USER MOD reduce.3.24.130724 H: found=0, std=0, add=859, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 849 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 99 HIS : no HD1:sc= 0.84 K(o=-0.31,f=-6.4!) USER MOD Set 1.2: B 105 A O2' : rot 51:sc= -1.15 USER MOD Set 2.1: A 72 MET CE :methyl -142:sc= -1.64 (180deg=-3.83!) USER MOD Set 2.2: A 89 MET CE :methyl 168:sc= -1.23 (180deg=-0.327) USER MOD Set 3.1: A 36 LYS NZ :NH3+ -117:sc= 1.49 (180deg=-0.308) USER MOD Set 3.2: A 37 TYR OH : rot 9:sc= 1.36 USER MOD Set 4.1: A 26 SER OG : rot 180:sc= 0.26 USER MOD Set 4.2: A 29 THR OG1 : rot 86:sc= 0.275 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 MET CE :methyl 165:sc= -0.2 (180deg=-0.782) USER MOD Single : A 14 THR OG1 : rot 110:sc= -1.37 USER MOD Single : A 15 SER OG : rot 17:sc= 1.56 USER MOD Single : A 17 LYS NZ :NH3+ -167:sc= 2.69 (180deg=2.39) USER MOD Single : A 20 ASN : amide:sc= -1.83! C(o=-1.8!,f=-5.6!) USER MOD Single : A 22 THR OG1 : rot 164:sc= 1.23 USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 TYR OH : rot 180:sc= -0.0973 USER MOD Single : A 50 TYR OH : rot 180:sc= -0.0472 USER MOD Single : A 51 THR OG1 : rot 180:sc= -0.545 USER MOD Single : A 52 LYS NZ :NH3+ -130:sc= 0.217 (180deg=-0.331) USER MOD Single : A 54 SER OG : rot 180:sc= 0.0731 USER MOD Single : A 63 HIS :FLIP no HD1:sc= -0.731 F(o=-3,f=-0.73) USER MOD Single : A 65 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.026) USER MOD Single : A 75 MET CE :methyl 171:sc= -3.85! (180deg=-4.01) USER MOD Single : A 88 GLN : amide:sc= 0.572 K(o=0.57,f=-5.8!) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 100 HIS : no HD1:sc= -0.0213 X(o=-0.021,f=0) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : B 102 U O2' : rot 154:sc= 0.441 USER MOD Single : B 102 U O5' : rot 180:sc= 0 USER MOD Single : B 103 G O2' : rot 60:sc= 0.601 USER MOD Single : B 104 G O2' : rot -170:sc= -0.926 USER MOD Single : B 106 G O2' : rot -5:sc= 0.0707 USER MOD Single : B 107 U O2' : rot 180:sc= 0 USER MOD Single : B 107 U O3' : rot 132:sc= -0.928 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -13.167 20.614 4.665 1.00 0.00 N ATOM 2 CA MET A 1 -13.819 19.384 4.175 1.00 0.00 C ATOM 3 C MET A 1 -12.772 18.337 3.811 1.00 0.00 C ATOM 4 O MET A 1 -12.085 18.470 2.802 1.00 0.00 O ATOM 5 CB MET A 1 -14.723 19.694 2.977 1.00 0.00 C ATOM 6 CG MET A 1 -15.394 18.427 2.449 1.00 0.00 C ATOM 7 SD MET A 1 -16.415 17.565 3.670 1.00 0.00 S ATOM 8 CE MET A 1 -16.942 16.164 2.654 1.00 0.00 C ATOM 0 H1 MET A 1 -13.893 21.318 4.909 1.00 0.00 H new ATOM 0 H2 MET A 1 -12.600 20.394 5.509 1.00 0.00 H new ATOM 0 H3 MET A 1 -12.548 20.998 3.923 1.00 0.00 H new ATOM 0 HA MET A 1 -14.443 18.980 4.972 1.00 0.00 H new ATOM 0 HB2 MET A 1 -15.484 20.417 3.270 1.00 0.00 H new ATOM 0 HB3 MET A 1 -14.135 20.155 2.184 1.00 0.00 H new ATOM 0 HG2 MET A 1 -16.015 18.688 1.592 1.00 0.00 H new ATOM 0 HG3 MET A 1 -14.624 17.745 2.089 1.00 0.00 H new ATOM 0 HE1 MET A 1 -17.588 15.511 3.241 1.00 0.00 H new ATOM 0 HE2 MET A 1 -17.489 16.530 1.785 1.00 0.00 H new ATOM 0 HE3 MET A 1 -16.067 15.605 2.322 1.00 0.00 H new ATOM 18 N SER A 2 -12.650 17.293 4.635 1.00 0.00 N ATOM 19 CA SER A 2 -11.721 16.197 4.390 1.00 0.00 C ATOM 20 C SER A 2 -12.046 15.518 3.063 1.00 0.00 C ATOM 21 O SER A 2 -13.217 15.395 2.703 1.00 0.00 O ATOM 22 CB SER A 2 -11.803 15.194 5.540 1.00 0.00 C ATOM 23 OG SER A 2 -11.549 15.852 6.764 1.00 0.00 O ATOM 0 H SER A 2 -13.195 17.188 5.491 1.00 0.00 H new ATOM 0 HA SER A 2 -10.706 16.589 4.333 1.00 0.00 H new ATOM 0 HB2 SER A 2 -12.790 14.732 5.562 1.00 0.00 H new ATOM 0 HB3 SER A 2 -11.079 14.393 5.389 1.00 0.00 H new ATOM 0 HG SER A 2 -11.604 15.207 7.500 1.00 0.00 H new ATOM 29 N TYR A 3 -11.008 15.077 2.343 1.00 0.00 N ATOM 30 CA TYR A 3 -11.122 14.459 1.025 1.00 0.00 C ATOM 31 C TYR A 3 -11.981 15.279 0.061 1.00 0.00 C ATOM 32 O TYR A 3 -12.469 14.752 -0.937 1.00 0.00 O ATOM 33 CB TYR A 3 -11.636 13.028 1.170 1.00 0.00 C ATOM 34 CG TYR A 3 -10.828 12.194 2.144 1.00 0.00 C ATOM 35 CD1 TYR A 3 -11.086 12.297 3.520 1.00 0.00 C ATOM 36 CD2 TYR A 3 -9.822 11.337 1.678 1.00 0.00 C ATOM 37 CE1 TYR A 3 -10.342 11.537 4.435 1.00 0.00 C ATOM 38 CE2 TYR A 3 -9.073 10.573 2.586 1.00 0.00 C ATOM 39 CZ TYR A 3 -9.332 10.673 3.968 1.00 0.00 C ATOM 40 OH TYR A 3 -8.602 9.936 4.855 1.00 0.00 O ATOM 0 H TYR A 3 -10.045 15.143 2.672 1.00 0.00 H new ATOM 0 HA TYR A 3 -10.128 14.432 0.580 1.00 0.00 H new ATOM 0 HB2 TYR A 3 -12.674 13.055 1.500 1.00 0.00 H new ATOM 0 HB3 TYR A 3 -11.625 12.545 0.193 1.00 0.00 H new ATOM 0 HD1 TYR A 3 -11.859 12.963 3.875 1.00 0.00 H new ATOM 0 HD2 TYR A 3 -9.623 11.264 0.619 1.00 0.00 H new ATOM 0 HE1 TYR A 3 -10.543 11.614 5.493 1.00 0.00 H new ATOM 0 HE2 TYR A 3 -8.300 9.910 2.227 1.00 0.00 H new ATOM 0 HH TYR A 3 -7.948 9.392 4.368 1.00 0.00 H new ATOM 50 N GLY A 4 -12.175 16.569 0.353 1.00 0.00 N ATOM 51 CA GLY A 4 -12.996 17.463 -0.445 1.00 0.00 C ATOM 52 C GLY A 4 -12.199 18.022 -1.620 1.00 0.00 C ATOM 53 O GLY A 4 -11.952 19.224 -1.685 1.00 0.00 O ATOM 0 H GLY A 4 -11.756 17.021 1.165 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -13.871 16.929 -0.814 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -13.361 18.281 0.176 1.00 0.00 H new ATOM 57 N ARG A 5 -11.802 17.133 -2.540 1.00 0.00 N ATOM 58 CA ARG A 5 -11.013 17.442 -3.734 1.00 0.00 C ATOM 59 C ARG A 5 -9.853 18.417 -3.502 1.00 0.00 C ATOM 60 O ARG A 5 -9.718 19.389 -4.251 1.00 0.00 O ATOM 61 CB ARG A 5 -11.900 17.850 -4.908 1.00 0.00 C ATOM 62 CG ARG A 5 -12.912 18.918 -4.525 1.00 0.00 C ATOM 63 CD ARG A 5 -13.824 19.152 -5.711 1.00 0.00 C ATOM 64 NE ARG A 5 -13.126 19.821 -6.811 1.00 0.00 N ATOM 65 CZ ARG A 5 -13.617 19.964 -8.043 1.00 0.00 C ATOM 66 NH1 ARG A 5 -14.818 19.483 -8.359 1.00 0.00 N ATOM 67 NH2 ARG A 5 -12.903 20.589 -8.974 1.00 0.00 N ATOM 0 H ARG A 5 -12.032 16.142 -2.468 1.00 0.00 H new ATOM 0 HA ARG A 5 -10.522 16.506 -4.002 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -11.275 18.220 -5.721 1.00 0.00 H new ATOM 0 HB3 ARG A 5 -12.426 16.973 -5.285 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -13.490 18.600 -3.658 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -12.404 19.842 -4.248 1.00 0.00 H new ATOM 0 HD2 ARG A 5 -14.220 18.198 -6.059 1.00 0.00 H new ATOM 0 HD3 ARG A 5 -14.676 19.756 -5.400 1.00 0.00 H new ATOM 0 HE ARG A 5 -12.200 20.204 -6.622 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -15.375 18.998 -7.655 1.00 0.00 H new ATOM 0 HH12 ARG A 5 -15.181 19.599 -9.305 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -11.980 20.959 -8.746 1.00 0.00 H new ATOM 0 HH22 ARG A 5 -13.278 20.699 -9.916 1.00 0.00 H new ATOM 81 N PRO A 6 -9.003 18.196 -2.488 1.00 0.00 N ATOM 82 CA PRO A 6 -7.816 19.004 -2.283 1.00 0.00 C ATOM 83 C PRO A 6 -6.810 18.678 -3.387 1.00 0.00 C ATOM 84 O PRO A 6 -6.840 17.577 -3.936 1.00 0.00 O ATOM 85 CB PRO A 6 -7.291 18.595 -0.908 1.00 0.00 C ATOM 86 CG PRO A 6 -7.736 17.139 -0.788 1.00 0.00 C ATOM 87 CD PRO A 6 -9.090 17.143 -1.493 1.00 0.00 C ATOM 0 HA PRO A 6 -8.005 20.077 -2.321 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -6.207 18.692 -0.845 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -7.713 19.212 -0.115 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -7.032 16.459 -1.268 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -7.822 16.826 0.253 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -9.294 16.179 -1.958 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -9.899 17.334 -0.788 1.00 0.00 H new ATOM 95 N PRO A 7 -5.915 19.616 -3.723 1.00 0.00 N ATOM 96 CA PRO A 7 -4.918 19.430 -4.764 1.00 0.00 C ATOM 97 C PRO A 7 -3.834 18.448 -4.306 1.00 0.00 C ATOM 98 O PRO A 7 -3.107 18.740 -3.353 1.00 0.00 O ATOM 99 CB PRO A 7 -4.342 20.825 -5.013 1.00 0.00 C ATOM 100 CG PRO A 7 -4.519 21.534 -3.671 1.00 0.00 C ATOM 101 CD PRO A 7 -5.817 20.939 -3.133 1.00 0.00 C ATOM 0 HA PRO A 7 -5.342 19.004 -5.673 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -3.293 20.779 -5.306 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -4.874 21.341 -5.812 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -3.680 21.344 -3.001 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -4.591 22.615 -3.793 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -5.801 20.882 -2.045 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -6.674 21.555 -3.407 1.00 0.00 H new ATOM 109 N PRO A 8 -3.710 17.290 -4.968 1.00 0.00 N ATOM 110 CA PRO A 8 -2.677 16.304 -4.690 1.00 0.00 C ATOM 111 C PRO A 8 -1.377 16.699 -5.395 1.00 0.00 C ATOM 112 O PRO A 8 -1.214 17.840 -5.827 1.00 0.00 O ATOM 113 CB PRO A 8 -3.248 15.003 -5.253 1.00 0.00 C ATOM 114 CG PRO A 8 -3.984 15.488 -6.502 1.00 0.00 C ATOM 115 CD PRO A 8 -4.562 16.831 -6.053 1.00 0.00 C ATOM 0 HA PRO A 8 -2.434 16.216 -3.631 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -2.464 14.285 -5.495 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -3.921 14.515 -4.548 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -3.310 15.601 -7.351 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -4.766 14.792 -6.807 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -4.568 17.548 -6.874 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -5.594 16.720 -5.719 1.00 0.00 H new ATOM 123 N ASP A 9 -0.447 15.749 -5.517 1.00 0.00 N ATOM 124 CA ASP A 9 0.835 15.959 -6.173 1.00 0.00 C ATOM 125 C ASP A 9 1.121 14.822 -7.160 1.00 0.00 C ATOM 126 O ASP A 9 2.267 14.596 -7.541 1.00 0.00 O ATOM 127 CB ASP A 9 1.919 16.084 -5.104 1.00 0.00 C ATOM 128 CG ASP A 9 3.266 16.520 -5.680 1.00 0.00 C ATOM 129 OD1 ASP A 9 3.272 17.508 -6.453 1.00 0.00 O ATOM 130 OD2 ASP A 9 4.278 15.866 -5.345 1.00 0.00 O ATOM 0 H ASP A 9 -0.570 14.803 -5.157 1.00 0.00 H new ATOM 0 HA ASP A 9 0.817 16.881 -6.754 1.00 0.00 H new ATOM 0 HB2 ASP A 9 1.600 16.805 -4.351 1.00 0.00 H new ATOM 0 HB3 ASP A 9 2.037 15.126 -4.598 1.00 0.00 H new ATOM 135 N VAL A 10 0.068 14.106 -7.576 1.00 0.00 N ATOM 136 CA VAL A 10 0.150 12.974 -8.502 1.00 0.00 C ATOM 137 C VAL A 10 0.810 13.355 -9.822 1.00 0.00 C ATOM 138 O VAL A 10 1.158 12.480 -10.610 1.00 0.00 O ATOM 139 CB VAL A 10 -1.250 12.406 -8.770 1.00 0.00 C ATOM 140 CG1 VAL A 10 -1.896 11.922 -7.472 1.00 0.00 C ATOM 141 CG2 VAL A 10 -2.159 13.460 -9.404 1.00 0.00 C ATOM 0 H VAL A 10 -0.885 14.304 -7.270 1.00 0.00 H new ATOM 0 HA VAL A 10 0.772 12.215 -8.027 1.00 0.00 H new ATOM 0 HB VAL A 10 -1.132 11.568 -9.457 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -2.888 11.523 -7.686 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -1.279 11.141 -7.028 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -1.983 12.756 -6.776 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -3.145 13.030 -9.583 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -2.252 14.313 -8.731 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -1.729 13.789 -10.350 1.00 0.00 H new ATOM 151 N GLU A 11 0.979 14.655 -10.067 1.00 0.00 N ATOM 152 CA GLU A 11 1.600 15.176 -11.276 1.00 0.00 C ATOM 153 C GLU A 11 3.108 14.898 -11.328 1.00 0.00 C ATOM 154 O GLU A 11 3.763 15.268 -12.303 1.00 0.00 O ATOM 155 CB GLU A 11 1.327 16.681 -11.364 1.00 0.00 C ATOM 156 CG GLU A 11 1.911 17.423 -10.161 1.00 0.00 C ATOM 157 CD GLU A 11 1.663 18.923 -10.286 1.00 0.00 C ATOM 158 OE1 GLU A 11 0.574 19.370 -9.861 1.00 0.00 O ATOM 159 OE2 GLU A 11 2.570 19.612 -10.809 1.00 0.00 O ATOM 0 H GLU A 11 0.682 15.384 -9.418 1.00 0.00 H new ATOM 0 HA GLU A 11 1.162 14.663 -12.132 1.00 0.00 H new ATOM 0 HB2 GLU A 11 1.758 17.078 -12.283 1.00 0.00 H new ATOM 0 HB3 GLU A 11 0.252 16.855 -11.415 1.00 0.00 H new ATOM 0 HG2 GLU A 11 1.460 17.049 -9.242 1.00 0.00 H new ATOM 0 HG3 GLU A 11 2.982 17.230 -10.092 1.00 0.00 H new ATOM 166 N GLY A 12 3.675 14.257 -10.301 1.00 0.00 N ATOM 167 CA GLY A 12 5.110 14.005 -10.259 1.00 0.00 C ATOM 168 C GLY A 12 5.532 13.035 -9.160 1.00 0.00 C ATOM 169 O GLY A 12 6.648 13.152 -8.655 1.00 0.00 O ATOM 0 H GLY A 12 3.161 13.906 -9.493 1.00 0.00 H new ATOM 0 HA2 GLY A 12 5.428 13.608 -11.223 1.00 0.00 H new ATOM 0 HA3 GLY A 12 5.632 14.951 -10.116 1.00 0.00 H new ATOM 173 N MET A 13 4.673 12.081 -8.776 1.00 0.00 N ATOM 174 CA MET A 13 5.032 11.115 -7.743 1.00 0.00 C ATOM 175 C MET A 13 4.556 9.701 -8.075 1.00 0.00 C ATOM 176 O MET A 13 3.764 9.492 -8.996 1.00 0.00 O ATOM 177 CB MET A 13 4.585 11.617 -6.364 1.00 0.00 C ATOM 178 CG MET A 13 3.079 11.825 -6.209 1.00 0.00 C ATOM 179 SD MET A 13 2.100 10.316 -6.030 1.00 0.00 S ATOM 180 CE MET A 13 0.684 11.009 -5.136 1.00 0.00 C ATOM 0 H MET A 13 3.737 11.962 -9.163 1.00 0.00 H new ATOM 0 HA MET A 13 6.118 11.033 -7.709 1.00 0.00 H new ATOM 0 HB2 MET A 13 4.918 10.904 -5.609 1.00 0.00 H new ATOM 0 HB3 MET A 13 5.090 12.560 -6.156 1.00 0.00 H new ATOM 0 HG2 MET A 13 2.905 12.456 -5.337 1.00 0.00 H new ATOM 0 HG3 MET A 13 2.714 12.373 -7.078 1.00 0.00 H new ATOM 0 HE1 MET A 13 -0.145 10.302 -5.164 1.00 0.00 H new ATOM 0 HE2 MET A 13 0.965 11.198 -4.100 1.00 0.00 H new ATOM 0 HE3 MET A 13 0.380 11.944 -5.606 1.00 0.00 H new ATOM 190 N THR A 14 5.056 8.728 -7.307 1.00 0.00 N ATOM 191 CA THR A 14 4.943 7.297 -7.571 1.00 0.00 C ATOM 192 C THR A 14 3.515 6.753 -7.695 1.00 0.00 C ATOM 193 O THR A 14 3.314 5.764 -8.396 1.00 0.00 O ATOM 194 CB THR A 14 5.723 6.552 -6.486 1.00 0.00 C ATOM 195 OG1 THR A 14 7.091 6.807 -6.676 1.00 0.00 O ATOM 196 CG2 THR A 14 5.512 5.043 -6.547 1.00 0.00 C ATOM 0 H THR A 14 5.571 8.928 -6.450 1.00 0.00 H new ATOM 0 HA THR A 14 5.364 7.127 -8.562 1.00 0.00 H new ATOM 0 HB THR A 14 5.366 6.903 -5.518 1.00 0.00 H new ATOM 0 HG1 THR A 14 7.420 7.381 -5.953 1.00 0.00 H new ATOM 0 HG21 THR A 14 6.088 4.563 -5.756 1.00 0.00 H new ATOM 0 HG22 THR A 14 4.454 4.818 -6.414 1.00 0.00 H new ATOM 0 HG23 THR A 14 5.843 4.668 -7.515 1.00 0.00 H new ATOM 203 N SER A 15 2.532 7.365 -7.038 1.00 0.00 N ATOM 204 CA SER A 15 1.143 6.913 -7.063 1.00 0.00 C ATOM 205 C SER A 15 1.002 5.392 -6.950 1.00 0.00 C ATOM 206 O SER A 15 0.439 4.750 -7.836 1.00 0.00 O ATOM 207 CB SER A 15 0.426 7.439 -8.306 1.00 0.00 C ATOM 208 OG SER A 15 0.277 8.843 -8.228 1.00 0.00 O ATOM 0 H SER A 15 2.679 8.197 -6.467 1.00 0.00 H new ATOM 0 HA SER A 15 0.665 7.330 -6.176 1.00 0.00 H new ATOM 0 HB2 SER A 15 0.992 7.175 -9.200 1.00 0.00 H new ATOM 0 HB3 SER A 15 -0.552 6.967 -8.397 1.00 0.00 H new ATOM 0 HG SER A 15 0.881 9.199 -7.543 1.00 0.00 H new ATOM 214 N LEU A 16 1.508 4.800 -5.863 1.00 0.00 N ATOM 215 CA LEU A 16 1.245 3.384 -5.604 1.00 0.00 C ATOM 216 C LEU A 16 -0.252 3.219 -5.351 1.00 0.00 C ATOM 217 O LEU A 16 -0.941 4.216 -5.152 1.00 0.00 O ATOM 218 CB LEU A 16 1.998 2.923 -4.350 1.00 0.00 C ATOM 219 CG LEU A 16 2.026 1.399 -4.152 1.00 0.00 C ATOM 220 CD1 LEU A 16 2.965 0.722 -5.144 1.00 0.00 C ATOM 221 CD2 LEU A 16 2.488 1.077 -2.735 1.00 0.00 C ATOM 0 H LEU A 16 2.088 5.267 -5.165 1.00 0.00 H new ATOM 0 HA LEU A 16 1.573 2.792 -6.458 1.00 0.00 H new ATOM 0 HB2 LEU A 16 3.023 3.290 -4.401 1.00 0.00 H new ATOM 0 HB3 LEU A 16 1.538 3.383 -3.475 1.00 0.00 H new ATOM 0 HG LEU A 16 1.017 1.022 -4.320 1.00 0.00 H new ATOM 0 HD11 LEU A 16 2.959 -0.355 -4.974 1.00 0.00 H new ATOM 0 HD12 LEU A 16 2.632 0.931 -6.161 1.00 0.00 H new ATOM 0 HD13 LEU A 16 3.976 1.105 -5.007 1.00 0.00 H new ATOM 0 HD21 LEU A 16 2.508 -0.004 -2.595 1.00 0.00 H new ATOM 0 HD22 LEU A 16 3.488 1.481 -2.578 1.00 0.00 H new ATOM 0 HD23 LEU A 16 1.799 1.523 -2.018 1.00 0.00 H new ATOM 233 N LYS A 17 -0.758 1.982 -5.351 1.00 0.00 N ATOM 234 CA LYS A 17 -2.121 1.714 -4.921 1.00 0.00 C ATOM 235 C LYS A 17 -2.203 0.473 -4.035 1.00 0.00 C ATOM 236 O LYS A 17 -1.334 -0.394 -4.082 1.00 0.00 O ATOM 237 CB LYS A 17 -3.063 1.595 -6.118 1.00 0.00 C ATOM 238 CG LYS A 17 -2.746 0.359 -6.959 1.00 0.00 C ATOM 239 CD LYS A 17 -4.031 -0.234 -7.522 1.00 0.00 C ATOM 240 CE LYS A 17 -3.749 -1.640 -8.048 1.00 0.00 C ATOM 241 NZ LYS A 17 -5.001 -2.412 -8.187 1.00 0.00 N ATOM 0 H LYS A 17 -0.239 1.155 -5.645 1.00 0.00 H new ATOM 0 HA LYS A 17 -2.443 2.565 -4.320 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -4.094 1.543 -5.767 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -2.981 2.488 -6.737 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -2.072 0.626 -7.773 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -2.230 -0.383 -6.349 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -4.798 -0.270 -6.749 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -4.416 0.396 -8.324 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -3.247 -1.577 -9.013 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -3.071 -2.158 -7.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -4.775 -3.417 -8.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -5.572 -2.305 -7.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -5.538 -2.058 -9.004 1.00 0.00 H new ATOM 255 N VAL A 18 -3.262 0.390 -3.227 1.00 0.00 N ATOM 256 CA VAL A 18 -3.541 -0.776 -2.379 1.00 0.00 C ATOM 257 C VAL A 18 -5.012 -1.153 -2.517 1.00 0.00 C ATOM 258 O VAL A 18 -5.847 -0.272 -2.722 1.00 0.00 O ATOM 259 CB VAL A 18 -3.283 -0.432 -0.907 1.00 0.00 C ATOM 260 CG1 VAL A 18 -3.665 -1.607 -0.005 1.00 0.00 C ATOM 261 CG2 VAL A 18 -1.825 -0.058 -0.658 1.00 0.00 C ATOM 0 H VAL A 18 -3.955 1.133 -3.140 1.00 0.00 H new ATOM 0 HA VAL A 18 -2.895 -1.597 -2.690 1.00 0.00 H new ATOM 0 HB VAL A 18 -3.904 0.431 -0.668 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -3.475 -1.344 1.035 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -4.723 -1.836 -0.134 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -3.070 -2.480 -0.273 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -1.685 0.178 0.397 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -1.183 -0.896 -0.930 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -1.564 0.811 -1.262 1.00 0.00 H new ATOM 271 N ASP A 19 -5.318 -2.451 -2.400 1.00 0.00 N ATOM 272 CA ASP A 19 -6.670 -2.995 -2.475 1.00 0.00 C ATOM 273 C ASP A 19 -6.790 -4.266 -1.626 1.00 0.00 C ATOM 274 O ASP A 19 -5.845 -4.646 -0.937 1.00 0.00 O ATOM 275 CB ASP A 19 -6.983 -3.360 -3.931 1.00 0.00 C ATOM 276 CG ASP A 19 -6.924 -2.147 -4.849 1.00 0.00 C ATOM 277 OD1 ASP A 19 -7.835 -1.297 -4.738 1.00 0.00 O ATOM 278 OD2 ASP A 19 -5.968 -2.090 -5.654 1.00 0.00 O ATOM 0 H ASP A 19 -4.609 -3.168 -2.246 1.00 0.00 H new ATOM 0 HA ASP A 19 -7.367 -2.244 -2.102 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -6.273 -4.111 -4.277 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -7.975 -3.809 -3.987 1.00 0.00 H new ATOM 283 N ASN A 20 -7.962 -4.915 -1.688 1.00 0.00 N ATOM 284 CA ASN A 20 -8.225 -6.259 -1.166 1.00 0.00 C ATOM 285 C ASN A 20 -8.752 -6.280 0.274 1.00 0.00 C ATOM 286 O ASN A 20 -8.531 -7.248 1.002 1.00 0.00 O ATOM 287 CB ASN A 20 -7.000 -7.157 -1.351 1.00 0.00 C ATOM 288 CG ASN A 20 -7.373 -8.531 -1.878 1.00 0.00 C ATOM 289 OD1 ASN A 20 -8.346 -8.690 -2.610 1.00 0.00 O ATOM 290 ND2 ASN A 20 -6.604 -9.546 -1.510 1.00 0.00 N ATOM 0 H ASN A 20 -8.785 -4.498 -2.122 1.00 0.00 H new ATOM 0 HA ASN A 20 -9.043 -6.666 -1.760 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -6.303 -6.681 -2.041 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -6.482 -7.263 -0.398 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -6.814 -10.489 -1.836 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -5.802 -9.384 -0.901 1.00 0.00 H new ATOM 297 N LEU A 21 -9.449 -5.220 0.683 1.00 0.00 N ATOM 298 CA LEU A 21 -9.988 -5.063 2.024 1.00 0.00 C ATOM 299 C LEU A 21 -10.945 -6.208 2.335 1.00 0.00 C ATOM 300 O LEU A 21 -11.941 -6.397 1.639 1.00 0.00 O ATOM 301 CB LEU A 21 -10.740 -3.731 2.115 1.00 0.00 C ATOM 302 CG LEU A 21 -9.863 -2.473 2.174 1.00 0.00 C ATOM 303 CD1 LEU A 21 -9.510 -2.160 3.623 1.00 0.00 C ATOM 304 CD2 LEU A 21 -8.561 -2.591 1.375 1.00 0.00 C ATOM 0 H LEU A 21 -9.657 -4.430 0.072 1.00 0.00 H new ATOM 0 HA LEU A 21 -9.170 -5.074 2.745 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -11.402 -3.649 1.253 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -11.373 -3.752 3.002 1.00 0.00 H new ATOM 0 HG LEU A 21 -10.452 -1.675 1.723 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -8.887 -1.266 3.661 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -10.424 -1.990 4.192 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -8.966 -3.000 4.054 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -7.994 -1.664 1.464 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -7.968 -3.418 1.766 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -8.793 -2.775 0.326 1.00 0.00 H new ATOM 316 N THR A 22 -10.640 -6.968 3.385 1.00 0.00 N ATOM 317 CA THR A 22 -11.477 -8.075 3.806 1.00 0.00 C ATOM 318 C THR A 22 -12.728 -7.537 4.508 1.00 0.00 C ATOM 319 O THR A 22 -12.832 -6.339 4.782 1.00 0.00 O ATOM 320 CB THR A 22 -10.646 -8.990 4.709 1.00 0.00 C ATOM 321 OG1 THR A 22 -9.400 -9.230 4.093 1.00 0.00 O ATOM 322 CG2 THR A 22 -11.307 -10.344 4.943 1.00 0.00 C ATOM 0 H THR A 22 -9.809 -6.830 3.961 1.00 0.00 H new ATOM 0 HA THR A 22 -11.819 -8.658 2.951 1.00 0.00 H new ATOM 0 HB THR A 22 -10.544 -8.484 5.669 1.00 0.00 H new ATOM 0 HG1 THR A 22 -8.770 -9.583 4.756 1.00 0.00 H new ATOM 0 HG21 THR A 22 -10.674 -10.951 5.590 1.00 0.00 H new ATOM 0 HG22 THR A 22 -12.277 -10.198 5.418 1.00 0.00 H new ATOM 0 HG23 THR A 22 -11.443 -10.852 3.988 1.00 0.00 H new ATOM 329 N TYR A 23 -13.688 -8.419 4.805 1.00 0.00 N ATOM 330 CA TYR A 23 -14.945 -8.071 5.457 1.00 0.00 C ATOM 331 C TYR A 23 -14.751 -7.531 6.884 1.00 0.00 C ATOM 332 O TYR A 23 -15.734 -7.329 7.600 1.00 0.00 O ATOM 333 CB TYR A 23 -15.847 -9.306 5.470 1.00 0.00 C ATOM 334 CG TYR A 23 -15.294 -10.460 6.273 1.00 0.00 C ATOM 335 CD1 TYR A 23 -14.473 -11.415 5.656 1.00 0.00 C ATOM 336 CD2 TYR A 23 -15.597 -10.576 7.638 1.00 0.00 C ATOM 337 CE1 TYR A 23 -13.951 -12.486 6.397 1.00 0.00 C ATOM 338 CE2 TYR A 23 -15.076 -11.639 8.389 1.00 0.00 C ATOM 339 CZ TYR A 23 -14.247 -12.600 7.770 1.00 0.00 C ATOM 340 OH TYR A 23 -13.737 -13.632 8.503 1.00 0.00 O ATOM 0 H TYR A 23 -13.607 -9.413 4.593 1.00 0.00 H new ATOM 0 HA TYR A 23 -15.408 -7.264 4.889 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -16.820 -9.028 5.874 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -16.010 -9.635 4.444 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -14.241 -11.326 4.605 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -16.234 -9.844 8.112 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -13.323 -13.222 5.916 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -15.309 -11.723 9.440 1.00 0.00 H new ATOM 0 HH TYR A 23 -14.041 -13.556 9.431 1.00 0.00 H new ATOM 350 N ARG A 24 -13.502 -7.303 7.303 1.00 0.00 N ATOM 351 CA ARG A 24 -13.161 -6.878 8.655 1.00 0.00 C ATOM 352 C ARG A 24 -12.211 -5.681 8.652 1.00 0.00 C ATOM 353 O ARG A 24 -11.613 -5.375 9.683 1.00 0.00 O ATOM 354 CB ARG A 24 -12.530 -8.072 9.379 1.00 0.00 C ATOM 355 CG ARG A 24 -11.174 -8.403 8.751 1.00 0.00 C ATOM 356 CD ARG A 24 -10.650 -9.727 9.295 1.00 0.00 C ATOM 357 NE ARG A 24 -9.262 -9.954 8.866 1.00 0.00 N ATOM 358 CZ ARG A 24 -8.349 -10.609 9.589 1.00 0.00 C ATOM 359 NH1 ARG A 24 -8.665 -11.160 10.760 1.00 0.00 N ATOM 360 NH2 ARG A 24 -7.101 -10.718 9.144 1.00 0.00 N ATOM 0 H ARG A 24 -12.689 -7.412 6.697 1.00 0.00 H new ATOM 0 HA ARG A 24 -14.064 -6.553 9.171 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -12.404 -7.842 10.437 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -13.190 -8.937 9.317 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -11.272 -8.460 7.667 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -10.462 -7.606 8.965 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -10.703 -9.725 10.384 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -11.282 -10.544 8.947 1.00 0.00 H new ATOM 0 HE ARG A 24 -8.978 -9.588 7.958 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -9.617 -11.086 11.118 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -7.955 -11.656 11.298 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -6.840 -10.301 8.250 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -6.404 -11.218 9.696 1.00 0.00 H new ATOM 374 N THR A 25 -12.069 -5.009 7.507 1.00 0.00 N ATOM 375 CA THR A 25 -11.084 -3.945 7.340 1.00 0.00 C ATOM 376 C THR A 25 -11.755 -2.635 6.920 1.00 0.00 C ATOM 377 O THR A 25 -12.922 -2.627 6.527 1.00 0.00 O ATOM 378 CB THR A 25 -10.026 -4.389 6.320 1.00 0.00 C ATOM 379 OG1 THR A 25 -9.784 -5.776 6.420 1.00 0.00 O ATOM 380 CG2 THR A 25 -8.702 -3.671 6.574 1.00 0.00 C ATOM 0 H THR A 25 -12.632 -5.188 6.675 1.00 0.00 H new ATOM 0 HA THR A 25 -10.593 -3.757 8.295 1.00 0.00 H new ATOM 0 HB THR A 25 -10.410 -4.144 5.330 1.00 0.00 H new ATOM 0 HG1 THR A 25 -9.108 -6.039 5.761 1.00 0.00 H new ATOM 0 HG21 THR A 25 -7.964 -3.998 5.841 1.00 0.00 H new ATOM 0 HG22 THR A 25 -8.849 -2.595 6.485 1.00 0.00 H new ATOM 0 HG23 THR A 25 -8.347 -3.907 7.577 1.00 0.00 H new ATOM 387 N SER A 26 -11.015 -1.524 7.004 1.00 0.00 N ATOM 388 CA SER A 26 -11.528 -0.182 6.747 1.00 0.00 C ATOM 389 C SER A 26 -10.394 0.716 6.247 1.00 0.00 C ATOM 390 O SER A 26 -9.226 0.334 6.358 1.00 0.00 O ATOM 391 CB SER A 26 -12.092 0.350 8.068 1.00 0.00 C ATOM 392 OG SER A 26 -11.045 0.549 8.999 1.00 0.00 O ATOM 0 H SER A 26 -10.027 -1.537 7.257 1.00 0.00 H new ATOM 0 HA SER A 26 -12.305 -0.198 5.983 1.00 0.00 H new ATOM 0 HB2 SER A 26 -12.619 1.288 7.896 1.00 0.00 H new ATOM 0 HB3 SER A 26 -12.819 -0.354 8.472 1.00 0.00 H new ATOM 0 HG SER A 26 -11.415 0.891 9.840 1.00 0.00 H new ATOM 398 N PRO A 27 -10.698 1.899 5.695 1.00 0.00 N ATOM 399 CA PRO A 27 -9.685 2.802 5.170 1.00 0.00 C ATOM 400 C PRO A 27 -8.870 3.420 6.299 1.00 0.00 C ATOM 401 O PRO A 27 -7.700 3.748 6.115 1.00 0.00 O ATOM 402 CB PRO A 27 -10.456 3.883 4.416 1.00 0.00 C ATOM 403 CG PRO A 27 -11.797 3.920 5.148 1.00 0.00 C ATOM 404 CD PRO A 27 -12.026 2.463 5.530 1.00 0.00 C ATOM 0 HA PRO A 27 -8.979 2.279 4.525 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -9.947 4.846 4.457 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -10.578 3.632 3.362 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -11.759 4.565 6.026 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -12.594 4.299 4.509 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -12.605 2.384 6.450 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -12.584 1.936 4.756 1.00 0.00 H new ATOM 412 N ASP A 28 -9.485 3.578 7.474 1.00 0.00 N ATOM 413 CA ASP A 28 -8.806 4.133 8.635 1.00 0.00 C ATOM 414 C ASP A 28 -7.726 3.158 9.114 1.00 0.00 C ATOM 415 O ASP A 28 -6.673 3.572 9.595 1.00 0.00 O ATOM 416 CB ASP A 28 -9.848 4.387 9.724 1.00 0.00 C ATOM 417 CG ASP A 28 -10.773 5.542 9.347 1.00 0.00 C ATOM 418 OD1 ASP A 28 -10.338 6.705 9.512 1.00 0.00 O ATOM 419 OD2 ASP A 28 -11.906 5.251 8.898 1.00 0.00 O ATOM 0 H ASP A 28 -10.459 3.326 7.641 1.00 0.00 H new ATOM 0 HA ASP A 28 -8.316 5.074 8.384 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -10.437 3.484 9.885 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -9.346 4.612 10.665 1.00 0.00 H new ATOM 424 N THR A 29 -7.982 1.855 8.976 1.00 0.00 N ATOM 425 CA THR A 29 -6.991 0.854 9.334 1.00 0.00 C ATOM 426 C THR A 29 -5.925 0.829 8.252 1.00 0.00 C ATOM 427 O THR A 29 -4.735 0.800 8.546 1.00 0.00 O ATOM 428 CB THR A 29 -7.638 -0.524 9.462 1.00 0.00 C ATOM 429 OG1 THR A 29 -8.581 -0.507 10.506 1.00 0.00 O ATOM 430 CG2 THR A 29 -6.561 -1.557 9.780 1.00 0.00 C ATOM 0 H THR A 29 -8.861 1.477 8.622 1.00 0.00 H new ATOM 0 HA THR A 29 -6.547 1.107 10.297 1.00 0.00 H new ATOM 0 HB THR A 29 -8.134 -0.780 8.526 1.00 0.00 H new ATOM 0 HG1 THR A 29 -9.440 -0.181 10.165 1.00 0.00 H new ATOM 0 HG21 THR A 29 -7.018 -2.542 9.872 1.00 0.00 H new ATOM 0 HG22 THR A 29 -5.824 -1.573 8.977 1.00 0.00 H new ATOM 0 HG23 THR A 29 -6.071 -1.295 10.718 1.00 0.00 H new ATOM 437 N LEU A 30 -6.347 0.844 6.986 1.00 0.00 N ATOM 438 CA LEU A 30 -5.427 0.849 5.860 1.00 0.00 C ATOM 439 C LEU A 30 -4.459 2.026 5.946 1.00 0.00 C ATOM 440 O LEU A 30 -3.404 1.996 5.319 1.00 0.00 O ATOM 441 CB LEU A 30 -6.238 0.884 4.559 1.00 0.00 C ATOM 442 CG LEU A 30 -6.182 -0.425 3.757 1.00 0.00 C ATOM 443 CD1 LEU A 30 -4.832 -0.587 3.070 1.00 0.00 C ATOM 444 CD2 LEU A 30 -6.428 -1.639 4.649 1.00 0.00 C ATOM 0 H LEU A 30 -7.331 0.853 6.719 1.00 0.00 H new ATOM 0 HA LEU A 30 -4.822 -0.058 5.880 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -7.278 1.109 4.796 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -5.870 1.698 3.934 1.00 0.00 H new ATOM 0 HG LEU A 30 -6.970 -0.368 3.006 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -4.819 -1.522 2.509 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -4.668 0.248 2.388 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -4.042 -0.603 3.820 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -6.381 -2.547 4.048 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -5.666 -1.679 5.427 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -7.413 -1.559 5.109 1.00 0.00 H new ATOM 456 N ARG A 31 -4.800 3.062 6.719 1.00 0.00 N ATOM 457 CA ARG A 31 -3.919 4.205 6.887 1.00 0.00 C ATOM 458 C ARG A 31 -2.845 3.875 7.911 1.00 0.00 C ATOM 459 O ARG A 31 -1.663 3.942 7.592 1.00 0.00 O ATOM 460 CB ARG A 31 -4.725 5.414 7.347 1.00 0.00 C ATOM 461 CG ARG A 31 -3.836 6.630 7.635 1.00 0.00 C ATOM 462 CD ARG A 31 -2.931 7.008 6.453 1.00 0.00 C ATOM 463 NE ARG A 31 -2.080 8.154 6.796 1.00 0.00 N ATOM 464 CZ ARG A 31 -2.069 9.329 6.170 1.00 0.00 C ATOM 465 NH1 ARG A 31 -2.875 9.579 5.141 1.00 0.00 N ATOM 466 NH2 ARG A 31 -1.231 10.272 6.590 1.00 0.00 N ATOM 0 H ARG A 31 -5.678 3.126 7.234 1.00 0.00 H new ATOM 0 HA ARG A 31 -3.444 4.438 5.934 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -5.455 5.674 6.581 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -5.284 5.154 8.246 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -4.467 7.482 7.889 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -3.216 6.421 8.507 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -2.309 6.156 6.178 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -3.542 7.250 5.584 1.00 0.00 H new ATOM 0 HE ARG A 31 -1.441 8.040 7.583 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -3.522 8.861 4.814 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -2.846 10.488 4.680 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -0.611 10.089 7.379 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -1.208 11.179 6.123 1.00 0.00 H new ATOM 480 N ARG A 32 -3.240 3.515 9.137 1.00 0.00 N ATOM 481 CA ARG A 32 -2.264 3.250 10.192 1.00 0.00 C ATOM 482 C ARG A 32 -1.438 1.993 9.911 1.00 0.00 C ATOM 483 O ARG A 32 -0.430 1.760 10.576 1.00 0.00 O ATOM 484 CB ARG A 32 -2.974 3.181 11.546 1.00 0.00 C ATOM 485 CG ARG A 32 -3.978 2.026 11.676 1.00 0.00 C ATOM 486 CD ARG A 32 -3.323 0.710 12.105 1.00 0.00 C ATOM 487 NE ARG A 32 -2.728 0.812 13.444 1.00 0.00 N ATOM 488 CZ ARG A 32 -2.021 -0.161 14.022 1.00 0.00 C ATOM 489 NH1 ARG A 32 -1.824 -1.326 13.403 1.00 0.00 N ATOM 490 NH2 ARG A 32 -1.504 0.022 15.232 1.00 0.00 N ATOM 0 H ARG A 32 -4.214 3.402 9.418 1.00 0.00 H new ATOM 0 HA ARG A 32 -1.552 4.075 10.217 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -2.224 3.085 12.331 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -3.497 4.122 11.717 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -4.744 2.298 12.402 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -4.482 1.880 10.720 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -4.067 -0.087 12.097 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -2.553 0.435 11.384 1.00 0.00 H new ATOM 0 HE ARG A 32 -2.863 1.679 13.964 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -2.216 -1.483 12.475 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -1.281 -2.060 13.858 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -1.647 0.906 15.719 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -0.964 -0.722 15.674 1.00 0.00 H new ATOM 504 N VAL A 33 -1.862 1.190 8.930 1.00 0.00 N ATOM 505 CA VAL A 33 -1.171 -0.032 8.546 1.00 0.00 C ATOM 506 C VAL A 33 -0.165 0.222 7.431 1.00 0.00 C ATOM 507 O VAL A 33 0.871 -0.437 7.389 1.00 0.00 O ATOM 508 CB VAL A 33 -2.218 -1.057 8.094 1.00 0.00 C ATOM 509 CG1 VAL A 33 -1.578 -2.275 7.435 1.00 0.00 C ATOM 510 CG2 VAL A 33 -3.028 -1.529 9.299 1.00 0.00 C ATOM 0 H VAL A 33 -2.701 1.376 8.380 1.00 0.00 H new ATOM 0 HA VAL A 33 -0.613 -0.411 9.402 1.00 0.00 H new ATOM 0 HB VAL A 33 -2.859 -0.565 7.363 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -2.356 -2.975 7.130 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -1.011 -1.959 6.559 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -0.909 -2.763 8.144 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -3.771 -2.257 8.975 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -2.361 -1.990 10.027 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -3.530 -0.677 9.756 1.00 0.00 H new ATOM 520 N PHE A 34 -0.452 1.167 6.531 1.00 0.00 N ATOM 521 CA PHE A 34 0.441 1.485 5.425 1.00 0.00 C ATOM 522 C PHE A 34 1.219 2.784 5.655 1.00 0.00 C ATOM 523 O PHE A 34 2.139 3.087 4.898 1.00 0.00 O ATOM 524 CB PHE A 34 -0.392 1.542 4.149 1.00 0.00 C ATOM 525 CG PHE A 34 -0.565 0.200 3.476 1.00 0.00 C ATOM 526 CD1 PHE A 34 -1.527 -0.694 3.951 1.00 0.00 C ATOM 527 CD2 PHE A 34 0.230 -0.158 2.377 1.00 0.00 C ATOM 528 CE1 PHE A 34 -1.715 -1.932 3.322 1.00 0.00 C ATOM 529 CE2 PHE A 34 0.056 -1.397 1.749 1.00 0.00 C ATOM 530 CZ PHE A 34 -0.925 -2.285 2.216 1.00 0.00 C ATOM 0 H PHE A 34 -1.305 1.727 6.552 1.00 0.00 H new ATOM 0 HA PHE A 34 1.200 0.707 5.340 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -1.375 1.949 4.385 1.00 0.00 H new ATOM 0 HB3 PHE A 34 0.079 2.232 3.449 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -2.129 -0.430 4.808 1.00 0.00 H new ATOM 0 HD2 PHE A 34 0.981 0.527 2.013 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -2.468 -2.615 3.688 1.00 0.00 H new ATOM 0 HE2 PHE A 34 0.675 -1.669 0.907 1.00 0.00 H new ATOM 0 HZ PHE A 34 -1.072 -3.236 1.727 1.00 0.00 H new ATOM 540 N GLU A 35 0.869 3.553 6.685 1.00 0.00 N ATOM 541 CA GLU A 35 1.582 4.778 7.015 1.00 0.00 C ATOM 542 C GLU A 35 2.949 4.469 7.628 1.00 0.00 C ATOM 543 O GLU A 35 3.865 5.287 7.530 1.00 0.00 O ATOM 544 CB GLU A 35 0.725 5.591 7.991 1.00 0.00 C ATOM 545 CG GLU A 35 1.454 6.834 8.500 1.00 0.00 C ATOM 546 CD GLU A 35 0.505 7.741 9.283 1.00 0.00 C ATOM 547 OE1 GLU A 35 0.373 7.526 10.507 1.00 0.00 O ATOM 548 OE2 GLU A 35 -0.081 8.643 8.643 1.00 0.00 O ATOM 0 H GLU A 35 0.089 3.344 7.308 1.00 0.00 H new ATOM 0 HA GLU A 35 1.756 5.353 6.106 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -0.200 5.890 7.498 1.00 0.00 H new ATOM 0 HB3 GLU A 35 0.446 4.963 8.837 1.00 0.00 H new ATOM 0 HG2 GLU A 35 2.287 6.537 9.137 1.00 0.00 H new ATOM 0 HG3 GLU A 35 1.876 7.383 7.658 1.00 0.00 H new ATOM 555 N LYS A 36 3.100 3.297 8.257 1.00 0.00 N ATOM 556 CA LYS A 36 4.334 2.947 8.951 1.00 0.00 C ATOM 557 C LYS A 36 5.491 2.702 7.988 1.00 0.00 C ATOM 558 O LYS A 36 6.652 2.831 8.371 1.00 0.00 O ATOM 559 CB LYS A 36 4.090 1.727 9.842 1.00 0.00 C ATOM 560 CG LYS A 36 3.826 0.452 9.039 1.00 0.00 C ATOM 561 CD LYS A 36 3.442 -0.665 10.010 1.00 0.00 C ATOM 562 CE LYS A 36 3.279 -1.991 9.272 1.00 0.00 C ATOM 563 NZ LYS A 36 4.581 -2.504 8.796 1.00 0.00 N ATOM 0 H LYS A 36 2.378 2.577 8.297 1.00 0.00 H new ATOM 0 HA LYS A 36 4.626 3.795 9.571 1.00 0.00 H new ATOM 0 HB2 LYS A 36 4.956 1.573 10.485 1.00 0.00 H new ATOM 0 HB3 LYS A 36 3.239 1.923 10.494 1.00 0.00 H new ATOM 0 HG2 LYS A 36 3.026 0.618 8.318 1.00 0.00 H new ATOM 0 HG3 LYS A 36 4.713 0.172 8.472 1.00 0.00 H new ATOM 0 HD2 LYS A 36 4.208 -0.763 10.780 1.00 0.00 H new ATOM 0 HD3 LYS A 36 2.512 -0.409 10.517 1.00 0.00 H new ATOM 0 HE2 LYS A 36 2.817 -2.724 9.934 1.00 0.00 H new ATOM 0 HE3 LYS A 36 2.606 -1.858 8.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 4.578 -2.548 7.757 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 5.341 -1.869 9.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 4.741 -3.456 9.182 1.00 0.00 H new ATOM 577 N TYR A 37 5.181 2.351 6.739 1.00 0.00 N ATOM 578 CA TYR A 37 6.182 2.152 5.705 1.00 0.00 C ATOM 579 C TYR A 37 6.778 3.477 5.243 1.00 0.00 C ATOM 580 O TYR A 37 7.856 3.488 4.651 1.00 0.00 O ATOM 581 CB TYR A 37 5.552 1.407 4.531 1.00 0.00 C ATOM 582 CG TYR A 37 5.156 -0.003 4.891 1.00 0.00 C ATOM 583 CD1 TYR A 37 3.901 -0.259 5.460 1.00 0.00 C ATOM 584 CD2 TYR A 37 6.052 -1.057 4.664 1.00 0.00 C ATOM 585 CE1 TYR A 37 3.548 -1.562 5.825 1.00 0.00 C ATOM 586 CE2 TYR A 37 5.704 -2.369 5.023 1.00 0.00 C ATOM 587 CZ TYR A 37 4.454 -2.622 5.616 1.00 0.00 C ATOM 588 OH TYR A 37 4.131 -3.890 5.993 1.00 0.00 O ATOM 0 H TYR A 37 4.224 2.198 6.421 1.00 0.00 H new ATOM 0 HA TYR A 37 6.997 1.558 6.118 1.00 0.00 H new ATOM 0 HB2 TYR A 37 4.673 1.952 4.188 1.00 0.00 H new ATOM 0 HB3 TYR A 37 6.256 1.383 3.699 1.00 0.00 H new ATOM 0 HD1 TYR A 37 3.205 0.552 5.617 1.00 0.00 H new ATOM 0 HD2 TYR A 37 7.013 -0.859 4.212 1.00 0.00 H new ATOM 0 HE1 TYR A 37 2.582 -1.756 6.267 1.00 0.00 H new ATOM 0 HE2 TYR A 37 6.394 -3.181 4.844 1.00 0.00 H new ATOM 0 HH TYR A 37 3.187 -3.923 6.255 1.00 0.00 H new ATOM 598 N GLY A 38 6.093 4.596 5.501 1.00 0.00 N ATOM 599 CA GLY A 38 6.640 5.905 5.174 1.00 0.00 C ATOM 600 C GLY A 38 5.565 6.980 5.237 1.00 0.00 C ATOM 601 O GLY A 38 5.392 7.625 6.269 1.00 0.00 O ATOM 0 H GLY A 38 5.168 4.616 5.931 1.00 0.00 H new ATOM 0 HA2 GLY A 38 7.444 6.150 5.868 1.00 0.00 H new ATOM 0 HA3 GLY A 38 7.076 5.881 4.175 1.00 0.00 H new ATOM 605 N ARG A 39 4.839 7.174 4.134 1.00 0.00 N ATOM 606 CA ARG A 39 3.734 8.119 4.076 1.00 0.00 C ATOM 607 C ARG A 39 2.749 7.754 2.982 1.00 0.00 C ATOM 608 O ARG A 39 3.042 6.952 2.098 1.00 0.00 O ATOM 609 CB ARG A 39 4.253 9.549 3.899 1.00 0.00 C ATOM 610 CG ARG A 39 5.260 9.703 2.755 1.00 0.00 C ATOM 611 CD ARG A 39 5.573 11.186 2.559 1.00 0.00 C ATOM 612 NE ARG A 39 6.298 11.741 3.705 1.00 0.00 N ATOM 613 CZ ARG A 39 7.620 11.668 3.870 1.00 0.00 C ATOM 614 NH1 ARG A 39 8.390 11.064 2.969 1.00 0.00 N ATOM 615 NH2 ARG A 39 8.188 12.204 4.946 1.00 0.00 N ATOM 0 H ARG A 39 5.005 6.678 3.258 1.00 0.00 H new ATOM 0 HA ARG A 39 3.200 8.067 5.025 1.00 0.00 H new ATOM 0 HB2 ARG A 39 3.408 10.213 3.718 1.00 0.00 H new ATOM 0 HB3 ARG A 39 4.720 9.874 4.829 1.00 0.00 H new ATOM 0 HG2 ARG A 39 6.173 9.153 2.982 1.00 0.00 H new ATOM 0 HG3 ARG A 39 4.853 9.280 1.837 1.00 0.00 H new ATOM 0 HD2 ARG A 39 6.167 11.316 1.654 1.00 0.00 H new ATOM 0 HD3 ARG A 39 4.645 11.738 2.413 1.00 0.00 H new ATOM 0 HE ARG A 39 5.755 12.216 4.426 1.00 0.00 H new ATOM 0 HH11 ARG A 39 7.971 10.648 2.137 1.00 0.00 H new ATOM 0 HH12 ARG A 39 9.399 11.017 3.110 1.00 0.00 H new ATOM 0 HH21 ARG A 39 7.613 12.672 5.647 1.00 0.00 H new ATOM 0 HH22 ARG A 39 9.199 12.147 5.071 1.00 0.00 H new ATOM 629 N VAL A 40 1.569 8.371 3.060 1.00 0.00 N ATOM 630 CA VAL A 40 0.441 8.104 2.183 1.00 0.00 C ATOM 631 C VAL A 40 -0.122 9.440 1.718 1.00 0.00 C ATOM 632 O VAL A 40 -0.253 10.371 2.514 1.00 0.00 O ATOM 633 CB VAL A 40 -0.607 7.309 2.976 1.00 0.00 C ATOM 634 CG1 VAL A 40 -1.859 7.050 2.148 1.00 0.00 C ATOM 635 CG2 VAL A 40 -0.040 5.960 3.431 1.00 0.00 C ATOM 0 H VAL A 40 1.372 9.090 3.757 1.00 0.00 H new ATOM 0 HA VAL A 40 0.737 7.521 1.310 1.00 0.00 H new ATOM 0 HB VAL A 40 -0.869 7.915 3.844 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -2.578 6.485 2.742 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -2.302 8.001 1.850 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -1.595 6.478 1.258 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -0.801 5.416 3.990 1.00 0.00 H new ATOM 0 HG22 VAL A 40 0.256 5.377 2.559 1.00 0.00 H new ATOM 0 HG23 VAL A 40 0.829 6.127 4.068 1.00 0.00 H new ATOM 645 N GLY A 41 -0.455 9.539 0.432 1.00 0.00 N ATOM 646 CA GLY A 41 -0.991 10.769 -0.136 1.00 0.00 C ATOM 647 C GLY A 41 -2.515 10.729 -0.153 1.00 0.00 C ATOM 648 O GLY A 41 -3.163 11.771 -0.203 1.00 0.00 O ATOM 0 H GLY A 41 -0.361 8.775 -0.238 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -0.650 11.625 0.447 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -0.613 10.903 -1.150 1.00 0.00 H new ATOM 652 N ASP A 42 -3.081 9.522 -0.113 1.00 0.00 N ATOM 653 CA ASP A 42 -4.517 9.345 -0.019 1.00 0.00 C ATOM 654 C ASP A 42 -4.856 7.921 0.409 1.00 0.00 C ATOM 655 O ASP A 42 -4.095 6.985 0.178 1.00 0.00 O ATOM 656 CB ASP A 42 -5.140 9.629 -1.387 1.00 0.00 C ATOM 657 CG ASP A 42 -6.659 9.510 -1.343 1.00 0.00 C ATOM 658 OD1 ASP A 42 -7.242 9.964 -0.333 1.00 0.00 O ATOM 659 OD2 ASP A 42 -7.214 8.968 -2.319 1.00 0.00 O ATOM 0 H ASP A 42 -2.554 8.649 -0.145 1.00 0.00 H new ATOM 0 HA ASP A 42 -4.914 10.033 0.727 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -4.862 10.631 -1.714 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -4.740 8.931 -2.122 1.00 0.00 H new ATOM 664 N VAL A 43 -6.017 7.769 1.038 1.00 0.00 N ATOM 665 CA VAL A 43 -6.595 6.491 1.413 1.00 0.00 C ATOM 666 C VAL A 43 -8.100 6.691 1.403 1.00 0.00 C ATOM 667 O VAL A 43 -8.672 7.312 2.299 1.00 0.00 O ATOM 668 CB VAL A 43 -6.046 6.000 2.758 1.00 0.00 C ATOM 669 CG1 VAL A 43 -5.980 7.102 3.815 1.00 0.00 C ATOM 670 CG2 VAL A 43 -6.884 4.838 3.280 1.00 0.00 C ATOM 0 H VAL A 43 -6.599 8.562 1.308 1.00 0.00 H new ATOM 0 HA VAL A 43 -6.326 5.700 0.713 1.00 0.00 H new ATOM 0 HB VAL A 43 -5.024 5.670 2.573 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -5.583 6.692 4.744 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -5.329 7.903 3.465 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -6.980 7.498 3.991 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -6.482 4.500 4.235 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -7.915 5.165 3.415 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -6.854 4.017 2.563 1.00 0.00 H new ATOM 680 N TYR A 44 -8.736 6.156 0.364 1.00 0.00 N ATOM 681 CA TYR A 44 -10.116 6.470 0.063 1.00 0.00 C ATOM 682 C TYR A 44 -10.829 5.267 -0.548 1.00 0.00 C ATOM 683 O TYR A 44 -10.192 4.328 -1.032 1.00 0.00 O ATOM 684 CB TYR A 44 -10.053 7.673 -0.878 1.00 0.00 C ATOM 685 CG TYR A 44 -11.283 7.972 -1.699 1.00 0.00 C ATOM 686 CD1 TYR A 44 -12.429 8.519 -1.104 1.00 0.00 C ATOM 687 CD2 TYR A 44 -11.250 7.707 -3.073 1.00 0.00 C ATOM 688 CE1 TYR A 44 -13.554 8.797 -1.897 1.00 0.00 C ATOM 689 CE2 TYR A 44 -12.366 7.984 -3.867 1.00 0.00 C ATOM 690 CZ TYR A 44 -13.531 8.506 -3.277 1.00 0.00 C ATOM 691 OH TYR A 44 -14.636 8.734 -4.045 1.00 0.00 O ATOM 0 H TYR A 44 -8.306 5.497 -0.285 1.00 0.00 H new ATOM 0 HA TYR A 44 -10.697 6.711 0.953 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -9.822 8.556 -0.282 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -9.218 7.523 -1.563 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -12.446 8.725 -0.044 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -10.361 7.288 -3.520 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -14.436 9.233 -1.451 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -12.334 7.798 -4.930 1.00 0.00 H new ATOM 0 HH TYR A 44 -14.448 8.479 -4.972 1.00 0.00 H new ATOM 701 N ILE A 45 -12.163 5.302 -0.518 1.00 0.00 N ATOM 702 CA ILE A 45 -12.995 4.183 -0.929 1.00 0.00 C ATOM 703 C ILE A 45 -14.155 4.685 -1.784 1.00 0.00 C ATOM 704 O ILE A 45 -14.891 5.576 -1.359 1.00 0.00 O ATOM 705 CB ILE A 45 -13.524 3.457 0.321 1.00 0.00 C ATOM 706 CG1 ILE A 45 -12.328 3.013 1.176 1.00 0.00 C ATOM 707 CG2 ILE A 45 -14.376 2.246 -0.052 1.00 0.00 C ATOM 708 CD1 ILE A 45 -12.718 2.015 2.259 1.00 0.00 C ATOM 0 H ILE A 45 -12.694 6.115 -0.205 1.00 0.00 H new ATOM 0 HA ILE A 45 -12.404 3.486 -1.523 1.00 0.00 H new ATOM 0 HB ILE A 45 -14.158 4.143 0.882 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -11.572 2.566 0.531 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -11.874 3.888 1.641 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -14.732 1.758 0.855 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -15.229 2.571 -0.648 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -13.776 1.543 -0.630 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -11.834 1.736 2.832 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -13.453 2.468 2.924 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -13.146 1.126 1.797 1.00 0.00 H new ATOM 720 N PRO A 46 -14.329 4.121 -2.989 1.00 0.00 N ATOM 721 CA PRO A 46 -15.439 4.408 -3.886 1.00 0.00 C ATOM 722 C PRO A 46 -16.721 3.744 -3.379 1.00 0.00 C ATOM 723 O PRO A 46 -17.395 3.023 -4.117 1.00 0.00 O ATOM 724 CB PRO A 46 -14.991 3.879 -5.250 1.00 0.00 C ATOM 725 CG PRO A 46 -14.112 2.694 -4.881 1.00 0.00 C ATOM 726 CD PRO A 46 -13.443 3.137 -3.582 1.00 0.00 C ATOM 0 HA PRO A 46 -15.676 5.470 -3.947 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -15.839 3.577 -5.865 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -14.440 4.631 -5.814 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -14.700 1.787 -4.741 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -13.378 2.481 -5.658 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -13.296 2.291 -2.911 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -12.459 3.565 -3.776 1.00 0.00 H new ATOM 734 N ARG A 47 -17.062 3.985 -2.108 1.00 0.00 N ATOM 735 CA ARG A 47 -18.268 3.472 -1.477 1.00 0.00 C ATOM 736 C ARG A 47 -19.495 4.223 -2.000 1.00 0.00 C ATOM 737 O ARG A 47 -20.102 5.007 -1.268 1.00 0.00 O ATOM 738 CB ARG A 47 -18.129 3.575 0.048 1.00 0.00 C ATOM 739 CG ARG A 47 -19.288 2.917 0.805 1.00 0.00 C ATOM 740 CD ARG A 47 -19.417 1.436 0.449 1.00 0.00 C ATOM 741 NE ARG A 47 -20.522 0.810 1.193 1.00 0.00 N ATOM 742 CZ ARG A 47 -20.395 0.217 2.385 1.00 0.00 C ATOM 743 NH1 ARG A 47 -19.210 0.156 2.993 1.00 0.00 N ATOM 744 NH2 ARG A 47 -21.457 -0.322 2.983 1.00 0.00 N ATOM 0 H ARG A 47 -16.491 4.554 -1.483 1.00 0.00 H new ATOM 0 HA ARG A 47 -18.404 2.420 -1.729 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -17.192 3.108 0.353 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -18.069 4.626 0.331 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -19.130 3.022 1.878 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -20.219 3.432 0.568 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -19.588 1.329 -0.622 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -18.483 0.921 0.675 1.00 0.00 H new ATOM 0 HE ARG A 47 -21.450 0.830 0.770 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -18.387 0.564 2.549 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -19.126 -0.299 3.902 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -22.371 -0.283 2.532 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -21.356 -0.773 3.892 1.00 0.00 H new ATOM 758 N ASP A 48 -19.852 3.979 -3.266 1.00 0.00 N ATOM 759 CA ASP A 48 -21.000 4.559 -3.954 1.00 0.00 C ATOM 760 C ASP A 48 -21.156 6.067 -3.749 1.00 0.00 C ATOM 761 O ASP A 48 -20.234 6.772 -3.352 1.00 0.00 O ATOM 762 CB ASP A 48 -22.270 3.775 -3.612 1.00 0.00 C ATOM 763 CG ASP A 48 -22.725 3.958 -2.164 1.00 0.00 C ATOM 764 OD1 ASP A 48 -23.470 4.936 -1.929 1.00 0.00 O ATOM 765 OD2 ASP A 48 -22.341 3.129 -1.309 1.00 0.00 O ATOM 0 H ASP A 48 -19.322 3.343 -3.861 1.00 0.00 H new ATOM 0 HA ASP A 48 -20.814 4.461 -5.023 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -23.073 4.089 -4.280 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -22.095 2.715 -3.799 1.00 0.00 H new ATOM 770 N ARG A 49 -22.369 6.533 -4.042 1.00 0.00 N ATOM 771 CA ARG A 49 -22.761 7.930 -4.124 1.00 0.00 C ATOM 772 C ARG A 49 -24.229 7.990 -4.547 1.00 0.00 C ATOM 773 O ARG A 49 -24.934 8.937 -4.208 1.00 0.00 O ATOM 774 CB ARG A 49 -21.824 8.611 -5.133 1.00 0.00 C ATOM 775 CG ARG A 49 -22.426 9.812 -5.860 1.00 0.00 C ATOM 776 CD ARG A 49 -21.450 10.224 -6.959 1.00 0.00 C ATOM 777 NE ARG A 49 -20.392 11.101 -6.444 1.00 0.00 N ATOM 778 CZ ARG A 49 -20.449 12.435 -6.443 1.00 0.00 C ATOM 779 NH1 ARG A 49 -21.504 13.084 -6.920 1.00 0.00 N ATOM 780 NH2 ARG A 49 -19.427 13.131 -5.956 1.00 0.00 N ATOM 0 H ARG A 49 -23.147 5.904 -4.239 1.00 0.00 H new ATOM 0 HA ARG A 49 -22.674 8.451 -3.170 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -20.924 8.935 -4.610 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -21.514 7.874 -5.874 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -23.396 9.555 -6.286 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -22.591 10.636 -5.166 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -21.002 9.334 -7.400 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -21.992 10.736 -7.754 1.00 0.00 H new ATOM 0 HE ARG A 49 -19.555 10.661 -6.060 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -22.295 12.563 -7.298 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -21.524 14.104 -6.908 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -18.609 12.646 -5.588 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -19.461 14.150 -5.951 1.00 0.00 H new ATOM 794 N TYR A 50 -24.688 6.971 -5.286 1.00 0.00 N ATOM 795 CA TYR A 50 -26.070 6.826 -5.721 1.00 0.00 C ATOM 796 C TYR A 50 -26.408 5.360 -6.042 1.00 0.00 C ATOM 797 O TYR A 50 -27.454 5.082 -6.626 1.00 0.00 O ATOM 798 CB TYR A 50 -26.281 7.666 -6.983 1.00 0.00 C ATOM 799 CG TYR A 50 -25.487 7.170 -8.174 1.00 0.00 C ATOM 800 CD1 TYR A 50 -24.090 7.244 -8.154 1.00 0.00 C ATOM 801 CD2 TYR A 50 -26.144 6.631 -9.289 1.00 0.00 C ATOM 802 CE1 TYR A 50 -23.343 6.751 -9.228 1.00 0.00 C ATOM 803 CE2 TYR A 50 -25.404 6.154 -10.382 1.00 0.00 C ATOM 804 CZ TYR A 50 -23.996 6.208 -10.352 1.00 0.00 C ATOM 805 OH TYR A 50 -23.269 5.734 -11.407 1.00 0.00 O ATOM 0 H TYR A 50 -24.088 6.209 -5.602 1.00 0.00 H new ATOM 0 HA TYR A 50 -26.721 7.161 -4.913 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -27.341 7.667 -7.237 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -26.002 8.699 -6.774 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -23.587 7.684 -7.306 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -27.223 6.583 -9.307 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -22.264 6.786 -9.196 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -25.912 5.747 -11.244 1.00 0.00 H new ATOM 0 HH TYR A 50 -23.877 5.394 -12.097 1.00 0.00 H new ATOM 815 N THR A 51 -25.528 4.421 -5.658 1.00 0.00 N ATOM 816 CA THR A 51 -25.639 3.013 -6.051 1.00 0.00 C ATOM 817 C THR A 51 -25.667 2.083 -4.844 1.00 0.00 C ATOM 818 O THR A 51 -25.891 0.884 -4.996 1.00 0.00 O ATOM 819 CB THR A 51 -24.461 2.641 -6.956 1.00 0.00 C ATOM 820 OG1 THR A 51 -23.261 2.680 -6.223 1.00 0.00 O ATOM 821 CG2 THR A 51 -24.321 3.642 -8.091 1.00 0.00 C ATOM 0 H THR A 51 -24.721 4.620 -5.067 1.00 0.00 H new ATOM 0 HA THR A 51 -26.581 2.891 -6.586 1.00 0.00 H new ATOM 0 HB THR A 51 -24.650 1.642 -7.349 1.00 0.00 H new ATOM 0 HG1 THR A 51 -22.512 2.439 -6.808 1.00 0.00 H new ATOM 0 HG21 THR A 51 -23.479 3.360 -8.723 1.00 0.00 H new ATOM 0 HG22 THR A 51 -25.234 3.648 -8.686 1.00 0.00 H new ATOM 0 HG23 THR A 51 -24.149 4.637 -7.680 1.00 0.00 H new ATOM 828 N LYS A 52 -25.441 2.648 -3.655 1.00 0.00 N ATOM 829 CA LYS A 52 -25.445 1.966 -2.363 1.00 0.00 C ATOM 830 C LYS A 52 -24.759 0.597 -2.380 1.00 0.00 C ATOM 831 O LYS A 52 -25.256 -0.359 -1.785 1.00 0.00 O ATOM 832 CB LYS A 52 -26.847 1.936 -1.733 1.00 0.00 C ATOM 833 CG LYS A 52 -27.871 1.102 -2.509 1.00 0.00 C ATOM 834 CD LYS A 52 -28.670 1.959 -3.493 1.00 0.00 C ATOM 835 CE LYS A 52 -29.651 1.088 -4.270 1.00 0.00 C ATOM 836 NZ LYS A 52 -28.947 0.107 -5.124 1.00 0.00 N ATOM 0 H LYS A 52 -25.240 3.644 -3.566 1.00 0.00 H new ATOM 0 HA LYS A 52 -24.820 2.571 -1.705 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -26.768 1.542 -0.720 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -27.217 2.958 -1.650 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -27.358 0.308 -3.051 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -28.553 0.620 -1.809 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -29.211 2.737 -2.954 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -27.992 2.461 -4.183 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -30.304 0.563 -3.573 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -30.288 1.719 -4.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -29.329 0.150 -6.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -27.931 0.329 -5.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -29.085 -0.850 -4.740 1.00 0.00 H new ATOM 850 N GLU A 53 -23.613 0.495 -3.061 1.00 0.00 N ATOM 851 CA GLU A 53 -22.838 -0.730 -3.133 1.00 0.00 C ATOM 852 C GLU A 53 -21.351 -0.429 -2.943 1.00 0.00 C ATOM 853 O GLU A 53 -20.957 0.714 -2.719 1.00 0.00 O ATOM 854 CB GLU A 53 -23.125 -1.456 -4.452 1.00 0.00 C ATOM 855 CG GLU A 53 -22.786 -0.588 -5.662 1.00 0.00 C ATOM 856 CD GLU A 53 -23.098 -1.306 -6.975 1.00 0.00 C ATOM 857 OE1 GLU A 53 -24.239 -1.798 -7.112 1.00 0.00 O ATOM 858 OE2 GLU A 53 -22.188 -1.356 -7.830 1.00 0.00 O ATOM 0 H GLU A 53 -23.201 1.271 -3.579 1.00 0.00 H new ATOM 0 HA GLU A 53 -23.134 -1.398 -2.324 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -22.546 -2.379 -4.493 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -24.177 -1.738 -4.490 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -23.351 0.343 -5.613 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -21.729 -0.321 -5.635 1.00 0.00 H new ATOM 865 N SER A 54 -20.513 -1.461 -3.031 1.00 0.00 N ATOM 866 CA SER A 54 -19.091 -1.369 -2.712 1.00 0.00 C ATOM 867 C SER A 54 -18.257 -2.222 -3.667 1.00 0.00 C ATOM 868 O SER A 54 -18.793 -2.822 -4.598 1.00 0.00 O ATOM 869 CB SER A 54 -18.884 -1.795 -1.260 1.00 0.00 C ATOM 870 OG SER A 54 -17.550 -1.564 -0.855 1.00 0.00 O ATOM 0 H SER A 54 -20.806 -2.392 -3.328 1.00 0.00 H new ATOM 0 HA SER A 54 -18.756 -0.339 -2.835 1.00 0.00 H new ATOM 0 HB2 SER A 54 -19.566 -1.243 -0.613 1.00 0.00 H new ATOM 0 HB3 SER A 54 -19.125 -2.852 -1.148 1.00 0.00 H new ATOM 0 HG SER A 54 -17.439 -1.842 0.078 1.00 0.00 H new ATOM 876 N ARG A 55 -16.939 -2.271 -3.437 1.00 0.00 N ATOM 877 CA ARG A 55 -15.996 -2.953 -4.321 1.00 0.00 C ATOM 878 C ARG A 55 -15.032 -3.859 -3.554 1.00 0.00 C ATOM 879 O ARG A 55 -14.203 -4.525 -4.167 1.00 0.00 O ATOM 880 CB ARG A 55 -15.219 -1.911 -5.130 1.00 0.00 C ATOM 881 CG ARG A 55 -16.122 -1.033 -6.001 1.00 0.00 C ATOM 882 CD ARG A 55 -16.752 -1.865 -7.118 1.00 0.00 C ATOM 883 NE ARG A 55 -17.610 -1.041 -7.977 1.00 0.00 N ATOM 884 CZ ARG A 55 -18.946 -1.084 -7.978 1.00 0.00 C ATOM 885 NH1 ARG A 55 -19.609 -1.896 -7.161 1.00 0.00 N ATOM 886 NH2 ARG A 55 -19.637 -0.308 -8.804 1.00 0.00 N ATOM 0 H ARG A 55 -16.498 -1.835 -2.627 1.00 0.00 H new ATOM 0 HA ARG A 55 -16.567 -3.596 -4.991 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -14.654 -1.276 -4.447 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -14.494 -2.420 -5.766 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -16.903 -0.583 -5.389 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -15.542 -0.216 -6.430 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -15.967 -2.325 -7.718 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -17.338 -2.675 -6.685 1.00 0.00 H new ATOM 0 HE ARG A 55 -17.156 -0.390 -8.618 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -19.098 -2.501 -6.518 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -20.629 -1.914 -7.177 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -19.149 0.323 -9.440 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -20.656 -0.342 -8.803 1.00 0.00 H new ATOM 900 N GLY A 56 -15.126 -3.890 -2.221 1.00 0.00 N ATOM 901 CA GLY A 56 -14.310 -4.790 -1.414 1.00 0.00 C ATOM 902 C GLY A 56 -12.841 -4.379 -1.361 1.00 0.00 C ATOM 903 O GLY A 56 -11.973 -5.221 -1.128 1.00 0.00 O ATOM 0 H GLY A 56 -15.760 -3.301 -1.682 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -14.709 -4.822 -0.400 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -14.385 -5.800 -1.818 1.00 0.00 H new ATOM 907 N PHE A 57 -12.541 -3.096 -1.574 1.00 0.00 N ATOM 908 CA PHE A 57 -11.177 -2.597 -1.486 1.00 0.00 C ATOM 909 C PHE A 57 -11.166 -1.126 -1.077 1.00 0.00 C ATOM 910 O PHE A 57 -12.207 -0.477 -1.021 1.00 0.00 O ATOM 911 CB PHE A 57 -10.457 -2.812 -2.821 1.00 0.00 C ATOM 912 CG PHE A 57 -11.065 -2.134 -4.033 1.00 0.00 C ATOM 913 CD1 PHE A 57 -11.007 -0.740 -4.170 1.00 0.00 C ATOM 914 CD2 PHE A 57 -11.666 -2.908 -5.038 1.00 0.00 C ATOM 915 CE1 PHE A 57 -11.533 -0.127 -5.315 1.00 0.00 C ATOM 916 CE2 PHE A 57 -12.172 -2.292 -6.193 1.00 0.00 C ATOM 917 CZ PHE A 57 -12.109 -0.901 -6.330 1.00 0.00 C ATOM 0 H PHE A 57 -13.232 -2.384 -1.810 1.00 0.00 H new ATOM 0 HA PHE A 57 -10.643 -3.154 -0.716 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -9.430 -2.464 -2.715 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -10.412 -3.883 -3.016 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -10.557 -0.139 -3.394 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -11.739 -3.979 -4.922 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -11.494 0.948 -5.415 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -12.610 -2.892 -6.977 1.00 0.00 H new ATOM 0 HZ PHE A 57 -12.503 -0.426 -7.216 1.00 0.00 H new ATOM 927 N ALA A 58 -9.969 -0.617 -0.798 1.00 0.00 N ATOM 928 CA ALA A 58 -9.750 0.769 -0.421 1.00 0.00 C ATOM 929 C ALA A 58 -8.498 1.259 -1.129 1.00 0.00 C ATOM 930 O ALA A 58 -7.388 0.921 -0.729 1.00 0.00 O ATOM 931 CB ALA A 58 -9.615 0.900 1.096 1.00 0.00 C ATOM 0 H ALA A 58 -9.112 -1.169 -0.829 1.00 0.00 H new ATOM 0 HA ALA A 58 -10.602 1.380 -0.720 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -9.452 1.945 1.358 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -10.528 0.544 1.575 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -8.769 0.304 1.439 1.00 0.00 H new ATOM 937 N PHE A 59 -8.697 2.053 -2.183 1.00 0.00 N ATOM 938 CA PHE A 59 -7.632 2.525 -3.051 1.00 0.00 C ATOM 939 C PHE A 59 -6.773 3.520 -2.281 1.00 0.00 C ATOM 940 O PHE A 59 -7.057 4.721 -2.245 1.00 0.00 O ATOM 941 CB PHE A 59 -8.259 3.113 -4.326 1.00 0.00 C ATOM 942 CG PHE A 59 -7.312 3.820 -5.283 1.00 0.00 C ATOM 943 CD1 PHE A 59 -6.613 3.124 -6.282 1.00 0.00 C ATOM 944 CD2 PHE A 59 -7.159 5.213 -5.170 1.00 0.00 C ATOM 945 CE1 PHE A 59 -5.739 3.812 -7.137 1.00 0.00 C ATOM 946 CE2 PHE A 59 -6.304 5.899 -6.040 1.00 0.00 C ATOM 947 CZ PHE A 59 -5.575 5.198 -7.013 1.00 0.00 C ATOM 0 H PHE A 59 -9.621 2.388 -2.457 1.00 0.00 H new ATOM 0 HA PHE A 59 -6.974 1.714 -3.363 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -8.752 2.306 -4.868 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -9.035 3.819 -4.030 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -6.748 2.058 -6.392 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -7.702 5.755 -4.410 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -5.190 3.271 -7.894 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -6.205 6.972 -5.962 1.00 0.00 H new ATOM 0 HZ PHE A 59 -4.891 5.724 -7.663 1.00 0.00 H new ATOM 957 N VAL A 60 -5.711 3.011 -1.652 1.00 0.00 N ATOM 958 CA VAL A 60 -4.713 3.874 -1.028 1.00 0.00 C ATOM 959 C VAL A 60 -3.790 4.380 -2.123 1.00 0.00 C ATOM 960 O VAL A 60 -3.744 3.774 -3.192 1.00 0.00 O ATOM 961 CB VAL A 60 -3.921 3.101 0.031 1.00 0.00 C ATOM 962 CG1 VAL A 60 -2.942 4.000 0.793 1.00 0.00 C ATOM 963 CG2 VAL A 60 -4.888 2.513 1.052 1.00 0.00 C ATOM 0 H VAL A 60 -5.523 2.012 -1.563 1.00 0.00 H new ATOM 0 HA VAL A 60 -5.197 4.712 -0.526 1.00 0.00 H new ATOM 0 HB VAL A 60 -3.359 2.327 -0.491 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -2.404 3.407 1.533 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -2.231 4.439 0.093 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -3.494 4.794 1.296 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -4.328 1.962 1.808 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -5.447 3.318 1.529 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -5.581 1.838 0.550 1.00 0.00 H new ATOM 973 N ARG A 61 -3.058 5.466 -1.866 1.00 0.00 N ATOM 974 CA ARG A 61 -2.149 6.054 -2.835 1.00 0.00 C ATOM 975 C ARG A 61 -0.881 6.557 -2.139 1.00 0.00 C ATOM 976 O ARG A 61 -0.975 7.267 -1.140 1.00 0.00 O ATOM 977 CB ARG A 61 -2.885 7.180 -3.574 1.00 0.00 C ATOM 978 CG ARG A 61 -2.128 7.572 -4.839 1.00 0.00 C ATOM 979 CD ARG A 61 -2.878 8.695 -5.554 1.00 0.00 C ATOM 980 NE ARG A 61 -2.461 8.778 -6.959 1.00 0.00 N ATOM 981 CZ ARG A 61 -3.318 8.822 -7.980 1.00 0.00 C ATOM 982 NH1 ARG A 61 -4.626 8.889 -7.766 1.00 0.00 N ATOM 983 NH2 ARG A 61 -2.862 8.799 -9.228 1.00 0.00 N ATOM 0 H ARG A 61 -3.084 5.960 -0.974 1.00 0.00 H new ATOM 0 HA ARG A 61 -1.834 5.306 -3.563 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -3.893 6.856 -3.832 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -2.986 8.046 -2.920 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -1.119 7.898 -4.586 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -2.028 6.710 -5.498 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -3.952 8.517 -5.497 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -2.685 9.645 -5.055 1.00 0.00 H new ATOM 0 HE ARG A 61 -1.462 8.803 -7.165 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -4.986 8.907 -6.812 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -5.271 8.922 -8.556 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -1.859 8.748 -9.403 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -3.515 8.833 -10.010 1.00 0.00 H new ATOM 997 N PHE A 62 0.302 6.199 -2.652 1.00 0.00 N ATOM 998 CA PHE A 62 1.573 6.643 -2.069 1.00 0.00 C ATOM 999 C PHE A 62 2.309 7.582 -3.013 1.00 0.00 C ATOM 1000 O PHE A 62 1.970 7.673 -4.192 1.00 0.00 O ATOM 1001 CB PHE A 62 2.509 5.458 -1.800 1.00 0.00 C ATOM 1002 CG PHE A 62 2.223 4.639 -0.563 1.00 0.00 C ATOM 1003 CD1 PHE A 62 0.991 3.992 -0.391 1.00 0.00 C ATOM 1004 CD2 PHE A 62 3.223 4.528 0.411 1.00 0.00 C ATOM 1005 CE1 PHE A 62 0.774 3.203 0.749 1.00 0.00 C ATOM 1006 CE2 PHE A 62 3.016 3.718 1.532 1.00 0.00 C ATOM 1007 CZ PHE A 62 1.800 3.044 1.695 1.00 0.00 C ATOM 0 H PHE A 62 0.405 5.601 -3.472 1.00 0.00 H new ATOM 0 HA PHE A 62 1.321 7.150 -1.137 1.00 0.00 H new ATOM 0 HB2 PHE A 62 2.475 4.794 -2.664 1.00 0.00 H new ATOM 0 HB3 PHE A 62 3.528 5.838 -1.729 1.00 0.00 H new ATOM 0 HD1 PHE A 62 0.213 4.100 -1.132 1.00 0.00 H new ATOM 0 HD2 PHE A 62 4.152 5.067 0.297 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -0.180 2.719 0.899 1.00 0.00 H new ATOM 0 HE2 PHE A 62 3.795 3.612 2.273 1.00 0.00 H new ATOM 0 HZ PHE A 62 1.650 2.401 2.550 1.00 0.00 H new ATOM 1017 N HIS A 63 3.320 8.277 -2.478 1.00 0.00 N ATOM 1018 CA HIS A 63 4.113 9.229 -3.242 1.00 0.00 C ATOM 1019 C HIS A 63 5.605 8.926 -3.230 1.00 0.00 C ATOM 1020 O HIS A 63 6.290 9.180 -4.223 1.00 0.00 O ATOM 1021 CB HIS A 63 3.877 10.665 -2.759 1.00 0.00 C ATOM 1022 CG HIS A 63 3.232 10.871 -1.407 1.00 0.00 C ATOM 1023 ND1 HIS A 63 3.433 10.167 -0.247 1.00 0.00 N flip ATOM 1024 CD2 HIS A 63 2.301 11.885 -1.163 1.00 0.00 C flip ATOM 1025 CE1 HIS A 63 2.627 10.752 0.703 1.00 0.00 C flip ATOM 1026 NE2 HIS A 63 1.971 11.776 0.130 1.00 0.00 N flip ATOM 0 H HIS A 63 3.606 8.190 -1.503 1.00 0.00 H new ATOM 0 HA HIS A 63 3.771 9.128 -4.272 1.00 0.00 H new ATOM 0 HB2 HIS A 63 4.841 11.175 -2.748 1.00 0.00 H new ATOM 0 HB3 HIS A 63 3.258 11.168 -3.502 1.00 0.00 H new ATOM 0 HD2 HIS A 63 1.925 12.608 -1.872 1.00 0.00 H new ATOM 0 HE1 HIS A 63 2.537 10.441 1.733 1.00 0.00 H new ATOM 0 HE2 HIS A 63 1.312 12.386 0.614 1.00 0.00 H new ATOM 1034 N ASP A 64 6.121 8.384 -2.131 1.00 0.00 N ATOM 1035 CA ASP A 64 7.520 8.001 -2.060 1.00 0.00 C ATOM 1036 C ASP A 64 7.730 6.681 -2.785 1.00 0.00 C ATOM 1037 O ASP A 64 7.089 5.684 -2.456 1.00 0.00 O ATOM 1038 CB ASP A 64 7.916 7.842 -0.594 1.00 0.00 C ATOM 1039 CG ASP A 64 8.422 9.162 -0.027 1.00 0.00 C ATOM 1040 OD1 ASP A 64 9.628 9.433 -0.211 1.00 0.00 O ATOM 1041 OD2 ASP A 64 7.608 9.886 0.582 1.00 0.00 O ATOM 0 H ASP A 64 5.589 8.202 -1.280 1.00 0.00 H new ATOM 0 HA ASP A 64 8.133 8.769 -2.531 1.00 0.00 H new ATOM 0 HB2 ASP A 64 7.059 7.497 -0.016 1.00 0.00 H new ATOM 0 HB3 ASP A 64 8.690 7.080 -0.502 1.00 0.00 H new ATOM 1046 N LYS A 65 8.630 6.665 -3.774 1.00 0.00 N ATOM 1047 CA LYS A 65 8.942 5.448 -4.506 1.00 0.00 C ATOM 1048 C LYS A 65 9.485 4.390 -3.553 1.00 0.00 C ATOM 1049 O LYS A 65 8.964 3.281 -3.520 1.00 0.00 O ATOM 1050 CB LYS A 65 9.943 5.778 -5.618 1.00 0.00 C ATOM 1051 CG LYS A 65 10.598 4.536 -6.244 1.00 0.00 C ATOM 1052 CD LYS A 65 9.586 3.506 -6.768 1.00 0.00 C ATOM 1053 CE LYS A 65 8.618 4.104 -7.787 1.00 0.00 C ATOM 1054 NZ LYS A 65 9.328 4.570 -8.995 1.00 0.00 N ATOM 0 H LYS A 65 9.152 7.486 -4.081 1.00 0.00 H new ATOM 0 HA LYS A 65 8.040 5.042 -4.963 1.00 0.00 H new ATOM 0 HB2 LYS A 65 9.433 6.342 -6.399 1.00 0.00 H new ATOM 0 HB3 LYS A 65 10.722 6.425 -5.214 1.00 0.00 H new ATOM 0 HG2 LYS A 65 11.242 4.850 -7.065 1.00 0.00 H new ATOM 0 HG3 LYS A 65 11.238 4.059 -5.501 1.00 0.00 H new ATOM 0 HD2 LYS A 65 10.122 2.675 -7.225 1.00 0.00 H new ATOM 0 HD3 LYS A 65 9.020 3.098 -5.930 1.00 0.00 H new ATOM 0 HE2 LYS A 65 7.874 3.358 -8.066 1.00 0.00 H new ATOM 0 HE3 LYS A 65 8.080 4.937 -7.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 8.637 4.908 -9.695 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 9.972 5.346 -8.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 9.875 3.784 -9.401 1.00 0.00 H new ATOM 1068 N ARG A 66 10.524 4.728 -2.779 1.00 0.00 N ATOM 1069 CA ARG A 66 11.177 3.766 -1.902 1.00 0.00 C ATOM 1070 C ARG A 66 10.229 3.185 -0.852 1.00 0.00 C ATOM 1071 O ARG A 66 10.378 2.025 -0.472 1.00 0.00 O ATOM 1072 CB ARG A 66 12.430 4.371 -1.266 1.00 0.00 C ATOM 1073 CG ARG A 66 12.166 5.499 -0.258 1.00 0.00 C ATOM 1074 CD ARG A 66 11.676 6.804 -0.891 1.00 0.00 C ATOM 1075 NE ARG A 66 12.619 7.298 -1.900 1.00 0.00 N ATOM 1076 CZ ARG A 66 12.591 8.525 -2.426 1.00 0.00 C ATOM 1077 NH1 ARG A 66 11.684 9.420 -2.039 1.00 0.00 N ATOM 1078 NH2 ARG A 66 13.479 8.873 -3.351 1.00 0.00 N ATOM 0 H ARG A 66 10.926 5.665 -2.747 1.00 0.00 H new ATOM 0 HA ARG A 66 11.487 2.926 -2.523 1.00 0.00 H new ATOM 0 HB2 ARG A 66 12.984 3.578 -0.764 1.00 0.00 H new ATOM 0 HB3 ARG A 66 13.072 4.755 -2.059 1.00 0.00 H new ATOM 0 HG2 ARG A 66 11.425 5.159 0.465 1.00 0.00 H new ATOM 0 HG3 ARG A 66 13.084 5.699 0.295 1.00 0.00 H new ATOM 0 HD2 ARG A 66 10.701 6.643 -1.350 1.00 0.00 H new ATOM 0 HD3 ARG A 66 11.543 7.558 -0.116 1.00 0.00 H new ATOM 0 HE ARG A 66 13.347 6.660 -2.222 1.00 0.00 H new ATOM 0 HH11 ARG A 66 10.995 9.173 -1.329 1.00 0.00 H new ATOM 0 HH12 ARG A 66 11.679 10.352 -2.453 1.00 0.00 H new ATOM 0 HH21 ARG A 66 14.183 8.203 -3.660 1.00 0.00 H new ATOM 0 HH22 ARG A 66 13.457 9.811 -3.752 1.00 0.00 H new ATOM 1092 N ASP A 67 9.263 3.975 -0.382 1.00 0.00 N ATOM 1093 CA ASP A 67 8.340 3.513 0.647 1.00 0.00 C ATOM 1094 C ASP A 67 7.178 2.752 0.012 1.00 0.00 C ATOM 1095 O ASP A 67 6.522 1.954 0.678 1.00 0.00 O ATOM 1096 CB ASP A 67 7.812 4.703 1.443 1.00 0.00 C ATOM 1097 CG ASP A 67 8.927 5.456 2.166 1.00 0.00 C ATOM 1098 OD1 ASP A 67 9.908 4.800 2.582 1.00 0.00 O ATOM 1099 OD2 ASP A 67 8.792 6.694 2.300 1.00 0.00 O ATOM 0 H ASP A 67 9.102 4.932 -0.697 1.00 0.00 H new ATOM 0 HA ASP A 67 8.872 2.841 1.321 1.00 0.00 H new ATOM 0 HB2 ASP A 67 7.292 5.385 0.771 1.00 0.00 H new ATOM 0 HB3 ASP A 67 7.080 4.354 2.172 1.00 0.00 H new ATOM 1104 N ALA A 68 6.924 2.998 -1.277 1.00 0.00 N ATOM 1105 CA ALA A 68 5.872 2.329 -2.009 1.00 0.00 C ATOM 1106 C ALA A 68 6.328 0.943 -2.450 1.00 0.00 C ATOM 1107 O ALA A 68 5.572 -0.019 -2.339 1.00 0.00 O ATOM 1108 CB ALA A 68 5.560 3.167 -3.246 1.00 0.00 C ATOM 0 H ALA A 68 7.451 3.671 -1.834 1.00 0.00 H new ATOM 0 HA ALA A 68 4.993 2.219 -1.374 1.00 0.00 H new ATOM 0 HB1 ALA A 68 4.768 2.687 -3.820 1.00 0.00 H new ATOM 0 HB2 ALA A 68 5.234 4.161 -2.939 1.00 0.00 H new ATOM 0 HB3 ALA A 68 6.455 3.252 -3.863 1.00 0.00 H new ATOM 1114 N GLU A 69 7.561 0.838 -2.953 1.00 0.00 N ATOM 1115 CA GLU A 69 8.054 -0.446 -3.418 1.00 0.00 C ATOM 1116 C GLU A 69 8.342 -1.383 -2.249 1.00 0.00 C ATOM 1117 O GLU A 69 8.251 -2.599 -2.403 1.00 0.00 O ATOM 1118 CB GLU A 69 9.286 -0.275 -4.309 1.00 0.00 C ATOM 1119 CG GLU A 69 10.454 0.366 -3.562 1.00 0.00 C ATOM 1120 CD GLU A 69 11.748 0.242 -4.362 1.00 0.00 C ATOM 1121 OE1 GLU A 69 12.407 -0.812 -4.230 1.00 0.00 O ATOM 1122 OE2 GLU A 69 12.070 1.201 -5.100 1.00 0.00 O ATOM 0 H GLU A 69 8.218 1.613 -3.045 1.00 0.00 H new ATOM 0 HA GLU A 69 7.270 -0.903 -4.022 1.00 0.00 H new ATOM 0 HB2 GLU A 69 9.593 -1.248 -4.693 1.00 0.00 H new ATOM 0 HB3 GLU A 69 9.027 0.340 -5.171 1.00 0.00 H new ATOM 0 HG2 GLU A 69 10.237 1.418 -3.375 1.00 0.00 H new ATOM 0 HG3 GLU A 69 10.576 -0.113 -2.590 1.00 0.00 H new ATOM 1129 N ASP A 70 8.688 -0.835 -1.079 1.00 0.00 N ATOM 1130 CA ASP A 70 8.913 -1.669 0.087 1.00 0.00 C ATOM 1131 C ASP A 70 7.586 -2.201 0.625 1.00 0.00 C ATOM 1132 O ASP A 70 7.503 -3.364 1.013 1.00 0.00 O ATOM 1133 CB ASP A 70 9.644 -0.854 1.153 1.00 0.00 C ATOM 1134 CG ASP A 70 10.009 -1.723 2.356 1.00 0.00 C ATOM 1135 OD1 ASP A 70 10.882 -2.602 2.190 1.00 0.00 O ATOM 1136 OD2 ASP A 70 9.414 -1.499 3.435 1.00 0.00 O ATOM 0 H ASP A 70 8.814 0.165 -0.924 1.00 0.00 H new ATOM 0 HA ASP A 70 9.528 -2.525 -0.191 1.00 0.00 H new ATOM 0 HB2 ASP A 70 10.548 -0.420 0.727 1.00 0.00 H new ATOM 0 HB3 ASP A 70 9.014 -0.025 1.477 1.00 0.00 H new ATOM 1141 N ALA A 71 6.542 -1.367 0.650 1.00 0.00 N ATOM 1142 CA ALA A 71 5.256 -1.781 1.190 1.00 0.00 C ATOM 1143 C ALA A 71 4.639 -2.909 0.362 1.00 0.00 C ATOM 1144 O ALA A 71 3.944 -3.764 0.912 1.00 0.00 O ATOM 1145 CB ALA A 71 4.318 -0.575 1.239 1.00 0.00 C ATOM 0 H ALA A 71 6.567 -0.408 0.303 1.00 0.00 H new ATOM 0 HA ALA A 71 5.409 -2.166 2.198 1.00 0.00 H new ATOM 0 HB1 ALA A 71 3.353 -0.881 1.643 1.00 0.00 H new ATOM 0 HB2 ALA A 71 4.750 0.196 1.876 1.00 0.00 H new ATOM 0 HB3 ALA A 71 4.181 -0.179 0.233 1.00 0.00 H new ATOM 1151 N MET A 72 4.884 -2.924 -0.952 1.00 0.00 N ATOM 1152 CA MET A 72 4.345 -3.989 -1.781 1.00 0.00 C ATOM 1153 C MET A 72 5.207 -5.237 -1.611 1.00 0.00 C ATOM 1154 O MET A 72 4.693 -6.354 -1.575 1.00 0.00 O ATOM 1155 CB MET A 72 4.251 -3.536 -3.241 1.00 0.00 C ATOM 1156 CG MET A 72 5.433 -3.981 -4.108 1.00 0.00 C ATOM 1157 SD MET A 72 5.235 -3.562 -5.856 1.00 0.00 S ATOM 1158 CE MET A 72 5.548 -1.782 -5.764 1.00 0.00 C ATOM 0 H MET A 72 5.439 -2.226 -1.448 1.00 0.00 H new ATOM 0 HA MET A 72 3.331 -4.234 -1.466 1.00 0.00 H new ATOM 0 HB2 MET A 72 3.329 -3.926 -3.673 1.00 0.00 H new ATOM 0 HB3 MET A 72 4.181 -2.449 -3.270 1.00 0.00 H new ATOM 0 HG2 MET A 72 6.345 -3.518 -3.732 1.00 0.00 H new ATOM 0 HG3 MET A 72 5.560 -5.059 -4.012 1.00 0.00 H new ATOM 0 HE1 MET A 72 4.882 -1.259 -6.450 1.00 0.00 H new ATOM 0 HE2 MET A 72 5.368 -1.433 -4.747 1.00 0.00 H new ATOM 0 HE3 MET A 72 6.583 -1.580 -6.039 1.00 0.00 H new ATOM 1168 N ASP A 73 6.526 -5.043 -1.504 1.00 0.00 N ATOM 1169 CA ASP A 73 7.476 -6.133 -1.349 1.00 0.00 C ATOM 1170 C ASP A 73 7.528 -6.637 0.097 1.00 0.00 C ATOM 1171 O ASP A 73 8.329 -7.521 0.404 1.00 0.00 O ATOM 1172 CB ASP A 73 8.855 -5.648 -1.808 1.00 0.00 C ATOM 1173 CG ASP A 73 9.876 -6.787 -1.870 1.00 0.00 C ATOM 1174 OD1 ASP A 73 9.596 -7.776 -2.584 1.00 0.00 O ATOM 1175 OD2 ASP A 73 10.930 -6.655 -1.210 1.00 0.00 O ATOM 0 H ASP A 73 6.959 -4.120 -1.523 1.00 0.00 H new ATOM 0 HA ASP A 73 7.155 -6.975 -1.963 1.00 0.00 H new ATOM 0 HB2 ASP A 73 8.767 -5.187 -2.792 1.00 0.00 H new ATOM 0 HB3 ASP A 73 9.213 -4.878 -1.125 1.00 0.00 H new ATOM 1180 N ALA A 74 6.694 -6.096 0.992 1.00 0.00 N ATOM 1181 CA ALA A 74 6.732 -6.478 2.394 1.00 0.00 C ATOM 1182 C ALA A 74 5.358 -6.814 2.963 1.00 0.00 C ATOM 1183 O ALA A 74 5.287 -7.328 4.080 1.00 0.00 O ATOM 1184 CB ALA A 74 7.342 -5.334 3.198 1.00 0.00 C ATOM 0 H ALA A 74 5.989 -5.395 0.764 1.00 0.00 H new ATOM 0 HA ALA A 74 7.335 -7.383 2.467 1.00 0.00 H new ATOM 0 HB1 ALA A 74 7.376 -5.608 4.252 1.00 0.00 H new ATOM 0 HB2 ALA A 74 8.353 -5.137 2.841 1.00 0.00 H new ATOM 0 HB3 ALA A 74 6.733 -4.438 3.076 1.00 0.00 H new ATOM 1190 N MET A 75 4.272 -6.546 2.228 1.00 0.00 N ATOM 1191 CA MET A 75 2.957 -6.832 2.779 1.00 0.00 C ATOM 1192 C MET A 75 1.898 -7.266 1.766 1.00 0.00 C ATOM 1193 O MET A 75 0.853 -7.762 2.179 1.00 0.00 O ATOM 1194 CB MET A 75 2.485 -5.606 3.552 1.00 0.00 C ATOM 1195 CG MET A 75 1.611 -6.052 4.717 1.00 0.00 C ATOM 1196 SD MET A 75 1.193 -4.753 5.913 1.00 0.00 S ATOM 1197 CE MET A 75 0.746 -3.428 4.768 1.00 0.00 C ATOM 0 H MET A 75 4.280 -6.148 1.289 1.00 0.00 H new ATOM 0 HA MET A 75 3.076 -7.701 3.427 1.00 0.00 H new ATOM 0 HB2 MET A 75 3.342 -5.042 3.920 1.00 0.00 H new ATOM 0 HB3 MET A 75 1.924 -4.941 2.895 1.00 0.00 H new ATOM 0 HG2 MET A 75 0.686 -6.467 4.318 1.00 0.00 H new ATOM 0 HG3 MET A 75 2.121 -6.858 5.244 1.00 0.00 H new ATOM 0 HE1 MET A 75 0.308 -2.599 5.324 1.00 0.00 H new ATOM 0 HE2 MET A 75 1.638 -3.083 4.245 1.00 0.00 H new ATOM 0 HE3 MET A 75 0.022 -3.802 4.044 1.00 0.00 H new ATOM 1207 N ASP A 76 2.122 -7.099 0.460 1.00 0.00 N ATOM 1208 CA ASP A 76 1.181 -7.635 -0.513 1.00 0.00 C ATOM 1209 C ASP A 76 1.063 -9.141 -0.303 1.00 0.00 C ATOM 1210 O ASP A 76 2.064 -9.857 -0.309 1.00 0.00 O ATOM 1211 CB ASP A 76 1.682 -7.314 -1.922 1.00 0.00 C ATOM 1212 CG ASP A 76 0.948 -8.115 -2.993 1.00 0.00 C ATOM 1213 OD1 ASP A 76 -0.169 -7.693 -3.357 1.00 0.00 O ATOM 1214 OD2 ASP A 76 1.510 -9.140 -3.440 1.00 0.00 O ATOM 0 H ASP A 76 2.925 -6.610 0.064 1.00 0.00 H new ATOM 0 HA ASP A 76 0.196 -7.185 -0.386 1.00 0.00 H new ATOM 0 HB2 ASP A 76 1.555 -6.249 -2.117 1.00 0.00 H new ATOM 0 HB3 ASP A 76 2.750 -7.524 -1.982 1.00 0.00 H new ATOM 1219 N GLY A 77 -0.171 -9.619 -0.117 1.00 0.00 N ATOM 1220 CA GLY A 77 -0.431 -11.040 0.048 1.00 0.00 C ATOM 1221 C GLY A 77 -0.054 -11.573 1.426 1.00 0.00 C ATOM 1222 O GLY A 77 0.272 -12.753 1.543 1.00 0.00 O ATOM 0 H GLY A 77 -1.005 -9.034 -0.078 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -1.490 -11.230 -0.129 1.00 0.00 H new ATOM 0 HA3 GLY A 77 0.123 -11.593 -0.710 1.00 0.00 H new ATOM 1226 N ALA A 78 -0.090 -10.738 2.472 1.00 0.00 N ATOM 1227 CA ALA A 78 0.223 -11.177 3.832 1.00 0.00 C ATOM 1228 C ALA A 78 -0.998 -11.871 4.440 1.00 0.00 C ATOM 1229 O ALA A 78 -1.307 -11.716 5.620 1.00 0.00 O ATOM 1230 CB ALA A 78 0.665 -9.977 4.670 1.00 0.00 C ATOM 0 H ALA A 78 -0.334 -9.750 2.399 1.00 0.00 H new ATOM 0 HA ALA A 78 1.044 -11.894 3.814 1.00 0.00 H new ATOM 0 HB1 ALA A 78 0.898 -10.306 5.683 1.00 0.00 H new ATOM 0 HB2 ALA A 78 1.551 -9.527 4.222 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -0.138 -9.241 4.703 1.00 0.00 H new ATOM 1236 N VAL A 79 -1.694 -12.637 3.595 1.00 0.00 N ATOM 1237 CA VAL A 79 -3.000 -13.209 3.863 1.00 0.00 C ATOM 1238 C VAL A 79 -3.029 -14.347 4.865 1.00 0.00 C ATOM 1239 O VAL A 79 -1.995 -14.830 5.330 1.00 0.00 O ATOM 1240 CB VAL A 79 -3.598 -13.652 2.534 1.00 0.00 C ATOM 1241 CG1 VAL A 79 -2.994 -14.954 2.014 1.00 0.00 C ATOM 1242 CG2 VAL A 79 -5.107 -13.717 2.559 1.00 0.00 C ATOM 0 H VAL A 79 -1.341 -12.881 2.670 1.00 0.00 H new ATOM 0 HA VAL A 79 -3.590 -12.428 4.342 1.00 0.00 H new ATOM 0 HB VAL A 79 -3.326 -12.870 1.825 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -3.460 -15.218 1.065 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -1.922 -14.825 1.868 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -3.168 -15.750 2.737 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -5.474 -14.038 1.584 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -5.428 -14.428 3.320 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -5.510 -12.731 2.791 1.00 0.00 H new ATOM 1252 N LEU A 80 -4.258 -14.759 5.181 1.00 0.00 N ATOM 1253 CA LEU A 80 -4.488 -15.873 6.096 1.00 0.00 C ATOM 1254 C LEU A 80 -5.800 -16.616 5.827 1.00 0.00 C ATOM 1255 O LEU A 80 -6.101 -17.575 6.531 1.00 0.00 O ATOM 1256 CB LEU A 80 -4.417 -15.391 7.553 1.00 0.00 C ATOM 1257 CG LEU A 80 -5.734 -14.817 8.101 1.00 0.00 C ATOM 1258 CD1 LEU A 80 -5.514 -14.356 9.538 1.00 0.00 C ATOM 1259 CD2 LEU A 80 -6.226 -13.626 7.284 1.00 0.00 C ATOM 0 H LEU A 80 -5.110 -14.335 4.814 1.00 0.00 H new ATOM 0 HA LEU A 80 -3.691 -16.595 5.918 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -4.109 -16.225 8.183 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -3.642 -14.628 7.633 1.00 0.00 H new ATOM 0 HG LEU A 80 -6.486 -15.604 8.045 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -6.443 -13.947 9.935 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -5.200 -15.203 10.148 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -4.741 -13.588 9.559 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -7.159 -13.254 7.708 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -5.476 -12.835 7.306 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -6.395 -13.937 6.253 1.00 0.00 H new ATOM 1271 N ASP A 81 -6.580 -16.190 4.829 1.00 0.00 N ATOM 1272 CA ASP A 81 -7.858 -16.816 4.546 1.00 0.00 C ATOM 1273 C ASP A 81 -8.181 -16.851 3.053 1.00 0.00 C ATOM 1274 O ASP A 81 -9.224 -17.375 2.666 1.00 0.00 O ATOM 1275 CB ASP A 81 -8.946 -16.084 5.341 1.00 0.00 C ATOM 1276 CG ASP A 81 -10.296 -16.793 5.272 1.00 0.00 C ATOM 1277 OD1 ASP A 81 -10.346 -17.977 5.670 1.00 0.00 O ATOM 1278 OD2 ASP A 81 -11.265 -16.144 4.819 1.00 0.00 O ATOM 0 H ASP A 81 -6.342 -15.415 4.209 1.00 0.00 H new ATOM 0 HA ASP A 81 -7.811 -17.860 4.857 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -8.636 -16.000 6.383 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -9.052 -15.069 4.957 1.00 0.00 H new ATOM 1283 N GLY A 82 -7.308 -16.306 2.204 1.00 0.00 N ATOM 1284 CA GLY A 82 -7.524 -16.345 0.762 1.00 0.00 C ATOM 1285 C GLY A 82 -7.449 -14.957 0.141 1.00 0.00 C ATOM 1286 O GLY A 82 -7.285 -14.837 -1.070 1.00 0.00 O ATOM 0 H GLY A 82 -6.450 -15.835 2.491 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -6.777 -16.991 0.300 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -8.499 -16.785 0.552 1.00 0.00 H new ATOM 1290 N ARG A 83 -7.564 -13.917 0.974 1.00 0.00 N ATOM 1291 CA ARG A 83 -7.369 -12.534 0.556 1.00 0.00 C ATOM 1292 C ARG A 83 -7.190 -11.677 1.807 1.00 0.00 C ATOM 1293 O ARG A 83 -7.944 -11.800 2.766 1.00 0.00 O ATOM 1294 CB ARG A 83 -8.544 -12.066 -0.314 1.00 0.00 C ATOM 1295 CG ARG A 83 -9.767 -11.672 0.505 1.00 0.00 C ATOM 1296 CD ARG A 83 -9.871 -10.154 0.690 1.00 0.00 C ATOM 1297 NE ARG A 83 -10.164 -9.497 -0.592 1.00 0.00 N ATOM 1298 CZ ARG A 83 -11.378 -9.128 -1.002 1.00 0.00 C ATOM 1299 NH1 ARG A 83 -12.457 -9.338 -0.248 1.00 0.00 N ATOM 1300 NH2 ARG A 83 -11.521 -8.537 -2.184 1.00 0.00 N ATOM 0 H ARG A 83 -7.797 -14.017 1.962 1.00 0.00 H new ATOM 0 HA ARG A 83 -6.475 -12.440 -0.061 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -8.227 -11.215 -0.917 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -8.817 -12.863 -1.006 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -10.667 -12.039 0.012 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -9.720 -12.154 1.482 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -10.655 -9.923 1.411 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -8.938 -9.767 1.099 1.00 0.00 H new ATOM 0 HE ARG A 83 -9.379 -9.309 -1.215 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -12.363 -9.789 0.662 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -13.376 -9.048 -0.581 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -10.705 -8.368 -2.772 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -12.447 -8.252 -2.503 1.00 0.00 H new ATOM 1314 N GLU A 84 -6.182 -10.807 1.796 1.00 0.00 N ATOM 1315 CA GLU A 84 -5.989 -9.838 2.865 1.00 0.00 C ATOM 1316 C GLU A 84 -5.469 -8.536 2.272 1.00 0.00 C ATOM 1317 O GLU A 84 -5.878 -7.455 2.691 1.00 0.00 O ATOM 1318 CB GLU A 84 -5.013 -10.320 3.927 1.00 0.00 C ATOM 1319 CG GLU A 84 -5.664 -11.185 5.009 1.00 0.00 C ATOM 1320 CD GLU A 84 -6.566 -10.361 5.926 1.00 0.00 C ATOM 1321 OE1 GLU A 84 -6.013 -9.645 6.788 1.00 0.00 O ATOM 1322 OE2 GLU A 84 -7.806 -10.450 5.768 1.00 0.00 O ATOM 0 H GLU A 84 -5.485 -10.756 1.053 1.00 0.00 H new ATOM 0 HA GLU A 84 -6.955 -9.693 3.348 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -4.218 -10.891 3.446 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -4.545 -9.456 4.397 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -6.248 -11.976 4.539 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -4.889 -11.670 5.602 1.00 0.00 H new ATOM 1329 N LEU A 85 -4.565 -8.659 1.291 1.00 0.00 N ATOM 1330 CA LEU A 85 -3.934 -7.507 0.652 1.00 0.00 C ATOM 1331 C LEU A 85 -3.610 -7.756 -0.816 1.00 0.00 C ATOM 1332 O LEU A 85 -3.364 -8.891 -1.218 1.00 0.00 O ATOM 1333 CB LEU A 85 -2.611 -7.142 1.331 1.00 0.00 C ATOM 1334 CG LEU A 85 -2.720 -6.975 2.839 1.00 0.00 C ATOM 1335 CD1 LEU A 85 -2.370 -8.291 3.512 1.00 0.00 C ATOM 1336 CD2 LEU A 85 -1.791 -5.861 3.292 1.00 0.00 C ATOM 0 H LEU A 85 -4.255 -9.558 0.922 1.00 0.00 H new ATOM 0 HA LEU A 85 -4.662 -6.701 0.745 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -1.876 -7.917 1.113 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -2.235 -6.215 0.898 1.00 0.00 H new ATOM 0 HG LEU A 85 -3.738 -6.704 3.118 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -2.446 -8.178 4.593 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -3.061 -9.065 3.178 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -1.351 -8.575 3.248 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -1.868 -5.740 4.373 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -0.764 -6.113 3.027 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -2.074 -4.930 2.802 1.00 0.00 H new ATOM 1348 N ARG A 86 -3.612 -6.668 -1.591 1.00 0.00 N ATOM 1349 CA ARG A 86 -3.111 -6.610 -2.954 1.00 0.00 C ATOM 1350 C ARG A 86 -2.546 -5.208 -3.164 1.00 0.00 C ATOM 1351 O ARG A 86 -3.273 -4.227 -3.011 1.00 0.00 O ATOM 1352 CB ARG A 86 -4.222 -6.906 -3.968 1.00 0.00 C ATOM 1353 CG ARG A 86 -4.493 -8.403 -4.126 1.00 0.00 C ATOM 1354 CD ARG A 86 -3.308 -9.131 -4.767 1.00 0.00 C ATOM 1355 NE ARG A 86 -3.147 -8.737 -6.170 1.00 0.00 N ATOM 1356 CZ ARG A 86 -2.087 -8.104 -6.686 1.00 0.00 C ATOM 1357 NH1 ARG A 86 -1.041 -7.771 -5.938 1.00 0.00 N ATOM 1358 NH2 ARG A 86 -2.076 -7.794 -7.978 1.00 0.00 N ATOM 0 H ARG A 86 -3.978 -5.773 -1.268 1.00 0.00 H new ATOM 0 HA ARG A 86 -2.340 -7.366 -3.107 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -5.138 -6.406 -3.653 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -3.946 -6.487 -4.936 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -4.703 -8.839 -3.149 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -5.383 -8.549 -4.738 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -2.396 -8.905 -4.215 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -3.461 -10.208 -4.703 1.00 0.00 H new ATOM 0 HE ARG A 86 -3.909 -8.965 -6.808 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -1.032 -7.998 -4.944 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -0.246 -7.289 -6.358 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -2.871 -8.039 -8.568 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -1.272 -7.311 -8.380 1.00 0.00 H new ATOM 1372 N VAL A 87 -1.261 -5.106 -3.512 1.00 0.00 N ATOM 1373 CA VAL A 87 -0.588 -3.821 -3.673 1.00 0.00 C ATOM 1374 C VAL A 87 0.280 -3.839 -4.929 1.00 0.00 C ATOM 1375 O VAL A 87 0.942 -4.834 -5.209 1.00 0.00 O ATOM 1376 CB VAL A 87 0.300 -3.560 -2.453 1.00 0.00 C ATOM 1377 CG1 VAL A 87 0.885 -2.151 -2.468 1.00 0.00 C ATOM 1378 CG2 VAL A 87 -0.439 -3.795 -1.137 1.00 0.00 C ATOM 0 H VAL A 87 -0.661 -5.912 -3.689 1.00 0.00 H new ATOM 0 HA VAL A 87 -1.337 -3.034 -3.765 1.00 0.00 H new ATOM 0 HB VAL A 87 1.116 -4.279 -2.519 1.00 0.00 H new ATOM 0 HG11 VAL A 87 1.508 -2.006 -1.586 1.00 0.00 H new ATOM 0 HG12 VAL A 87 1.489 -2.017 -3.365 1.00 0.00 H new ATOM 0 HG13 VAL A 87 0.076 -1.421 -2.464 1.00 0.00 H new ATOM 0 HG21 VAL A 87 0.233 -3.597 -0.302 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.298 -3.127 -1.078 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -0.780 -4.829 -1.091 1.00 0.00 H new ATOM 1388 N GLN A 88 0.271 -2.730 -5.671 1.00 0.00 N ATOM 1389 CA GLN A 88 1.054 -2.536 -6.883 1.00 0.00 C ATOM 1390 C GLN A 88 0.990 -1.067 -7.293 1.00 0.00 C ATOM 1391 O GLN A 88 0.274 -0.269 -6.690 1.00 0.00 O ATOM 1392 CB GLN A 88 0.478 -3.400 -8.018 1.00 0.00 C ATOM 1393 CG GLN A 88 1.354 -4.620 -8.346 1.00 0.00 C ATOM 1394 CD GLN A 88 2.753 -4.230 -8.815 1.00 0.00 C ATOM 1395 OE1 GLN A 88 2.984 -3.110 -9.253 1.00 0.00 O ATOM 1396 NE2 GLN A 88 3.701 -5.156 -8.728 1.00 0.00 N ATOM 0 H GLN A 88 -0.301 -1.919 -5.434 1.00 0.00 H new ATOM 0 HA GLN A 88 2.088 -2.826 -6.695 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -0.519 -3.740 -7.739 1.00 0.00 H new ATOM 0 HB3 GLN A 88 0.367 -2.788 -8.913 1.00 0.00 H new ATOM 0 HG2 GLN A 88 1.435 -5.253 -7.462 1.00 0.00 H new ATOM 0 HG3 GLN A 88 0.868 -5.214 -9.120 1.00 0.00 H new ATOM 0 HE21 GLN A 88 3.479 -6.080 -8.359 1.00 0.00 H new ATOM 0 HE22 GLN A 88 4.652 -4.943 -9.030 1.00 0.00 H new ATOM 1405 N MET A 89 1.746 -0.715 -8.329 1.00 0.00 N ATOM 1406 CA MET A 89 1.794 0.628 -8.879 1.00 0.00 C ATOM 1407 C MET A 89 0.516 0.916 -9.666 1.00 0.00 C ATOM 1408 O MET A 89 -0.023 0.029 -10.328 1.00 0.00 O ATOM 1409 CB MET A 89 3.018 0.688 -9.789 1.00 0.00 C ATOM 1410 CG MET A 89 4.264 0.530 -8.922 1.00 0.00 C ATOM 1411 SD MET A 89 4.824 2.094 -8.198 1.00 0.00 S ATOM 1412 CE MET A 89 6.094 1.449 -7.085 1.00 0.00 C ATOM 0 H MET A 89 2.354 -1.373 -8.817 1.00 0.00 H new ATOM 0 HA MET A 89 1.867 1.378 -8.091 1.00 0.00 H new ATOM 0 HB2 MET A 89 2.974 -0.102 -10.539 1.00 0.00 H new ATOM 0 HB3 MET A 89 3.046 1.636 -10.326 1.00 0.00 H new ATOM 0 HG2 MET A 89 4.056 -0.181 -8.122 1.00 0.00 H new ATOM 0 HG3 MET A 89 5.068 0.106 -9.524 1.00 0.00 H new ATOM 0 HE1 MET A 89 6.699 2.273 -6.707 1.00 0.00 H new ATOM 0 HE2 MET A 89 5.619 0.934 -6.250 1.00 0.00 H new ATOM 0 HE3 MET A 89 6.731 0.750 -7.626 1.00 0.00 H new ATOM 1422 N ALA A 90 0.025 2.154 -9.595 1.00 0.00 N ATOM 1423 CA ALA A 90 -1.165 2.565 -10.323 1.00 0.00 C ATOM 1424 C ALA A 90 -0.852 2.738 -11.809 1.00 0.00 C ATOM 1425 O ALA A 90 0.296 2.984 -12.182 1.00 0.00 O ATOM 1426 CB ALA A 90 -1.684 3.881 -9.746 1.00 0.00 C ATOM 0 H ALA A 90 0.443 2.894 -9.032 1.00 0.00 H new ATOM 0 HA ALA A 90 -1.927 1.793 -10.218 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -2.576 4.190 -10.291 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -1.931 3.744 -8.693 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -0.916 4.648 -9.842 1.00 0.00 H new ATOM 1432 N ARG A 91 -1.884 2.615 -12.650 1.00 0.00 N ATOM 1433 CA ARG A 91 -1.794 2.860 -14.085 1.00 0.00 C ATOM 1434 C ARG A 91 -3.058 3.578 -14.567 1.00 0.00 C ATOM 1435 O ARG A 91 -3.306 3.665 -15.768 1.00 0.00 O ATOM 1436 CB ARG A 91 -1.592 1.550 -14.853 1.00 0.00 C ATOM 1437 CG ARG A 91 -0.261 0.888 -14.484 1.00 0.00 C ATOM 1438 CD ARG A 91 -0.094 -0.401 -15.288 1.00 0.00 C ATOM 1439 NE ARG A 91 1.165 -1.078 -14.950 1.00 0.00 N ATOM 1440 CZ ARG A 91 1.554 -2.238 -15.488 1.00 0.00 C ATOM 1441 NH1 ARG A 91 0.801 -2.860 -16.391 1.00 0.00 N ATOM 1442 NH2 ARG A 91 2.710 -2.781 -15.118 1.00 0.00 N ATOM 0 H ARG A 91 -2.817 2.338 -12.344 1.00 0.00 H new ATOM 0 HA ARG A 91 -0.929 3.495 -14.277 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -2.413 0.867 -14.634 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -1.618 1.747 -15.925 1.00 0.00 H new ATOM 0 HG2 ARG A 91 0.565 1.568 -14.691 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -0.235 0.670 -13.416 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -0.933 -1.068 -15.090 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -0.113 -0.173 -16.354 1.00 0.00 H new ATOM 0 HE ARG A 91 1.778 -0.637 -14.265 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -0.087 -2.452 -16.682 1.00 0.00 H new ATOM 0 HH12 ARG A 91 1.112 -3.745 -16.792 1.00 0.00 H new ATOM 0 HH21 ARG A 91 3.295 -2.312 -14.427 1.00 0.00 H new ATOM 0 HH22 ARG A 91 3.011 -3.666 -15.526 1.00 0.00 H new ATOM 1456 N TYR A 92 -3.851 4.091 -13.622 1.00 0.00 N ATOM 1457 CA TYR A 92 -5.079 4.816 -13.901 1.00 0.00 C ATOM 1458 C TYR A 92 -5.070 6.131 -13.126 1.00 0.00 C ATOM 1459 O TYR A 92 -4.356 6.254 -12.132 1.00 0.00 O ATOM 1460 CB TYR A 92 -6.291 3.964 -13.525 1.00 0.00 C ATOM 1461 CG TYR A 92 -6.408 2.648 -14.266 1.00 0.00 C ATOM 1462 CD1 TYR A 92 -6.182 2.583 -15.650 1.00 0.00 C ATOM 1463 CD2 TYR A 92 -6.753 1.486 -13.565 1.00 0.00 C ATOM 1464 CE1 TYR A 92 -6.292 1.359 -16.325 1.00 0.00 C ATOM 1465 CE2 TYR A 92 -6.864 0.259 -14.230 1.00 0.00 C ATOM 1466 CZ TYR A 92 -6.633 0.188 -15.618 1.00 0.00 C ATOM 1467 OH TYR A 92 -6.739 -1.006 -16.267 1.00 0.00 O ATOM 0 H TYR A 92 -3.648 4.009 -12.626 1.00 0.00 H new ATOM 0 HA TYR A 92 -5.144 5.036 -14.967 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -6.253 3.758 -12.455 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -7.195 4.546 -13.706 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -5.923 3.478 -16.196 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -6.935 1.537 -12.502 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -6.115 1.313 -17.389 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -7.126 -0.632 -13.679 1.00 0.00 H new ATOM 0 HH TYR A 92 -6.980 -1.707 -15.626 1.00 0.00 H new ATOM 1477 N GLY A 93 -5.861 7.113 -13.580 1.00 0.00 N ATOM 1478 CA GLY A 93 -5.909 8.430 -12.966 1.00 0.00 C ATOM 1479 C GLY A 93 -7.231 8.644 -12.243 1.00 0.00 C ATOM 1480 O GLY A 93 -8.104 7.776 -12.266 1.00 0.00 O ATOM 0 H GLY A 93 -6.482 7.008 -14.383 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -5.083 8.538 -12.262 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -5.779 9.197 -13.730 1.00 0.00 H new ATOM 1484 N ARG A 94 -7.394 9.804 -11.594 1.00 0.00 N ATOM 1485 CA ARG A 94 -8.624 10.091 -10.860 1.00 0.00 C ATOM 1486 C ARG A 94 -9.823 10.073 -11.813 1.00 0.00 C ATOM 1487 O ARG A 94 -9.655 10.285 -13.016 1.00 0.00 O ATOM 1488 CB ARG A 94 -8.504 11.424 -10.111 1.00 0.00 C ATOM 1489 CG ARG A 94 -8.675 12.628 -11.041 1.00 0.00 C ATOM 1490 CD ARG A 94 -8.606 13.939 -10.253 1.00 0.00 C ATOM 1491 NE ARG A 94 -9.465 13.921 -9.061 1.00 0.00 N ATOM 1492 CZ ARG A 94 -10.794 13.764 -9.060 1.00 0.00 C ATOM 1493 NH1 ARG A 94 -11.487 13.645 -10.188 1.00 0.00 N ATOM 1494 NH2 ARG A 94 -11.450 13.726 -7.905 1.00 0.00 N ATOM 0 H ARG A 94 -6.697 10.548 -11.564 1.00 0.00 H new ATOM 0 HA ARG A 94 -8.785 9.314 -10.112 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -9.257 11.465 -9.324 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -7.530 11.479 -9.624 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -7.897 12.616 -11.805 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -9.632 12.560 -11.559 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -7.575 14.125 -9.952 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -8.903 14.765 -10.900 1.00 0.00 H new ATOM 0 HE ARG A 94 -9.009 14.038 -8.156 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -11.006 13.672 -11.087 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -12.500 13.526 -10.154 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -10.941 13.816 -7.026 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -12.463 13.607 -7.898 1.00 0.00 H new ATOM 1508 N PRO A 95 -11.033 9.827 -11.291 1.00 0.00 N ATOM 1509 CA PRO A 95 -12.235 9.688 -12.094 1.00 0.00 C ATOM 1510 C PRO A 95 -12.486 10.879 -13.018 1.00 0.00 C ATOM 1511 O PRO A 95 -12.622 12.005 -12.538 1.00 0.00 O ATOM 1512 CB PRO A 95 -13.375 9.554 -11.089 1.00 0.00 C ATOM 1513 CG PRO A 95 -12.687 8.965 -9.863 1.00 0.00 C ATOM 1514 CD PRO A 95 -11.326 9.643 -9.882 1.00 0.00 C ATOM 0 HA PRO A 95 -12.143 8.828 -12.757 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -13.834 10.518 -10.869 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -14.165 8.901 -11.460 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -13.235 9.184 -8.947 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -12.600 7.881 -9.930 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -11.350 10.596 -9.354 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -10.569 9.028 -9.396 1.00 0.00 H new ATOM 1522 N PRO A 96 -12.556 10.658 -14.339 1.00 0.00 N ATOM 1523 CA PRO A 96 -13.010 11.676 -15.269 1.00 0.00 C ATOM 1524 C PRO A 96 -14.533 11.777 -15.179 1.00 0.00 C ATOM 1525 O PRO A 96 -15.080 12.876 -15.109 1.00 0.00 O ATOM 1526 CB PRO A 96 -12.575 11.174 -16.644 1.00 0.00 C ATOM 1527 CG PRO A 96 -12.581 9.653 -16.496 1.00 0.00 C ATOM 1528 CD PRO A 96 -12.217 9.424 -15.028 1.00 0.00 C ATOM 0 HA PRO A 96 -12.601 12.665 -15.063 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -13.261 11.503 -17.425 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -11.586 11.546 -16.911 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -13.558 9.232 -16.736 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -11.859 9.184 -17.164 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -12.770 8.581 -14.615 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -11.157 9.194 -14.919 1.00 0.00 H new ATOM 1536 N ASP A 97 -15.199 10.617 -15.177 1.00 0.00 N ATOM 1537 CA ASP A 97 -16.635 10.452 -15.017 1.00 0.00 C ATOM 1538 C ASP A 97 -16.898 8.998 -14.613 1.00 0.00 C ATOM 1539 O ASP A 97 -16.462 8.082 -15.310 1.00 0.00 O ATOM 1540 CB ASP A 97 -17.357 10.722 -16.342 1.00 0.00 C ATOM 1541 CG ASP A 97 -17.364 12.197 -16.731 1.00 0.00 C ATOM 1542 OD1 ASP A 97 -18.060 12.973 -16.042 1.00 0.00 O ATOM 1543 OD2 ASP A 97 -16.674 12.536 -17.722 1.00 0.00 O ATOM 0 H ASP A 97 -14.719 9.725 -15.294 1.00 0.00 H new ATOM 0 HA ASP A 97 -17.000 11.151 -14.264 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -16.878 10.146 -17.134 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -18.385 10.367 -16.267 1.00 0.00 H new ATOM 1548 N SER A 98 -17.604 8.786 -13.499 1.00 0.00 N ATOM 1549 CA SER A 98 -17.920 7.442 -13.018 1.00 0.00 C ATOM 1550 C SER A 98 -19.249 7.406 -12.265 1.00 0.00 C ATOM 1551 O SER A 98 -19.605 6.364 -11.720 1.00 0.00 O ATOM 1552 CB SER A 98 -16.824 6.948 -12.069 1.00 0.00 C ATOM 1553 OG SER A 98 -15.590 6.826 -12.750 1.00 0.00 O ATOM 0 H SER A 98 -17.969 9.535 -12.911 1.00 0.00 H new ATOM 0 HA SER A 98 -17.989 6.800 -13.896 1.00 0.00 H new ATOM 0 HB2 SER A 98 -16.718 7.642 -11.235 1.00 0.00 H new ATOM 0 HB3 SER A 98 -17.109 5.984 -11.647 1.00 0.00 H new ATOM 0 HG SER A 98 -14.902 6.511 -12.127 1.00 0.00 H new ATOM 1559 N HIS A 99 -19.984 8.524 -12.224 1.00 0.00 N ATOM 1560 CA HIS A 99 -21.188 8.598 -11.409 1.00 0.00 C ATOM 1561 C HIS A 99 -22.290 9.429 -12.063 1.00 0.00 C ATOM 1562 O HIS A 99 -23.462 9.210 -11.773 1.00 0.00 O ATOM 1563 CB HIS A 99 -20.803 9.197 -10.052 1.00 0.00 C ATOM 1564 CG HIS A 99 -20.292 10.616 -10.147 1.00 0.00 C ATOM 1565 ND1 HIS A 99 -21.082 11.765 -10.102 1.00 0.00 N ATOM 1566 CD2 HIS A 99 -18.983 10.978 -10.281 1.00 0.00 C ATOM 1567 CE1 HIS A 99 -20.226 12.794 -10.210 1.00 0.00 C ATOM 1568 NE2 HIS A 99 -18.960 12.350 -10.320 1.00 0.00 N ATOM 0 H HIS A 99 -19.765 9.376 -12.741 1.00 0.00 H new ATOM 0 HA HIS A 99 -21.594 7.593 -11.292 1.00 0.00 H new ATOM 0 HB2 HIS A 99 -21.671 9.174 -9.393 1.00 0.00 H new ATOM 0 HB3 HIS A 99 -20.037 8.573 -9.591 1.00 0.00 H new ATOM 0 HD2 HIS A 99 -18.132 10.315 -10.344 1.00 0.00 H new ATOM 0 HE1 HIS A 99 -20.514 13.835 -10.209 1.00 0.00 H new ATOM 0 HE2 HIS A 99 -18.128 12.932 -10.416 1.00 0.00 H new ATOM 1576 N HIS A 100 -21.919 10.367 -12.941 1.00 0.00 N ATOM 1577 CA HIS A 100 -22.848 11.229 -13.671 1.00 0.00 C ATOM 1578 C HIS A 100 -23.958 11.827 -12.798 1.00 0.00 C ATOM 1579 O HIS A 100 -25.018 12.184 -13.317 1.00 0.00 O ATOM 1580 CB HIS A 100 -23.421 10.451 -14.858 1.00 0.00 C ATOM 1581 CG HIS A 100 -22.360 9.885 -15.764 1.00 0.00 C ATOM 1582 ND1 HIS A 100 -21.774 10.557 -16.845 1.00 0.00 N ATOM 1583 CD2 HIS A 100 -21.815 8.637 -15.662 1.00 0.00 C ATOM 1584 CE1 HIS A 100 -20.893 9.686 -17.368 1.00 0.00 C ATOM 1585 NE2 HIS A 100 -20.897 8.530 -16.681 1.00 0.00 N ATOM 0 H HIS A 100 -20.941 10.550 -13.167 1.00 0.00 H new ATOM 0 HA HIS A 100 -22.284 12.091 -14.028 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -24.043 9.637 -14.485 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -24.070 11.109 -15.436 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -22.057 7.883 -14.927 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -20.267 9.888 -18.224 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -20.319 7.714 -16.881 1.00 0.00 H new ATOM 1593 N SER A 101 -23.737 11.944 -11.482 1.00 0.00 N ATOM 1594 CA SER A 101 -24.736 12.452 -10.551 1.00 0.00 C ATOM 1595 C SER A 101 -24.058 13.094 -9.339 1.00 0.00 C ATOM 1596 O SER A 101 -23.806 12.367 -8.353 1.00 0.00 O ATOM 1597 CB SER A 101 -25.635 11.291 -10.118 1.00 0.00 C ATOM 1598 OG SER A 101 -26.643 11.775 -9.256 1.00 0.00 O ATOM 1599 OXT SER A 101 -23.798 14.313 -9.411 1.00 0.00 O ATOM 0 H SER A 101 -22.855 11.686 -11.038 1.00 0.00 H new ATOM 0 HA SER A 101 -25.340 13.218 -11.037 1.00 0.00 H new ATOM 0 HB2 SER A 101 -26.084 10.819 -10.992 1.00 0.00 H new ATOM 0 HB3 SER A 101 -25.044 10.528 -9.612 1.00 0.00 H new ATOM 0 HG SER A 101 -27.220 11.033 -8.979 1.00 0.00 H new TER 1605 SER A 101 ATOM 1606 O5' U B 102 -11.525 -3.224 -12.838 1.00 0.00 O ATOM 1607 C5' U B 102 -11.347 -4.490 -12.234 1.00 0.00 C ATOM 1608 C4' U B 102 -10.832 -4.319 -10.804 1.00 0.00 C ATOM 1609 O4' U B 102 -11.886 -3.860 -9.968 1.00 0.00 O ATOM 1610 C3' U B 102 -10.384 -5.678 -10.251 1.00 0.00 C ATOM 1611 O3' U B 102 -9.412 -5.542 -9.229 1.00 0.00 O ATOM 1612 C2' U B 102 -11.683 -6.178 -9.650 1.00 0.00 C ATOM 1613 O2' U B 102 -11.457 -7.191 -8.689 1.00 0.00 O ATOM 1614 C1' U B 102 -12.206 -4.883 -9.045 1.00 0.00 C ATOM 1615 N1 U B 102 -13.641 -5.025 -8.703 1.00 0.00 N ATOM 1616 C2 U B 102 -14.632 -4.512 -9.540 1.00 0.00 C ATOM 1617 O2 U B 102 -14.405 -3.958 -10.613 1.00 0.00 O ATOM 1618 N3 U B 102 -15.938 -4.657 -9.095 1.00 0.00 N ATOM 1619 C4 U B 102 -16.338 -5.283 -7.930 1.00 0.00 C ATOM 1620 O4 U B 102 -17.529 -5.346 -7.631 1.00 0.00 O ATOM 1621 C5 U B 102 -15.253 -5.822 -7.148 1.00 0.00 C ATOM 1622 C6 U B 102 -13.966 -5.683 -7.554 1.00 0.00 C ATOM 0 H5' U B 102 -10.641 -5.083 -12.815 1.00 0.00 H new ATOM 0 H5'' U B 102 -12.291 -5.035 -12.227 1.00 0.00 H new ATOM 0 H4' U B 102 -10.005 -3.609 -10.818 1.00 0.00 H new ATOM 0 H3' U B 102 -9.926 -6.323 -11.000 1.00 0.00 H new ATOM 0 H2' U B 102 -12.373 -6.654 -10.347 1.00 0.00 H new ATOM 0 HO2' U B 102 -12.198 -7.204 -8.047 1.00 0.00 H new ATOM 0 HO5' U B 102 -11.853 -3.342 -13.754 1.00 0.00 H new ATOM 0 H1' U B 102 -11.743 -4.623 -8.093 1.00 0.00 H new ATOM 0 H3 U B 102 -16.673 -4.264 -9.684 1.00 0.00 H new ATOM 0 H5 U B 102 -15.468 -6.343 -6.227 1.00 0.00 H new ATOM 0 H6 U B 102 -13.177 -6.105 -6.950 1.00 0.00 H new ATOM 1634 P G B 103 -7.960 -4.913 -9.526 1.00 0.00 P ATOM 1635 OP1 G B 103 -7.615 -5.169 -10.942 1.00 0.00 O ATOM 1636 OP2 G B 103 -7.038 -5.353 -8.455 1.00 0.00 O ATOM 1637 O5' G B 103 -8.224 -3.337 -9.338 1.00 0.00 O ATOM 1638 C5' G B 103 -8.571 -2.818 -8.073 1.00 0.00 C ATOM 1639 C4' G B 103 -8.608 -1.289 -8.090 1.00 0.00 C ATOM 1640 O4' G B 103 -7.304 -0.797 -8.362 1.00 0.00 O ATOM 1641 C3' G B 103 -9.534 -0.694 -9.155 1.00 0.00 C ATOM 1642 O3' G B 103 -10.108 0.451 -8.556 1.00 0.00 O ATOM 1643 C2' G B 103 -8.546 -0.379 -10.267 1.00 0.00 C ATOM 1644 O2' G B 103 -9.008 0.527 -11.246 1.00 0.00 O ATOM 1645 C1' G B 103 -7.427 0.154 -9.400 1.00 0.00 C ATOM 1646 N9 G B 103 -6.188 0.309 -10.169 1.00 0.00 N ATOM 1647 C8 G B 103 -5.504 1.468 -10.374 1.00 0.00 C ATOM 1648 N7 G B 103 -4.404 1.324 -11.063 1.00 0.00 N ATOM 1649 C5 G B 103 -4.376 -0.043 -11.351 1.00 0.00 C ATOM 1650 C6 G B 103 -3.414 -0.819 -12.063 1.00 0.00 C ATOM 1651 O6 G B 103 -2.359 -0.455 -12.574 1.00 0.00 O ATOM 1652 N1 G B 103 -3.776 -2.154 -12.152 1.00 0.00 N ATOM 1653 C2 G B 103 -4.923 -2.689 -11.619 1.00 0.00 C ATOM 1654 N2 G B 103 -5.137 -3.990 -11.811 1.00 0.00 N ATOM 1655 N3 G B 103 -5.814 -1.979 -10.924 1.00 0.00 N ATOM 1656 C4 G B 103 -5.484 -0.668 -10.833 1.00 0.00 C ATOM 0 H5' G B 103 -7.851 -3.158 -7.328 1.00 0.00 H new ATOM 0 H5'' G B 103 -9.546 -3.204 -7.774 1.00 0.00 H new ATOM 0 H4' G B 103 -8.986 -0.993 -7.111 1.00 0.00 H new ATOM 0 H3' G B 103 -10.356 -1.303 -9.531 1.00 0.00 H new ATOM 0 H2' G B 103 -8.293 -1.217 -10.917 1.00 0.00 H new ATOM 0 HO2' G B 103 -9.233 1.381 -10.821 1.00 0.00 H new ATOM 0 H1' G B 103 -7.635 1.149 -9.007 1.00 0.00 H new ATOM 0 H8 G B 103 -5.842 2.423 -10.000 1.00 0.00 H new ATOM 0 H1 G B 103 -3.146 -2.784 -12.649 1.00 0.00 H new ATOM 0 H21 G B 103 -5.976 -4.430 -11.433 1.00 0.00 H new ATOM 0 H22 G B 103 -4.462 -4.546 -12.336 1.00 0.00 H new ATOM 1668 P G B 104 -11.207 1.364 -9.293 1.00 0.00 P ATOM 1669 OP1 G B 104 -12.302 0.497 -9.786 1.00 0.00 O ATOM 1670 OP2 G B 104 -10.506 2.281 -10.222 1.00 0.00 O ATOM 1671 O5' G B 104 -11.762 2.231 -8.061 1.00 0.00 O ATOM 1672 C5' G B 104 -10.861 2.984 -7.274 1.00 0.00 C ATOM 1673 C4' G B 104 -11.442 4.338 -6.873 1.00 0.00 C ATOM 1674 O4' G B 104 -10.398 5.098 -6.302 1.00 0.00 O ATOM 1675 C3' G B 104 -11.951 5.099 -8.088 1.00 0.00 C ATOM 1676 O3' G B 104 -13.309 4.779 -8.334 1.00 0.00 O ATOM 1677 C2' G B 104 -11.714 6.545 -7.671 1.00 0.00 C ATOM 1678 O2' G B 104 -12.841 7.091 -7.028 1.00 0.00 O ATOM 1679 C1' G B 104 -10.570 6.448 -6.667 1.00 0.00 C ATOM 1680 N9 G B 104 -9.346 6.979 -7.288 1.00 0.00 N ATOM 1681 C8 G B 104 -8.729 8.165 -7.005 1.00 0.00 C ATOM 1682 N7 G B 104 -7.667 8.395 -7.731 1.00 0.00 N ATOM 1683 C5 G B 104 -7.567 7.269 -8.545 1.00 0.00 C ATOM 1684 C6 G B 104 -6.599 6.929 -9.533 1.00 0.00 C ATOM 1685 O6 G B 104 -5.627 7.585 -9.906 1.00 0.00 O ATOM 1686 N1 G B 104 -6.845 5.689 -10.107 1.00 0.00 N ATOM 1687 C2 G B 104 -7.942 4.909 -9.822 1.00 0.00 C ATOM 1688 N2 G B 104 -8.099 3.789 -10.526 1.00 0.00 N ATOM 1689 N3 G B 104 -8.850 5.217 -8.896 1.00 0.00 N ATOM 1690 C4 G B 104 -8.597 6.399 -8.283 1.00 0.00 C ATOM 0 H5' G B 104 -9.936 3.137 -7.829 1.00 0.00 H new ATOM 0 H5'' G B 104 -10.605 2.420 -6.377 1.00 0.00 H new ATOM 0 H4' G B 104 -12.269 4.178 -6.181 1.00 0.00 H new ATOM 0 H3' G B 104 -11.459 4.865 -9.032 1.00 0.00 H new ATOM 0 H2' G B 104 -11.504 7.183 -8.530 1.00 0.00 H new ATOM 0 HO2' G B 104 -12.718 8.057 -6.916 1.00 0.00 H new ATOM 0 H1' G B 104 -10.792 7.030 -5.772 1.00 0.00 H new ATOM 0 H8 G B 104 -9.086 8.850 -6.250 1.00 0.00 H new ATOM 0 H1 G B 104 -6.169 5.334 -10.783 1.00 0.00 H new ATOM 0 H21 G B 104 -8.899 3.182 -10.347 1.00 0.00 H new ATOM 0 H22 G B 104 -7.419 3.539 -11.244 1.00 0.00 H new ATOM 1702 P A B 105 -14.035 5.128 -9.725 1.00 0.00 P ATOM 1703 OP1 A B 105 -15.256 4.298 -9.828 1.00 0.00 O ATOM 1704 OP2 A B 105 -13.025 5.071 -10.807 1.00 0.00 O ATOM 1705 O5' A B 105 -14.490 6.663 -9.572 1.00 0.00 O ATOM 1706 C5' A B 105 -15.457 7.040 -8.615 1.00 0.00 C ATOM 1707 C4' A B 105 -15.928 8.470 -8.893 1.00 0.00 C ATOM 1708 O4' A B 105 -17.325 8.457 -9.130 1.00 0.00 O ATOM 1709 C3' A B 105 -15.700 9.473 -7.757 1.00 0.00 C ATOM 1710 O3' A B 105 -15.433 10.700 -8.426 1.00 0.00 O ATOM 1711 C2' A B 105 -17.054 9.431 -7.024 1.00 0.00 C ATOM 1712 O2' A B 105 -17.689 10.685 -6.958 1.00 0.00 O ATOM 1713 C1' A B 105 -17.943 8.513 -7.862 1.00 0.00 C ATOM 1714 N9 A B 105 -18.032 7.160 -7.270 1.00 0.00 N ATOM 1715 C8 A B 105 -17.265 6.633 -6.272 1.00 0.00 C ATOM 1716 N7 A B 105 -17.568 5.412 -5.946 1.00 0.00 N ATOM 1717 C5 A B 105 -18.612 5.093 -6.807 1.00 0.00 C ATOM 1718 C6 A B 105 -19.369 3.924 -7.008 1.00 0.00 C ATOM 1719 N6 A B 105 -19.182 2.790 -6.326 1.00 0.00 N ATOM 1720 N1 A B 105 -20.331 3.943 -7.937 1.00 0.00 N ATOM 1721 C2 A B 105 -20.518 5.057 -8.634 1.00 0.00 C ATOM 1722 N3 A B 105 -19.874 6.212 -8.554 1.00 0.00 N ATOM 1723 C4 A B 105 -18.910 6.161 -7.608 1.00 0.00 C ATOM 0 H5' A B 105 -15.035 6.974 -7.612 1.00 0.00 H new ATOM 0 H5'' A B 105 -16.304 6.355 -8.650 1.00 0.00 H new ATOM 0 H4' A B 105 -15.331 8.796 -9.745 1.00 0.00 H new ATOM 0 H3' A B 105 -14.890 9.299 -7.048 1.00 0.00 H new ATOM 0 H2' A B 105 -16.893 9.098 -5.999 1.00 0.00 H new ATOM 0 HO2' A B 105 -17.724 11.081 -7.854 1.00 0.00 H new ATOM 0 H1' A B 105 -18.965 8.889 -7.916 1.00 0.00 H new ATOM 0 H8 A B 105 -16.471 7.186 -5.792 1.00 0.00 H new ATOM 0 H61 A B 105 -19.766 1.976 -6.520 1.00 0.00 H new ATOM 0 H62 A B 105 -18.456 2.738 -5.612 1.00 0.00 H new ATOM 0 H2 A B 105 -21.307 5.016 -9.371 1.00 0.00 H new ATOM 1735 P G B 106 -15.156 12.122 -7.701 1.00 0.00 P ATOM 1736 OP1 G B 106 -16.420 12.891 -7.697 1.00 0.00 O ATOM 1737 OP2 G B 106 -13.967 12.718 -8.352 1.00 0.00 O ATOM 1738 O5' G B 106 -14.745 11.812 -6.173 1.00 0.00 O ATOM 1739 C5' G B 106 -15.704 11.657 -5.142 1.00 0.00 C ATOM 1740 C4' G B 106 -15.180 12.241 -3.832 1.00 0.00 C ATOM 1741 O4' G B 106 -13.982 11.591 -3.447 1.00 0.00 O ATOM 1742 C3' G B 106 -14.866 13.725 -4.023 1.00 0.00 C ATOM 1743 O3' G B 106 -15.010 14.460 -2.823 1.00 0.00 O ATOM 1744 C2' G B 106 -13.401 13.678 -4.415 1.00 0.00 C ATOM 1745 O2' G B 106 -12.714 14.867 -4.083 1.00 0.00 O ATOM 1746 C1' G B 106 -12.902 12.492 -3.611 1.00 0.00 C ATOM 1747 N9 G B 106 -11.773 11.887 -4.332 1.00 0.00 N ATOM 1748 C8 G B 106 -11.751 11.345 -5.588 1.00 0.00 C ATOM 1749 N7 G B 106 -10.573 10.912 -5.954 1.00 0.00 N ATOM 1750 C5 G B 106 -9.756 11.207 -4.862 1.00 0.00 C ATOM 1751 C6 G B 106 -8.357 11.002 -4.667 1.00 0.00 C ATOM 1752 O6 G B 106 -7.540 10.514 -5.443 1.00 0.00 O ATOM 1753 N1 G B 106 -7.938 11.434 -3.415 1.00 0.00 N ATOM 1754 C2 G B 106 -8.746 12.043 -2.486 1.00 0.00 C ATOM 1755 N2 G B 106 -8.176 12.435 -1.352 1.00 0.00 N ATOM 1756 N3 G B 106 -10.052 12.253 -2.662 1.00 0.00 N ATOM 1757 C4 G B 106 -10.488 11.799 -3.864 1.00 0.00 C ATOM 0 H5' G B 106 -15.936 10.600 -5.009 1.00 0.00 H new ATOM 0 H5'' G B 106 -16.632 12.154 -5.423 1.00 0.00 H new ATOM 0 H4' G B 106 -15.943 12.102 -3.066 1.00 0.00 H new ATOM 0 H3' G B 106 -15.527 14.209 -4.741 1.00 0.00 H new ATOM 0 H2' G B 106 -13.243 13.583 -5.489 1.00 0.00 H new ATOM 0 HO2' G B 106 -13.351 15.527 -3.738 1.00 0.00 H new ATOM 0 H1' G B 106 -12.548 12.783 -2.622 1.00 0.00 H new ATOM 0 H8 G B 106 -12.625 11.281 -6.219 1.00 0.00 H new ATOM 0 H1 G B 106 -6.959 11.288 -3.168 1.00 0.00 H new ATOM 0 H21 G B 106 -8.735 12.892 -0.632 1.00 0.00 H new ATOM 0 H22 G B 106 -7.179 12.279 -1.202 1.00 0.00 H new ATOM 1769 P U B 107 -16.420 14.575 -2.059 1.00 0.00 P ATOM 1770 OP1 U B 107 -16.580 13.374 -1.209 1.00 0.00 O ATOM 1771 OP2 U B 107 -17.466 14.913 -3.054 1.00 0.00 O ATOM 1772 O5' U B 107 -16.195 15.838 -1.081 1.00 0.00 O ATOM 1773 C5' U B 107 -16.628 17.144 -1.412 1.00 0.00 C ATOM 1774 C4' U B 107 -15.754 17.851 -2.460 1.00 0.00 C ATOM 1775 O4' U B 107 -16.070 17.398 -3.763 1.00 0.00 O ATOM 1776 C3' U B 107 -16.095 19.343 -2.426 1.00 0.00 C ATOM 1777 O3' U B 107 -15.088 20.136 -3.014 1.00 0.00 O ATOM 1778 C2' U B 107 -17.352 19.310 -3.272 1.00 0.00 C ATOM 1779 O2' U B 107 -17.720 20.588 -3.744 1.00 0.00 O ATOM 1780 C1' U B 107 -16.923 18.349 -4.378 1.00 0.00 C ATOM 1781 N1 U B 107 -18.055 17.690 -5.070 1.00 0.00 N ATOM 1782 C2 U B 107 -18.009 17.636 -6.456 1.00 0.00 C ATOM 1783 O2 U B 107 -17.071 18.101 -7.106 1.00 0.00 O ATOM 1784 N3 U B 107 -19.082 17.028 -7.086 1.00 0.00 N ATOM 1785 C4 U B 107 -20.177 16.471 -6.454 1.00 0.00 C ATOM 1786 O4 U B 107 -21.072 15.947 -7.112 1.00 0.00 O ATOM 1787 C5 U B 107 -20.148 16.573 -5.014 1.00 0.00 C ATOM 1788 C6 U B 107 -19.108 17.159 -4.377 1.00 0.00 C ATOM 0 H5' U B 107 -16.649 17.748 -0.505 1.00 0.00 H new ATOM 0 H5'' U B 107 -17.651 17.092 -1.784 1.00 0.00 H new ATOM 0 H4' U B 107 -14.706 17.650 -2.236 1.00 0.00 H new ATOM 0 H3' U B 107 -16.202 19.776 -1.431 1.00 0.00 H new ATOM 0 H2' U B 107 -18.251 18.995 -2.742 1.00 0.00 H new ATOM 0 HO2' U B 107 -18.534 20.515 -4.285 1.00 0.00 H new ATOM 0 HO3' U B 107 -15.495 20.772 -3.638 1.00 0.00 H new ATOM 0 H1' U B 107 -16.416 18.904 -5.167 1.00 0.00 H new ATOM 0 H3 U B 107 -19.062 16.988 -8.105 1.00 0.00 H new ATOM 0 H5 U B 107 -20.969 16.175 -4.436 1.00 0.00 H new ATOM 0 H6 U B 107 -19.109 17.209 -3.298 1.00 0.00 H new TER 1800 U B 107