00 0.00 C ATOM 172 CE3 TRP A 13 18.330 13.531 1.818 1.00 0.00 C ATOM 173 CZ2 TRP A 13 19.667 14.950 -0.216 1.00 0.00 C ATOM 174 CZ3 TRP A 13 18.364 14.913 1.815 1.00 0.00 C ATOM 175 CH2 TRP A 13 19.031 15.609 0.801 1.00 0.00 C ATOM 0 H TRP A 13 17.886 9.924 -1.537 1.00 0.00 H new ATOM 0 HA TRP A 13 17.972 8.302 0.928 1.00 0.00 H new ATOM 0 HB2 TRP A 13 18.104 10.603 2.072 1.00 0.00 H new ATOM 0 HB3 TRP A 13 19.552 9.737 1.596 1.00 0.00 H new ATOM 0 HD1 TRP A 13 20.248 10.576 -1.186 1.00 0.00 H new ATOM 0 HE1 TRP A 13 20.706 12.973 -1.905 1.00 0.00 H new ATOM 0 HE3 TRP A 13 17.812 12.993 2.598 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 20.178 15.489 -1.000 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 17.870 15.461 2.604 1.00 0.00 H new ATOM 0 HH2 TRP A 13 19.044 16.689 0.821 1.00 0.00 H new ATOM 186 N ARG A 14 15.676 9.071 1.402 1.00 0.00 N ATOM 187 CA ARG A 14 14.244 9.137 1.335 1.00 0.00 C ATOM 188 C ARG A 14 13.672 9.781 2.521 1.00 0.00 C ATOM 189 O ARG A 14 14.239 9.744 3.610 1.00 0.00 O ATOM 190 CB ARG A 14 13.611 7.769 1.116 1.00 0.00 C ATOM 191 CG ARG A 14 13.764 7.165 -0.295 1.00 0.00 C ATOM 192 CD ARG A 14 15.213 6.875 -0.642 1.00 0.00 C ATOM 193 NE ARG A 14 15.412 6.413 -2.013 1.00 0.00 N ATOM 194 CZ ARG A 14 16.263 5.449 -2.397 1.00 0.00 C ATOM 195 NH1 ARG A 14 17.042 4.856 -1.521 1.00 0.00 N ATOM 196 NH2 ARG A 14 16.349 5.107 -3.679 1.00 0.00 N ATOM 0 H ARG A 14 16.062 8.652 2.248 1.00 0.00 H new ATOM 0 HA ARG A 14 14.010 9.753 0.467 1.00 0.00 H new ATOM 0 HB2 ARG A 14 14.043 7.073 1.835 1.00 0.00 H new ATOM 0 HB3 ARG A 14 12.548 7.843 1.343 1.00 0.00 H new ATOM 0 HG2 ARG A 14 13.186 6.243 -0.358 1.00 0.00 H new ATOM 0 HG3 ARG A 14 13.347 7.854 -1.030 1.00 0.00 H new ATOM 0 HD2 ARG A 14 15.802 7.779 -0.484 1.00 0.00 H new ATOM 0 HD3 ARG A 14 15.597 6.120 0.045 1.00 0.00 H new ATOM 0 HE ARG A 14 14.856 6.862 -2.741 1.00 0.00 H new ATOM 0 HH11 ARG A 14 17.004 5.127 -0.538 1.00 0.00 H new ATOM 0 HH12 ARG A 14 17.685 4.124 -1.823 1.00 0.00 H new ATOM 0 HH21 ARG A 14 15.768 5.578 -4.372 1.00 0.00 H new ATOM 0 HH22 ARG A 14 16.996 4.374 -3.969 1.00 0.00 H new ATOM 210 N HIS A 15 12.570 10.404 2.310 1.00 0.00 N ATOM 211 CA HIS A 15 11.880 11.119 3.336 1.00 0.00 C ATOM 212 C HIS A 15 10.517 10.562 3.479 1.00 0.00 C ATOM 213 O HIS A 15 9.840 10.275 2.480 1.00 0.00 O ATOM 214 CB HIS A 15 11.836 12.622 3.031 1.00 0.00 C ATOM 215 CG HIS A 15 13.159 13.308 3.225 1.00 0.00 C ATOM 216 ND1 HIS A 15 13.283 14.596 3.676 1.00 0.00 N ATOM 217 CD2 HIS A 15 14.425 12.864 3.019 1.00 0.00 C ATOM 218 CE1 HIS A 15 14.560 14.914 3.739 1.00 0.00 C ATOM 219 NE2 HIS A 15 15.272 13.876 3.350 1.00 0.00 N ATOM 0 H HIS A 15 12.108 10.435 1.401 1.00 0.00 H new ATOM 0 HA HIS A 15 12.416 11.001 4.278 1.00 0.00 H new ATOM 0 HB2 HIS A 15 11.507 12.767 2.002 1.00 0.00 H new ATOM 0 HB3 HIS A 15 11.092 13.094 3.673 1.00 0.00 H new ATOM 0 HD2 HIS A 15 14.708 11.886 2.658 1.00 0.00 H new ATOM 0 HE1 HIS A 15 14.957 15.867 4.057 1.00 0.00 H new ATOM 0 HE2 HIS A 15 16.290 13.837 3.304 1.00 0.00 H new ATOM 228 N HIS A 16 10.117 10.367 4.681 1.00 0.00 N ATOM 229 CA HIS A 16 8.833 9.811 4.950 1.00 0.00 C ATOM 230 C HIS A 16 7.872 10.947 5.007 1.00 0.00 C ATOM 231 O HIS A 16 8.154 11.990 5.621 1.00 0.00 O ATOM 232 CB HIS A 16 8.778 9.080 6.296 1.00 0.00 C ATOM 233 CG HIS A 16 9.863 8.081 6.574 1.00 0.00 C ATOM 234 ND1 HIS A 16 10.454 7.965 7.812 1.00 0.00 N ATOM 235 CD2 HIS A 16 10.453 7.146 5.791 1.00 0.00 C ATOM 236 CE1 HIS A 16 11.359 7.007 7.783 1.00 0.00 C ATOM 237 NE2 HIS A 16 11.382 6.491 6.566 1.00 0.00 N ATOM 0 H HIS A 16 10.667 10.587 5.511 1.00 0.00 H new ATOM 0 HA HIS A 16 8.597 9.087 4.170 1.00 0.00 H new ATOM 0 HB2 HIS A 16 8.795 9.828 7.089 1.00 0.00 H new ATOM 0 HB3 HIS A 16 7.819 8.566 6.363 1.00 0.00 H new ATOM 0 HD2 HIS A 16 10.235 6.951 4.751 1.00 0.00 H new ATOM 0 HE1 HIS A 16 11.977 6.696 8.613 1.00 0.00 H new ATOM 0 HE2 HIS A 16 11.988 5.733 6.253 1.00 0.00 H new ATOM 246 N ASN A 17 6.778 10.782 4.386 1.00 0.00 N ATOM 247 CA ASN A 17 5.719 11.728 4.415 1.00 0.00 C ATOM 248 C ASN A 17 4.619 11.098 5.195 1.00 0.00 C ATOM 249 O ASN A 17 4.341 9.902 5.005 1.00 0.00 O ATOM 250 CB ASN A 17 5.216 12.014 2.986 1.00 0.00 C ATOM 251 CG ASN A 17 6.235 12.638 2.045 1.00 0.00 C ATOM 252 OD1 ASN A 17 6.191 12.388 0.842 1.00 0.00 O ATOM 253 ND2 ASN A 17 7.133 13.456 2.550 1.00 0.00 N ATOM 0 H ASN A 17 6.576 9.958 3.819 1.00 0.00 H new ATOM 0 HA ASN A 17 6.052 12.668 4.855 1.00 0.00 H new ATOM 0 HB2 ASN A 17 4.868 11.078 2.548 1.00 0.00 H new ATOM 0 HB3 ASN A 17 4.353 12.676 3.049 1.00 0.00 H new ATOM 0 HD21 ASN A 17 7.817 13.902 1.939 1.00 0.00 H new ATOM 0 HD22 ASN A 17 7.145 13.644 3.552 1.00 0.00 H new ATOM 260 N GLY A 18 3.999 11.844 6.058 1.00 0.00 N ATOM 261 CA GLY A 18 2.920 11.307 6.830 1.00 0.00 C ATOM 262 C GLY A 18 1.651 11.225 6.019 1.00 0.00 C ATOM 263 O GLY A 18 1.682 11.016 4.796 1.00 0.00 O ATOM 0 H GLY A 18 4.220 12.822 6.245 1.00 0.00 H new ATOM 0 HA2 GLY A 18 3.188 10.314 7.191 1.00 0.00 H new ATOM 0 HA3 GLY A 18 2.753 11.931 7.708 1.00 0.00 H new ATOM 267 N PHE A 19 0.559 11.430 6.645 1.00 0.00 N ATOM 268 CA PHE A 19 -0.686 11.290 5.975 1.00 0.00 C ATOM 269 C PHE A 19 -1.260 12.625 5.655 1.00 0.00 C ATOM 270 O PHE A 19 -1.620 13.392 6.556 1.00 0.00 O ATOM 271 CB PHE A 19 -1.639 10.428 6.806 1.00 0.00 C ATOM 272 CG PHE A 19 -1.034 9.092 7.089 1.00 0.00 C ATOM 273 CD1 PHE A 19 -1.067 8.100 6.133 1.00 0.00 C ATOM 274 CD2 PHE A 19 -0.372 8.851 8.283 1.00 0.00 C ATOM 275 CE1 PHE A 19 -0.468 6.886 6.360 1.00 0.00 C ATOM 276 CE2 PHE A 19 0.238 7.644 8.515 1.00 0.00 C ATOM 277 CZ PHE A 19 0.195 6.657 7.554 1.00 0.00 C ATOM 0 H PHE A 19 0.494 11.697 7.627 1.00 0.00 H new ATOM 0 HA PHE A 19 -0.529 10.777 5.026 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -1.870 10.934 7.744 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -2.581 10.300 6.272 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -1.570 8.280 5.194 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -0.336 9.622 9.039 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -0.514 6.111 5.609 1.00 0.00 H new ATOM 0 HE2 PHE A 19 0.751 7.468 9.449 1.00 0.00 H new ATOM 0 HZ PHE A 19 0.677 5.707 7.732 1.00 0.00 H new ATOM 287 N ASP A 20 -1.302 12.934 4.384 1.00 0.00 N ATOM 288 CA ASP A 20 -1.898 14.153 3.929 1.00 0.00 C ATOM 289 C ASP A 20 -3.358 13.911 3.977 1.00 0.00 C ATOM 290 O ASP A 20 -3.845 12.936 3.361 1.00 0.00 O ATOM 291 CB ASP A 20 -1.483 14.474 2.486 1.00 0.00 C ATOM 292 CG ASP A 20 -0.001 14.673 2.313 1.00 0.00 C ATOM 293 OD1 ASP A 20 0.481 15.816 2.450 1.00 0.00 O ATOM 294 OD2 ASP A 20 0.723 13.684 2.024 1.00 0.00 O ATOM 0 H ASP A 20 -0.924 12.346 3.641 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.585 14.996 4.545 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -1.810 13.664 1.834 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -2.002 15.375 2.160 1.00 0.00 H new ATOM 299 N PHE A 21 -4.072 14.736 4.697 1.00 0.00 N ATOM 300 CA PHE A 21 -5.459 14.466 4.911 1.00 0.00 C ATOM 301 C PHE A 21 -6.256 14.538 3.633 1.00 0.00 C ATOM 302 O PHE A 21 -7.161 13.801 3.482 1.00 0.00 O ATOM 303 CB PHE A 21 -6.089 15.320 6.011 1.00 0.00 C ATOM 304 CG PHE A 21 -7.460 14.816 6.382 1.00 0.00 C ATOM 305 CD1 PHE A 21 -7.596 13.596 7.016 1.00 0.00 C ATOM 306 CD2 PHE A 21 -8.600 15.525 6.060 1.00 0.00 C ATOM 307 CE1 PHE A 21 -8.838 13.093 7.328 1.00 0.00 C ATOM 308 CE2 PHE A 21 -9.853 15.023 6.365 1.00 0.00 C ATOM 309 CZ PHE A 21 -9.971 13.806 7.000 1.00 0.00 C ATOM 0 H PHE A 21 -3.719 15.586 5.137 1.00 0.00 H new ATOM 0 HA PHE A 21 -5.497 13.438 5.270 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -5.447 15.313 6.892 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -6.159 16.355 5.675 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -6.713 13.028 7.271 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -8.513 16.481 5.565 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -8.925 12.140 7.829 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -10.738 15.585 6.105 1.00 0.00 H new ATOM 0 HZ PHE A 21 -10.948 13.412 7.240 1.00 0.00 H new ATOM 319 N ALA A 22 -5.870 15.404 2.717 1.00 0.00 N ATOM 320 CA ALA A 22 -6.541 15.566 1.423 1.00 0.00 C ATOM 321 C ALA A 22 -6.751 14.223 0.698 1.00 0.00 C ATOM 322 O ALA A 22 -7.854 13.928 0.259 1.00 0.00 O ATOM 323 CB ALA A 22 -5.752 16.521 0.545 1.00 0.00 C ATOM 0 H ALA A 22 -5.072 16.027 2.843 1.00 0.00 H new ATOM 0 HA ALA A 22 -7.530 15.981 1.619 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.257 16.635 -0.414 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -5.681 17.492 1.036 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -4.751 16.122 0.382 1.00 0.00 H new ATOM 329 N VAL A 23 -5.704 13.408 0.645 1.00 0.00 N ATOM 330 CA VAL A 23 -5.747 12.100 -0.032 1.00 0.00 C ATOM 331 C VAL A 23 -6.727 11.148 0.683 1.00 0.00 C ATOM 332 O VAL A 23 -7.654 10.600 0.074 1.00 0.00 O ATOM 333 CB VAL A 23 -4.327 11.455 -0.077 1.00 0.00 C ATOM 334 CG1 VAL A 23 -4.336 10.118 -0.813 1.00 0.00 C ATOM 335 CG2 VAL A 23 -3.320 12.415 -0.706 1.00 0.00 C ATOM 0 H VAL A 23 -4.801 13.626 1.066 1.00 0.00 H new ATOM 0 HA VAL A 23 -6.094 12.263 -1.052 1.00 0.00 H new ATOM 0 HB VAL A 23 -4.022 11.258 0.951 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -3.329 9.701 -0.823 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -5.010 9.428 -0.305 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -4.676 10.269 -1.838 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -2.336 11.947 -0.728 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -3.631 12.654 -1.723 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -3.273 13.331 -0.116 1.00 0.00 H new ATOM 345 N ILE A 24 -6.497 10.969 1.969 1.00 0.00 N ATOM 346 CA ILE A 24 -7.353 10.142 2.828 1.00 0.00 C ATOM 347 C ILE A 24 -8.828 10.634 2.776 1.00 0.00 C ATOM 348 O ILE A 24 -9.752 9.847 2.683 1.00 0.00 O ATOM 349 CB ILE A 24 -6.849 10.183 4.306 1.00 0.00 C ATOM 350 CG1 ILE A 24 -5.392 9.678 4.428 1.00 0.00 C ATOM 351 CG2 ILE A 24 -7.766 9.393 5.232 1.00 0.00 C ATOM 352 CD1 ILE A 24 -5.163 8.233 3.999 1.00 0.00 C ATOM 0 H ILE A 24 -5.709 11.391 2.460 1.00 0.00 H new ATOM 0 HA ILE A 24 -7.305 9.118 2.458 1.00 0.00 H new ATOM 0 HB ILE A 24 -6.870 11.227 4.617 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -4.750 10.323 3.828 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -5.073 9.786 5.465 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -7.384 9.444 6.252 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -8.770 9.817 5.199 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -7.801 8.353 4.909 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -4.110 7.979 4.123 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -5.771 7.570 4.614 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -5.443 8.115 2.952 1.00 0.00 H new ATOM 364 N LYS A 25 -8.986 11.930 2.790 1.00 0.00 N ATOM 365 CA LYS A 25 -10.278 12.609 2.731 1.00 0.00 C ATOM 366 C LYS A 25 -10.961 12.269 1.429 1.00 0.00 C ATOM 367 O LYS A 25 -12.125 11.902 1.410 1.00 0.00 O ATOM 368 CB LYS A 25 -10.032 14.124 2.788 1.00 0.00 C ATOM 369 CG LYS A 25 -11.258 15.004 2.843 1.00 0.00 C ATOM 370 CD LYS A 25 -10.870 16.477 2.707 1.00 0.00 C ATOM 371 CE LYS A 25 -10.482 16.851 1.264 1.00 0.00 C ATOM 372 NZ LYS A 25 -11.608 16.720 0.300 1.00 0.00 N ATOM 0 H LYS A 25 -8.199 12.576 2.844 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.906 12.295 3.564 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.419 14.337 3.664 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -9.447 14.408 1.913 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.946 14.728 2.044 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -11.784 14.846 3.785 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.704 17.101 3.029 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -10.034 16.693 3.373 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -10.116 17.878 1.248 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -9.659 16.214 0.940 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -11.356 17.187 -0.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -11.798 15.713 0.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.459 17.168 0.697 1.00 0.00 H new ATOM 386 N GLU A 26 -10.211 12.382 0.355 1.00 0.00 N ATOM 387 CA GLU A 26 -10.678 12.090 -0.987 1.00 0.00 C ATOM 388 C GLU A 26 -11.190 10.652 -1.068 1.00 0.00 C ATOM 389 O GLU A 26 -12.358 10.407 -1.404 1.00 0.00 O ATOM 390 CB GLU A 26 -9.514 12.286 -1.984 1.00 0.00 C ATOM 391 CG GLU A 26 -9.872 12.057 -3.442 1.00 0.00 C ATOM 392 CD GLU A 26 -10.955 12.990 -3.903 1.00 0.00 C ATOM 393 OE1 GLU A 26 -10.644 14.122 -4.335 1.00 0.00 O ATOM 394 OE2 GLU A 26 -12.149 12.624 -3.817 1.00 0.00 O ATOM 0 H GLU A 26 -9.238 12.686 0.389 1.00 0.00 H new ATOM 0 HA GLU A 26 -11.495 12.766 -1.237 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -9.129 13.300 -1.875 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -8.705 11.607 -1.713 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -8.985 12.196 -4.060 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -10.198 11.026 -3.579 1.00 0.00 H new ATOM 401 N LEU A 27 -10.335 9.714 -0.713 1.00 0.00 N ATOM 402 CA LEU A 27 -10.692 8.314 -0.824 1.00 0.00 C ATOM 403 C LEU A 27 -11.782 7.934 0.196 1.00 0.00 C ATOM 404 O LEU A 27 -12.515 6.993 -0.017 1.00 0.00 O ATOM 405 CB LEU A 27 -9.454 7.399 -0.714 1.00 0.00 C ATOM 406 CG LEU A 27 -9.649 5.935 -1.131 1.00 0.00 C ATOM 407 CD1 LEU A 27 -10.137 5.864 -2.552 1.00 0.00 C ATOM 408 CD2 LEU A 27 -8.343 5.183 -1.007 1.00 0.00 C ATOM 0 H LEU A 27 -9.399 9.892 -0.349 1.00 0.00 H new ATOM 0 HA LEU A 27 -11.111 8.159 -1.818 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.659 7.825 -1.325 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -9.107 7.417 0.319 1.00 0.00 H new ATOM 0 HG LEU A 27 -10.390 5.480 -0.474 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -10.272 4.821 -2.839 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -11.088 6.390 -2.637 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -9.405 6.329 -3.212 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -8.491 4.145 -1.305 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -7.596 5.643 -1.653 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -8.000 5.218 0.027 1.00 0.00 H new ATOM 420 N LYS A 28 -11.896 8.696 1.285 1.00 0.00 N ATOM 421 CA LYS A 28 -12.940 8.463 2.286 1.00 0.00 C ATOM 422 C LYS A 28 -14.280 9.023 1.785 1.00 0.00 C ATOM 423 O LYS A 28 -15.355 8.477 2.075 1.00 0.00 O ATOM 424 CB LYS A 28 -12.568 9.085 3.649 1.00 0.00 C ATOM 425 CG LYS A 28 -13.551 8.763 4.770 1.00 0.00 C ATOM 426 CD LYS A 28 -13.116 9.375 6.098 1.00 0.00 C ATOM 427 CE LYS A 28 -14.091 9.030 7.229 1.00 0.00 C ATOM 428 NZ LYS A 28 -15.463 9.530 6.972 1.00 0.00 N ATOM 0 H LYS A 28 -11.279 9.480 1.497 1.00 0.00 H new ATOM 0 HA LYS A 28 -13.035 7.387 2.433 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -11.577 8.735 3.938 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -12.503 10.167 3.537 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -14.540 9.136 4.504 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -13.637 7.682 4.879 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -12.119 9.016 6.355 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -13.048 10.458 5.994 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -14.121 7.948 7.360 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -13.723 9.454 8.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -16.043 9.407 7.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -15.424 10.539 6.723 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -15.886 8.996 6.186 1.00 0.00 H new ATOM 442 N THR A 29 -14.216 10.095 1.027 1.00 0.00 N ATOM 443 CA THR A 29 -15.403 10.669 0.427 1.00 0.00 C ATOM 444 C THR A 29 -15.943 9.666 -0.587 1.00 0.00 C ATOM 445 O THR A 29 -17.127 9.274 -0.535 1.00 0.00 O ATOM 446 CB THR A 29 -15.097 12.031 -0.241 1.00 0.00 C ATOM 447 OG1 THR A 29 -14.511 12.895 0.741 1.00 0.00 O ATOM 448 CG2 THR A 29 -16.374 12.677 -0.756 1.00 0.00 C ATOM 0 H THR A 29 -13.351 10.590 0.810 1.00 0.00 H new ATOM 0 HA THR A 29 -16.150 10.865 1.196 1.00 0.00 H new ATOM 0 HB THR A 29 -14.419 11.872 -1.080 1.00 0.00 H new ATOM 0 HG1 THR A 29 -13.556 12.693 0.826 1.00 0.00 H new ATOM 0 HG21 THR A 29 -16.136 13.633 -1.222 1.00 0.00 H new ATOM 0 HG22 THR A 29 -16.842 12.022 -1.491 1.00 0.00 H new ATOM 0 HG23 THR A 29 -17.060 12.839 0.075 1.00 0.00 H new ATOM 456 N ALA A 30 -15.065 9.216 -1.486 1.00 0.00 N ATOM 457 CA ALA A 30 -15.369 8.164 -2.397 1.00 0.00 C ATOM 458 C ALA A 30 -15.837 6.915 -1.652 1.00 0.00 C ATOM 459 O ALA A 30 -16.713 6.291 -2.077 1.00 0.00 O ATOM 460 CB ALA A 30 -14.165 7.867 -3.255 1.00 0.00 C ATOM 0 H ALA A 30 -14.121 9.589 -1.585 1.00 0.00 H new ATOM 0 HA ALA A 30 -16.186 8.484 -3.044 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -14.403 7.062 -3.950 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -13.888 8.760 -3.816 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -13.332 7.564 -2.621 1.00 0.00 H new ATOM 466 N ALA A 31 -15.198 6.580 -0.554 1.00 0.00 N ATOM 467 CA ALA A 31 -15.600 5.409 0.261 1.00 0.00 C ATOM 468 C ALA A 31 -17.062 5.449 0.645 1.00 0.00 C ATOM 469 O ALA A 31 -17.746 4.410 0.684 1.00 0.00 O ATOM 470 CB ALA A 31 -14.823 5.386 1.538 1.00 0.00 C ATOM 0 H ALA A 31 -14.394 7.090 -0.187 1.00 0.00 H new ATOM 0 HA ALA A 31 -15.407 4.529 -0.352 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -15.124 4.523 2.132 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -13.758 5.320 1.315 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -15.020 6.299 2.100 1.00 0.00 H new ATOM 476 N SER A 32 -17.526 6.633 0.935 1.00 0.00 N ATOM 477 CA SER A 32 -18.859 6.833 1.398 1.00 0.00 C ATOM 478 C SER A 32 -19.851 6.800 0.219 1.00 0.00 C ATOM 479 O SER A 32 -20.806 6.026 0.224 1.00 0.00 O ATOM 480 CB SER A 32 -18.935 8.166 2.148 1.00 0.00 C ATOM 481 OG SER A 32 -17.872 8.270 3.113 1.00 0.00 O ATOM 0 H SER A 32 -16.979 7.490 0.854 1.00 0.00 H new ATOM 0 HA SER A 32 -19.134 6.028 2.080 1.00 0.00 H new ATOM 0 HB2 SER A 32 -18.871 8.992 1.439 1.00 0.00 H new ATOM 0 HB3 SER A 32 -19.898 8.251 2.651 1.00 0.00 H new ATOM 0 HG SER A 32 -17.018 8.386 2.647 1.00 0.00 H new ATOM 487 N GLN A 33 -19.588 7.601 -0.805 1.00 0.00 N ATOM 488 CA GLN A 33 -20.469 7.778 -1.941 1.00 0.00 C ATOM 489 C GLN A 33 -20.254 6.715 -3.018 1.00 0.00 C ATOM 490 O GLN A 33 -21.164 5.979 -3.379 1.00 0.00 O ATOM 491 CB GLN A 33 -20.152 9.159 -2.540 1.00 0.00 C ATOM 492 CG GLN A 33 -20.243 10.298 -1.565 1.00 0.00 C ATOM 493 CD GLN A 33 -21.637 10.743 -1.378 1.00 0.00 C ATOM 494 OE1 GLN A 33 -22.365 10.242 -0.530 1.00 0.00 O ATOM 495 NE2 GLN A 33 -22.015 11.692 -2.156 1.00 0.00 N ATOM 0 H GLN A 33 -18.735 8.157 -0.866 1.00 0.00 H new ATOM 0 HA GLN A 33 -21.503 7.691 -1.606 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -19.146 9.136 -2.960 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -20.838 9.349 -3.366 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -19.827 9.991 -0.606 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -19.639 11.132 -1.922 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -21.368 12.074 -2.846 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -22.962 12.064 -2.084 1.00 0.00 H new ATOM 504 N TYR A 34 -19.024 6.601 -3.433 1.00 0.00 N ATOM 505 CA TYR A 34 -18.602 5.847 -4.602 1.00 0.00 C ATOM 506 C TYR A 34 -17.817 4.596 -4.188 1.00 0.00 C ATOM 507 O TYR A 34 -16.909 4.203 -4.903 1.00 0.00 O ATOM 508 CB TYR A 34 -17.652 6.760 -5.422 1.00 0.00 C ATOM 509 CG TYR A 34 -18.285 8.005 -6.009 1.00 0.00 C ATOM 510 CD1 TYR A 34 -18.968 7.955 -7.212 1.00 0.00 C ATOM 511 CD2 TYR A 34 -18.181 9.230 -5.364 1.00 0.00 C ATOM 512 CE1 TYR A 34 -19.535 9.089 -7.757 1.00 0.00 C ATOM 513 CE2 TYR A 34 -18.741 10.367 -5.904 1.00 0.00 C ATOM 514 CZ TYR A 34 -19.418 10.290 -7.100 1.00 0.00 C ATOM 515 OH TYR A 34 -19.959 11.433 -7.654 1.00 0.00 O ATOM 0 H TYR A 34 -18.245 7.048 -2.950 1.00 0.00 H new ATOM 0 HA TYR A 34 -19.477 5.541 -5.175 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -16.825 7.063 -4.780 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -17.226 6.173 -6.235 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -19.059 7.013 -7.733 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -17.653 9.293 -4.424 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -20.068 9.033 -8.695 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -18.649 11.313 -5.392 1.00 0.00 H new ATOM 0 HH TYR A 34 -19.789 12.195 -7.062 1.00 0.00 H new ATOM 525 N GLY A 35 -18.166 4.021 -3.008 1.00 0.00 N ATOM 526 CA GLY A 35 -17.505 2.819 -2.423 1.00 0.00 C ATOM 527 C GLY A 35 -16.965 1.807 -3.425 1.00 0.00 C ATOM 528 O GLY A 35 -17.611 1.527 -4.440 1.00 0.00 O ATOM 0 H GLY A 35 -18.923 4.381 -2.427 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -16.681 3.152 -1.791 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -18.220 2.314 -1.774 1.00 0.00 H new ATOM 532 N ALA A 36 -15.782 1.240 -3.103 1.00 0.00 N ATOM 533 CA ALA A 36 -15.006 0.376 -3.987 1.00 0.00 C ATOM 534 C ALA A 36 -15.758 -0.638 -4.832 1.00 0.00 C ATOM 535 O ALA A 36 -16.210 -1.667 -4.366 1.00 0.00 O ATOM 536 CB ALA A 36 -13.876 -0.284 -3.229 1.00 0.00 C ATOM 0 H ALA A 36 -15.338 1.381 -2.195 1.00 0.00 H new ATOM 0 HA ALA A 36 -14.626 1.072 -4.735 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -13.309 -0.924 -3.905 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -13.218 0.481 -2.817 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -14.285 -0.886 -2.417 1.00 0.00 H new ATOM 542 N THR A 37 -15.769 -0.278 -6.113 1.00 0.00 N ATOM 543 CA THR A 37 -16.351 -0.941 -7.271 1.00 0.00 C ATOM 544 C THR A 37 -16.652 0.128 -8.306 1.00 0.00 C ATOM 545 O THR A 37 -16.466 -0.075 -9.513 1.00 0.00 O ATOM 546 CB THR A 37 -17.561 -1.869 -6.970 1.00 0.00 C ATOM 547 OG1 THR A 37 -17.050 -3.142 -6.545 1.00 0.00 O ATOM 548 CG2 THR A 37 -18.484 -2.076 -8.164 1.00 0.00 C ATOM 0 H THR A 37 -15.314 0.591 -6.394 1.00 0.00 H new ATOM 0 HA THR A 37 -15.622 -1.652 -7.659 1.00 0.00 H new ATOM 0 HB THR A 37 -18.160 -1.387 -6.197 1.00 0.00 H new ATOM 0 HG1 THR A 37 -17.405 -3.357 -5.657 1.00 0.00 H new ATOM 0 HG21 THR A 37 -19.305 -2.734 -7.879 1.00 0.00 H new ATOM 0 HG22 THR A 37 -18.884 -1.114 -8.485 1.00 0.00 H new ATOM 0 HG23 THR A 37 -17.924 -2.528 -8.983 1.00 0.00 H new ATOM 556 N ALA A 38 -17.034 1.298 -7.820 1.00 0.00 N ATOM 557 CA ALA A 38 -17.166 2.457 -8.669 1.00 0.00 C ATOM 558 C ALA A 38 -15.762 2.842 -9.137 1.00 0.00 C ATOM 559 O ALA A 38 -14.868 3.012 -8.298 1.00 0.00 O ATOM 560 CB ALA A 38 -17.826 3.611 -7.923 1.00 0.00 C ATOM 0 H ALA A 38 -17.257 1.464 -6.839 1.00 0.00 H new ATOM 0 HA ALA A 38 -17.804 2.230 -9.523 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -17.913 4.471 -8.587 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -18.819 3.308 -7.590 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -17.219 3.880 -7.058 1.00 0.00 H new ATOM 566 N PRO A 39 -15.549 2.971 -10.475 1.00 0.00 N ATOM 567 CA PRO A 39 -14.214 3.173 -11.094 1.00 0.00 C ATOM 568 C PRO A 39 -13.378 4.293 -10.479 1.00 0.00 C ATOM 569 O PRO A 39 -12.142 4.251 -10.513 1.00 0.00 O ATOM 570 CB PRO A 39 -14.519 3.480 -12.568 1.00 0.00 C ATOM 571 CG PRO A 39 -15.997 3.681 -12.651 1.00 0.00 C ATOM 572 CD PRO A 39 -16.600 2.927 -11.504 1.00 0.00 C ATOM 0 HA PRO A 39 -13.602 2.285 -10.938 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -13.985 4.371 -12.899 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -14.200 2.660 -13.211 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -16.247 4.740 -12.592 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -16.385 3.314 -13.602 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -17.522 3.394 -11.157 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -16.847 1.902 -11.782 1.00 0.00 H new ATOM 580 N TYR A 40 -14.046 5.271 -9.927 1.00 0.00 N ATOM 581 CA TYR A 40 -13.409 6.400 -9.293 1.00 0.00 C ATOM 582 C TYR A 40 -12.499 5.978 -8.117 1.00 0.00 C ATOM 583 O TYR A 40 -11.264 6.099 -8.195 1.00 0.00 O ATOM 584 CB TYR A 40 -14.498 7.362 -8.829 1.00 0.00 C ATOM 585 CG TYR A 40 -14.024 8.624 -8.153 1.00 0.00 C ATOM 586 CD1 TYR A 40 -13.301 9.578 -8.845 1.00 0.00 C ATOM 587 CD2 TYR A 40 -14.320 8.865 -6.825 1.00 0.00 C ATOM 588 CE1 TYR A 40 -12.892 10.740 -8.233 1.00 0.00 C ATOM 589 CE2 TYR A 40 -13.921 10.032 -6.203 1.00 0.00 C ATOM 590 CZ TYR A 40 -13.203 10.966 -6.913 1.00 0.00 C ATOM 591 OH TYR A 40 -12.800 12.144 -6.311 1.00 0.00 O ATOM 0 H TYR A 40 -15.065 5.308 -9.904 1.00 0.00 H new ATOM 0 HA TYR A 40 -12.755 6.890 -10.015 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -15.100 7.641 -9.694 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -15.155 6.830 -8.141 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -13.053 9.408 -9.882 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -14.874 8.127 -6.263 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -12.327 11.474 -8.789 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -14.171 10.210 -5.167 1.00 0.00 H new ATOM 0 HH TYR A 40 -12.847 12.046 -5.337 1.00 0.00 H new ATOM 601 N THR A 41 -13.102 5.460 -7.039 1.00 0.00 N ATOM 602 CA THR A 41 -12.405 5.126 -5.814 1.00 0.00 C ATOM 603 C THR A 41 -11.199 4.172 -6.024 1.00 0.00 C ATOM 604 O THR A 41 -10.117 4.447 -5.518 1.00 0.00 O ATOM 605 CB THR A 41 -13.398 4.590 -4.738 1.00 0.00 C ATOM 606 OG1 THR A 41 -12.746 4.360 -3.494 1.00 0.00 O ATOM 607 CG2 THR A 41 -14.033 3.311 -5.187 1.00 0.00 C ATOM 0 H THR A 41 -14.102 5.263 -7.004 1.00 0.00 H new ATOM 0 HA THR A 41 -11.970 6.054 -5.443 1.00 0.00 H new ATOM 0 HB THR A 41 -14.162 5.356 -4.606 1.00 0.00 H new ATOM 0 HG1 THR A 41 -13.396 4.026 -2.841 1.00 0.00 H new ATOM 0 HG21 THR A 41 -14.721 2.957 -4.419 1.00 0.00 H new ATOM 0 HG22 THR A 41 -14.580 3.482 -6.114 1.00 0.00 H new ATOM 0 HG23 THR A 41 -13.260 2.561 -5.355 1.00 0.00 H new ATOM 615 N LEU A 42 -11.348 3.105 -6.822 1.00 0.00 N ATOM 616 CA LEU A 42 -10.221 2.196 -7.005 1.00 0.00 C ATOM 617 C LEU A 42 -9.099 2.758 -7.846 1.00 0.00 C ATOM 618 O LEU A 42 -7.962 2.335 -7.701 1.00 0.00 O ATOM 619 CB LEU A 42 -10.545 0.693 -7.301 1.00 0.00 C ATOM 620 CG LEU A 42 -11.663 0.310 -8.294 1.00 0.00 C ATOM 621 CD1 LEU A 42 -13.019 0.506 -7.672 1.00 0.00 C ATOM 622 CD2 LEU A 42 -11.555 1.081 -9.599 1.00 0.00 C ATOM 0 H LEU A 42 -12.199 2.861 -7.328 1.00 0.00 H new ATOM 0 HA LEU A 42 -9.833 2.139 -5.988 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -9.625 0.231 -7.659 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -10.787 0.223 -6.348 1.00 0.00 H new ATOM 0 HG LEU A 42 -11.537 -0.747 -8.530 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -13.792 0.230 -8.390 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -13.107 -0.121 -6.785 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -13.142 1.552 -7.390 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -12.361 0.780 -10.267 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -11.631 2.150 -9.398 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -10.595 0.868 -10.069 1.00 0.00 H new ATOM 634 N ALA A 43 -9.414 3.750 -8.682 1.00 0.00 N ATOM 635 CA ALA A 43 -8.394 4.449 -9.456 1.00 0.00 C ATOM 636 C ALA A 43 -7.525 5.240 -8.507 1.00 0.00 C ATOM 637 O ALA A 43 -6.310 5.388 -8.699 1.00 0.00 O ATOM 638 CB ALA A 43 -9.021 5.358 -10.503 1.00 0.00 C ATOM 0 H ALA A 43 -10.365 4.084 -8.838 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.785 3.720 -9.991 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -8.235 5.865 -11.063 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -9.627 4.763 -11.186 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -9.651 6.099 -10.011 1.00 0.00 H new ATOM 644 N ILE A 44 -8.147 5.707 -7.462 1.00 0.00 N ATOM 645 CA ILE A 44 -7.461 6.420 -6.423 1.00 0.00 C ATOM 646 C ILE A 44 -6.658 5.415 -5.568 1.00 0.00 C ATOM 647 O ILE A 44 -5.495 5.638 -5.298 1.00 0.00 O ATOM 648 CB ILE A 44 -8.462 7.217 -5.568 1.00 0.00 C ATOM 649 CG1 ILE A 44 -9.324 8.099 -6.478 1.00 0.00 C ATOM 650 CG2 ILE A 44 -7.729 8.085 -4.540 1.00 0.00 C ATOM 651 CD1 ILE A 44 -10.468 8.752 -5.772 1.00 0.00 C ATOM 0 H ILE A 44 -9.150 5.603 -7.306 1.00 0.00 H new ATOM 0 HA ILE A 44 -6.767 7.137 -6.862 1.00 0.00 H new ATOM 0 HB ILE A 44 -9.099 6.515 -5.030 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -8.695 8.870 -6.923 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -9.712 7.492 -7.296 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -8.456 8.639 -3.947 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -7.135 7.449 -3.884 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -7.073 8.785 -5.057 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -11.033 9.360 -6.479 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -11.120 7.987 -5.350 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -10.087 9.386 -4.971 1.00 0.00 H new ATOM 663 N VAL A 45 -7.293 4.283 -5.200 1.00 0.00 N ATOM 664 CA VAL A 45 -6.631 3.180 -4.441 1.00 0.00 C ATOM 665 C VAL A 45 -5.284 2.816 -5.075 1.00 0.00 C ATOM 666 O VAL A 45 -4.214 2.911 -4.432 1.00 0.00 O ATOM 667 CB VAL A 45 -7.521 1.878 -4.403 1.00 0.00 C ATOM 668 CG1 VAL A 45 -6.800 0.721 -3.724 1.00 0.00 C ATOM 669 CG2 VAL A 45 -8.831 2.122 -3.695 1.00 0.00 C ATOM 0 H VAL A 45 -8.273 4.100 -5.415 1.00 0.00 H new ATOM 0 HA VAL A 45 -6.486 3.547 -3.425 1.00 0.00 H new ATOM 0 HB VAL A 45 -7.718 1.613 -5.442 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -7.446 -0.157 -3.718 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.884 0.493 -4.269 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -6.554 0.997 -2.699 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -9.418 1.203 -3.688 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -8.637 2.436 -2.669 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -9.386 2.903 -4.215 1.00 0.00 H new ATOM 679 N GLU A 46 -5.326 2.455 -6.346 1.00 0.00 N ATOM 680 CA GLU A 46 -4.136 2.048 -7.050 1.00 0.00 C ATOM 681 C GLU A 46 -3.116 3.166 -7.205 1.00 0.00 C ATOM 682 O GLU A 46 -1.928 2.912 -7.087 1.00 0.00 O ATOM 683 CB GLU A 46 -4.451 1.372 -8.383 1.00 0.00 C ATOM 684 CG GLU A 46 -5.407 2.138 -9.256 1.00 0.00 C ATOM 685 CD GLU A 46 -5.555 1.537 -10.614 1.00 0.00 C ATOM 686 OE1 GLU A 46 -6.303 0.551 -10.776 1.00 0.00 O ATOM 687 OE2 GLU A 46 -4.919 2.034 -11.555 1.00 0.00 O ATOM 0 H GLU A 46 -6.177 2.438 -6.908 1.00 0.00 H new ATOM 0 HA GLU A 46 -3.664 1.298 -6.415 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -3.520 1.221 -8.929 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -4.869 0.385 -8.186 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -6.383 2.177 -8.772 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -5.059 3.166 -9.354 1.00 0.00 H new ATOM 694 N SER A 47 -3.565 4.403 -7.405 1.00 0.00 N ATOM 695 CA SER A 47 -2.633 5.505 -7.582 1.00 0.00 C ATOM 696 C SER A 47 -1.957 5.908 -6.259 1.00 0.00 C ATOM 697 O SER A 47 -0.804 6.370 -6.249 1.00 0.00 O ATOM 698 CB SER A 47 -3.300 6.694 -8.281 1.00 0.00 C ATOM 699 OG SER A 47 -4.490 7.085 -7.630 1.00 0.00 O ATOM 0 H SER A 47 -4.551 4.661 -7.448 1.00 0.00 H new ATOM 0 HA SER A 47 -1.836 5.155 -8.238 1.00 0.00 H new ATOM 0 HB2 SER A 47 -2.607 7.535 -8.308 1.00 0.00 H new ATOM 0 HB3 SER A 47 -3.521 6.430 -9.315 1.00 0.00 H new ATOM 0 HG SER A 47 -5.205 6.451 -7.847 1.00 0.00 H new ATOM 705 N VAL A 48 -2.647 5.693 -5.146 1.00 0.00 N ATOM 706 CA VAL A 48 -2.078 5.974 -3.831 1.00 0.00 C ATOM 707 C VAL A 48 -1.031 4.910 -3.473 1.00 0.00 C ATOM 708 O VAL A 48 -0.076 5.173 -2.751 1.00 0.00 O ATOM 709 CB VAL A 48 -3.177 6.094 -2.722 1.00 0.00 C ATOM 710 CG1 VAL A 48 -2.563 6.360 -1.353 1.00 0.00 C ATOM 711 CG2 VAL A 48 -4.151 7.209 -3.069 1.00 0.00 C ATOM 0 H VAL A 48 -3.599 5.326 -5.126 1.00 0.00 H new ATOM 0 HA VAL A 48 -1.586 6.946 -3.880 1.00 0.00 H new ATOM 0 HB VAL A 48 -3.708 5.143 -2.679 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.355 6.437 -0.608 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.895 5.541 -1.089 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -2.000 7.293 -1.382 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -4.911 7.284 -2.291 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -3.612 8.154 -3.141 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.629 6.990 -4.024 1.00 0.00 H new ATOM 721 N ALA A 49 -1.176 3.717 -4.021 1.00 0.00 N ATOM 722 CA ALA A 49 -0.174 2.685 -3.782 1.00 0.00 C ATOM 723 C ALA A 49 0.794 2.607 -4.947 1.00 0.00 C ATOM 724 O ALA A 49 1.631 1.727 -5.002 1.00 0.00 O ATOM 725 CB ALA A 49 -0.822 1.330 -3.542 1.00 0.00 C ATOM 0 H ALA A 49 -1.954 3.440 -4.619 1.00 0.00 H new ATOM 0 HA ALA A 49 0.378 2.957 -2.882 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -0.048 0.583 -3.367 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -1.474 1.388 -2.671 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -1.409 1.047 -4.416 1.00 0.00 H new ATOM 731 N ASP A 50 0.655 3.518 -5.888 1.00 0.00 N ATOM 732 CA ASP A 50 1.509 3.564 -7.093 1.00 0.00 C ATOM 733 C ASP A 50 2.827 4.250 -6.778 1.00 0.00 C ATOM 734 O ASP A 50 3.791 4.228 -7.546 1.00 0.00 O ATOM 735 CB ASP A 50 0.765 4.282 -8.239 1.00 0.00 C ATOM 736 CG ASP A 50 1.592 4.484 -9.492 1.00 0.00 C ATOM 737 OD1 ASP A 50 1.875 3.505 -10.217 1.00 0.00 O ATOM 738 OD2 ASP A 50 1.981 5.635 -9.765 1.00 0.00 O ATOM 0 H ASP A 50 -0.049 4.255 -5.854 1.00 0.00 H new ATOM 0 HA ASP A 50 1.730 2.546 -7.415 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -0.125 3.707 -8.495 1.00 0.00 H new ATOM 0 HB3 ASP A 50 0.425 5.254 -7.882 1.00 0.00 H new ATOM 743 N ASN A 51 2.870 4.840 -5.629 1.00 0.00 N ATOM 744 CA ASN A 51 4.048 5.529 -5.166 1.00 0.00 C ATOM 745 C ASN A 51 4.721 4.706 -4.082 1.00 0.00 C ATOM 746 O ASN A 51 4.307 3.585 -3.815 1.00 0.00 O ATOM 747 CB ASN A 51 3.731 6.962 -4.689 1.00 0.00 C ATOM 748 CG ASN A 51 2.780 7.046 -3.518 1.00 0.00 C ATOM 749 OD1 ASN A 51 3.185 6.975 -2.372 1.00 0.00 O ATOM 750 ND2 ASN A 51 1.524 7.268 -3.804 1.00 0.00 N ATOM 0 H ASN A 51 2.088 4.863 -4.974 1.00 0.00 H new ATOM 0 HA ASN A 51 4.739 5.638 -6.002 1.00 0.00 H new ATOM 0 HB2 ASN A 51 4.665 7.454 -4.416 1.00 0.00 H new ATOM 0 HB3 ASN A 51 3.308 7.522 -5.523 1.00 0.00 H new ATOM 0 HD21 ASN A 51 0.844 7.389 -3.054 1.00 0.00 H new ATOM 0 HD22 ASN A 51 1.224 7.321 -4.778 1.00 0.00 H new ATOM 757 N TRP A 52 5.750 5.240 -3.481 1.00 0.00 N ATOM 758 CA TRP A 52 6.503 4.506 -2.489 1.00 0.00 C ATOM 759 C TRP A 52 5.826 4.677 -1.151 1.00 0.00 C ATOM 760 O TRP A 52 5.639 5.794 -0.702 1.00 0.00 O ATOM 761 CB TRP A 52 7.964 5.023 -2.407 1.00 0.00 C ATOM 762 CG TRP A 52 8.765 4.912 -3.685 1.00 0.00 C ATOM 763 CD1 TRP A 52 8.305 4.622 -4.933 1.00 0.00 C ATOM 764 CD2 TRP A 52 10.177 5.121 -3.829 1.00 0.00 C ATOM 765 NE1 TRP A 52 9.324 4.630 -5.834 1.00 0.00 N ATOM 766 CE2 TRP A 52 10.487 4.936 -5.189 1.00 0.00 C ATOM 767 CE3 TRP A 52 11.206 5.443 -2.944 1.00 0.00 C ATOM 768 CZ2 TRP A 52 11.779 5.064 -5.684 1.00 0.00 C ATOM 769 CZ3 TRP A 52 12.485 5.569 -3.441 1.00 0.00 C ATOM 770 CH2 TRP A 52 12.762 5.381 -4.797 1.00 0.00 C ATOM 0 H TRP A 52 6.091 6.185 -3.659 1.00 0.00 H new ATOM 0 HA TRP A 52 6.534 3.453 -2.768 1.00 0.00 H new ATOM 0 HB2 TRP A 52 7.945 6.069 -2.100 1.00 0.00 H new ATOM 0 HB3 TRP A 52 8.483 4.471 -1.624 1.00 0.00 H new ATOM 0 HD1 TRP A 52 7.273 4.414 -5.174 1.00 0.00 H new ATOM 0 HE1 TRP A 52 9.233 4.438 -6.832 1.00 0.00 H new ATOM 0 HE3 TRP A 52 11.005 5.590 -1.893 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 11.995 4.918 -6.732 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 13.291 5.819 -2.767 1.00 0.00 H new ATOM 0 HH2 TRP A 52 13.777 5.489 -5.149 1.00 0.00 H new ATOM 781 N LEU A 53 5.412 3.607 -0.553 1.00 0.00 N ATOM 782 CA LEU A 53 4.791 3.688 0.747 1.00 0.00 C ATOM 783 C LEU A 53 5.056 2.430 1.551 1.00 0.00 C ATOM 784 O LEU A 53 5.475 1.413 0.995 1.00 0.00 O ATOM 785 CB LEU A 53 3.272 4.042 0.668 1.00 0.00 C ATOM 786 CG LEU A 53 2.271 2.989 0.139 1.00 0.00 C ATOM 787 CD1 LEU A 53 0.859 3.542 0.217 1.00 0.00 C ATOM 788 CD2 LEU A 53 2.568 2.567 -1.294 1.00 0.00 C ATOM 0 H LEU A 53 5.488 2.665 -0.936 1.00 0.00 H new ATOM 0 HA LEU A 53 5.255 4.519 1.278 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.950 4.324 1.670 1.00 0.00 H new ATOM 0 HB3 LEU A 53 3.175 4.928 0.041 1.00 0.00 H new ATOM 0 HG LEU A 53 2.372 2.105 0.769 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.156 2.798 -0.156 1.00 0.00 H new ATOM 0 HD12 LEU A 53 0.619 3.781 1.253 1.00 0.00 H new ATOM 0 HD13 LEU A 53 0.788 4.445 -0.389 1.00 0.00 H new ATOM 0 HD21 LEU A 53 1.835 1.827 -1.615 1.00 0.00 H new ATOM 0 HD22 LEU A 53 2.515 3.437 -1.948 1.00 0.00 H new ATOM 0 HD23 LEU A 53 3.567 2.135 -1.346 1.00 0.00 H new ATOM 800 N THR A 54 4.821 2.515 2.835 1.00 0.00 N ATOM 801 CA THR A 54 5.142 1.454 3.758 1.00 0.00 C ATOM 802 C THR A 54 3.877 0.670 4.128 1.00 0.00 C ATOM 803 O THR A 54 2.751 1.121 3.848 1.00 0.00 O ATOM 804 CB THR A 54 5.718 2.061 5.064 1.00 0.00 C ATOM 805 OG1 THR A 54 4.701 2.836 5.719 1.00 0.00 O ATOM 806 CG2 THR A 54 6.914 2.963 4.774 1.00 0.00 C ATOM 0 H THR A 54 4.397 3.331 3.275 1.00 0.00 H new ATOM 0 HA THR A 54 5.867 0.794 3.282 1.00 0.00 H new ATOM 0 HB THR A 54 6.046 1.241 5.703 1.00 0.00 H new ATOM 0 HG1 THR A 54 4.567 3.677 5.234 1.00 0.00 H new ATOM 0 HG21 THR A 54 7.295 3.373 5.709 1.00 0.00 H new ATOM 0 HG22 THR A 54 7.697 2.383 4.286 1.00 0.00 H new ATOM 0 HG23 THR A 54 6.605 3.778 4.120 1.00 0.00 H new ATOM 814 N PRO A 55 4.028 -0.519 4.762 1.00 0.00 N ATOM 815 CA PRO A 55 2.896 -1.243 5.345 1.00 0.00 C ATOM 816 C PRO A 55 2.198 -0.408 6.446 1.00 0.00 C ATOM 817 O PRO A 55 1.007 -0.604 6.738 1.00 0.00 O ATOM 818 CB PRO A 55 3.518 -2.519 5.946 1.00 0.00 C ATOM 819 CG PRO A 55 4.997 -2.295 5.944 1.00 0.00 C ATOM 820 CD PRO A 55 5.286 -1.290 4.865 1.00 0.00 C ATOM 0 HA PRO A 55 2.129 -1.461 4.602 1.00 0.00 H new ATOM 0 HB2 PRO A 55 3.151 -2.693 6.957 1.00 0.00 H new ATOM 0 HB3 PRO A 55 3.255 -3.397 5.356 1.00 0.00 H new ATOM 0 HG2 PRO A 55 5.333 -1.928 6.914 1.00 0.00 H new ATOM 0 HG3 PRO A 55 5.528 -3.228 5.755 1.00 0.00 H new ATOM 0 HD2 PRO A 55 6.128 -0.650 5.128 1.00 0.00 H new ATOM 0 HD3 PRO A 55 5.537 -1.775 3.922 1.00 0.00 H new ATOM 828 N THR A 56 2.941 0.533 7.024 1.00 0.00 N ATOM 829 CA THR A 56 2.430 1.427 8.037 1.00 0.00 C ATOM 830 C THR A 56 1.475 2.429 7.380 1.00 0.00 C ATOM 831 O THR A 56 0.365 2.678 7.895 1.00 0.00 O ATOM 832 CB THR A 56 3.604 2.150 8.717 1.00 0.00 C ATOM 833 OG1 THR A 56 4.571 1.152 9.098 1.00 0.00 O ATOM 834 CG2 THR A 56 3.140 2.893 9.962 1.00 0.00 C ATOM 0 H THR A 56 3.922 0.690 6.794 1.00 0.00 H new ATOM 0 HA THR A 56 1.884 0.868 8.797 1.00 0.00 H new ATOM 0 HB THR A 56 4.032 2.877 8.027 1.00 0.00 H new ATOM 0 HG1 THR A 56 5.334 1.586 9.534 1.00 0.00 H new ATOM 0 HG21 THR A 56 3.990 3.396 10.424 1.00 0.00 H new ATOM 0 HG22 THR A 56 2.388 3.632 9.686 1.00 0.00 H new ATOM 0 HG23 THR A 56 2.710 2.184 10.669 1.00 0.00 H new ATOM 842 N ASP A 57 1.898 2.962 6.214 1.00 0.00 N ATOM 843 CA ASP A 57 1.046 3.837 5.400 1.00 0.00 C ATOM 844 C ASP A 57 -0.220 3.099 5.074 1.00 0.00 C ATOM 845 O ASP A 57 -1.318 3.593 5.302 1.00 0.00 O ATOM 846 CB ASP A 57 1.715 4.264 4.073 1.00 0.00 C ATOM 847 CG ASP A 57 2.862 5.235 4.213 1.00 0.00 C ATOM 848 OD1 ASP A 57 2.630 6.446 4.286 1.00 0.00 O ATOM 849 OD2 ASP A 57 4.029 4.803 4.202 1.00 0.00 O ATOM 0 H ASP A 57 2.825 2.798 5.821 1.00 0.00 H new ATOM 0 HA ASP A 57 0.857 4.740 5.980 1.00 0.00 H new ATOM 0 HB2 ASP A 57 2.077 3.371 3.564 1.00 0.00 H new ATOM 0 HB3 ASP A 57 0.957 4.712 3.431 1.00 0.00 H new ATOM 854 N TRP A 58 -0.041 1.882 4.577 1.00 0.00 N ATOM 855 CA TRP A 58 -1.135 0.988 4.257 1.00 0.00 C ATOM 856 C TRP A 58 -2.116 0.814 5.419 1.00 0.00 C ATOM 857 O TRP A 58 -3.330 0.869 5.219 1.00 0.00 O ATOM 858 CB TRP A 58 -0.607 -0.379 3.805 1.00 0.00 C ATOM 859 CG TRP A 58 -0.020 -0.388 2.426 1.00 0.00 C ATOM 860 CD1 TRP A 58 -0.282 0.485 1.414 1.00 0.00 C ATOM 861 CD2 TRP A 58 0.881 -1.354 1.888 1.00 0.00 C ATOM 862 NE1 TRP A 58 0.428 0.142 0.299 1.00 0.00 N ATOM 863 CE2 TRP A 58 1.141 -0.981 0.557 1.00 0.00 C ATOM 864 CE3 TRP A 58 1.504 -2.492 2.403 1.00 0.00 C ATOM 865 CZ2 TRP A 58 1.987 -1.702 -0.261 1.00 0.00 C ATOM 866 CZ3 TRP A 58 2.344 -3.211 1.584 1.00 0.00 C ATOM 867 CH2 TRP A 58 2.579 -2.814 0.267 1.00 0.00 C ATOM 0 H TRP A 58 0.880 1.488 4.384 1.00 0.00 H new ATOM 0 HA TRP A 58 -1.684 1.452 3.437 1.00 0.00 H new ATOM 0 HB2 TRP A 58 0.151 -0.714 4.512 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -1.422 -1.102 3.845 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -0.954 1.327 1.483 1.00 0.00 H new ATOM 0 HE1 TRP A 58 0.422 0.650 -0.586 1.00 0.00 H new ATOM 0 HE3 TRP A 58 1.330 -2.802 3.423 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 2.174 -1.398 -1.280 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 2.829 -4.097 1.967 1.00 0.00 H new ATOM 0 HH2 TRP A 58 3.245 -3.400 -0.349 1.00 0.00 H new ATOM 878 N ASN A 59 -1.601 0.617 6.618 1.00 0.00 N ATOM 879 CA ASN A 59 -2.452 0.457 7.808 1.00 0.00 C ATOM 880 C ASN A 59 -3.384 1.654 7.959 1.00 0.00 C ATOM 881 O ASN A 59 -4.585 1.498 7.945 1.00 0.00 O ATOM 882 CB ASN A 59 -1.603 0.292 9.088 1.00 0.00 C ATOM 883 CG ASN A 59 -2.453 0.215 10.367 1.00 0.00 C ATOM 884 OD1 ASN A 59 -2.747 1.234 11.001 1.00 0.00 O ATOM 885 ND2 ASN A 59 -2.844 -0.976 10.754 1.00 0.00 N ATOM 0 H ASN A 59 -0.600 0.562 6.806 1.00 0.00 H new ATOM 0 HA ASN A 59 -3.045 -0.447 7.671 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -1.001 -0.613 9.004 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -0.910 1.130 9.169 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -3.406 -1.079 11.599 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -2.586 -1.799 10.210 1.00 0.00 H new ATOM 892 N THR A 60 -2.800 2.836 7.939 1.00 0.00 N ATOM 893 CA THR A 60 -3.578 4.037 8.214 1.00 0.00 C ATOM 894 C THR A 60 -4.495 4.407 7.031 1.00 0.00 C ATOM 895 O THR A 60 -5.584 4.957 7.228 1.00 0.00 O ATOM 896 CB THR A 60 -2.645 5.212 8.557 1.00 0.00 C ATOM 897 OG1 THR A 60 -1.687 4.769 9.531 1.00 0.00 O ATOM 898 CG2 THR A 60 -3.427 6.393 9.134 1.00 0.00 C ATOM 0 H THR A 60 -1.812 2.994 7.740 1.00 0.00 H new ATOM 0 HA THR A 60 -4.216 3.827 9.072 1.00 0.00 H new ATOM 0 HB THR A 60 -2.151 5.541 7.643 1.00 0.00 H new ATOM 0 HG1 THR A 60 -0.807 5.145 9.319 1.00 0.00 H new ATOM 0 HG21 THR A 60 -2.739 7.206 9.366 1.00 0.00 H new ATOM 0 HG22 THR A 60 -4.161 6.735 8.404 1.00 0.00 H new ATOM 0 HG23 THR A 60 -3.939 6.080 10.044 1.00 0.00 H new ATOM 906 N LEU A 61 -4.068 4.035 5.833 1.00 0.00 N ATOM 907 CA LEU A 61 -4.789 4.328 4.610 1.00 0.00 C ATOM 908 C LEU A 61 -6.149 3.635 4.658 1.00 0.00 C ATOM 909 O LEU A 61 -7.164 4.301 4.801 1.00 0.00 O ATOM 910 CB LEU A 61 -3.951 3.833 3.388 1.00 0.00 C ATOM 911 CG LEU A 61 -4.284 4.359 1.963 1.00 0.00 C ATOM 912 CD1 LEU A 61 -3.334 3.771 0.941 1.00 0.00 C ATOM 913 CD2 LEU A 61 -5.706 4.092 1.540 1.00 0.00 C ATOM 0 H LEU A 61 -3.202 3.516 5.685 1.00 0.00 H new ATOM 0 HA LEU A 61 -4.947 5.402 4.507 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -2.907 4.075 3.589 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -4.026 2.746 3.360 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.162 5.441 2.010 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -3.584 4.152 -0.049 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -2.311 4.053 1.191 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -3.422 2.685 0.945 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -5.867 4.486 0.537 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -5.891 3.018 1.542 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -6.390 4.579 2.235 1.00 0.00 H new ATOM 925 N VAL A 62 -6.135 2.296 4.649 1.00 0.00 N ATOM 926 CA VAL A 62 -7.374 1.489 4.553 1.00 0.00 C ATOM 927 C VAL A 62 -8.248 1.724 5.767 1.00 0.00 C ATOM 928 O VAL A 62 -9.465 1.831 5.681 1.00 0.00 O ATOM 929 CB VAL A 62 -7.056 -0.043 4.405 1.00 0.00 C ATOM 930 CG1 VAL A 62 -6.277 -0.594 5.600 1.00 0.00 C ATOM 931 CG2 VAL A 62 -8.322 -0.851 4.177 1.00 0.00 C ATOM 0 H VAL A 62 -5.281 1.741 4.707 1.00 0.00 H new ATOM 0 HA VAL A 62 -7.909 1.808 3.658 1.00 0.00 H new ATOM 0 HB VAL A 62 -6.419 -0.143 3.526 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -6.082 -1.656 5.449 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -5.331 -0.061 5.694 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.862 -0.458 6.510 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -8.067 -1.906 4.079 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.996 -0.718 5.023 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.812 -0.510 3.265 1.00 0.00 H new ATOM 941 N ARG A 63 -7.565 1.885 6.861 1.00 0.00 N ATOM 942 CA ARG A 63 -8.154 2.093 8.177 1.00 0.00 C ATOM 943 C ARG A 63 -9.040 3.323 8.206 1.00 0.00 C ATOM 944 O ARG A 63 -10.102 3.324 8.832 1.00 0.00 O ATOM 945 CB ARG A 63 -7.027 2.247 9.159 1.00 0.00 C ATOM 946 CG ARG A 63 -7.357 2.449 10.601 1.00 0.00 C ATOM 947 CD ARG A 63 -6.056 2.506 11.358 1.00 0.00 C ATOM 948 NE ARG A 63 -6.228 2.654 12.795 1.00 0.00 N ATOM 949 CZ ARG A 63 -5.351 2.209 13.713 1.00 0.00 C ATOM 950 NH1 ARG A 63 -4.202 1.640 13.330 1.00 0.00 N ATOM 951 NH2 ARG A 63 -5.613 2.352 15.004 1.00 0.00 N ATOM 0 H ARG A 63 -6.545 1.877 6.876 1.00 0.00 H new ATOM 0 HA ARG A 63 -8.784 1.241 8.432 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.400 1.359 9.084 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.421 3.093 8.837 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -7.922 3.371 10.740 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -7.980 1.634 10.970 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -5.489 1.597 11.159 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -5.463 3.340 10.983 1.00 0.00 H new ATOM 0 HE ARG A 63 -7.069 3.126 13.128 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -3.987 1.542 12.338 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -3.541 1.304 14.030 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -6.480 2.800 15.302 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -4.948 2.014 15.700 1.00 0.00 H new ATOM 965 N ALA A 64 -8.614 4.355 7.542 1.00 0.00 N ATOM 966 CA ALA A 64 -9.350 5.588 7.543 1.00 0.00 C ATOM 967 C ALA A 64 -10.286 5.686 6.338 1.00 0.00 C ATOM 968 O ALA A 64 -11.492 5.917 6.504 1.00 0.00 O ATOM 969 CB ALA A 64 -8.385 6.757 7.554 1.00 0.00 C ATOM 0 H ALA A 64 -7.757 4.370 6.989 1.00 0.00 H new ATOM 0 HA ALA A 64 -9.967 5.615 8.441 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -8.946 7.692 7.555 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -7.763 6.707 8.447 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -7.752 6.714 6.668 1.00 0.00 H new ATOM 975 N VAL A 65 -9.713 5.556 5.168 1.00 0.00 N ATOM 976 CA VAL A 65 -10.438 5.721 3.897 1.00 0.00 C ATOM 977 C VAL A 65 -11.799 4.966 3.830 1.00 0.00 C ATOM 978 O VAL A 65 -12.848 5.594 3.973 1.00 0.00 O ATOM 979 CB VAL A 65 -9.567 5.520 2.617 1.00 0.00 C ATOM 980 CG1 VAL A 65 -8.403 6.493 2.638 1.00 0.00 C ATOM 981 CG2 VAL A 65 -9.068 4.080 2.450 1.00 0.00 C ATOM 0 H VAL A 65 -8.725 5.331 5.051 1.00 0.00 H new ATOM 0 HA VAL A 65 -10.696 6.780 3.897 1.00 0.00 H new ATOM 0 HB VAL A 65 -10.203 5.721 1.755 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -7.795 6.352 1.744 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -8.783 7.514 2.661 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -7.794 6.312 3.523 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -8.469 4.005 1.542 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -8.459 3.804 3.311 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -9.921 3.405 2.378 1.00 0.00 H new ATOM 991 N LEU A 66 -11.803 3.664 3.638 1.00 0.00 N ATOM 992 CA LEU A 66 -13.049 2.922 3.595 1.00 0.00 C ATOM 993 C LEU A 66 -13.297 2.242 4.934 1.00 0.00 C ATOM 994 O LEU A 66 -12.509 2.409 5.887 1.00 0.00 O ATOM 995 CB LEU A 66 -13.098 1.901 2.410 1.00 0.00 C ATOM 996 CG LEU A 66 -13.371 2.451 0.970 1.00 0.00 C ATOM 997 CD1 LEU A 66 -12.273 3.348 0.442 1.00 0.00 C ATOM 998 CD2 LEU A 66 -13.618 1.321 0.016 1.00 0.00 C ATOM 0 H LEU A 66 -10.964 3.098 3.510 1.00 0.00 H new ATOM 0 HA LEU A 66 -13.854 3.634 3.411 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -12.146 1.370 2.389 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -13.869 1.165 2.637 1.00 0.00 H new ATOM 0 HG LEU A 66 -14.263 3.072 1.049 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -12.533 3.690 -0.560 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -12.158 4.209 1.101 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -11.336 2.792 0.404 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -13.806 1.721 -0.980 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -12.743 0.671 -0.013 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -14.484 0.748 0.347 1.00 0.00 H new ATOM 1010 N SER A 67 -14.378 1.502 5.035 1.00 0.00 N ATOM 1011 CA SER A 67 -14.754 0.839 6.267 1.00 0.00 C ATOM 1012 C SER A 67 -15.711 -0.301 5.996 1.00 0.00 C ATOM 1013 O SER A 67 -16.394 -0.322 4.959 1.00 0.00 O ATOM 1014 CB SER A 67 -15.405 1.834 7.247 1.00 0.00 C ATOM 1015 OG SER A 67 -14.487 2.841 7.667 1.00 0.00 O ATOM 0 H SER A 67 -15.025 1.341 4.263 1.00 0.00 H new ATOM 0 HA SER A 67 -13.845 0.439 6.717 1.00 0.00 H new ATOM 0 HB2 SER A 67 -16.266 2.303 6.770 1.00 0.00 H new ATOM 0 HB3 SER A 67 -15.777 1.295 8.118 1.00 0.00 H new ATOM 0 HG SER A 67 -13.587 2.614 7.353 1.00 0.00 H new ATOM 1021 N GLY A 68 -15.710 -1.268 6.887 1.00 0.00 N ATOM 1022 CA GLY A 68 -16.642 -2.355 6.836 1.00 0.00 C ATOM 1023 C GLY A 68 -16.157 -3.454 5.938 1.00 0.00 C ATOM 1024 O GLY A 68 -15.407 -4.342 6.360 1.00 0.00 O ATOM 0 H GLY A 68 -15.056 -1.316 7.668 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -16.800 -2.748 7.841 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -17.606 -1.992 6.480 1.00 0.00 H new ATOM 1028 N GLY A 69 -16.554 -3.375 4.689 1.00 0.00 N ATOM 1029 CA GLY A 69 -16.180 -4.357 3.707 1.00 0.00 C ATOM 1030 C GLY A 69 -14.717 -4.291 3.335 1.00 0.00 C ATOM 1031 O GLY A 69 -14.164 -5.269 2.828 1.00 0.00 O ATOM 0 H GLY A 69 -17.146 -2.626 4.328 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -16.407 -5.352 4.091 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -16.784 -4.215 2.811 1.00 0.00 H new ATOM 1035 N ASP A 70 -14.116 -3.123 3.576 1.00 0.00 N ATOM 1036 CA ASP A 70 -12.701 -2.828 3.263 1.00 0.00 C ATOM 1037 C ASP A 70 -11.835 -3.977 3.735 1.00 0.00 C ATOM 1038 O ASP A 70 -11.143 -4.622 2.955 1.00 0.00 O ATOM 1039 CB ASP A 70 -12.246 -1.470 3.925 1.00 0.00 C ATOM 1040 CG ASP A 70 -12.067 -1.510 5.452 1.00 0.00 C ATOM 1041 OD1 ASP A 70 -12.987 -1.961 6.174 1.00 0.00 O ATOM 1042 OD2 ASP A 70 -10.995 -1.191 5.945 1.00 0.00 O ATOM 0 H ASP A 70 -14.603 -2.335 4.003 1.00 0.00 H new ATOM 0 HA ASP A 70 -12.591 -2.716 2.184 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -11.303 -1.163 3.473 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -12.981 -0.702 3.682 1.00 0.00 H new ATOM 1047 N HIS A 71 -12.018 -4.289 4.976 1.00 0.00 N ATOM 1048 CA HIS A 71 -11.348 -5.321 5.663 1.00 0.00 C ATOM 1049 C HIS A 71 -11.525 -6.657 4.991 1.00 0.00 C ATOM 1050 O HIS A 71 -10.552 -7.265 4.566 1.00 0.00 O ATOM 1051 CB HIS A 71 -11.860 -5.350 7.082 1.00 0.00 C ATOM 1052 CG HIS A 71 -11.123 -4.454 8.023 1.00 0.00 C ATOM 1053 ND1 HIS A 71 -11.288 -3.092 8.052 1.00 0.00 N ATOM 1054 CD2 HIS A 71 -10.202 -4.738 8.973 1.00 0.00 C ATOM 1055 CE1 HIS A 71 -10.510 -2.576 8.973 1.00 0.00 C ATOM 1056 NE2 HIS A 71 -9.838 -3.554 9.552 1.00 0.00 N ATOM 0 H HIS A 71 -12.685 -3.792 5.567 1.00 0.00 H new ATOM 0 HA HIS A 71 -10.277 -5.121 5.655 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -12.913 -5.068 7.081 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -11.804 -6.373 7.455 1.00 0.00 H new ATOM 0 HD1 HIS A 71 -11.919 -2.563 7.450 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -9.825 -5.718 9.227 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -10.432 -1.527 9.217 1.00 0.00 H new ATOM 1065 N LEU A 72 -12.757 -7.085 4.841 1.00 0.00 N ATOM 1066 CA LEU A 72 -13.014 -8.385 4.283 1.00 0.00 C ATOM 1067 C LEU A 72 -12.408 -8.621 2.890 1.00 0.00 C ATOM 1068 O LEU A 72 -11.632 -9.538 2.730 1.00 0.00 O ATOM 1069 CB LEU A 72 -14.480 -8.887 4.497 1.00 0.00 C ATOM 1070 CG LEU A 72 -15.654 -7.936 4.169 1.00 0.00 C ATOM 1071 CD1 LEU A 72 -15.901 -7.814 2.676 1.00 0.00 C ATOM 1072 CD2 LEU A 72 -16.915 -8.385 4.884 1.00 0.00 C ATOM 0 H LEU A 72 -13.589 -6.554 5.097 1.00 0.00 H new ATOM 0 HA LEU A 72 -12.430 -9.074 4.894 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -14.610 -9.788 3.898 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -14.578 -9.182 5.542 1.00 0.00 H new ATOM 0 HG LEU A 72 -15.375 -6.945 4.527 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -16.735 -7.135 2.500 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -15.007 -7.424 2.190 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -16.139 -8.795 2.265 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -17.732 -7.705 4.643 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -17.176 -9.394 4.563 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -16.744 -8.379 5.961 1.00 0.00 H new ATOM 1084 N LEU A 73 -12.667 -7.783 1.918 1.00 0.00 N ATOM 1085 CA LEU A 73 -12.061 -8.048 0.614 1.00 0.00 C ATOM 1086 C LEU A 73 -10.688 -7.442 0.384 1.00 0.00 C ATOM 1087 O LEU A 73 -9.739 -8.195 0.099 1.00 0.00 O ATOM 1088 CB LEU A 73 -12.985 -7.880 -0.566 1.00 0.00 C ATOM 1089 CG LEU A 73 -13.733 -9.157 -1.035 1.00 0.00 C ATOM 1090 CD1 LEU A 73 -12.754 -10.250 -1.448 1.00 0.00 C ATOM 1091 CD2 LEU A 73 -14.687 -9.668 0.022 1.00 0.00 C ATOM 0 H LEU A 73 -13.257 -6.954 1.982 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.871 -9.119 0.679 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.726 -7.121 -0.316 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -12.404 -7.495 -1.404 1.00 0.00 H new ATOM 0 HG LEU A 73 -14.323 -8.879 -1.908 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -13.308 -11.131 -1.771 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -12.132 -9.891 -2.268 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -12.121 -10.511 -0.600 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -15.191 -10.562 -0.344 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -14.131 -9.910 0.928 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -15.428 -8.900 0.246 1.00 0.00 H new ATOM 1103 N TRP A 74 -10.564 -6.095 0.499 1.00 0.00 N ATOM 1104 CA TRP A 74 -9.273 -5.414 0.344 1.00 0.00 C ATOM 1105 C TRP A 74 -8.228 -6.098 1.234 1.00 0.00 C ATOM 1106 O TRP A 74 -7.124 -6.398 0.847 1.00 0.00 O ATOM 1107 CB TRP A 74 -9.335 -3.923 0.818 1.00 0.00 C ATOM 1108 CG TRP A 74 -10.028 -2.822 -0.020 1.00 0.00 C ATOM 1109 CD1 TRP A 74 -11.015 -2.892 -0.978 1.00 0.00 C ATOM 1110 CD2 TRP A 74 -9.677 -1.437 0.062 1.00 0.00 C ATOM 1111 NE1 TRP A 74 -11.321 -1.612 -1.431 1.00 0.00 N ATOM 1112 CE2 TRP A 74 -10.508 -0.709 -0.788 1.00 0.00 C ATOM 1113 CE3 TRP A 74 -8.739 -0.776 0.797 1.00 0.00 C ATOM 1114 CZ2 TRP A 74 -10.418 0.683 -0.905 1.00 0.00 C ATOM 1115 CZ3 TRP A 74 -8.622 0.617 0.694 1.00 0.00 C ATOM 1116 CH2 TRP A 74 -9.469 1.331 -0.148 1.00 0.00 C ATOM 0 H TRP A 74 -11.345 -5.470 0.698 1.00 0.00 H new ATOM 0 HA TRP A 74 -9.018 -5.459 -0.715 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -9.818 -3.924 1.795 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -8.306 -3.599 0.971 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -11.481 -3.802 -1.325 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -12.032 -1.382 -2.126 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -8.086 -1.325 1.459 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -11.072 1.230 -1.568 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -7.872 1.138 1.270 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -9.381 2.406 -0.208 1.00 0.00 H new ATOM 1127 N LYS A 75 -8.609 -6.345 2.414 1.00 0.00 N ATOM 1128 CA LYS A 75 -7.688 -6.796 3.400 1.00 0.00 C ATOM 1129 C LYS A 75 -7.442 -8.281 3.492 1.00 0.00 C ATOM 1130 O LYS A 75 -6.285 -8.675 3.751 1.00 0.00 O ATOM 1131 CB LYS A 75 -7.844 -6.066 4.696 1.00 0.00 C ATOM 1132 CG LYS A 75 -7.756 -4.559 4.488 1.00 0.00 C ATOM 1133 CD LYS A 75 -6.370 -4.120 4.007 1.00 0.00 C ATOM 1134 CE LYS A 75 -5.377 -4.151 5.182 1.00 0.00 C ATOM 1135 NZ LYS A 75 -4.036 -3.642 4.840 1.00 0.00 N ATOM 0 H LYS A 75 -9.570 -6.245 2.741 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.714 -6.499 3.012 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -8.804 -6.319 5.147 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -7.070 -6.386 5.393 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -8.506 -4.250 3.760 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -7.992 -4.051 5.423 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -6.026 -4.779 3.210 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -6.422 -3.115 3.589 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -5.782 -3.560 6.003 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -5.286 -5.176 5.542 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -3.580 -3.264 5.695 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -3.459 -4.416 4.453 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -4.122 -2.887 4.130 1.00 0.00 H new ATOM 1149 N SER A 76 -8.466 -9.128 3.269 1.00 0.00 N ATOM 1150 CA SER A 76 -8.200 -10.554 3.259 1.00 0.00 C ATOM 1151 C SER A 76 -7.190 -10.828 2.173 1.00 0.00 C ATOM 1152 O SER A 76 -6.137 -11.441 2.422 1.00 0.00 O ATOM 1153 CB SER A 76 -9.467 -11.396 3.046 1.00 0.00 C ATOM 1154 OG SER A 76 -9.200 -12.795 3.135 1.00 0.00 O ATOM 0 H SER A 76 -9.435 -8.855 3.102 1.00 0.00 H new ATOM 0 HA SER A 76 -7.812 -10.844 4.235 1.00 0.00 H new ATOM 0 HB2 SER A 76 -10.214 -11.121 3.791 1.00 0.00 H new ATOM 0 HB3 SER A 76 -9.893 -11.170 2.068 1.00 0.00 H new ATOM 0 HG SER A 76 -9.028 -13.153 2.239 1.00 0.00 H new ATOM 1160 N GLU A 77 -7.437 -10.259 1.003 1.00 0.00 N ATOM 1161 CA GLU A 77 -6.551 -10.467 -0.088 1.00 0.00 C ATOM 1162 C GLU A 77 -5.255 -9.707 0.082 1.00 0.00 C ATOM 1163 O GLU A 77 -4.308 -9.997 -0.624 1.00 0.00 O ATOM 1164 CB GLU A 77 -7.169 -10.164 -1.438 1.00 0.00 C ATOM 1165 CG GLU A 77 -8.416 -10.930 -1.742 1.00 0.00 C ATOM 1166 CD GLU A 77 -8.738 -10.952 -3.211 1.00 0.00 C ATOM 1167 OE1 GLU A 77 -7.844 -11.260 -4.024 1.00 0.00 O ATOM 1168 OE2 GLU A 77 -9.894 -10.665 -3.596 1.00 0.00 O ATOM 0 H GLU A 77 -8.238 -9.660 0.804 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.332 -11.535 -0.075 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -7.392 -9.098 -1.489 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -6.433 -10.373 -2.214 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -8.306 -11.953 -1.383 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -9.251 -10.489 -1.197 1.00 0.00 H new ATOM 1175 N PHE A 78 -5.200 -8.712 0.986 1.00 0.00 N ATOM 1176 CA PHE A 78 -3.935 -8.052 1.246 1.00 0.00 C ATOM 1177 C PHE A 78 -2.965 -9.065 1.760 1.00 0.00 C ATOM 1178 O PHE A 78 -1.872 -9.199 1.235 1.00 0.00 O ATOM 1179 CB PHE A 78 -4.096 -6.887 2.246 1.00 0.00 C ATOM 1180 CG PHE A 78 -2.791 -6.303 2.726 1.00 0.00 C ATOM 1181 CD1 PHE A 78 -1.975 -5.590 1.869 1.00 0.00 C ATOM 1182 CD2 PHE A 78 -2.386 -6.481 4.043 1.00 0.00 C ATOM 1183 CE1 PHE A 78 -0.781 -5.067 2.311 1.00 0.00 C ATOM 1184 CE2 PHE A 78 -1.193 -5.958 4.489 1.00 0.00 C ATOM 1185 CZ PHE A 78 -0.388 -5.250 3.622 1.00 0.00 C ATOM 0 H PHE A 78 -5.994 -8.366 1.525 1.00 0.00 H new ATOM 0 HA PHE A 78 -3.561 -7.620 0.318 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -4.684 -6.098 1.777 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -4.664 -7.238 3.108 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -2.277 -5.442 0.843 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -3.014 -7.036 4.724 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -0.151 -4.513 1.631 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -0.889 -6.102 5.515 1.00 0.00 H new ATOM 0 HZ PHE A 78 0.549 -4.839 3.968 1.00 0.00 H new ATOM 1195 N PHE A 79 -3.408 -9.823 2.736 1.00 0.00 N ATOM 1196 CA PHE A 79 -2.581 -10.842 3.353 1.00 0.00 C ATOM 1197 C PHE A 79 -2.316 -12.007 2.396 1.00 0.00 C ATOM 1198 O PHE A 79 -1.180 -12.538 2.316 1.00 0.00 O ATOM 1199 CB PHE A 79 -3.235 -11.329 4.645 1.00 0.00 C ATOM 1200 CG PHE A 79 -3.250 -10.286 5.732 1.00 0.00 C ATOM 1201 CD1 PHE A 79 -2.114 -10.038 6.488 1.00 0.00 C ATOM 1202 CD2 PHE A 79 -4.391 -9.554 5.991 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -2.120 -9.074 7.475 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -4.407 -8.590 6.977 1.00 0.00 C ATOM 1205 CZ PHE A 79 -3.269 -8.349 7.722 1.00 0.00 C ATOM 0 H PHE A 79 -4.348 -9.754 3.126 1.00 0.00 H new ATOM 0 HA PHE A 79 -1.614 -10.400 3.593 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.259 -11.638 4.433 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -2.704 -12.211 5.004 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -1.214 -10.606 6.302 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -5.284 -9.739 5.413 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -1.227 -8.887 8.054 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -5.307 -8.025 7.166 1.00 0.00 H new ATOM 0 HZ PHE A 79 -3.278 -7.595 8.496 1.00 0.00 H new ATOM 1215 N GLU A 80 -3.330 -12.376 1.654 1.00 0.00 N ATOM 1216 CA GLU A 80 -3.240 -13.491 0.746 1.00 0.00 C ATOM 1217 C GLU A 80 -2.329 -13.201 -0.453 1.00 0.00 C ATOM 1218 O GLU A 80 -1.445 -13.996 -0.747 1.00 0.00 O ATOM 1219 CB GLU A 80 -4.635 -13.955 0.323 1.00 0.00 C ATOM 1220 CG GLU A 80 -5.498 -14.323 1.522 1.00 0.00 C ATOM 1221 CD GLU A 80 -6.906 -14.710 1.175 1.00 0.00 C ATOM 1222 OE1 GLU A 80 -7.161 -15.908 0.920 1.00 0.00 O ATOM 1223 OE2 GLU A 80 -7.795 -13.839 1.191 1.00 0.00 O ATOM 0 H GLU A 80 -4.239 -11.913 1.662 1.00 0.00 H new ATOM 0 HA GLU A 80 -2.765 -14.314 1.280 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -5.123 -13.165 -0.247 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.546 -14.817 -0.339 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.027 -15.150 2.054 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -5.525 -13.477 2.209 1.00 0.00 H new ATOM 1230 N ASN A 81 -2.514 -12.058 -1.120 1.00 0.00 N ATOM 1231 CA ASN A 81 -1.699 -11.721 -2.299 1.00 0.00 C ATOM 1232 C ASN A 81 -0.254 -11.483 -1.970 1.00 0.00 C ATOM 1233 O ASN A 81 0.630 -11.919 -2.725 1.00 0.00 O ATOM 1234 CB ASN A 81 -2.230 -10.510 -3.107 1.00 0.00 C ATOM 1235 CG ASN A 81 -3.500 -10.776 -3.883 1.00 0.00 C ATOM 1236 OD1 ASN A 81 -3.464 -11.360 -4.956 1.00 0.00 O ATOM 1237 ND2 ASN A 81 -4.595 -10.269 -3.410 1.00 0.00 N ATOM 0 H ASN A 81 -3.211 -11.356 -0.871 1.00 0.00 H new ATOM 0 HA ASN A 81 -1.782 -12.611 -2.923 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -2.407 -9.682 -2.421 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -1.456 -10.187 -3.803 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -5.464 -10.351 -3.937 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -4.587 -9.788 -2.510 1.00 0.00 H new ATOM 1244 N CYS A 82 0.006 -10.808 -0.852 1.00 0.00 N ATOM 1245 CA CYS A 82 1.373 -10.488 -0.500 1.00 0.00 C ATOM 1246 C CYS A 82 2.173 -11.745 -0.187 1.00 0.00 C ATOM 1247 O CYS A 82 3.218 -11.991 -0.774 1.00 0.00 O ATOM 1248 CB CYS A 82 1.442 -9.476 0.654 1.00 0.00 C ATOM 1249 SG CYS A 82 0.678 -10.018 2.184 1.00 0.00 S ATOM 0 H CYS A 82 -0.700 -10.481 -0.192 1.00 0.00 H new ATOM 0 HA CYS A 82 1.829 -10.015 -1.370 1.00 0.00 H new ATOM 0 HB2 CYS A 82 2.488 -9.243 0.851 1.00 0.00 H new ATOM 0 HB3 CYS A 82 0.964 -8.550 0.335 1.00 0.00 H new ATOM 0 HG CYS A 82 -0.571 -9.658 2.197 1.00 0.00 H new ATOM 1255 N ARG A 83 1.650 -12.573 0.682 1.00 0.00 N ATOM 1256 CA ARG A 83 2.344 -13.779 1.050 1.00 0.00 C ATOM 1257 C ARG A 83 2.340 -14.829 -0.044 1.00 0.00 C ATOM 1258 O ARG A 83 3.213 -15.719 -0.072 1.00 0.00 O ATOM 1259 CB ARG A 83 1.947 -14.282 2.426 1.00 0.00 C ATOM 1260 CG ARG A 83 2.484 -13.373 3.529 1.00 0.00 C ATOM 1261 CD ARG A 83 4.010 -13.483 3.627 1.00 0.00 C ATOM 1262 NE ARG A 83 4.625 -12.421 4.443 1.00 0.00 N ATOM 1263 CZ ARG A 83 4.921 -12.512 5.738 1.00 0.00 C ATOM 1264 NH1 ARG A 83 4.457 -13.527 6.465 1.00 0.00 N ATOM 1265 NH2 ARG A 83 5.663 -11.573 6.307 1.00 0.00 N ATOM 0 H ARG A 83 0.752 -12.435 1.145 1.00 0.00 H new ATOM 0 HA ARG A 83 3.397 -13.517 1.150 1.00 0.00 H new ATOM 0 HB2 ARG A 83 0.861 -14.337 2.495 1.00 0.00 H new ATOM 0 HB3 ARG A 83 2.327 -15.293 2.569 1.00 0.00 H new ATOM 0 HG2 ARG A 83 2.201 -12.340 3.326 1.00 0.00 H new ATOM 0 HG3 ARG A 83 2.033 -13.645 4.483 1.00 0.00 H new ATOM 0 HD2 ARG A 83 4.270 -14.453 4.051 1.00 0.00 H new ATOM 0 HD3 ARG A 83 4.434 -13.450 2.623 1.00 0.00 H new ATOM 0 HE ARG A 83 4.843 -11.541 3.976 1.00 0.00 H new ATOM 0 HH11 ARG A 83 3.871 -14.240 6.030 1.00 0.00 H new ATOM 0 HH12 ARG A 83 4.687 -13.591 7.457 1.00 0.00 H new ATOM 0 HH21 ARG A 83 6.004 -10.787 5.753 1.00 0.00 H new ATOM 0 HH22 ARG A 83 5.894 -11.636 7.299 1.00 0.00 H new ATOM 1279 N ASP A 84 1.371 -14.747 -0.942 1.00 0.00 N ATOM 1280 CA ASP A 84 1.357 -15.634 -2.092 1.00 0.00 C ATOM 1281 C ASP A 84 2.579 -15.378 -2.932 1.00 0.00 C ATOM 1282 O ASP A 84 3.364 -16.283 -3.198 1.00 0.00 O ATOM 1283 CB ASP A 84 0.147 -15.435 -2.970 1.00 0.00 C ATOM 1284 CG ASP A 84 0.047 -16.528 -4.007 1.00 0.00 C ATOM 1285 OD1 ASP A 84 -0.293 -17.670 -3.650 1.00 0.00 O ATOM 1286 OD2 ASP A 84 0.351 -16.273 -5.181 1.00 0.00 O ATOM 0 H ASP A 84 0.596 -14.086 -0.898 1.00 0.00 H new ATOM 0 HA ASP A 84 1.335 -16.652 -1.703 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -0.754 -15.426 -2.357 1.00 0.00 H new ATOM 0 HB3 ASP A 84 0.206 -14.465 -3.463 1.00 0.00 H new ATOM 1291 N THR A 85 2.780 -14.130 -3.297 1.00 0.00 N ATOM 1292 CA THR A 85 3.906 -13.790 -4.122 1.00 0.00 C ATOM 1293 C THR A 85 5.200 -13.962 -3.335 1.00 0.00 C ATOM 1294 O THR A 85 6.234 -14.229 -3.911 1.00 0.00 O ATOM 1295 CB THR A 85 3.787 -12.372 -4.755 1.00 0.00 C ATOM 1296 OG1 THR A 85 4.826 -12.168 -5.745 1.00 0.00 O ATOM 1297 CG2 THR A 85 3.894 -11.273 -3.724 1.00 0.00 C ATOM 0 H THR A 85 2.182 -13.346 -3.036 1.00 0.00 H new ATOM 0 HA THR A 85 3.920 -14.481 -4.965 1.00 0.00 H new ATOM 0 HB THR A 85 2.801 -12.324 -5.218 1.00 0.00 H new ATOM 0 HG1 THR A 85 5.664 -11.931 -5.296 1.00 0.00 H new ATOM 0 HG21 THR A 85 3.805 -10.304 -4.215 1.00 0.00 H new ATOM 0 HG22 THR A 85 3.095 -11.383 -2.991 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.859 -11.338 -3.222 1.00 0.00 H new ATOM 1305 N ALA A 86 5.111 -13.860 -2.002 1.00 0.00 N ATOM 1306 CA ALA A 86 6.238 -14.116 -1.143 1.00 0.00 C ATOM 1307 C ALA A 86 6.797 -15.492 -1.410 1.00 0.00 C ATOM 1308 O ALA A 86 7.989 -15.631 -1.691 1.00 0.00 O ATOM 1309 CB ALA A 86 5.853 -13.986 0.311 1.00 0.00 C ATOM 0 H ALA A 86 4.257 -13.599 -1.508 1.00 0.00 H new ATOM 0 HA ALA A 86 7.004 -13.372 -1.361 1.00 0.00 H new ATOM 0 HB1 ALA A 86 6.723 -14.185 0.937 1.00 0.00 H new ATOM 0 HB2 ALA A 86 5.491 -12.976 0.503 1.00 0.00 H new ATOM 0 HB3 ALA A 86 5.067 -14.704 0.545 1.00 0.00 H new ATOM 1315 N LYS A 87 5.932 -16.507 -1.382 1.00 0.00 N ATOM 1316 CA LYS A 87 6.394 -17.880 -1.612 1.00 0.00 C ATOM 1317 C LYS A 87 6.900 -18.084 -3.042 1.00 0.00 C ATOM 1318 O LYS A 87 7.826 -18.869 -3.276 1.00 0.00 O ATOM 1319 CB LYS A 87 5.365 -18.969 -1.221 1.00 0.00 C ATOM 1320 CG LYS A 87 4.021 -18.918 -1.920 1.00 0.00 C ATOM 1321 CD LYS A 87 3.206 -20.166 -1.602 1.00 0.00 C ATOM 1322 CE LYS A 87 1.857 -20.170 -2.309 1.00 0.00 C ATOM 1323 NZ LYS A 87 0.916 -19.179 -1.749 1.00 0.00 N ATOM 0 H LYS A 87 4.932 -16.412 -1.207 1.00 0.00 H new ATOM 0 HA LYS A 87 7.235 -18.009 -0.931 1.00 0.00 H new ATOM 0 HB2 LYS A 87 5.812 -19.944 -1.414 1.00 0.00 H new ATOM 0 HB3 LYS A 87 5.192 -18.904 -0.147 1.00 0.00 H new ATOM 0 HG2 LYS A 87 3.474 -18.029 -1.605 1.00 0.00 H new ATOM 0 HG3 LYS A 87 4.168 -18.837 -2.997 1.00 0.00 H new ATOM 0 HD2 LYS A 87 3.771 -21.051 -1.896 1.00 0.00 H new ATOM 0 HD3 LYS A 87 3.050 -20.231 -0.525 1.00 0.00 H new ATOM 0 HE2 LYS A 87 2.007 -19.964 -3.369 1.00 0.00 H new ATOM 0 HE3 LYS A 87 1.417 -21.164 -2.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 0.077 -19.668 -1.378 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 1.380 -18.656 -0.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 0.628 -18.514 -2.495 1.00 0.00 H new ATOM 1337 N ARG A 88 6.314 -17.360 -3.993 1.00 0.00 N ATOM 1338 CA ARG A 88 6.773 -17.430 -5.401 1.00 0.00 C ATOM 1339 C ARG A 88 8.162 -16.786 -5.526 1.00 0.00 C ATOM 1340 O ARG A 88 9.033 -17.266 -6.235 1.00 0.00 O ATOM 1341 CB ARG A 88 5.804 -16.709 -6.360 1.00 0.00 C ATOM 1342 CG ARG A 88 4.514 -17.444 -6.786 1.00 0.00 C ATOM 1343 CD ARG A 88 3.720 -17.994 -5.619 1.00 0.00 C ATOM 1344 NE ARG A 88 2.276 -18.087 -5.896 1.00 0.00 N ATOM 1345 CZ ARG A 88 1.599 -19.143 -6.354 1.00 0.00 C ATOM 1346 NH1 ARG A 88 2.221 -20.170 -6.912 1.00 0.00 N ATOM 1347 NH2 ARG A 88 0.278 -19.117 -6.317 1.00 0.00 N ATOM 0 H ARG A 88 5.533 -16.725 -3.831 1.00 0.00 H new ATOM 0 HA ARG A 88 6.811 -18.483 -5.679 1.00 0.00 H new ATOM 0 HB2 ARG A 88 5.512 -15.769 -5.893 1.00 0.00 H new ATOM 0 HB3 ARG A 88 6.357 -16.457 -7.265 1.00 0.00 H new ATOM 0 HG2 ARG A 88 3.884 -16.758 -7.353 1.00 0.00 H new ATOM 0 HG3 ARG A 88 4.776 -18.263 -7.456 1.00 0.00 H new ATOM 0 HD2 ARG A 88 4.099 -18.983 -5.363 1.00 0.00 H new ATOM 0 HD3 ARG A 88 3.877 -17.357 -4.748 1.00 0.00 H new ATOM 0 HE ARG A 88 1.729 -17.245 -5.717 1.00 0.00 H new ATOM 0 HH11 ARG A 88 3.237 -20.165 -6.999 1.00 0.00 H new ATOM 0 HH12 ARG A 88 1.684 -20.966 -7.255 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -0.206 -18.300 -5.943 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -0.258 -19.914 -6.662 1.00 0.00 H new ATOM 1361 N ASN A 89 8.361 -15.734 -4.782 1.00 0.00 N ATOM 1362 CA ASN A 89 9.580 -14.963 -4.834 1.00 0.00 C ATOM 1363 C ASN A 89 10.706 -15.659 -4.057 1.00 0.00 C ATOM 1364 O ASN A 89 11.886 -15.563 -4.427 1.00 0.00 O ATOM 1365 CB ASN A 89 9.275 -13.529 -4.349 1.00 0.00 C ATOM 1366 CG ASN A 89 10.363 -12.508 -4.577 1.00 0.00 C ATOM 1367 OD1 ASN A 89 11.539 -12.760 -4.385 1.00 0.00 O ATOM 1368 ND2 ASN A 89 9.955 -11.343 -5.019 1.00 0.00 N ATOM 0 H ASN A 89 7.676 -15.381 -4.114 1.00 0.00 H new ATOM 0 HA ASN A 89 9.949 -14.892 -5.857 1.00 0.00 H new ATOM 0 HB2 ASN A 89 8.369 -13.183 -4.847 1.00 0.00 H new ATOM 0 HB3 ASN A 89 9.057 -13.566 -3.282 1.00 0.00 H new ATOM 0 HD21 ASN A 89 10.633 -10.606 -5.216 1.00 0.00 H new ATOM 0 HD22 ASN A 89 8.960 -11.173 -5.166 1.00 0.00 H new ATOM 1375 N GLN A 90 10.350 -16.424 -3.028 1.00 0.00 N ATOM 1376 CA GLN A 90 11.365 -17.151 -2.260 1.00 0.00 C ATOM 1377 C GLN A 90 11.889 -18.341 -3.043 1.00 0.00 C ATOM 1378 O GLN A 90 13.083 -18.620 -3.017 1.00 0.00 O ATOM 1379 CB GLN A 90 10.867 -17.639 -0.891 1.00 0.00 C ATOM 1380 CG GLN A 90 10.291 -16.577 0.044 1.00 0.00 C ATOM 1381 CD GLN A 90 11.017 -15.252 0.003 1.00 0.00 C ATOM 1382 OE1 GLN A 90 11.986 -15.017 0.714 1.00 0.00 O ATOM 1383 NE2 GLN A 90 10.507 -14.363 -0.791 1.00 0.00 N ATOM 0 H GLN A 90 9.390 -16.557 -2.710 1.00 0.00 H new ATOM 0 HA GLN A 90 12.164 -16.431 -2.083 1.00 0.00 H new ATOM 0 HB2 GLN A 90 10.102 -18.398 -1.057 1.00 0.00 H new ATOM 0 HB3 GLN A 90 11.697 -18.129 -0.381 1.00 0.00 H new ATOM 0 HG2 GLN A 90 9.245 -16.413 -0.213 1.00 0.00 H new ATOM 0 HG3 GLN A 90 10.313 -16.958 1.065 1.00 0.00 H new ATOM 0 HE21 GLN A 90 9.699 -14.598 -1.368 1.00 0.00 H new ATOM 0 HE22 GLN A 90 10.914 -13.429 -0.839 1.00 0.00 H new ATOM 1392 N GLN A 91 10.998 -19.021 -3.752 1.00 0.00 N ATOM 1393 CA GLN A 91 11.401 -20.180 -4.560 1.00 0.00 C ATOM 1394 C GLN A 91 12.203 -19.708 -5.769 1.00 0.00 C ATOM 1395 O GLN A 91 13.031 -20.444 -6.314 1.00 0.00 O ATOM 1396 CB GLN A 91 10.189 -21.017 -4.985 1.00 0.00 C ATOM 1397 CG GLN A 91 9.208 -20.279 -5.865 1.00 0.00 C ATOM 1398 CD GLN A 91 7.978 -21.069 -6.173 1.00 0.00 C ATOM 1399 OE1 GLN A 91 7.916 -21.786 -7.154 1.00 0.00 O ATOM 1400 NE2 GLN A 91 6.985 -20.951 -5.334 1.00 0.00 N ATOM 0 H GLN A 91 10.003 -18.800 -3.789 1.00 0.00 H new ATOM 0 HA GLN A 91 12.033 -20.827 -3.951 1.00 0.00 H new ATOM 0 HB2 GLN A 91 10.540 -21.903 -5.514 1.00 0.00 H new ATOM 0 HB3 GLN A 91 9.670 -21.364 -4.092 1.00 0.00 H new ATOM 0 HG2 GLN A 91 8.920 -19.349 -5.375 1.00 0.00 H new ATOM 0 HG3 GLN A 91 9.701 -20.009 -6.799 1.00 0.00 H new ATOM 0 HE21 GLN A 91 7.073 -20.340 -4.522 1.00 0.00 H new ATOM 0 HE22 GLN A 91 6.121 -21.470 -5.490 1.00 0.00 H new ATOM 1409 N ALA A 92 11.945 -18.473 -6.183 1.00 0.00 N ATOM 1410 CA ALA A 92 12.706 -17.847 -7.227 1.00 0.00 C ATOM 1411 C ALA A 92 14.079 -17.482 -6.666 1.00 0.00 C ATOM 1412 O ALA A 92 15.092 -17.624 -7.337 1.00 0.00 O ATOM 1413 CB ALA A 92 11.980 -16.611 -7.737 1.00 0.00 C ATOM 0 H ALA A 92 11.202 -17.889 -5.798 1.00 0.00 H new ATOM 0 HA ALA A 92 12.826 -18.529 -8.069 1.00 0.00 H new ATOM 0 HB1 ALA A 92 12.567 -16.145 -8.528 1.00 0.00 H new ATOM 0 HB2 ALA A 92 11.005 -16.898 -8.130 1.00 0.00 H new ATOM 0 HB3 ALA A 92 11.848 -15.903 -6.919 1.00 0.00 H new ATOM 1419 N GLY A 93 14.088 -17.025 -5.429 1.00 0.00 N ATOM 1420 CA GLY A 93 15.318 -16.722 -4.739 1.00 0.00 C ATOM 1421 C GLY A 93 15.696 -15.268 -4.828 1.00 0.00 C ATOM 1422 O GLY A 93 16.862 -14.921 -4.669 1.00 0.00 O ATOM 0 H GLY A 93 13.245 -16.855 -4.880 1.00 0.00 H new ATOM 0 HA2 GLY A 93 15.219 -17.003 -3.691 1.00 0.00 H new ATOM 0 HA3 GLY A 93 16.122 -17.328 -5.157 1.00 0.00 H new ATOM 1426 N ASN A 94 14.722 -14.416 -5.117 1.00 0.00 N ATOM 1427 CA ASN A 94 14.978 -12.968 -5.189 1.00 0.00 C ATOM 1428 C ASN A 94 15.061 -12.389 -3.789 1.00 0.00 C ATOM 1429 O ASN A 94 15.766 -11.425 -3.555 1.00 0.00 O ATOM 1430 CB ASN A 94 13.898 -12.210 -5.974 1.00 0.00 C ATOM 1431 CG ASN A 94 13.760 -12.584 -7.435 1.00 0.00 C ATOM 1432 OD1 ASN A 94 14.730 -12.967 -8.099 1.00 0.00 O ATOM 1433 ND2 ASN A 94 12.550 -12.481 -7.946 1.00 0.00 N ATOM 0 H ASN A 94 13.757 -14.688 -5.304 1.00 0.00 H new ATOM 0 HA ASN A 94 15.923 -12.844 -5.718 1.00 0.00 H new ATOM 0 HB2 ASN A 94 12.938 -12.373 -5.484 1.00 0.00 H new ATOM 0 HB3 ASN A 94 14.111 -11.143 -5.910 1.00 0.00 H new ATOM 0 HD21 ASN A 94 12.387 -12.722 -8.924 1.00 0.00 H new ATOM 0 HD22 ASN A 94 11.776 -12.161 -7.364 1.00 0.00 H new ATOM 1440 N GLY A 95 14.294 -12.958 -2.871 1.00 0.00 N ATOM 1441 CA GLY A 95 14.374 -12.547 -1.478 1.00 0.00 C ATOM 1442 C GLY A 95 13.445 -11.400 -1.120 1.00 0.00 C ATOM 1443 O GLY A 95 13.495 -10.863 -0.015 1.00 0.00 O ATOM 0 H GLY A 95 13.617 -13.697 -3.062 1.00 0.00 H new ATOM 0 HA2 GLY A 95 14.141 -13.402 -0.843 1.00 0.00 H new ATOM 0 HA3 GLY A 95 15.400 -12.254 -1.254 1.00 0.00 H new ATOM 1447 N TRP A 96 12.580 -11.056 -2.011 1.00 0.00 N ATOM 1448 CA TRP A 96 11.635 -9.990 -1.795 1.00 0.00 C ATOM 1449 C TRP A 96 10.336 -10.602 -1.445 1.00 0.00 C ATOM 1450 O TRP A 96 10.258 -11.811 -1.314 1.00 0.00 O ATOM 1451 CB TRP A 96 11.445 -9.115 -3.031 1.00 0.00 C ATOM 1452 CG TRP A 96 12.647 -8.366 -3.452 1.00 0.00 C ATOM 1453 CD1 TRP A 96 13.426 -7.570 -2.672 1.00 0.00 C ATOM 1454 CD2 TRP A 96 13.184 -8.294 -4.766 1.00 0.00 C ATOM 1455 NE1 TRP A 96 14.428 -7.033 -3.413 1.00 0.00 N ATOM 1456 CE2 TRP A 96 14.303 -7.458 -4.707 1.00 0.00 C ATOM 1457 CE3 TRP A 96 12.832 -8.867 -5.994 1.00 0.00 C ATOM 1458 CZ2 TRP A 96 15.071 -7.175 -5.816 1.00 0.00 C ATOM 1459 CZ3 TRP A 96 13.603 -8.582 -7.097 1.00 0.00 C ATOM 1460 CH2 TRP A 96 14.712 -7.739 -6.998 1.00 0.00 C ATOM 0 H TRP A 96 12.500 -11.505 -2.923 1.00 0.00 H new ATOM 0 HA TRP A 96 12.018 -9.351 -0.999 1.00 0.00 H new ATOM 0 HB2 TRP A 96 11.119 -9.745 -3.858 1.00 0.00 H new ATOM 0 HB3 TRP A 96 10.642 -8.405 -2.836 1.00 0.00 H new ATOM 0 HD1 TRP A 96 13.270 -7.391 -1.618 1.00 0.00 H new ATOM 0 HE1 TRP A 96 15.157 -6.412 -3.062 1.00 0.00 H new ATOM 0 HE3 TRP A 96 11.974 -9.518 -6.074 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 15.931 -6.525 -5.747 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 13.347 -9.016 -8.052 1.00 0.00 H new ATOM 0 HH2 TRP A 96 15.297 -7.531 -7.881 1.00 0.00 H new ATOM 1471 N ASP A 97 9.374 -9.784 -1.170 1.00 0.00 N ATOM 1472 CA ASP A 97 7.989 -10.206 -1.009 1.00 0.00 C ATOM 1473 C ASP A 97 7.649 -10.852 0.341 1.00 0.00 C ATOM 1474 O ASP A 97 6.535 -10.755 0.796 1.00 0.00 O ATOM 1475 CB ASP A 97 7.499 -11.086 -2.189 1.00 0.00 C ATOM 1476 CG ASP A 97 7.455 -10.365 -3.527 1.00 0.00 C ATOM 1477 OD1 ASP A 97 7.739 -9.167 -3.577 1.00 0.00 O ATOM 1478 OD2 ASP A 97 7.180 -11.033 -4.576 1.00 0.00 O ATOM 0 H ASP A 97 9.513 -8.781 -1.045 1.00 0.00 H new ATOM 0 HA ASP A 97 7.434 -9.268 -1.020 1.00 0.00 H new ATOM 0 HB2 ASP A 97 8.154 -11.953 -2.277 1.00 0.00 H new ATOM 0 HB3 ASP A 97 6.502 -11.461 -1.958 1.00 0.00 H new ATOM 1483 N PHE A 98 8.578 -11.547 0.958 1.00 0.00 N ATOM 1484 CA PHE A 98 8.272 -12.163 2.236 1.00 0.00 C ATOM 1485 C PHE A 98 8.333 -11.196 3.439 1.00 0.00 C ATOM 1486 O PHE A 98 7.304 -10.892 4.032 1.00 0.00 O ATOM 1487 CB PHE A 98 9.066 -13.461 2.469 1.00 0.00 C ATOM 1488 CG PHE A 98 8.736 -14.114 3.778 1.00 0.00 C ATOM 1489 CD1 PHE A 98 7.477 -14.649 3.985 1.00 0.00 C ATOM 1490 CD2 PHE A 98 9.666 -14.176 4.808 1.00 0.00 C ATOM 1491 CE1 PHE A 98 7.147 -15.233 5.183 1.00 0.00 C ATOM 1492 CE2 PHE A 98 9.340 -14.764 6.013 1.00 0.00 C ATOM 1493 CZ PHE A 98 8.076 -15.292 6.204 1.00 0.00 C ATOM 0 H PHE A 98 9.525 -11.699 0.612 1.00 0.00 H new ATOM 0 HA PHE A 98 7.222 -12.447 2.168 1.00 0.00 H new ATOM 0 HB2 PHE A 98 8.860 -14.159 1.657 1.00 0.00 H new ATOM 0 HB3 PHE A 98 10.133 -13.240 2.436 1.00 0.00 H new ATOM 0 HD1 PHE A 98 6.744 -14.607 3.193 1.00 0.00 H new ATOM 0 HD2 PHE A 98 10.652 -13.760 4.664 1.00 0.00 H new ATOM 0 HE1 PHE A 98 6.160 -15.647 5.327 1.00 0.00 H new ATOM 0 HE2 PHE A 98 10.071 -14.812 6.806 1.00 0.00 H new ATOM 0 HZ PHE A 98 7.816 -15.749 7.148 1.00 0.00 H new ATOM 1503 N ASP A 99 9.520 -10.764 3.817 1.00 0.00 N ATOM 1504 CA ASP A 99 9.650 -9.806 4.942 1.00 0.00 C ATOM 1505 C ASP A 99 9.569 -8.392 4.434 1.00 0.00 C ATOM 1506 O ASP A 99 9.056 -7.499 5.098 1.00 0.00 O ATOM 1507 CB ASP A 99 10.937 -10.032 5.717 1.00 0.00 C ATOM 1508 CG ASP A 99 10.953 -9.277 7.025 1.00 0.00 C ATOM 1509 OD1 ASP A 99 10.150 -9.614 7.916 1.00 0.00 O ATOM 1510 OD2 ASP A 99 11.802 -8.391 7.224 1.00 0.00 O ATOM 0 H ASP A 99 10.401 -11.042 3.385 1.00 0.00 H new ATOM 0 HA ASP A 99 8.822 -9.976 5.630 1.00 0.00 H new ATOM 0 HB2 ASP A 99 11.060 -11.097 5.912 1.00 0.00 H new ATOM 0 HB3 ASP A 99 11.786 -9.720 5.108 1.00 0.00 H new ATOM 1515 N MET A 100 10.097 -8.208 3.233 1.00 0.00 N ATOM 1516 CA MET A 100 10.117 -6.911 2.550 1.00 0.00 C ATOM 1517 C MET A 100 8.699 -6.425 2.282 1.00 0.00 C ATOM 1518 O MET A 100 8.354 -5.286 2.536 1.00 0.00 O ATOM 1519 CB MET A 100 10.883 -7.045 1.237 1.00 0.00 C ATOM 1520 CG MET A 100 12.378 -7.221 1.379 1.00 0.00 C ATOM 1521 SD MET A 100 13.172 -5.772 2.076 1.00 0.00 S ATOM 1522 CE MET A 100 14.890 -6.204 1.859 1.00 0.00 C ATOM 0 H MET A 100 10.529 -8.959 2.695 1.00 0.00 H new ATOM 0 HA MET A 100 10.613 -6.180 3.189 1.00 0.00 H new ATOM 0 HB2 MET A 100 10.484 -7.897 0.687 1.00 0.00 H new ATOM 0 HB3 MET A 100 10.693 -6.158 0.632 1.00 0.00 H new ATOM 0 HG2 MET A 100 12.581 -8.084 2.013 1.00 0.00 H new ATOM 0 HG3 MET A 100 12.811 -7.435 0.402 1.00 0.00 H new ATOM 0 HE1 MET A 100 15.411 -6.113 2.812 1.00 0.00 H new ATOM 0 HE2 MET A 100 14.965 -7.231 1.501 1.00 0.00 H new ATOM 0 HE3 MET A 100 15.345 -5.532 1.131 1.00 0.00 H new ATOM 1532 N LEU A 101 7.899 -7.312 1.803 1.00 0.00 N ATOM 1533 CA LEU A 101 6.527 -7.054 1.535 1.00 0.00 C ATOM 1534 C LEU A 101 5.728 -7.657 2.648 1.00 0.00 C ATOM 1535 O LEU A 101 5.737 -8.854 2.813 1.00 0.00 O ATOM 1536 CB LEU A 101 6.145 -7.735 0.255 1.00 0.00 C ATOM 1537 CG LEU A 101 4.664 -7.868 -0.046 1.00 0.00 C ATOM 1538 CD1 LEU A 101 3.994 -6.553 -0.350 1.00 0.00 C ATOM 1539 CD2 LEU A 101 4.463 -8.849 -1.142 1.00 0.00 C ATOM 0 H LEU A 101 8.189 -8.264 1.580 1.00 0.00 H new ATOM 0 HA LEU A 101 6.345 -5.982 1.454 1.00 0.00 H new ATOM 0 HB2 LEU A 101 6.609 -7.192 -0.568 1.00 0.00 H new ATOM 0 HB3 LEU A 101 6.579 -8.735 0.262 1.00 0.00 H new ATOM 0 HG LEU A 101 4.180 -8.234 0.860 1.00 0.00 H new ATOM 0 HD11 LEU A 101 2.937 -6.722 -0.556 1.00 0.00 H new ATOM 0 HD12 LEU A 101 4.095 -5.887 0.507 1.00 0.00 H new ATOM 0 HD13 LEU A 101 4.465 -6.098 -1.221 1.00 0.00 H new ATOM 0 HD21 LEU A 101 3.398 -8.942 -1.356 1.00 0.00 H new ATOM 0 HD22 LEU A 101 4.984 -8.507 -2.036 1.00 0.00 H new ATOM 0 HD23 LEU A 101 4.859 -9.819 -0.840 1.00 0.00 H new ATOM 1551 N THR A 102 5.146 -6.813 3.436 1.00 0.00 N ATOM 1552 CA THR A 102 4.267 -7.161 4.540 1.00 0.00 C ATOM 1553 C THR A 102 5.057 -7.738 5.738 1.00 0.00 C ATOM 1554 O THR A 102 6.255 -7.963 5.636 1.00 0.00 O ATOM 1555 CB THR A 102 3.022 -8.070 4.150 1.00 0.00 C ATOM 1556 OG1 THR A 102 1.940 -7.798 5.061 1.00 0.00 O ATOM 1557 CG2 THR A 102 3.322 -9.569 4.248 1.00 0.00 C ATOM 0 H THR A 102 5.268 -5.805 3.334 1.00 0.00 H new ATOM 0 HA THR A 102 3.821 -6.215 4.849 1.00 0.00 H new ATOM 0 HB THR A 102 2.772 -7.831 3.116 1.00 0.00 H new ATOM 0 HG1 THR A 102 1.167 -8.353 4.826 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.434 -10.137 3.970 1.00 0.00 H new ATOM 0 HG22 THR A 102 4.140 -9.821 3.573 1.00 0.00 H new ATOM 0 HG23 THR A 102 3.606 -9.817 5.271 1.00 0.00 H new ATOM 1565 N GLY A 103 4.352 -8.034 6.810 1.00 0.00 N ATOM 1566 CA GLY A 103 4.984 -8.489 8.040 1.00 0.00 C ATOM 1567 C GLY A 103 6.015 -7.488 8.541 1.00 0.00 C ATOM 1568 O GLY A 103 5.673 -6.545 9.267 1.00 0.00 O ATOM 0 H GLY A 103 3.335 -7.969 6.858 1.00 0.00 H new ATOM 0 HA2 GLY A 103 4.223 -8.643 8.805 1.00 0.00 H new ATOM 0 HA3 GLY A 103 5.464 -9.452 7.869 1.00 0.00 H new ATOM 1572 N SER A 104 7.279 -7.719 8.157 1.00 0.00 N ATOM 1573 CA SER A 104 8.405 -6.864 8.429 1.00 0.00 C ATOM 1574 C SER A 104 8.933 -7.014 9.844 1.00 0.00 C ATOM 1575 O SER A 104 8.569 -6.287 10.769 1.00 0.00 O ATOM 1576 CB SER A 104 8.161 -5.423 7.997 1.00 0.00 C ATOM 1577 OG SER A 104 7.829 -5.371 6.601 1.00 0.00 O ATOM 0 H SER A 104 7.538 -8.550 7.625 1.00 0.00 H new ATOM 0 HA SER A 104 9.222 -7.212 7.797 1.00 0.00 H new ATOM 0 HB2 SER A 104 7.352 -4.991 8.587 1.00 0.00 H new ATOM 0 HB3 SER A 104 9.051 -4.823 8.189 1.00 0.00 H new ATOM 0 HG SER A 104 8.256 -6.120 6.135 1.00 0.00 H new ATOM 1583 N GLY A 105 9.695 -8.019 9.981 1.00 0.00 N ATOM 1584 CA GLY A 105 10.284 -8.301 11.250 1.00 0.00 C ATOM 1585 C GLY A 105 11.690 -8.831 11.168 1.00 0.00 C ATOM 1586 O GLY A 105 12.354 -8.989 12.207 1.00 0.00 O ATOM 0 H GLY A 105 9.936 -8.672 9.236 1.00 0.00 H new ATOM 0 HA2 GLY A 105 10.284 -7.391 11.849 1.00 0.00 H new ATOM 0 HA3 GLY A 105 9.663 -9.027 11.774 1.00 0.00 H new ATOM 1590 N ASN A 106 12.186 -9.091 9.974 1.00 0.00 N ATOM 1591 CA ASN A 106 13.498 -9.696 9.878 1.00 0.00 C ATOM 1592 C ASN A 106 14.548 -8.725 9.391 1.00 0.00 C ATOM 1593 O ASN A 106 15.619 -8.603 10.016 1.00 0.00 O ATOM 1594 CB ASN A 106 13.496 -10.938 8.975 1.00 0.00 C ATOM 1595 CG ASN A 106 12.523 -12.016 9.404 1.00 0.00 C ATOM 1596 OD1 ASN A 106 12.171 -12.139 10.579 1.00 0.00 O ATOM 1597 ND2 ASN A 106 12.117 -12.833 8.473 1.00 0.00 N ATOM 0 H ASN A 106 11.720 -8.901 9.087 1.00 0.00 H new ATOM 0 HA ASN A 106 13.754 -9.999 10.893 1.00 0.00 H new ATOM 0 HB2 ASN A 106 13.256 -10.632 7.957 1.00 0.00 H new ATOM 0 HB3 ASN A 106 14.501 -11.359 8.953 1.00 0.00 H new ATOM 0 HD21 ASN A 106 11.489 -13.602 8.708 1.00 0.00 H new ATOM 0 HD22 ASN A 106 12.427 -12.703 7.510 1.00 0.00 H new ATOM 1604 N TYR A 107 14.250 -7.986 8.332 1.00 0.00 N ATOM 1605 CA TYR A 107 15.241 -7.054 7.779 1.00 0.00 C ATOM 1606 C TYR A 107 14.621 -6.068 6.811 1.00 0.00 C ATOM 1607 O TYR A 107 15.328 -5.409 6.065 1.00 0.00 O ATOM 1608 CB TYR A 107 16.419 -7.810 7.099 1.00 0.00 C ATOM 1609 CG TYR A 107 16.058 -8.620 5.857 1.00 0.00 C ATOM 1610 CD1 TYR A 107 15.255 -9.748 5.939 1.00 0.00 C ATOM 1611 CD2 TYR A 107 16.524 -8.245 4.603 1.00 0.00 C ATOM 1612 CE1 TYR A 107 14.932 -10.475 4.819 1.00 0.00 C ATOM 1613 CE2 TYR A 107 16.206 -8.970 3.477 1.00 0.00 C ATOM 1614 CZ TYR A 107 15.409 -10.077 3.587 1.00 0.00 C ATOM 1615 OH TYR A 107 15.093 -10.803 2.460 1.00 0.00 O ATOM 0 H TYR A 107 13.355 -8.006 7.843 1.00 0.00 H new ATOM 0 HA TYR A 107 15.636 -6.488 8.623 1.00 0.00 H new ATOM 0 HB2 TYR A 107 17.184 -7.083 6.826 1.00 0.00 H new ATOM 0 HB3 TYR A 107 16.866 -8.482 7.831 1.00 0.00 H new ATOM 0 HD1 TYR A 107 14.877 -10.061 6.901 1.00 0.00 H new ATOM 0 HD2 TYR A 107 17.148 -7.368 4.510 1.00 0.00 H new ATOM 0 HE1 TYR A 107 14.308 -11.353 4.902 1.00 0.00 H new ATOM 0 HE2 TYR A 107 16.584 -8.667 2.512 1.00 0.00 H new ATOM 0 HH TYR A 107 14.431 -10.312 1.930 1.00 0.00 H new ATOM 1625 N SER A 108 13.332 -5.924 6.873 1.00 0.00 N ATOM 1626 CA SER A 108 12.647 -5.038 5.975 1.00 0.00 C ATOM 1627 C SER A 108 12.767 -3.612 6.490 1.00 0.00 C ATOM 1628 O SER A 108 13.406 -2.750 5.863 1.00 0.00 O ATOM 1629 CB SER A 108 11.185 -5.446 5.867 1.00 0.00 C ATOM 1630 OG SER A 108 10.461 -4.618 4.981 1.00 0.00 O ATOM 0 H SER A 108 12.730 -6.409 7.538 1.00 0.00 H new ATOM 0 HA SER A 108 13.096 -5.096 4.984 1.00 0.00 H new ATOM 0 HB2 SER A 108 11.123 -6.480 5.527 1.00 0.00 H new ATOM 0 HB3 SER A 108 10.725 -5.407 6.855 1.00 0.00 H new ATOM 0 HG SER A 108 9.512 -4.628 5.226 1.00 0.00 H new ATOM 1636 N SER A 109 12.206 -3.391 7.671 1.00 0.00 N ATOM 1637 CA SER A 109 12.158 -2.096 8.311 1.00 0.00 C ATOM 1638 C SER A 109 11.511 -1.055 7.351 1.00 0.00 C ATOM 1639 O SER A 109 10.926 -1.411 6.321 1.00 0.00 O ATOM 1640 CB SER A 109 13.588 -1.680 8.679 1.00 0.00 C ATOM 1641 OG SER A 109 14.293 -2.780 9.253 1.00 0.00 O ATOM 0 H SER A 109 11.763 -4.129 8.219 1.00 0.00 H new ATOM 0 HA SER A 109 11.551 -2.144 9.215 1.00 0.00 H new ATOM 0 HB2 SER A 109 14.112 -1.328 7.790 1.00 0.00 H new ATOM 0 HB3 SER A 109 13.562 -0.849 9.384 1.00 0.00 H new ATOM 0 HG SER A 109 15.204 -2.501 9.481 1.00 0.00 H new ATOM 1647 N THR A 110 11.563 0.185 7.704 1.00 0.00 N ATOM 1648 CA THR A 110 11.143 1.218 6.798 1.00 0.00 C ATOM 1649 C THR A 110 12.289 1.486 5.805 1.00 0.00 C ATOM 1650 O THR A 110 12.085 1.855 4.640 1.00 0.00 O ATOM 1651 CB THR A 110 10.824 2.495 7.580 1.00 0.00 C ATOM 1652 OG1 THR A 110 9.973 2.156 8.689 1.00 0.00 O ATOM 1653 CG2 THR A 110 10.114 3.498 6.688 1.00 0.00 C ATOM 0 H THR A 110 11.891 0.515 8.612 1.00 0.00 H new ATOM 0 HA THR A 110 10.247 0.905 6.261 1.00 0.00 H new ATOM 0 HB THR A 110 11.752 2.941 7.937 1.00 0.00 H new ATOM 0 HG1 THR A 110 9.763 2.966 9.199 1.00 0.00 H new ATOM 0 HG21 THR A 110 9.894 4.400 7.258 1.00 0.00 H new ATOM 0 HG22 THR A 110 10.754 3.750 5.843 1.00 0.00 H new ATOM 0 HG23 THR A 110 9.183 3.064 6.322 1.00 0.00 H new ATOM 1661 N ASP A 111 13.490 1.224 6.277 1.00 0.00 N ATOM 1662 CA ASP A 111 14.708 1.526 5.557 1.00 0.00 C ATOM 1663 C ASP A 111 14.882 0.718 4.263 1.00 0.00 C ATOM 1664 O ASP A 111 14.982 1.298 3.193 1.00 0.00 O ATOM 1665 CB ASP A 111 15.928 1.316 6.460 1.00 0.00 C ATOM 1666 CG ASP A 111 17.218 1.825 5.826 1.00 0.00 C ATOM 1667 OD1 ASP A 111 17.791 1.143 4.970 1.00 0.00 O ATOM 1668 OD2 ASP A 111 17.668 2.941 6.179 1.00 0.00 O ATOM 0 H ASP A 111 13.649 0.789 7.186 1.00 0.00 H new ATOM 0 HA ASP A 111 14.627 2.573 5.264 1.00 0.00 H new ATOM 0 HB2 ASP A 111 15.766 1.828 7.409 1.00 0.00 H new ATOM 0 HB3 ASP A 111 16.031 0.254 6.684 1.00 0.00 H new ATOM 1673 N ALA A 112 14.785 -0.602 4.335 1.00 0.00 N ATOM 1674 CA ALA A 112 15.245 -1.424 3.227 1.00 0.00 C ATOM 1675 C ALA A 112 14.337 -1.286 2.054 1.00 0.00 C ATOM 1676 O ALA A 112 14.775 -1.311 0.897 1.00 0.00 O ATOM 1677 CB ALA A 112 15.404 -2.875 3.635 1.00 0.00 C ATOM 0 H ALA A 112 14.402 -1.116 5.128 1.00 0.00 H new ATOM 0 HA ALA A 112 16.231 -1.064 2.934 1.00 0.00 H new ATOM 0 HB1 ALA A 112 15.749 -3.457 2.781 1.00 0.00 H new ATOM 0 HB2 ALA A 112 16.133 -2.948 4.442 1.00 0.00 H new ATOM 0 HB3 ALA A 112 14.445 -3.264 3.976 1.00 0.00 H new ATOM 1683 N GLN A 113 13.089 -1.077 2.342 1.00 0.00 N ATOM 1684 CA GLN A 113 12.135 -0.901 1.319 1.00 0.00 C ATOM 1685 C GLN A 113 12.105 0.493 0.737 1.00 0.00 C ATOM 1686 O GLN A 113 11.755 0.663 -0.426 1.00 0.00 O ATOM 1687 CB GLN A 113 10.756 -1.460 1.677 1.00 0.00 C ATOM 1688 CG GLN A 113 10.214 -1.282 3.105 1.00 0.00 C ATOM 1689 CD GLN A 113 9.487 0.045 3.377 1.00 0.00 C ATOM 1690 OE1 GLN A 113 9.938 1.129 2.815 1.00 0.00 O flip ATOM 1691 NE2 GLN A 113 8.558 0.089 4.159 1.00 0.00 N flip ATOM 0 H GLN A 113 12.716 -1.026 3.290 1.00 0.00 H new ATOM 0 HA GLN A 113 12.486 -1.522 0.495 1.00 0.00 H new ATOM 0 HB2 GLN A 113 10.034 -1.010 0.995 1.00 0.00 H new ATOM 0 HB3 GLN A 113 10.772 -2.529 1.465 1.00 0.00 H new ATOM 0 HG2 GLN A 113 9.529 -2.102 3.320 1.00 0.00 H new ATOM 0 HG3 GLN A 113 11.046 -1.370 3.804 1.00 0.00 H new ATOM 0 HE21 GLN A 113 8.215 -0.768 4.592 1.00 0.00 H new ATOM 0 HE22 GLN A 113 8.121 0.983 4.382 1.00 0.00 H new ATOM 1700 N MET A 114 12.499 1.513 1.520 1.00 0.00 N ATOM 1701 CA MET A 114 12.491 2.858 0.979 1.00 0.00 C ATOM 1702 C MET A 114 13.712 3.047 0.126 1.00 0.00 C ATOM 1703 O MET A 114 13.803 3.980 -0.645 1.00 0.00 O ATOM 1704 CB MET A 114 12.380 3.950 2.067 1.00 0.00 C ATOM 1705 CG MET A 114 13.626 4.203 2.897 1.00 0.00 C ATOM 1706 SD MET A 114 13.361 5.505 4.126 1.00 0.00 S ATOM 1707 CE MET A 114 15.009 5.657 4.821 1.00 0.00 C ATOM 0 H MET A 114 12.812 1.427 2.487 1.00 0.00 H new ATOM 0 HA MET A 114 11.595 2.972 0.369 1.00 0.00 H new ATOM 0 HB2 MET A 114 12.094 4.885 1.585 1.00 0.00 H new ATOM 0 HB3 MET A 114 11.569 3.679 2.742 1.00 0.00 H new ATOM 0 HG2 MET A 114 13.921 3.282 3.401 1.00 0.00 H new ATOM 0 HG3 MET A 114 14.449 4.485 2.240 1.00 0.00 H new ATOM 0 HE1 MET A 114 15.053 6.536 5.464 1.00 0.00 H new ATOM 0 HE2 MET A 114 15.240 4.767 5.407 1.00 0.00 H new ATOM 0 HE3 MET A 114 15.736 5.760 4.015 1.00 0.00 H new ATOM 1717 N GLN A 115 14.640 2.126 0.274 1.00 0.00 N ATOM 1718 CA GLN A 115 15.813 2.103 -0.533 1.00 0.00 C ATOM 1719 C GLN A 115 15.525 1.592 -1.939 1.00 0.00 C ATOM 1720 O GLN A 115 16.351 1.783 -2.844 1.00 0.00 O ATOM 1721 CB GLN A 115 16.979 1.414 0.169 1.00 0.00 C ATOM 1722 CG GLN A 115 17.906 2.409 0.876 1.00 0.00 C ATOM 1723 CD GLN A 115 17.165 3.424 1.728 1.00 0.00 C ATOM 1724 OE1 GLN A 115 16.789 4.495 1.253 1.00 0.00 O ATOM 1725 NE2 GLN A 115 16.971 3.130 2.963 1.00 0.00 N ATOM 0 H GLN A 115 14.590 1.376 0.963 1.00 0.00 H new ATOM 0 HA GLN A 115 16.145 3.132 -0.672 1.00 0.00 H new ATOM 0 HB2 GLN A 115 16.591 0.702 0.898 1.00 0.00 H new ATOM 0 HB3 GLN A 115 17.553 0.843 -0.561 1.00 0.00 H new ATOM 0 HG2 GLN A 115 18.605 1.858 1.506 1.00 0.00 H new ATOM 0 HG3 GLN A 115 18.498 2.937 0.128 1.00 0.00 H new ATOM 0 HE21 GLN A 115 17.293 2.235 3.331 1.00 0.00 H new ATOM 0 HE22 GLN A 115 16.495 3.792 3.576 1.00 0.00 H new ATOM 1734 N TYR A 116 14.358 0.931 -2.104 1.00 0.00 N ATOM 1735 CA TYR A 116 13.780 0.622 -3.390 1.00 0.00 C ATOM 1736 C TYR A 116 14.505 -0.426 -4.213 1.00 0.00 C ATOM 1737 O TYR A 116 15.690 -0.307 -4.565 1.00 0.00 O ATOM 1738 CB TYR A 116 13.517 1.906 -4.207 1.00 0.00 C ATOM 1739 CG TYR A 116 13.073 1.687 -5.653 1.00 0.00 C ATOM 1740 CD1 TYR A 116 11.739 1.494 -5.972 1.00 0.00 C ATOM 1741 CD2 TYR A 116 14.004 1.671 -6.694 1.00 0.00 C ATOM 1742 CE1 TYR A 116 11.344 1.298 -7.281 1.00 0.00 C ATOM 1743 CE2 TYR A 116 13.614 1.474 -7.996 1.00 0.00 C ATOM 1744 CZ TYR A 116 12.287 1.285 -8.284 1.00 0.00 C ATOM 1745 OH TYR A 116 11.897 1.082 -9.584 1.00 0.00 O ATOM 0 H TYR A 116 13.796 0.600 -1.320 1.00 0.00 H new ATOM 0 HA TYR A 116 12.830 0.146 -3.148 1.00 0.00 H new ATOM 0 HB2 TYR A 116 12.753 2.491 -3.695 1.00 0.00 H new ATOM 0 HB3 TYR A 116 14.427 2.505 -4.212 1.00 0.00 H new ATOM 0 HD1 TYR A 116 10.998 1.497 -5.187 1.00 0.00 H new ATOM 0 HD2 TYR A 116 15.051 1.816 -6.471 1.00 0.00 H new ATOM 0 HE1 TYR A 116 10.300 1.156 -7.517 1.00 0.00 H new ATOM 0 HE2 TYR A 116 14.348 1.468 -8.788 1.00 0.00 H new ATOM 0 HH TYR A 116 12.683 1.103 -10.169 1.00 0.00 H new ATOM 1755 N ASP A 117 13.763 -1.444 -4.524 1.00 0.00 N ATOM 1756 CA ASP A 117 14.138 -2.436 -5.476 1.00 0.00 C ATOM 1757 C ASP A 117 12.987 -2.583 -6.433 1.00 0.00 C ATOM 1758 O ASP A 117 11.830 -2.667 -5.987 1.00 0.00 O ATOM 1759 CB ASP A 117 14.494 -3.782 -4.835 1.00 0.00 C ATOM 1760 CG ASP A 117 15.880 -3.794 -4.215 1.00 0.00 C ATOM 1761 OD1 ASP A 117 16.866 -4.073 -4.944 1.00 0.00 O ATOM 1762 OD2 ASP A 117 16.014 -3.525 -3.011 1.00 0.00 O ATOM 0 H ASP A 117 12.848 -1.610 -4.105 1.00 0.00 H new ATOM 0 HA ASP A 117 15.045 -2.117 -5.989 1.00 0.00 H new ATOM 0 HB2 ASP A 117 13.757 -4.020 -4.068 1.00 0.00 H new ATOM 0 HB3 ASP A 117 14.433 -4.566 -5.590 1.00 0.00 H new ATOM 1767 N PRO A 118 13.254 -2.603 -7.756 1.00 0.00 N ATOM 1768 CA PRO A 118 12.207 -2.645 -8.801 1.00 0.00 C ATOM 1769 C PRO A 118 11.266 -3.824 -8.671 1.00 0.00 C ATOM 1770 O PRO A 118 10.092 -3.720 -9.011 1.00 0.00 O ATOM 1771 CB PRO A 118 13.007 -2.763 -10.099 1.00 0.00 C ATOM 1772 CG PRO A 118 14.316 -2.162 -9.776 1.00 0.00 C ATOM 1773 CD PRO A 118 14.604 -2.582 -8.370 1.00 0.00 C ATOM 0 HA PRO A 118 11.562 -1.769 -8.741 1.00 0.00 H new ATOM 0 HB2 PRO A 118 13.112 -3.803 -10.408 1.00 0.00 H new ATOM 0 HB3 PRO A 118 12.518 -2.235 -10.917 1.00 0.00 H new ATOM 0 HG2 PRO A 118 15.090 -2.514 -10.458 1.00 0.00 H new ATOM 0 HG3 PRO A 118 14.283 -1.076 -9.864 1.00 0.00 H new ATOM 0 HD2 PRO A 118 15.083 -3.560 -8.329 1.00 0.00 H new ATOM 0 HD3 PRO A 118 15.268 -1.880 -7.865 1.00 0.00 H new ATOM 1781 N GLY A 119 11.738 -4.888 -8.057 1.00 0.00 N ATOM 1782 CA GLY A 119 10.942 -6.084 -7.990 1.00 0.00 C ATOM 1783 C GLY A 119 10.079 -6.053 -6.766 1.00 0.00 C ATOM 1784 O GLY A 119 8.970 -6.566 -6.751 1.00 0.00 O ATOM 0 H GLY A 119 12.651 -4.946 -7.607 1.00 0.00 H new ATOM 0 HA2 GLY A 119 10.321 -6.168 -8.882 1.00 0.00 H new ATOM 0 HA3 GLY A 119 11.589 -6.961 -7.968 1.00 0.00 H new ATOM 1788 N LEU A 120 10.548 -5.330 -5.768 1.00 0.00 N ATOM 1789 CA LEU A 120 9.838 -5.233 -4.539 1.00 0.00 C ATOM 1790 C LEU A 120 8.739 -4.227 -4.711 1.00 0.00 C ATOM 1791 O LEU A 120 7.588 -4.477 -4.358 1.00 0.00 O ATOM 1792 CB LEU A 120 10.762 -4.824 -3.400 1.00 0.00 C ATOM 1793 CG LEU A 120 10.078 -4.634 -2.063 1.00 0.00 C ATOM 1794 CD1 LEU A 120 9.437 -5.944 -1.601 1.00 0.00 C ATOM 1795 CD2 LEU A 120 11.057 -4.087 -1.041 1.00 0.00 C ATOM 0 H LEU A 120 11.422 -4.805 -5.799 1.00 0.00 H new ATOM 0 HA LEU A 120 9.421 -6.207 -4.281 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.538 -5.582 -3.291 1.00 0.00 H new ATOM 0 HB3 LEU A 120 11.261 -3.894 -3.672 1.00 0.00 H new ATOM 0 HG LEU A 120 9.278 -3.901 -2.172 1.00 0.00 H new ATOM 0 HD11 LEU A 120 8.949 -5.791 -0.638 1.00 0.00 H new ATOM 0 HD12 LEU A 120 8.698 -6.266 -2.335 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.206 -6.710 -1.500 1.00 0.00 H new ATOM 0 HD21 LEU A 120 10.550 -3.956 -0.085 1.00 0.00 H new ATOM 0 HD22 LEU A 120 11.885 -4.786 -0.920 1.00 0.00 H new ATOM 0 HD23 LEU A 120 11.441 -3.126 -1.383 1.00 0.00 H new ATOM 1807 N PHE A 121 9.108 -3.073 -5.274 1.00 0.00 N ATOM 1808 CA PHE A 121 8.167 -2.033 -5.613 1.00 0.00 C ATOM 1809 C PHE A 121 7.061 -2.586 -6.518 1.00 0.00 C ATOM 1810 O PHE A 121 5.905 -2.209 -6.383 1.00 0.00 O ATOM 1811 CB PHE A 121 8.880 -0.859 -6.277 1.00 0.00 C ATOM 1812 CG PHE A 121 7.960 0.254 -6.679 1.00 0.00 C ATOM 1813 CD1 PHE A 121 7.321 1.014 -5.719 1.00 0.00 C ATOM 1814 CD2 PHE A 121 7.720 0.525 -8.014 1.00 0.00 C ATOM 1815 CE1 PHE A 121 6.461 2.023 -6.077 1.00 0.00 C ATOM 1816 CE2 PHE A 121 6.858 1.536 -8.380 1.00 0.00 C ATOM 1817 CZ PHE A 121 6.231 2.287 -7.409 1.00 0.00 C ATOM 0 H PHE A 121 10.075 -2.845 -5.503 1.00 0.00 H new ATOM 0 HA PHE A 121 7.705 -1.671 -4.695 1.00 0.00 H new ATOM 0 HB2 PHE A 121 9.632 -0.468 -5.592 1.00 0.00 H new ATOM 0 HB3 PHE A 121 9.409 -1.218 -7.160 1.00 0.00 H new ATOM 0 HD1 PHE A 121 7.500 0.812 -4.673 1.00 0.00 H new ATOM 0 HD2 PHE A 121 8.212 -0.061 -8.776 1.00 0.00 H new ATOM 0 HE1 PHE A 121 5.966 2.608 -5.316 1.00 0.00 H new ATOM 0 HE2 PHE A 121 6.674 1.739 -9.425 1.00 0.00 H new ATOM 0 HZ PHE A 121 5.559 3.083 -7.693 1.00 0.00 H new ATOM 1827 N ALA A 122 7.428 -3.503 -7.403 1.00 0.00 N ATOM 1828 CA ALA A 122 6.478 -4.143 -8.287 1.00 0.00 C ATOM 1829 C ALA A 122 5.404 -4.864 -7.491 1.00 0.00 C ATOM 1830 O ALA A 122 4.198 -4.594 -7.671 1.00 0.00 O ATOM 1831 CB ALA A 122 7.175 -5.117 -9.217 1.00 0.00 C ATOM 0 H ALA A 122 8.390 -3.820 -7.524 1.00 0.00 H new ATOM 0 HA ALA A 122 6.007 -3.366 -8.888 1.00 0.00 H new ATOM 0 HB1 ALA A 122 6.440 -5.585 -9.871 1.00 0.00 H new ATOM 0 HB2 ALA A 122 7.909 -4.582 -9.820 1.00 0.00 H new ATOM 0 HB3 ALA A 122 7.678 -5.885 -8.629 1.00 0.00 H new ATOM 1837 N GLN A 123 5.819 -5.753 -6.585 1.00 0.00 N ATOM 1838 CA GLN A 123 4.848 -6.505 -5.820 1.00 0.00 C ATOM 1839 C GLN A 123 4.113 -5.714 -4.757 1.00 0.00 C ATOM 1840 O GLN A 123 2.940 -5.971 -4.551 1.00 0.00 O ATOM 1841 CB GLN A 123 5.354 -7.823 -5.257 1.00 0.00 C ATOM 1842 CG GLN A 123 5.448 -8.961 -6.266 1.00 0.00 C ATOM 1843 CD GLN A 123 6.543 -8.800 -7.273 1.00 0.00 C ATOM 1844 OE1 GLN A 123 6.344 -8.234 -8.356 1.00 0.00 O ATOM 1845 NE2 GLN A 123 7.689 -9.297 -6.935 1.00 0.00 N ATOM 0 H GLN A 123 6.795 -5.959 -6.374 1.00 0.00 H new ATOM 0 HA GLN A 123 4.115 -6.752 -6.588 1.00 0.00 H new ATOM 0 HB2 GLN A 123 6.340 -7.660 -4.823 1.00 0.00 H new ATOM 0 HB3 GLN A 123 4.695 -8.131 -4.445 1.00 0.00 H new ATOM 0 HG2 GLN A 123 5.599 -9.897 -5.728 1.00 0.00 H new ATOM 0 HG3 GLN A 123 4.497 -9.045 -6.791 1.00 0.00 H new ATOM 0 HE21 GLN A 123 7.800 -9.754 -6.030 1.00 0.00 H new ATOM 0 HE22 GLN A 123 8.481 -9.232 -7.574 1.00 0.00 H new ATOM 1854 N ILE A 124 4.768 -4.766 -4.074 1.00 0.00 N ATOM 1855 CA ILE A 124 4.065 -3.968 -3.050 1.00 0.00 C ATOM 1856 C ILE A 124 2.903 -3.181 -3.656 1.00 0.00 C ATOM 1857 O ILE A 124 1.801 -3.167 -3.113 1.00 0.00 O ATOM 1858 CB ILE A 124 5.004 -3.023 -2.185 1.00 0.00 C ATOM 1859 CG1 ILE A 124 5.871 -2.127 -3.054 1.00 0.00 C ATOM 1860 CG2 ILE A 124 5.890 -3.834 -1.244 1.00 0.00 C ATOM 1861 CD1 ILE A 124 6.657 -1.065 -2.293 1.00 0.00 C ATOM 0 H ILE A 124 5.753 -4.534 -4.202 1.00 0.00 H new ATOM 0 HA ILE A 124 3.669 -4.701 -2.347 1.00 0.00 H new ATOM 0 HB ILE A 124 4.343 -2.389 -1.595 1.00 0.00 H new ATOM 0 HG12 ILE A 124 6.573 -2.751 -3.608 1.00 0.00 H new ATOM 0 HG13 ILE A 124 5.236 -1.632 -3.788 1.00 0.00 H new ATOM 0 HG21 ILE A 124 6.521 -3.159 -0.666 1.00 0.00 H new ATOM 0 HG22 ILE A 124 5.265 -4.416 -0.567 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.518 -4.508 -1.826 1.00 0.00 H new ATOM 0 HD11 ILE A 124 7.246 -0.475 -2.995 1.00 0.00 H new ATOM 0 HD12 ILE A 124 5.965 -0.412 -1.761 1.00 0.00 H new ATOM 0 HD13 ILE A 124 7.323 -1.548 -1.578 1.00 0.00 H new ATOM 1873 N GLN A 125 3.148 -2.620 -4.816 1.00 0.00 N ATOM 1874 CA GLN A 125 2.185 -1.821 -5.554 1.00 0.00 C ATOM 1875 C GLN A 125 0.998 -2.735 -5.968 1.00 0.00 C ATOM 1876 O GLN A 125 -0.196 -2.494 -5.602 1.00 0.00 O ATOM 1877 CB GLN A 125 2.933 -1.294 -6.805 1.00 0.00 C ATOM 1878 CG GLN A 125 2.440 -0.027 -7.466 1.00 0.00 C ATOM 1879 CD GLN A 125 1.031 -0.066 -7.907 1.00 0.00 C ATOM 1880 OE1 GLN A 125 0.188 0.440 -7.087 1.00 0.00 O flip ATOM 1881 NE2 GLN A 125 0.723 -0.494 -9.011 1.00 0.00 N flip ATOM 0 H GLN A 125 4.047 -2.706 -5.290 1.00 0.00 H new ATOM 0 HA GLN A 125 1.789 -0.993 -4.967 1.00 0.00 H new ATOM 0 HB2 GLN A 125 3.975 -1.137 -6.525 1.00 0.00 H new ATOM 0 HB3 GLN A 125 2.920 -2.085 -7.555 1.00 0.00 H new ATOM 0 HG2 GLN A 125 2.565 0.802 -6.769 1.00 0.00 H new ATOM 0 HG3 GLN A 125 3.071 0.185 -8.330 1.00 0.00 H new ATOM 0 HE21 GLN A 125 1.438 -0.887 -9.623 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -0.249 -0.458 -9.319 1.00 0.00 H new ATOM 1890 N ALA A 126 1.350 -3.812 -6.666 1.00 0.00 N ATOM 1891 CA ALA A 126 0.395 -4.751 -7.218 1.00 0.00 C ATOM 1892 C ALA A 126 -0.428 -5.448 -6.148 1.00 0.00 C ATOM 1893 O ALA A 126 -1.638 -5.513 -6.262 1.00 0.00 O ATOM 1894 CB ALA A 126 1.109 -5.774 -8.088 1.00 0.00 C ATOM 0 H ALA A 126 2.321 -4.054 -6.863 1.00 0.00 H new ATOM 0 HA ALA A 126 -0.302 -4.177 -7.828 1.00 0.00 H new ATOM 0 HB1 ALA A 126 0.381 -6.475 -8.497 1.00 0.00 H new ATOM 0 HB2 ALA A 126 1.621 -5.264 -8.904 1.00 0.00 H new ATOM 0 HB3 ALA A 126 1.838 -6.318 -7.487 1.00 0.00 H new ATOM 1900 N ALA A 127 0.233 -5.929 -5.090 1.00 0.00 N ATOM 1901 CA ALA A 127 -0.447 -6.686 -4.042 1.00 0.00 C ATOM 1902 C ALA A 127 -1.444 -5.829 -3.323 1.00 0.00 C ATOM 1903 O ALA A 127 -2.537 -6.300 -2.978 1.00 0.00 O ATOM 1904 CB ALA A 127 0.541 -7.274 -3.041 1.00 0.00 C ATOM 0 H ALA A 127 1.234 -5.807 -4.940 1.00 0.00 H new ATOM 0 HA ALA A 127 -0.970 -7.508 -4.531 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -0.003 -7.830 -2.277 1.00 0.00 H new ATOM 0 HB2 ALA A 127 1.227 -7.944 -3.558 1.00 0.00 H new ATOM 0 HB3 ALA A 127 1.106 -6.469 -2.571 1.00 0.00 H new ATOM 1910 N ALA A 128 -1.085 -4.563 -3.127 1.00 0.00 N ATOM 1911 CA ALA A 128 -1.940 -3.669 -2.422 1.00 0.00 C ATOM 1912 C ALA A 128 -3.235 -3.450 -3.164 1.00 0.00 C ATOM 1913 O ALA A 128 -4.231 -3.879 -2.706 1.00 0.00 O ATOM 1914 CB ALA A 128 -1.244 -2.347 -2.146 1.00 0.00 C ATOM 0 H ALA A 128 -0.209 -4.154 -3.452 1.00 0.00 H new ATOM 0 HA ALA A 128 -2.178 -4.130 -1.463 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -1.921 -1.685 -1.607 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.353 -2.524 -1.543 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.958 -1.883 -3.090 1.00 0.00 H new ATOM 1920 N THR A 129 -3.207 -2.888 -4.336 1.00 0.00 N ATOM 1921 CA THR A 129 -4.511 -2.628 -5.001 1.00 0.00 C ATOM 1922 C THR A 129 -5.321 -3.934 -5.327 1.00 0.00 C ATOM 1923 O THR A 129 -6.615 -3.937 -5.263 1.00 0.00 O ATOM 1924 CB THR A 129 -4.390 -1.697 -6.253 1.00 0.00 C ATOM 1925 OG1 THR A 129 -5.676 -1.503 -6.883 1.00 0.00 O ATOM 1926 CG2 THR A 129 -3.395 -2.233 -7.271 1.00 0.00 C ATOM 0 H THR A 129 -2.371 -2.606 -4.848 1.00 0.00 H new ATOM 0 HA THR A 129 -5.093 -2.083 -4.258 1.00 0.00 H new ATOM 0 HB THR A 129 -4.020 -0.737 -5.893 1.00 0.00 H new ATOM 0 HG1 THR A 129 -5.598 -1.675 -7.845 1.00 0.00 H new ATOM 0 HG21 THR A 129 -3.344 -1.554 -8.122 1.00 0.00 H new ATOM 0 HG22 THR A 129 -2.410 -2.312 -6.811 1.00 0.00 H new ATOM 0 HG23 THR A 129 -3.717 -3.218 -7.611 1.00 0.00 H new ATOM 1934 N LYS A 130 -4.576 -5.062 -5.519 1.00 0.00 N ATOM 1935 CA LYS A 130 -5.135 -6.345 -5.971 1.00 0.00 C ATOM 1936 C LYS A 130 -5.989 -6.910 -4.865 1.00 0.00 C ATOM 1937 O LYS A 130 -6.847 -7.727 -5.075 1.00 0.00 O ATOM 1938 CB LYS A 130 -3.993 -7.309 -6.324 1.00 0.00 C ATOM 1939 CG LYS A 130 -4.384 -8.514 -7.173 1.00 0.00 C ATOM 1940 CD LYS A 130 -3.179 -9.431 -7.443 1.00 0.00 C ATOM 1941 CE LYS A 130 -2.029 -8.723 -8.185 1.00 0.00 C ATOM 1942 NZ LYS A 130 -2.407 -8.240 -9.534 1.00 0.00 N ATOM 0 H LYS A 130 -3.569 -5.093 -5.360 1.00 0.00 H new ATOM 0 HA LYS A 130 -5.747 -6.202 -6.862 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -3.221 -6.750 -6.853 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -3.547 -7.670 -5.397 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -5.166 -9.079 -6.665 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -4.802 -8.172 -8.120 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -2.806 -9.818 -6.495 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -3.508 -10.288 -8.030 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -1.687 -7.878 -7.587 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -1.188 -9.410 -8.276 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -1.590 -7.774 -9.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -2.707 -9.045 -10.120 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -3.190 -7.561 -9.453 1.00 0.00 H new ATOM 1956 N ALA A 131 -5.656 -6.528 -3.694 1.00 0.00 N ATOM 1957 CA ALA A 131 -6.405 -6.719 -2.529 1.00 0.00 C ATOM 1958 C ALA A 131 -7.423 -5.599 -2.392 1.00 0.00 C ATOM 1959 O ALA A 131 -8.633 -5.838 -2.492 1.00 0.00 O ATOM 1960 CB ALA A 131 -5.404 -6.680 -1.439 1.00 0.00 C ATOM 0 H ALA A 131 -4.781 -6.034 -3.518 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.967 -7.653 -2.522 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.904 -6.822 -0.481 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -4.673 -7.474 -1.588 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.898 -5.715 -1.444 1.00 0.00 H new ATOM 1966 N TRP A 132 -6.907 -4.376 -2.307 1.00 0.00 N ATOM 1967 CA TRP A 132 -7.627 -3.152 -1.943 1.00 0.00 C ATOM 1968 C TRP A 132 -8.676 -2.656 -2.980 1.00 0.00 C ATOM 1969 O TRP A 132 -8.899 -1.478 -3.128 1.00 0.00 O ATOM 1970 CB TRP A 132 -6.667 -1.999 -1.550 1.00 0.00 C ATOM 1971 CG TRP A 132 -5.748 -2.329 -0.394 1.00 0.00 C ATOM 1972 CD1 TRP A 132 -5.268 -3.536 -0.109 1.00 0.00 C ATOM 1973 CD2 TRP A 132 -5.211 -1.463 0.618 1.00 0.00 C ATOM 1974 NE1 TRP A 132 -4.400 -3.504 0.873 1.00 0.00 N ATOM 1975 CE2 TRP A 132 -4.349 -2.260 1.376 1.00 0.00 C ATOM 1976 CE3 TRP A 132 -5.330 -0.105 0.958 1.00 0.00 C ATOM 1977 CZ2 TRP A 132 -3.623 -1.770 2.404 1.00 0.00 C ATOM 1978 CZ3 TRP A 132 -4.610 0.353 1.994 1.00 0.00 C ATOM 1979 CH2 TRP A 132 -3.769 -0.471 2.697 1.00 0.00 C ATOM 0 H TRP A 132 -5.921 -4.199 -2.500 1.00 0.00 H new ATOM 0 HA TRP A 132 -8.204 -3.453 -1.068 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -6.062 -1.732 -2.417 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -7.258 -1.120 -1.291 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -5.559 -4.438 -0.627 1.00 0.00 H new ATOM 0 HE1 TRP A 132 -3.851 -4.298 1.203 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -5.982 0.552 0.402 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -2.951 -2.401 2.968 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -4.695 1.391 2.280 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -3.203 -0.057 3.518 1.00 0.00 H new ATOM 1990 N ARG A 133 -9.241 -3.528 -3.733 1.00 0.00 N ATOM 1991 CA ARG A 133 -10.428 -3.163 -4.524 1.00 0.00 C ATOM 1992 C ARG A 133 -11.796 -3.874 -4.165 1.00 0.00 C ATOM 1993 O ARG A 133 -12.825 -3.211 -4.087 1.00 0.00 O ATOM 1994 CB ARG A 133 -10.144 -3.192 -6.042 1.00 0.00 C ATOM 1995 CG ARG A 133 -11.356 -2.839 -6.936 1.00 0.00 C ATOM 1996 CD ARG A 133 -12.264 -4.029 -7.168 1.00 0.00 C ATOM 1997 NE ARG A 133 -13.644 -3.658 -7.543 1.00 0.00 N ATOM 1998 CZ ARG A 133 -14.194 -3.806 -8.765 1.00 0.00 C ATOM 1999 NH1 ARG A 133 -13.432 -3.966 -9.849 1.00 0.00 N ATOM 2000 NH2 ARG A 133 -15.513 -3.755 -8.895 1.00 0.00 N ATOM 0 H ARG A 133 -8.930 -4.494 -3.839 1.00 0.00 H new ATOM 0 HA ARG A 133 -10.609 -2.135 -4.210 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -9.335 -2.495 -6.259 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -9.789 -4.187 -6.312 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -11.926 -2.035 -6.471 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -11.000 -2.464 -7.895 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -11.838 -4.652 -7.954 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -12.293 -4.635 -6.262 1.00 0.00 H new ATOM 0 HE ARG A 133 -14.232 -3.255 -6.814 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -12.416 -3.978 -9.761 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -13.866 -4.077 -10.766 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -16.101 -3.605 -8.075 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -15.939 -3.866 -9.815 1.00 0.00 H new ATOM 2014 N LYS A 134 -11.760 -5.177 -3.939 1.00 0.00 N ATOM 2015 CA LYS A 134 -12.966 -6.127 -4.048 1.00 0.00 C ATOM 2016 C LYS A 134 -14.258 -5.945 -3.203 1.00 0.00 C ATOM 2017 O LYS A 134 -14.872 -6.932 -2.806 1.00 0.00 O ATOM 2018 CB LYS A 134 -12.534 -7.583 -4.049 1.00 0.00 C ATOM 2019 CG LYS A 134 -12.166 -8.102 -5.417 1.00 0.00 C ATOM 2020 CD LYS A 134 -11.056 -7.303 -6.043 1.00 0.00 C ATOM 2021 CE LYS A 134 -9.780 -7.429 -5.268 1.00 0.00 C ATOM 2022 NZ LYS A 134 -9.242 -8.787 -5.338 1.00 0.00 N ATOM 0 H LYS A 134 -10.902 -5.658 -3.668 1.00 0.00 H new ATOM 0 HA LYS A 134 -13.337 -5.775 -5.010 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -11.679 -7.700 -3.383 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -13.341 -8.193 -3.643 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -11.862 -9.146 -5.339 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -13.043 -8.073 -6.064 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -10.896 -7.642 -7.066 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -11.348 -6.254 -6.097 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -9.045 -6.725 -5.658 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -9.958 -7.160 -4.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -8.230 -8.772 -5.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -9.748 -9.396 -4.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -9.365 -9.160 -6.301 1.00 0.00 H new ATOM 2036 N LEU A 135 -14.706 -4.772 -3.000 1.00 0.00 N ATOM 2037 CA LEU A 135 -15.930 -4.564 -2.209 1.00 0.00 C ATOM 2038 C LEU A 135 -17.200 -4.608 -3.071 1.00 0.00 C ATOM 2039 O LEU A 135 -17.107 -4.649 -4.295 1.00 0.00 O ATOM 2040 CB LEU A 135 -15.829 -3.255 -1.470 1.00 0.00 C ATOM 2041 CG LEU A 135 -15.164 -3.289 -0.097 1.00 0.00 C ATOM 2042 CD1 LEU A 135 -13.945 -4.176 -0.093 1.00 0.00 C ATOM 2043 CD2 LEU A 135 -14.755 -1.900 0.238 1.00 0.00 C ATOM 0 H LEU A 135 -14.273 -3.919 -3.353 1.00 0.00 H new ATOM 0 HA LEU A 135 -16.014 -5.384 -1.496 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -15.279 -2.553 -2.096 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -16.836 -2.854 -1.350 1.00 0.00 H new ATOM 0 HG LEU A 135 -15.868 -3.689 0.633 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -13.498 -4.176 0.901 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -14.234 -5.192 -0.361 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -13.221 -3.802 -0.817 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -14.275 -1.888 1.216 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -14.055 -1.535 -0.514 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -15.635 -1.256 0.258 1.00 0.00 H new ATOM 2055 N PRO A 136 -18.410 -4.668 -2.435 1.00 0.00 N ATOM 2056 CA PRO A 136 -19.712 -4.634 -3.145 1.00 0.00 C ATOM 2057 C PRO A 136 -19.989 -3.243 -3.809 1.00 0.00 C ATOM 2058 O PRO A 136 -19.140 -2.695 -4.477 1.00 0.00 O ATOM 2059 CB PRO A 136 -20.727 -4.921 -2.002 1.00 0.00 C ATOM 2060 CG PRO A 136 -19.919 -5.553 -0.934 1.00 0.00 C ATOM 2061 CD PRO A 136 -18.615 -4.842 -0.982 1.00 0.00 C ATOM 0 HA PRO A 136 -19.762 -5.345 -3.970 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -21.199 -4.003 -1.651 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -21.526 -5.582 -2.338 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -20.395 -5.444 0.041 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -19.795 -6.621 -1.110 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -18.652 -3.887 -0.458 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -17.816 -5.425 -0.525 1.00 0.00 H new ATOM 2069 N VAL A 137 -21.171 -2.677 -3.597 1.00 0.00 N ATOM 2070 CA VAL A 137 -21.545 -1.425 -4.257 1.00 0.00 C ATOM 2071 C VAL A 137 -22.151 -0.507 -3.199 1.00 0.00 C ATOM 2072 O VAL A 137 -22.757 -0.990 -2.245 1.00 0.00 O ATOM 2073 CB VAL A 137 -22.588 -1.658 -5.418 1.00 0.00 C ATOM 2074 CG1 VAL A 137 -22.933 -0.361 -6.145 1.00 0.00 C ATOM 2075 CG2 VAL A 137 -22.083 -2.686 -6.418 1.00 0.00 C ATOM 0 H VAL A 137 -21.885 -3.060 -2.978 1.00 0.00 H new ATOM 0 HA VAL A 137 -20.658 -0.981 -4.708 1.00 0.00 H new ATOM 0 HB VAL A 137 -23.495 -2.038 -4.947 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -23.654 -0.568 -6.936 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -23.363 0.349 -5.438 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -22.029 0.064 -6.580 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -22.825 -2.823 -7.205 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -21.148 -2.338 -6.857 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -21.913 -3.635 -5.910 1.00 0.00 H new ATOM 2085 N LYS A 138 -21.934 0.781 -3.302 1.00 0.00 N ATOM 2086 CA LYS A 138 -22.529 1.701 -2.362 1.00 0.00 C ATOM 2087 C LYS A 138 -23.880 2.220 -2.798 1.00 0.00 C ATOM 2088 O LYS A 138 -23.974 3.140 -3.604 1.00 0.00 O ATOM 2089 CB LYS A 138 -21.600 2.869 -2.007 1.00 0.00 C ATOM 2090 CG LYS A 138 -20.605 2.588 -0.922 1.00 0.00 C ATOM 2091 CD LYS A 138 -21.267 2.485 0.434 1.00 0.00 C ATOM 2092 CE LYS A 138 -20.220 2.350 1.507 1.00 0.00 C ATOM 2093 NZ LYS A 138 -19.477 1.078 1.411 1.00 0.00 N ATOM 0 H LYS A 138 -21.355 1.214 -4.021 1.00 0.00 H new ATOM 0 HA LYS A 138 -22.687 1.107 -1.462 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -21.059 3.168 -2.905 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -22.211 3.720 -1.705 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -20.080 1.658 -1.142 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -19.856 3.380 -0.902 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -21.877 3.369 0.618 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -21.937 1.625 0.457 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -19.520 3.183 1.435 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -20.696 2.417 2.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -18.878 0.962 2.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -20.149 0.287 1.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -18.880 1.088 0.560 1.00 0.00 H new ATOM 2107 N GLY A 139 -24.899 1.571 -2.324 1.00 0.00 N ATOM 2108 CA GLY A 139 -26.237 2.075 -2.441 1.00 0.00 C ATOM 2109 C GLY A 139 -26.578 2.636 -1.098 1.00 0.00 C ATOM 2110 O GLY A 139 -26.236 3.778 -0.797 1.00 0.00 O ATOM 0 H GLY A 139 -24.828 0.674 -1.843 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -26.300 2.842 -3.213 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -26.931 1.282 -2.722 1.00 0.00 H new ATOM 2114 N ASP A 140 -27.176 1.840 -0.269 1.00 0.00 N ATOM 2115 CA ASP A 140 -27.338 2.193 1.118 1.00 0.00 C ATOM 2116 C ASP A 140 -26.925 1.014 1.939 1.00 0.00 C ATOM 2117 O ASP A 140 -27.717 0.073 2.098 1.00 0.00 O ATOM 2118 CB ASP A 140 -28.748 2.621 1.486 1.00 0.00 C ATOM 2119 CG ASP A 140 -28.853 2.990 2.958 1.00 0.00 C ATOM 2120 OD1 ASP A 140 -28.329 4.057 3.360 1.00 0.00 O ATOM 2121 OD2 ASP A 140 -29.485 2.245 3.735 1.00 0.00 O ATOM 2122 OXT ASP A 140 -25.771 0.974 2.366 1.00 0.00 O ATOM 0 H ASP A 140 -27.565 0.933 -0.525 1.00 0.00 H new ATOM 0 HA ASP A 140 -26.713 3.064 1.317 1.00 0.00 H new ATOM 0 HB2 ASP A 140 -29.042 3.474 0.874 1.00 0.00 H new ATOM 0 HB3 ASP A 140 -29.445 1.813 1.262 1.00 0.00 H new TER 2127 ASP A 140