USER MOD reduce.3.24.130724 H: found=0, std=0, add=881, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 879 hydrogens (32 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 NoAdj-H: A 18 HIS HE2 : A 18 HIS NE2 : A 105 HECFE :(H bumps) USER MOD NoAdj-H: A 105 HEC HAC : A 105 HEC CAC : A 17 CYS SG :(H bumps) USER MOD NoAdj-H: A 105 HEC HAB : A 105 HEC CAB : A 14 CYS SG :(H bumps) USER MOD Set 1.1: A 78 THR OG1 : rot -72:sc= 1.23 USER MOD Set 1.2: A 105 HEC O2D : rot -130:sc= 0.598 USER MOD Set 2.1: A 70 ASN : amide:sc= 2.21 K(o=3.4,f=-6.1) USER MOD Set 2.2: A 73 LYS NZ :NH3+ 172:sc= 1.19 (180deg=0) USER MOD Set 3.1: A 49 THR OG1 : rot 161:sc= 1.25 USER MOD Set 3.2: A 52 ASN : amide:sc= -2.66! C(o=-1.4!,f=-2.7!) USER MOD Set 4.1: A 26 HIS : no HE2:sc= -0.804 K(o=-0.76,f=-9.4) USER MOD Set 4.2: A 31 ASN : amide:sc= -1.22! C(o=-0.76!,f=-6.5!) USER MOD Set 4.3: A 33 HIS : no HE2:sc= -2.23! C(o=-0.76!,f=-6.5!) USER MOD Set 4.4: A 42 GLN : amide:sc= 1.82! C(o=-0.76!,f=-8.7!) USER MOD Set 4.5: A 105 HEC O2A : rot -100:sc= 1.67 USER MOD Set 5.1: A 12 GLN : amide:sc= 1.05 K(o=2.3,f=-6.9!) USER MOD Set 5.2: A 13 LYS NZ :NH3+ 155:sc= 1.3 (180deg=-0.0422) USER MOD Single : A 1 GLY N :NH3+ -161:sc= 2.43 (180deg=1.76) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 153:sc= 1.25 (180deg=1.06) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 GLN : amide:sc= -0.447 X(o=-0.45,f=-0.1) USER MOD Single : A 19 THR OG1 : rot -71:sc= 0.862 USER MOD Single : A 22 LYS NZ :NH3+ -176:sc= 1.33 (180deg=1.12) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ -168:sc=-0.00448 (180deg=-0.14) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 THR OG1 : rot 34:sc= 1.17 USER MOD Single : A 47 THR OG1 : rot -9:sc= 1.03 USER MOD Single : A 48 TYR OH : rot -179:sc= 1.32 USER MOD Single : A 53 LYS NZ :NH3+ -164:sc= 2.08 (180deg=1.66) USER MOD Single : A 54 ASN : amide:sc= 1.12 K(o=1.1,f=-0.78) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 THR OG1 : rot 55:sc= 1.01 USER MOD Single : A 60 LYS NZ :NH3+ 161:sc= 1.27 (180deg=1.06) USER MOD Single : A 63 THR OG1 : rot -20:sc= 0.237 USER MOD Single : A 65 MET CE :methyl -159:sc= -0.112 (180deg=-0.496) USER MOD Single : A 67 TYR OH : rot -122:sc= 0.938 USER MOD Single : A 72 LYS NZ :NH3+ -109:sc= 1.23 (180deg=-0.255) USER MOD Single : A 74 TYR OH : rot 167:sc= -0.112 USER MOD Single : A 79 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00792) USER MOD Single : A 80 MET CE :methyl 169:sc=-0.000632 (180deg=-0.229) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ 171:sc= 1.19 (180deg=0.439) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 TYR OH : rot 126:sc= 1.25 USER MOD Single : A 99 LYS NZ :NH3+ -179:sc= 1.14 (180deg=1.12) USER MOD Single : A 100 LYS NZ :NH3+ -179:sc= 1.23 (180deg=1.2) USER MOD Single : A 102 THR OG1 : rot -97:sc= 1.22 USER MOD Single : A 103 ASN : amide:sc= 0.767 K(o=0.77,f=-0.027) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 1.688 0.459 0.268 1.00 10.00 N ATOM 2 CA GLY A 1 2.129 1.764 0.781 1.00 10.00 C ATOM 3 C GLY A 1 1.470 2.047 2.112 1.00 10.00 C ATOM 4 O GLY A 1 2.123 1.911 3.140 1.00 10.00 O ATOM 0 H1 GLY A 1 2.359 0.125 -0.453 1.00 10.00 H new ATOM 0 H2 GLY A 1 1.650 -0.226 1.049 1.00 10.00 H new ATOM 0 H3 GLY A 1 0.743 0.554 -0.156 1.00 10.00 H new ATOM 0 HA2 GLY A 1 3.213 1.772 0.894 1.00 10.00 H new ATOM 0 HA3 GLY A 1 1.877 2.548 0.067 1.00 10.00 H new ATOM 10 N ASP A 2 0.178 2.370 2.083 1.00 10.00 N ATOM 11 CA ASP A 2 -0.702 2.267 3.248 1.00 10.00 C ATOM 12 C ASP A 2 -1.189 0.802 3.401 1.00 10.00 C ATOM 13 O ASP A 2 -0.760 -0.084 2.653 1.00 10.00 O ATOM 14 CB ASP A 2 -1.871 3.258 3.088 1.00 10.00 C ATOM 15 CG ASP A 2 -1.466 4.729 2.904 1.00 10.00 C ATOM 16 OD1 ASP A 2 -0.450 5.144 3.506 1.00 10.00 O ATOM 17 OD2 ASP A 2 -2.204 5.446 2.184 1.00 10.00 O ATOM 0 H ASP A 2 -0.292 2.713 1.245 1.00 10.00 H new ATOM 0 HA ASP A 2 -0.166 2.530 4.160 1.00 10.00 H new ATOM 0 HB2 ASP A 2 -2.469 2.953 2.229 1.00 10.00 H new ATOM 0 HB3 ASP A 2 -2.512 3.182 3.966 1.00 10.00 H new ATOM 22 N VAL A 3 -2.046 0.507 4.390 1.00 10.00 N ATOM 23 CA VAL A 3 -3.106 -0.519 4.260 1.00 10.00 C ATOM 24 C VAL A 3 -4.315 0.030 3.474 1.00 10.00 C ATOM 25 O VAL A 3 -5.040 -0.690 2.781 1.00 10.00 O ATOM 26 CB VAL A 3 -3.495 -1.010 5.676 1.00 10.00 C ATOM 27 CG1 VAL A 3 -4.878 -1.669 5.770 1.00 10.00 C ATOM 28 CG2 VAL A 3 -2.441 -1.995 6.194 1.00 10.00 C ATOM 0 H VAL A 3 -2.029 0.967 5.300 1.00 10.00 H new ATOM 0 HA VAL A 3 -2.735 -1.369 3.687 1.00 10.00 H new ATOM 0 HB VAL A 3 -3.540 -0.111 6.290 1.00 10.00 H new ATOM 0 HG11 VAL A 3 -5.063 -1.981 6.798 1.00 10.00 H new ATOM 0 HG12 VAL A 3 -5.643 -0.955 5.464 1.00 10.00 H new ATOM 0 HG13 VAL A 3 -4.911 -2.540 5.115 1.00 10.00 H new ATOM 0 HG21 VAL A 3 -2.721 -2.336 7.191 1.00 10.00 H new ATOM 0 HG22 VAL A 3 -2.380 -2.850 5.521 1.00 10.00 H new ATOM 0 HG23 VAL A 3 -1.471 -1.500 6.239 1.00 10.00 H new ATOM 38 N GLU A 4 -4.570 1.323 3.664 1.00 10.00 N ATOM 39 CA GLU A 4 -5.831 2.025 3.469 1.00 10.00 C ATOM 40 C GLU A 4 -6.215 2.191 2.005 1.00 10.00 C ATOM 41 O GLU A 4 -7.389 2.016 1.672 1.00 10.00 O ATOM 42 CB GLU A 4 -5.738 3.392 4.161 1.00 10.00 C ATOM 43 CG GLU A 4 -5.829 3.341 5.696 1.00 10.00 C ATOM 44 CD GLU A 4 -4.882 2.331 6.365 1.00 10.00 C ATOM 45 OE1 GLU A 4 -3.673 2.342 6.024 1.00 10.00 O ATOM 46 OE2 GLU A 4 -5.400 1.482 7.125 1.00 10.00 O ATOM 0 H GLU A 4 -3.837 1.956 3.985 1.00 10.00 H new ATOM 0 HA GLU A 4 -6.621 1.418 3.911 1.00 10.00 H new ATOM 0 HB2 GLU A 4 -4.795 3.862 3.882 1.00 10.00 H new ATOM 0 HB3 GLU A 4 -6.537 4.030 3.784 1.00 10.00 H new ATOM 0 HG2 GLU A 4 -5.616 4.334 6.092 1.00 10.00 H new ATOM 0 HG3 GLU A 4 -6.854 3.098 5.977 1.00 10.00 H new ATOM 53 N LYS A 5 -5.247 2.464 1.118 1.00 10.00 N ATOM 54 CA LYS A 5 -5.479 2.514 -0.330 1.00 10.00 C ATOM 55 C LYS A 5 -5.903 1.120 -0.811 1.00 10.00 C ATOM 56 O LYS A 5 -6.699 0.995 -1.742 1.00 10.00 O ATOM 57 CB LYS A 5 -4.233 2.965 -1.122 1.00 10.00 C ATOM 58 CG LYS A 5 -3.287 3.967 -0.443 1.00 10.00 C ATOM 59 CD LYS A 5 -3.424 5.425 -0.880 1.00 10.00 C ATOM 60 CE LYS A 5 -4.461 6.113 0.008 1.00 10.00 C ATOM 61 NZ LYS A 5 -4.764 7.468 -0.491 1.00 10.00 N ATOM 0 H LYS A 5 -4.282 2.656 1.386 1.00 10.00 H new ATOM 0 HA LYS A 5 -6.260 3.252 -0.512 1.00 10.00 H new ATOM 0 HB2 LYS A 5 -3.656 2.076 -1.376 1.00 10.00 H new ATOM 0 HB3 LYS A 5 -4.571 3.404 -2.060 1.00 10.00 H new ATOM 0 HG2 LYS A 5 -3.448 3.915 0.634 1.00 10.00 H new ATOM 0 HG3 LYS A 5 -2.261 3.649 -0.627 1.00 10.00 H new ATOM 0 HD2 LYS A 5 -2.463 5.934 -0.801 1.00 10.00 H new ATOM 0 HD3 LYS A 5 -3.728 5.478 -1.925 1.00 10.00 H new ATOM 0 HE2 LYS A 5 -5.374 5.518 0.036 1.00 10.00 H new ATOM 0 HE3 LYS A 5 -4.088 6.172 1.031 1.00 10.00 H new ATOM 0 HZ1 LYS A 5 -5.470 7.916 0.127 1.00 10.00 H new ATOM 0 HZ2 LYS A 5 -3.895 8.039 -0.494 1.00 10.00 H new ATOM 0 HZ3 LYS A 5 -5.141 7.406 -1.458 1.00 10.00 H new ATOM 75 N GLY A 6 -5.391 0.083 -0.135 1.00 10.00 N ATOM 76 CA GLY A 6 -5.522 -1.321 -0.455 1.00 10.00 C ATOM 77 C GLY A 6 -6.934 -1.788 -0.194 1.00 10.00 C ATOM 78 O GLY A 6 -7.581 -2.287 -1.110 1.00 10.00 O ATOM 0 H GLY A 6 -4.836 0.228 0.709 1.00 10.00 H new ATOM 0 HA2 GLY A 6 -5.264 -1.488 -1.501 1.00 10.00 H new ATOM 0 HA3 GLY A 6 -4.822 -1.904 0.143 1.00 10.00 H new ATOM 82 N LYS A 7 -7.445 -1.566 1.023 1.00 10.00 N ATOM 83 CA LYS A 7 -8.822 -1.965 1.319 1.00 10.00 C ATOM 84 C LYS A 7 -9.851 -1.324 0.376 1.00 10.00 C ATOM 85 O LYS A 7 -10.704 -2.023 -0.173 1.00 10.00 O ATOM 86 CB LYS A 7 -9.194 -1.849 2.810 1.00 10.00 C ATOM 87 CG LYS A 7 -8.709 -0.591 3.547 1.00 10.00 C ATOM 88 CD LYS A 7 -9.129 -0.583 5.028 1.00 10.00 C ATOM 89 CE LYS A 7 -8.443 -1.687 5.855 1.00 10.00 C ATOM 90 NZ LYS A 7 -9.407 -2.684 6.389 1.00 10.00 N ATOM 0 H LYS A 7 -6.944 -1.127 1.795 1.00 10.00 H new ATOM 0 HA LYS A 7 -8.863 -3.034 1.108 1.00 10.00 H new ATOM 0 HB2 LYS A 7 -10.280 -1.895 2.894 1.00 10.00 H new ATOM 0 HB3 LYS A 7 -8.797 -2.721 3.329 1.00 10.00 H new ATOM 0 HG2 LYS A 7 -7.623 -0.529 3.479 1.00 10.00 H new ATOM 0 HG3 LYS A 7 -9.110 0.294 3.053 1.00 10.00 H new ATOM 0 HD2 LYS A 7 -8.892 0.388 5.462 1.00 10.00 H new ATOM 0 HD3 LYS A 7 -10.210 -0.706 5.094 1.00 10.00 H new ATOM 0 HE2 LYS A 7 -7.706 -2.196 5.234 1.00 10.00 H new ATOM 0 HE3 LYS A 7 -7.901 -1.231 6.684 1.00 10.00 H new ATOM 0 HZ1 LYS A 7 -8.925 -3.596 6.523 1.00 10.00 H new ATOM 0 HZ2 LYS A 7 -9.780 -2.352 7.301 1.00 10.00 H new ATOM 0 HZ3 LYS A 7 -10.192 -2.803 5.717 1.00 10.00 H new ATOM 104 N LYS A 8 -9.730 -0.018 0.109 1.00 10.00 N ATOM 105 CA LYS A 8 -10.659 0.705 -0.778 1.00 10.00 C ATOM 106 C LYS A 8 -10.489 0.407 -2.274 1.00 10.00 C ATOM 107 O LYS A 8 -11.480 0.506 -2.992 1.00 10.00 O ATOM 108 CB LYS A 8 -10.698 2.212 -0.460 1.00 10.00 C ATOM 109 CG LYS A 8 -9.368 2.980 -0.566 1.00 10.00 C ATOM 110 CD LYS A 8 -9.228 3.930 -1.762 1.00 10.00 C ATOM 111 CE LYS A 8 -8.857 3.208 -3.061 1.00 10.00 C ATOM 112 NZ LYS A 8 -8.469 4.172 -4.115 1.00 10.00 N ATOM 0 H LYS A 8 -8.991 0.568 0.498 1.00 10.00 H new ATOM 0 HA LYS A 8 -11.645 0.301 -0.549 1.00 10.00 H new ATOM 0 HB2 LYS A 8 -11.416 2.682 -1.132 1.00 10.00 H new ATOM 0 HB3 LYS A 8 -11.081 2.335 0.553 1.00 10.00 H new ATOM 0 HG2 LYS A 8 -9.232 3.558 0.348 1.00 10.00 H new ATOM 0 HG3 LYS A 8 -8.556 2.254 -0.608 1.00 10.00 H new ATOM 0 HD2 LYS A 8 -10.167 4.465 -1.906 1.00 10.00 H new ATOM 0 HD3 LYS A 8 -8.467 4.677 -1.538 1.00 10.00 H new ATOM 0 HE2 LYS A 8 -8.034 2.518 -2.875 1.00 10.00 H new ATOM 0 HE3 LYS A 8 -9.703 2.611 -3.403 1.00 10.00 H new ATOM 0 HZ1 LYS A 8 -8.223 3.656 -4.984 1.00 10.00 H new ATOM 0 HZ2 LYS A 8 -9.264 4.815 -4.307 1.00 10.00 H new ATOM 0 HZ3 LYS A 8 -7.647 4.724 -3.795 1.00 10.00 H new ATOM 126 N ILE A 9 -9.299 0.017 -2.765 1.00 10.00 N ATOM 127 CA ILE A 9 -9.168 -0.482 -4.149 1.00 10.00 C ATOM 128 C ILE A 9 -9.573 -1.963 -4.260 1.00 10.00 C ATOM 129 O ILE A 9 -10.185 -2.354 -5.255 1.00 10.00 O ATOM 130 CB ILE A 9 -7.774 -0.170 -4.751 1.00 10.00 C ATOM 131 CG1 ILE A 9 -7.742 -0.243 -6.293 1.00 10.00 C ATOM 132 CG2 ILE A 9 -6.678 -1.102 -4.233 1.00 10.00 C ATOM 133 CD1 ILE A 9 -8.601 0.819 -6.990 1.00 10.00 C ATOM 0 H ILE A 9 -8.427 0.036 -2.236 1.00 10.00 H new ATOM 0 HA ILE A 9 -9.878 0.067 -4.767 1.00 10.00 H new ATOM 0 HB ILE A 9 -7.581 0.853 -4.427 1.00 10.00 H new ATOM 0 HG12 ILE A 9 -6.711 -0.138 -6.629 1.00 10.00 H new ATOM 0 HG13 ILE A 9 -8.080 -1.231 -6.606 1.00 10.00 H new ATOM 0 HG21 ILE A 9 -5.726 -0.834 -4.691 1.00 10.00 H new ATOM 0 HG22 ILE A 9 -6.600 -1.005 -3.150 1.00 10.00 H new ATOM 0 HG23 ILE A 9 -6.926 -2.132 -4.488 1.00 10.00 H new ATOM 0 HD11 ILE A 9 -8.523 0.698 -8.070 1.00 10.00 H new ATOM 0 HD12 ILE A 9 -9.641 0.703 -6.686 1.00 10.00 H new ATOM 0 HD13 ILE A 9 -8.250 1.812 -6.710 1.00 10.00 H new ATOM 145 N PHE A 10 -9.342 -2.770 -3.212 1.00 10.00 N ATOM 146 CA PHE A 10 -9.852 -4.136 -3.124 1.00 10.00 C ATOM 147 C PHE A 10 -11.376 -4.140 -3.247 1.00 10.00 C ATOM 148 O PHE A 10 -11.931 -4.832 -4.098 1.00 10.00 O ATOM 149 CB PHE A 10 -9.377 -4.849 -1.849 1.00 10.00 C ATOM 150 CG PHE A 10 -9.770 -6.316 -1.830 1.00 10.00 C ATOM 151 CD1 PHE A 10 -11.057 -6.693 -1.409 1.00 10.00 C ATOM 152 CD2 PHE A 10 -8.876 -7.305 -2.280 1.00 10.00 C ATOM 153 CE1 PHE A 10 -11.469 -8.032 -1.481 1.00 10.00 C ATOM 154 CE2 PHE A 10 -9.264 -8.657 -2.272 1.00 10.00 C ATOM 155 CZ PHE A 10 -10.574 -9.018 -1.923 1.00 10.00 C ATOM 0 H PHE A 10 -8.793 -2.486 -2.401 1.00 10.00 H new ATOM 0 HA PHE A 10 -9.442 -4.704 -3.959 1.00 10.00 H new ATOM 0 HB2 PHE A 10 -8.293 -4.764 -1.770 1.00 10.00 H new ATOM 0 HB3 PHE A 10 -9.800 -4.350 -0.977 1.00 10.00 H new ATOM 0 HD1 PHE A 10 -11.735 -5.945 -1.026 1.00 10.00 H new ATOM 0 HD2 PHE A 10 -7.893 -7.026 -2.631 1.00 10.00 H new ATOM 0 HE1 PHE A 10 -12.475 -8.304 -1.196 1.00 10.00 H new ATOM 0 HE2 PHE A 10 -8.549 -9.422 -2.536 1.00 10.00 H new ATOM 0 HZ PHE A 10 -10.891 -10.048 -1.994 1.00 10.00 H new ATOM 165 N VAL A 11 -12.067 -3.319 -2.450 1.00 10.00 N ATOM 166 CA VAL A 11 -13.534 -3.247 -2.474 1.00 10.00 C ATOM 167 C VAL A 11 -14.117 -2.763 -3.820 1.00 10.00 C ATOM 168 O VAL A 11 -15.306 -2.937 -4.068 1.00 10.00 O ATOM 169 CB VAL A 11 -14.035 -2.432 -1.254 1.00 10.00 C ATOM 170 CG1 VAL A 11 -15.524 -2.056 -1.262 1.00 10.00 C ATOM 171 CG2 VAL A 11 -13.803 -3.245 0.028 1.00 10.00 C ATOM 0 H VAL A 11 -11.631 -2.690 -1.775 1.00 10.00 H new ATOM 0 HA VAL A 11 -13.918 -4.264 -2.386 1.00 10.00 H new ATOM 0 HB VAL A 11 -13.467 -1.503 -1.303 1.00 10.00 H new ATOM 0 HG11 VAL A 11 -15.761 -1.489 -0.362 1.00 10.00 H new ATOM 0 HG12 VAL A 11 -15.741 -1.449 -2.141 1.00 10.00 H new ATOM 0 HG13 VAL A 11 -16.128 -2.963 -1.289 1.00 10.00 H new ATOM 0 HG21 VAL A 11 -14.154 -2.675 0.889 1.00 10.00 H new ATOM 0 HG22 VAL A 11 -14.351 -4.185 -0.033 1.00 10.00 H new ATOM 0 HG23 VAL A 11 -12.739 -3.452 0.140 1.00 10.00 H new ATOM 181 N GLN A 12 -13.287 -2.232 -4.726 1.00 10.00 N ATOM 182 CA GLN A 12 -13.705 -1.755 -6.048 1.00 10.00 C ATOM 183 C GLN A 12 -13.776 -2.915 -7.050 1.00 10.00 C ATOM 184 O GLN A 12 -14.828 -3.178 -7.626 1.00 10.00 O ATOM 185 CB GLN A 12 -12.739 -0.658 -6.538 1.00 10.00 C ATOM 186 CG GLN A 12 -13.255 0.057 -7.797 1.00 10.00 C ATOM 187 CD GLN A 12 -12.186 0.955 -8.413 1.00 10.00 C ATOM 188 OE1 GLN A 12 -11.362 0.519 -9.208 1.00 10.00 O ATOM 189 NE2 GLN A 12 -12.162 2.233 -8.088 1.00 10.00 N ATOM 0 H GLN A 12 -12.287 -2.120 -4.557 1.00 10.00 H new ATOM 0 HA GLN A 12 -14.705 -1.328 -5.968 1.00 10.00 H new ATOM 0 HB2 GLN A 12 -12.591 0.073 -5.743 1.00 10.00 H new ATOM 0 HB3 GLN A 12 -11.766 -1.102 -6.749 1.00 10.00 H new ATOM 0 HG2 GLN A 12 -13.576 -0.683 -8.530 1.00 10.00 H new ATOM 0 HG3 GLN A 12 -14.131 0.655 -7.543 1.00 10.00 H new ATOM 0 HE21 GLN A 12 -12.844 2.604 -7.427 1.00 10.00 H new ATOM 0 HE22 GLN A 12 -11.461 2.850 -8.498 1.00 10.00 H new ATOM 198 N LYS A 13 -12.635 -3.575 -7.292 1.00 10.00 N ATOM 199 CA LYS A 13 -12.460 -4.578 -8.351 1.00 10.00 C ATOM 200 C LYS A 13 -12.484 -6.002 -7.813 1.00 10.00 C ATOM 201 O LYS A 13 -13.046 -6.891 -8.454 1.00 10.00 O ATOM 202 CB LYS A 13 -11.145 -4.287 -9.100 1.00 10.00 C ATOM 203 CG LYS A 13 -11.118 -2.905 -9.780 1.00 10.00 C ATOM 204 CD LYS A 13 -11.958 -2.868 -11.067 1.00 10.00 C ATOM 205 CE LYS A 13 -12.147 -1.469 -11.682 1.00 10.00 C ATOM 206 NZ LYS A 13 -10.919 -0.639 -11.647 1.00 10.00 N ATOM 0 H LYS A 13 -11.788 -3.423 -6.744 1.00 10.00 H new ATOM 0 HA LYS A 13 -13.301 -4.503 -9.040 1.00 10.00 H new ATOM 0 HB2 LYS A 13 -10.314 -4.354 -8.398 1.00 10.00 H new ATOM 0 HB3 LYS A 13 -10.988 -5.058 -9.855 1.00 10.00 H new ATOM 0 HG2 LYS A 13 -11.491 -2.154 -9.084 1.00 10.00 H new ATOM 0 HG3 LYS A 13 -10.087 -2.639 -10.014 1.00 10.00 H new ATOM 0 HD2 LYS A 13 -11.487 -3.514 -11.809 1.00 10.00 H new ATOM 0 HD3 LYS A 13 -12.940 -3.290 -10.854 1.00 10.00 H new ATOM 0 HE2 LYS A 13 -12.475 -1.576 -12.716 1.00 10.00 H new ATOM 0 HE3 LYS A 13 -12.943 -0.950 -11.148 1.00 10.00 H new ATOM 0 HZ1 LYS A 13 -10.958 0.072 -12.405 1.00 10.00 H new ATOM 0 HZ2 LYS A 13 -10.850 -0.160 -10.727 1.00 10.00 H new ATOM 0 HZ3 LYS A 13 -10.086 -1.246 -11.784 1.00 10.00 H new ATOM 220 N CYS A 14 -11.889 -6.205 -6.638 1.00 10.00 N ATOM 221 CA CYS A 14 -11.657 -7.503 -6.033 1.00 10.00 C ATOM 222 C CYS A 14 -12.886 -8.010 -5.285 1.00 10.00 C ATOM 223 O CYS A 14 -13.341 -9.101 -5.603 1.00 10.00 O ATOM 224 CB CYS A 14 -10.473 -7.406 -5.077 1.00 10.00 C ATOM 225 SG CYS A 14 -8.995 -6.559 -5.696 1.00 10.00 S ATOM 0 H CYS A 14 -11.544 -5.435 -6.064 1.00 10.00 H new ATOM 0 HA CYS A 14 -11.442 -8.215 -6.830 1.00 10.00 H new ATOM 0 HB2 CYS A 14 -10.806 -6.894 -4.174 1.00 10.00 H new ATOM 0 HB3 CYS A 14 -10.189 -8.417 -4.784 1.00 10.00 H new ATOM 230 N ALA A 15 -13.443 -7.245 -4.325 1.00 10.00 N ATOM 231 CA ALA A 15 -14.534 -7.733 -3.455 1.00 10.00 C ATOM 232 C ALA A 15 -15.823 -8.118 -4.213 1.00 10.00 C ATOM 233 O ALA A 15 -16.690 -8.817 -3.685 1.00 10.00 O ATOM 234 CB ALA A 15 -14.857 -6.688 -2.387 1.00 10.00 C ATOM 0 H ALA A 15 -13.155 -6.286 -4.132 1.00 10.00 H new ATOM 0 HA ALA A 15 -14.164 -8.651 -2.998 1.00 10.00 H new ATOM 0 HB1 ALA A 15 -15.662 -7.055 -1.750 1.00 10.00 H new ATOM 0 HB2 ALA A 15 -13.971 -6.502 -1.780 1.00 10.00 H new ATOM 0 HB3 ALA A 15 -15.169 -5.761 -2.868 1.00 10.00 H new ATOM 240 N GLN A 16 -15.910 -7.667 -5.463 1.00 10.00 N ATOM 241 CA GLN A 16 -16.845 -8.034 -6.512 1.00 10.00 C ATOM 242 C GLN A 16 -16.767 -9.546 -6.854 1.00 10.00 C ATOM 243 O GLN A 16 -17.794 -10.214 -6.770 1.00 10.00 O ATOM 244 CB GLN A 16 -16.544 -7.028 -7.639 1.00 10.00 C ATOM 245 CG GLN A 16 -17.204 -7.234 -9.002 1.00 10.00 C ATOM 246 CD GLN A 16 -16.510 -8.272 -9.874 1.00 10.00 C ATOM 247 OE1 GLN A 16 -17.149 -9.110 -10.486 1.00 10.00 O ATOM 248 NE2 GLN A 16 -15.192 -8.254 -9.978 1.00 10.00 N ATOM 0 H GLN A 16 -15.254 -6.960 -5.796 1.00 10.00 H new ATOM 0 HA GLN A 16 -17.897 -7.953 -6.240 1.00 10.00 H new ATOM 0 HB2 GLN A 16 -16.826 -6.037 -7.282 1.00 10.00 H new ATOM 0 HB3 GLN A 16 -15.465 -7.017 -7.793 1.00 10.00 H new ATOM 0 HG2 GLN A 16 -18.240 -7.536 -8.851 1.00 10.00 H new ATOM 0 HG3 GLN A 16 -17.223 -6.282 -9.533 1.00 10.00 H new ATOM 0 HE21 GLN A 16 -14.650 -7.556 -9.469 1.00 10.00 H new ATOM 0 HE22 GLN A 16 -14.718 -8.938 -10.567 1.00 10.00 H new ATOM 257 N CYS A 17 -15.586 -10.098 -7.190 1.00 10.00 N ATOM 258 CA CYS A 17 -15.344 -11.550 -7.317 1.00 10.00 C ATOM 259 C CYS A 17 -14.937 -12.266 -6.005 1.00 10.00 C ATOM 260 O CYS A 17 -15.068 -13.483 -5.907 1.00 10.00 O ATOM 261 CB CYS A 17 -14.291 -11.814 -8.404 1.00 10.00 C ATOM 262 SG CYS A 17 -14.812 -11.468 -10.115 1.00 10.00 S ATOM 0 H CYS A 17 -14.756 -9.537 -7.385 1.00 10.00 H new ATOM 0 HA CYS A 17 -16.307 -11.978 -7.594 1.00 10.00 H new ATOM 0 HB2 CYS A 17 -13.410 -11.211 -8.184 1.00 10.00 H new ATOM 0 HB3 CYS A 17 -13.986 -12.859 -8.341 1.00 10.00 H new ATOM 267 N HIS A 18 -14.422 -11.534 -5.009 1.00 10.00 N ATOM 268 CA HIS A 18 -13.751 -12.056 -3.815 1.00 10.00 C ATOM 269 C HIS A 18 -14.233 -11.359 -2.533 1.00 10.00 C ATOM 270 O HIS A 18 -13.445 -10.727 -1.826 1.00 10.00 O ATOM 271 CB HIS A 18 -12.233 -11.859 -3.969 1.00 10.00 C ATOM 272 CG HIS A 18 -11.585 -12.554 -5.113 1.00 10.00 C ATOM 273 ND1 HIS A 18 -11.301 -13.883 -5.134 1.00 10.00 N ATOM 274 CD2 HIS A 18 -10.907 -11.961 -6.135 1.00 10.00 C ATOM 275 CE1 HIS A 18 -10.448 -14.090 -6.147 1.00 10.00 C ATOM 276 NE2 HIS A 18 -10.188 -12.959 -6.806 1.00 10.00 N ATOM 0 H HIS A 18 -14.465 -10.515 -5.015 1.00 10.00 H new ATOM 0 HA HIS A 18 -13.994 -13.115 -3.724 1.00 10.00 H new ATOM 0 HB2 HIS A 18 -12.036 -10.791 -4.063 1.00 10.00 H new ATOM 0 HB3 HIS A 18 -11.751 -12.193 -3.050 1.00 10.00 H new ATOM 0 HD1 HIS A 18 -11.668 -14.591 -4.498 1.00 10.00 H new ATOM 0 HD2 HIS A 18 -10.921 -10.910 -6.383 1.00 10.00 H new ATOM 0 HE1 HIS A 18 -10.024 -15.051 -6.398 1.00 10.00 H new ATOM 284 N THR A 19 -15.531 -11.395 -2.240 1.00 10.00 N ATOM 285 CA THR A 19 -16.062 -10.650 -1.096 1.00 10.00 C ATOM 286 C THR A 19 -15.557 -11.245 0.224 1.00 10.00 C ATOM 287 O THR A 19 -15.759 -12.425 0.519 1.00 10.00 O ATOM 288 CB THR A 19 -17.589 -10.558 -1.109 1.00 10.00 C ATOM 289 OG1 THR A 19 -18.097 -10.552 -2.429 1.00 10.00 O ATOM 290 CG2 THR A 19 -18.057 -9.279 -0.417 1.00 10.00 C ATOM 0 H THR A 19 -16.227 -11.922 -2.768 1.00 10.00 H new ATOM 0 HA THR A 19 -15.688 -9.630 -1.183 1.00 10.00 H new ATOM 0 HB THR A 19 -17.962 -11.435 -0.580 1.00 10.00 H new ATOM 0 HG1 THR A 19 -17.884 -9.697 -2.858 1.00 10.00 H new ATOM 0 HG21 THR A 19 -19.146 -9.232 -0.437 1.00 10.00 H new ATOM 0 HG22 THR A 19 -17.712 -9.278 0.617 1.00 10.00 H new ATOM 0 HG23 THR A 19 -17.647 -8.413 -0.937 1.00 10.00 H new ATOM 298 N VAL A 20 -14.857 -10.400 0.985 1.00 10.00 N ATOM 299 CA VAL A 20 -14.208 -10.695 2.268 1.00 10.00 C ATOM 300 C VAL A 20 -14.314 -9.458 3.172 1.00 10.00 C ATOM 301 O VAL A 20 -15.014 -9.504 4.182 1.00 10.00 O ATOM 302 CB VAL A 20 -12.765 -11.218 2.035 1.00 10.00 C ATOM 303 CG1 VAL A 20 -11.844 -10.279 1.245 1.00 10.00 C ATOM 304 CG2 VAL A 20 -12.033 -11.573 3.330 1.00 10.00 C ATOM 0 H VAL A 20 -14.719 -9.429 0.705 1.00 10.00 H new ATOM 0 HA VAL A 20 -14.714 -11.504 2.795 1.00 10.00 H new ATOM 0 HB VAL A 20 -12.951 -12.109 1.436 1.00 10.00 H new ATOM 0 HG11 VAL A 20 -10.861 -10.738 1.138 1.00 10.00 H new ATOM 0 HG12 VAL A 20 -12.269 -10.098 0.258 1.00 10.00 H new ATOM 0 HG13 VAL A 20 -11.746 -9.333 1.777 1.00 10.00 H new ATOM 0 HG21 VAL A 20 -11.031 -11.932 3.095 1.00 10.00 H new ATOM 0 HG22 VAL A 20 -11.963 -10.688 3.963 1.00 10.00 H new ATOM 0 HG23 VAL A 20 -12.583 -12.353 3.857 1.00 10.00 H new ATOM 314 N GLU A 21 -13.783 -8.312 2.721 1.00 10.00 N ATOM 315 CA GLU A 21 -13.831 -6.960 3.320 1.00 10.00 C ATOM 316 C GLU A 21 -15.258 -6.369 3.452 1.00 10.00 C ATOM 317 O GLU A 21 -15.432 -5.205 3.803 1.00 10.00 O ATOM 318 CB GLU A 21 -12.899 -6.065 2.469 1.00 10.00 C ATOM 319 CG GLU A 21 -12.486 -4.683 3.014 1.00 10.00 C ATOM 320 CD GLU A 21 -11.681 -4.688 4.323 1.00 10.00 C ATOM 321 OE1 GLU A 21 -11.440 -5.767 4.906 1.00 10.00 O ATOM 322 OE2 GLU A 21 -11.225 -3.589 4.717 1.00 10.00 O ATOM 0 H GLU A 21 -13.259 -8.302 1.846 1.00 10.00 H new ATOM 0 HA GLU A 21 -13.491 -7.015 4.354 1.00 10.00 H new ATOM 0 HB2 GLU A 21 -11.986 -6.629 2.277 1.00 10.00 H new ATOM 0 HB3 GLU A 21 -13.384 -5.907 1.506 1.00 10.00 H new ATOM 0 HG2 GLU A 21 -11.897 -4.175 2.251 1.00 10.00 H new ATOM 0 HG3 GLU A 21 -13.388 -4.091 3.168 1.00 10.00 H new ATOM 329 N LYS A 22 -16.296 -7.178 3.203 1.00 10.00 N ATOM 330 CA LYS A 22 -17.717 -6.829 3.331 1.00 10.00 C ATOM 331 C LYS A 22 -18.602 -8.046 3.652 1.00 10.00 C ATOM 332 O LYS A 22 -19.816 -7.990 3.452 1.00 10.00 O ATOM 333 CB LYS A 22 -18.196 -6.126 2.041 1.00 10.00 C ATOM 334 CG LYS A 22 -19.234 -5.035 2.363 1.00 10.00 C ATOM 335 CD LYS A 22 -20.280 -4.824 1.252 1.00 10.00 C ATOM 336 CE LYS A 22 -21.657 -5.421 1.595 1.00 10.00 C ATOM 337 NZ LYS A 22 -21.639 -6.896 1.735 1.00 10.00 N ATOM 0 H LYS A 22 -16.161 -8.140 2.892 1.00 10.00 H new ATOM 0 HA LYS A 22 -17.815 -6.149 4.177 1.00 10.00 H new ATOM 0 HB2 LYS A 22 -17.344 -5.682 1.526 1.00 10.00 H new ATOM 0 HB3 LYS A 22 -18.632 -6.859 1.363 1.00 10.00 H new ATOM 0 HG2 LYS A 22 -19.748 -5.297 3.288 1.00 10.00 H new ATOM 0 HG3 LYS A 22 -18.714 -4.094 2.543 1.00 10.00 H new ATOM 0 HD2 LYS A 22 -20.391 -3.756 1.064 1.00 10.00 H new ATOM 0 HD3 LYS A 22 -19.916 -5.274 0.329 1.00 10.00 H new ATOM 0 HE2 LYS A 22 -22.015 -4.979 2.525 1.00 10.00 H new ATOM 0 HE3 LYS A 22 -22.369 -5.146 0.817 1.00 10.00 H new ATOM 0 HZ1 LYS A 22 -22.606 -7.241 1.898 1.00 10.00 H new ATOM 0 HZ2 LYS A 22 -21.262 -7.323 0.865 1.00 10.00 H new ATOM 0 HZ3 LYS A 22 -21.036 -7.161 2.540 1.00 10.00 H new ATOM 351 N GLY A 23 -18.001 -9.145 4.127 1.00 10.00 N ATOM 352 CA GLY A 23 -18.654 -10.428 4.407 1.00 10.00 C ATOM 353 C GLY A 23 -18.197 -11.516 3.426 1.00 10.00 C ATOM 354 O GLY A 23 -18.002 -11.237 2.245 1.00 10.00 O ATOM 0 H GLY A 23 -17.003 -9.164 4.335 1.00 10.00 H new ATOM 0 HA2 GLY A 23 -18.428 -10.738 5.427 1.00 10.00 H new ATOM 0 HA3 GLY A 23 -19.736 -10.309 4.342 1.00 10.00 H new ATOM 358 N GLY A 24 -18.046 -12.752 3.923 1.00 10.00 N ATOM 359 CA GLY A 24 -17.478 -13.881 3.188 1.00 10.00 C ATOM 360 C GLY A 24 -18.499 -14.597 2.303 1.00 10.00 C ATOM 361 O GLY A 24 -19.570 -14.986 2.765 1.00 10.00 O ATOM 0 H GLY A 24 -18.324 -12.996 4.873 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -16.655 -13.526 2.568 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -17.058 -14.594 3.897 1.00 10.00 H new ATOM 365 N LYS A 25 -18.134 -14.794 1.033 1.00 10.00 N ATOM 366 CA LYS A 25 -18.889 -15.505 -0.017 1.00 10.00 C ATOM 367 C LYS A 25 -17.945 -15.833 -1.187 1.00 10.00 C ATOM 368 O LYS A 25 -16.765 -15.490 -1.141 1.00 10.00 O ATOM 369 CB LYS A 25 -20.129 -14.679 -0.453 1.00 10.00 C ATOM 370 CG LYS A 25 -19.805 -13.202 -0.729 1.00 10.00 C ATOM 371 CD LYS A 25 -21.004 -12.330 -1.128 1.00 10.00 C ATOM 372 CE LYS A 25 -21.067 -12.080 -2.637 1.00 10.00 C ATOM 373 NZ LYS A 25 -22.082 -11.052 -2.961 1.00 10.00 N ATOM 0 H LYS A 25 -17.244 -14.439 0.682 1.00 10.00 H new ATOM 0 HA LYS A 25 -19.273 -16.448 0.371 1.00 10.00 H new ATOM 0 HB2 LYS A 25 -20.557 -15.125 -1.351 1.00 10.00 H new ATOM 0 HB3 LYS A 25 -20.889 -14.738 0.326 1.00 10.00 H new ATOM 0 HG2 LYS A 25 -19.347 -12.775 0.163 1.00 10.00 H new ATOM 0 HG3 LYS A 25 -19.061 -13.153 -1.524 1.00 10.00 H new ATOM 0 HD2 LYS A 25 -21.925 -12.814 -0.804 1.00 10.00 H new ATOM 0 HD3 LYS A 25 -20.945 -11.375 -0.606 1.00 10.00 H new ATOM 0 HE2 LYS A 25 -20.090 -11.758 -2.997 1.00 10.00 H new ATOM 0 HE3 LYS A 25 -21.307 -13.009 -3.154 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 -22.106 -10.900 -3.990 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 -23.017 -11.373 -2.636 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 -21.837 -10.160 -2.485 1.00 10.00 H new ATOM 387 N HIS A 26 -18.455 -16.467 -2.248 1.00 10.00 N ATOM 388 CA HIS A 26 -17.664 -17.071 -3.327 1.00 10.00 C ATOM 389 C HIS A 26 -18.498 -16.987 -4.616 1.00 10.00 C ATOM 390 O HIS A 26 -19.648 -17.429 -4.638 1.00 10.00 O ATOM 391 CB HIS A 26 -17.353 -18.565 -3.050 1.00 10.00 C ATOM 392 CG HIS A 26 -16.952 -18.988 -1.651 1.00 10.00 C ATOM 393 ND1 HIS A 26 -17.430 -20.102 -0.992 1.00 10.00 N ATOM 394 CD2 HIS A 26 -16.017 -18.415 -0.830 1.00 10.00 C ATOM 395 CE1 HIS A 26 -16.818 -20.172 0.201 1.00 10.00 C ATOM 396 NE2 HIS A 26 -15.944 -19.168 0.341 1.00 10.00 N ATOM 0 H HIS A 26 -19.460 -16.578 -2.384 1.00 10.00 H new ATOM 0 HA HIS A 26 -16.717 -16.537 -3.408 1.00 10.00 H new ATOM 0 HB2 HIS A 26 -18.236 -19.141 -3.327 1.00 10.00 H new ATOM 0 HB3 HIS A 26 -16.552 -18.865 -3.726 1.00 10.00 H new ATOM 0 HD1 HIS A 26 -18.126 -20.757 -1.348 1.00 10.00 H new ATOM 0 HD2 HIS A 26 -15.436 -17.532 -1.052 1.00 10.00 H new ATOM 0 HE1 HIS A 26 -17.005 -20.933 0.944 1.00 10.00 H new ATOM 404 N LYS A 27 -17.953 -16.338 -5.654 1.00 10.00 N ATOM 405 CA LYS A 27 -18.640 -16.032 -6.920 1.00 10.00 C ATOM 406 C LYS A 27 -17.615 -15.629 -7.978 1.00 10.00 C ATOM 407 O LYS A 27 -16.998 -14.573 -7.875 1.00 10.00 O ATOM 408 CB LYS A 27 -19.683 -14.909 -6.713 1.00 10.00 C ATOM 409 CG LYS A 27 -21.132 -15.438 -6.709 1.00 10.00 C ATOM 410 CD LYS A 27 -21.914 -14.994 -5.467 1.00 10.00 C ATOM 411 CE LYS A 27 -23.402 -15.359 -5.571 1.00 10.00 C ATOM 412 NZ LYS A 27 -24.094 -14.551 -6.603 1.00 10.00 N ATOM 0 H LYS A 27 -16.991 -16.000 -5.637 1.00 10.00 H new ATOM 0 HA LYS A 27 -19.167 -16.922 -7.262 1.00 10.00 H new ATOM 0 HB2 LYS A 27 -19.483 -14.402 -5.769 1.00 10.00 H new ATOM 0 HB3 LYS A 27 -19.573 -14.166 -7.503 1.00 10.00 H new ATOM 0 HG2 LYS A 27 -21.646 -15.087 -7.603 1.00 10.00 H new ATOM 0 HG3 LYS A 27 -21.118 -16.527 -6.756 1.00 10.00 H new ATOM 0 HD2 LYS A 27 -21.486 -15.462 -4.581 1.00 10.00 H new ATOM 0 HD3 LYS A 27 -21.812 -13.916 -5.339 1.00 10.00 H new ATOM 0 HE2 LYS A 27 -23.501 -16.418 -5.811 1.00 10.00 H new ATOM 0 HE3 LYS A 27 -23.883 -15.205 -4.605 1.00 10.00 H new ATOM 0 HZ1 LYS A 27 -25.122 -14.674 -6.508 1.00 10.00 H new ATOM 0 HZ2 LYS A 27 -23.852 -13.547 -6.478 1.00 10.00 H new ATOM 0 HZ3 LYS A 27 -23.793 -14.864 -7.548 1.00 10.00 H new ATOM 426 N THR A 28 -17.407 -16.493 -8.972 1.00 10.00 N ATOM 427 CA THR A 28 -16.240 -16.540 -9.877 1.00 10.00 C ATOM 428 C THR A 28 -14.891 -16.687 -9.156 1.00 10.00 C ATOM 429 O THR A 28 -14.103 -17.525 -9.581 1.00 10.00 O ATOM 430 CB THR A 28 -16.229 -15.345 -10.850 1.00 10.00 C ATOM 431 OG1 THR A 28 -17.492 -15.203 -11.460 1.00 10.00 O ATOM 432 CG2 THR A 28 -15.221 -15.529 -11.988 1.00 10.00 C ATOM 0 H THR A 28 -18.084 -17.225 -9.186 1.00 10.00 H new ATOM 0 HA THR A 28 -16.362 -17.455 -10.456 1.00 10.00 H new ATOM 0 HB THR A 28 -15.961 -14.473 -10.253 1.00 10.00 H new ATOM 0 HG1 THR A 28 -17.474 -14.440 -12.075 1.00 10.00 H new ATOM 0 HG21 THR A 28 -15.252 -14.660 -12.646 1.00 10.00 H new ATOM 0 HG22 THR A 28 -14.219 -15.634 -11.573 1.00 10.00 H new ATOM 0 HG23 THR A 28 -15.474 -16.424 -12.557 1.00 10.00 H new ATOM 440 N GLY A 29 -14.633 -15.967 -8.056 1.00 10.00 N ATOM 441 CA GLY A 29 -13.492 -16.184 -7.168 1.00 10.00 C ATOM 442 C GLY A 29 -13.881 -16.745 -5.784 1.00 10.00 C ATOM 443 O GLY A 29 -15.060 -16.719 -5.404 1.00 10.00 O ATOM 0 H GLY A 29 -15.231 -15.198 -7.754 1.00 10.00 H new ATOM 0 HA2 GLY A 29 -12.796 -16.873 -7.647 1.00 10.00 H new ATOM 0 HA3 GLY A 29 -12.964 -15.240 -7.032 1.00 10.00 H new ATOM 447 N PRO A 30 -12.886 -17.228 -5.010 1.00 10.00 N ATOM 448 CA PRO A 30 -13.002 -17.553 -3.587 1.00 10.00 C ATOM 449 C PRO A 30 -13.033 -16.275 -2.727 1.00 10.00 C ATOM 450 O PRO A 30 -12.768 -15.179 -3.214 1.00 10.00 O ATOM 451 CB PRO A 30 -11.739 -18.367 -3.286 1.00 10.00 C ATOM 452 CG PRO A 30 -10.692 -17.747 -4.200 1.00 10.00 C ATOM 453 CD PRO A 30 -11.507 -17.410 -5.442 1.00 10.00 C ATOM 0 HA PRO A 30 -13.921 -18.094 -3.361 1.00 10.00 H new ATOM 0 HB2 PRO A 30 -11.452 -18.290 -2.237 1.00 10.00 H new ATOM 0 HB3 PRO A 30 -11.883 -19.426 -3.501 1.00 10.00 H new ATOM 0 HG2 PRO A 30 -10.239 -16.860 -3.757 1.00 10.00 H new ATOM 0 HG3 PRO A 30 -9.882 -18.442 -4.421 1.00 10.00 H new ATOM 0 HD2 PRO A 30 -11.129 -16.505 -5.917 1.00 10.00 H new ATOM 0 HD3 PRO A 30 -11.436 -18.210 -6.179 1.00 10.00 H new ATOM 461 N ASN A 31 -13.268 -16.413 -1.420 1.00 10.00 N ATOM 462 CA ASN A 31 -12.889 -15.396 -0.435 1.00 10.00 C ATOM 463 C ASN A 31 -11.362 -15.504 -0.168 1.00 10.00 C ATOM 464 O ASN A 31 -10.681 -16.304 -0.807 1.00 10.00 O ATOM 465 CB ASN A 31 -13.766 -15.569 0.825 1.00 10.00 C ATOM 466 CG ASN A 31 -13.255 -16.686 1.714 1.00 10.00 C ATOM 467 OD1 ASN A 31 -12.447 -16.442 2.594 1.00 10.00 O ATOM 468 ND2 ASN A 31 -13.632 -17.926 1.472 1.00 10.00 N ATOM 0 H ASN A 31 -13.725 -17.230 -1.015 1.00 10.00 H new ATOM 0 HA ASN A 31 -13.070 -14.385 -0.799 1.00 10.00 H new ATOM 0 HB2 ASN A 31 -13.784 -14.635 1.387 1.00 10.00 H new ATOM 0 HB3 ASN A 31 -14.793 -15.781 0.527 1.00 10.00 H new ATOM 0 HD21 ASN A 31 -13.247 -18.693 2.023 1.00 10.00 H new ATOM 0 HD22 ASN A 31 -14.309 -18.118 0.733 1.00 10.00 H new ATOM 475 N LEU A 32 -10.816 -14.772 0.813 1.00 10.00 N ATOM 476 CA LEU A 32 -9.368 -14.718 1.081 1.00 10.00 C ATOM 477 C LEU A 32 -9.062 -14.733 2.596 1.00 10.00 C ATOM 478 O LEU A 32 -8.265 -13.959 3.122 1.00 10.00 O ATOM 479 CB LEU A 32 -8.745 -13.500 0.361 1.00 10.00 C ATOM 480 CG LEU A 32 -8.862 -13.502 -1.180 1.00 10.00 C ATOM 481 CD1 LEU A 32 -8.345 -12.169 -1.723 1.00 10.00 C ATOM 482 CD2 LEU A 32 -8.053 -14.620 -1.846 1.00 10.00 C ATOM 0 H LEU A 32 -11.368 -14.196 1.448 1.00 10.00 H new ATOM 0 HA LEU A 32 -8.905 -15.618 0.677 1.00 10.00 H new ATOM 0 HB2 LEU A 32 -9.218 -12.595 0.742 1.00 10.00 H new ATOM 0 HB3 LEU A 32 -7.689 -13.444 0.627 1.00 10.00 H new ATOM 0 HG LEU A 32 -9.915 -13.662 -1.412 1.00 10.00 H new ATOM 0 HD11 LEU A 32 -8.425 -12.163 -2.810 1.00 10.00 H new ATOM 0 HD12 LEU A 32 -8.940 -11.353 -1.311 1.00 10.00 H new ATOM 0 HD13 LEU A 32 -7.302 -12.039 -1.435 1.00 10.00 H new ATOM 0 HD21 LEU A 32 -8.178 -14.565 -2.927 1.00 10.00 H new ATOM 0 HD22 LEU A 32 -6.998 -14.504 -1.597 1.00 10.00 H new ATOM 0 HD23 LEU A 32 -8.406 -15.587 -1.488 1.00 10.00 H new ATOM 494 N HIS A 33 -9.646 -15.727 3.271 1.00 10.00 N ATOM 495 CA HIS A 33 -9.316 -16.256 4.595 1.00 10.00 C ATOM 496 C HIS A 33 -7.839 -16.677 4.729 1.00 10.00 C ATOM 497 O HIS A 33 -7.322 -17.400 3.877 1.00 10.00 O ATOM 498 CB HIS A 33 -10.210 -17.499 4.831 1.00 10.00 C ATOM 499 CG HIS A 33 -10.325 -18.443 3.640 1.00 10.00 C ATOM 500 ND1 HIS A 33 -9.445 -18.509 2.577 1.00 10.00 N ATOM 501 CD2 HIS A 33 -11.452 -19.128 3.271 1.00 10.00 C ATOM 502 CE1 HIS A 33 -10.073 -19.127 1.563 1.00 10.00 C ATOM 503 NE2 HIS A 33 -11.279 -19.567 1.957 1.00 10.00 N ATOM 0 H HIS A 33 -10.436 -16.228 2.865 1.00 10.00 H new ATOM 0 HA HIS A 33 -9.487 -15.469 5.329 1.00 10.00 H new ATOM 0 HB2 HIS A 33 -9.815 -18.056 5.681 1.00 10.00 H new ATOM 0 HB3 HIS A 33 -11.209 -17.162 5.107 1.00 10.00 H new ATOM 0 HD1 HIS A 33 -8.489 -18.152 2.564 1.00 10.00 H new ATOM 0 HD2 HIS A 33 -12.322 -19.299 3.888 1.00 10.00 H new ATOM 0 HE1 HIS A 33 -9.665 -19.252 0.571 1.00 10.00 H new ATOM 511 N GLY A 34 -7.190 -16.298 5.838 1.00 10.00 N ATOM 512 CA GLY A 34 -5.954 -16.890 6.381 1.00 10.00 C ATOM 513 C GLY A 34 -4.720 -17.004 5.467 1.00 10.00 C ATOM 514 O GLY A 34 -3.744 -17.637 5.867 1.00 10.00 O ATOM 0 H GLY A 34 -7.530 -15.528 6.414 1.00 10.00 H new ATOM 0 HA2 GLY A 34 -5.665 -16.305 7.254 1.00 10.00 H new ATOM 0 HA3 GLY A 34 -6.196 -17.892 6.734 1.00 10.00 H new ATOM 518 N LEU A 35 -4.737 -16.417 4.265 1.00 10.00 N ATOM 519 CA LEU A 35 -3.587 -16.258 3.374 1.00 10.00 C ATOM 520 C LEU A 35 -2.392 -15.618 4.119 1.00 10.00 C ATOM 521 O LEU A 35 -2.537 -15.085 5.217 1.00 10.00 O ATOM 522 CB LEU A 35 -4.030 -15.404 2.162 1.00 10.00 C ATOM 523 CG LEU A 35 -4.424 -16.194 0.904 1.00 10.00 C ATOM 524 CD1 LEU A 35 -5.766 -16.908 1.068 1.00 10.00 C ATOM 525 CD2 LEU A 35 -4.531 -15.229 -0.277 1.00 10.00 C ATOM 0 H LEU A 35 -5.592 -16.023 3.871 1.00 10.00 H new ATOM 0 HA LEU A 35 -3.246 -17.233 3.025 1.00 10.00 H new ATOM 0 HB2 LEU A 35 -4.878 -14.789 2.464 1.00 10.00 H new ATOM 0 HB3 LEU A 35 -3.219 -14.724 1.903 1.00 10.00 H new ATOM 0 HG LEU A 35 -3.655 -16.948 0.734 1.00 10.00 H new ATOM 0 HD11 LEU A 35 -6.002 -17.453 0.154 1.00 10.00 H new ATOM 0 HD12 LEU A 35 -5.707 -17.607 1.902 1.00 10.00 H new ATOM 0 HD13 LEU A 35 -6.547 -16.174 1.265 1.00 10.00 H new ATOM 0 HD21 LEU A 35 -4.810 -15.781 -1.174 1.00 10.00 H new ATOM 0 HD22 LEU A 35 -5.290 -14.476 -0.064 1.00 10.00 H new ATOM 0 HD23 LEU A 35 -3.570 -14.741 -0.436 1.00 10.00 H new ATOM 537 N PHE A 36 -1.202 -15.641 3.511 1.00 10.00 N ATOM 538 CA PHE A 36 0.072 -15.277 4.148 1.00 10.00 C ATOM 539 C PHE A 36 0.422 -16.193 5.333 1.00 10.00 C ATOM 540 O PHE A 36 0.991 -15.769 6.338 1.00 10.00 O ATOM 541 CB PHE A 36 0.146 -13.776 4.495 1.00 10.00 C ATOM 542 CG PHE A 36 -0.052 -12.824 3.333 1.00 10.00 C ATOM 543 CD1 PHE A 36 -1.337 -12.581 2.813 1.00 10.00 C ATOM 544 CD2 PHE A 36 1.059 -12.171 2.774 1.00 10.00 C ATOM 545 CE1 PHE A 36 -1.496 -11.747 1.695 1.00 10.00 C ATOM 546 CE2 PHE A 36 0.891 -11.290 1.697 1.00 10.00 C ATOM 547 CZ PHE A 36 -0.384 -11.092 1.146 1.00 10.00 C ATOM 0 H PHE A 36 -1.093 -15.920 2.536 1.00 10.00 H new ATOM 0 HA PHE A 36 0.852 -15.449 3.406 1.00 10.00 H new ATOM 0 HB2 PHE A 36 -0.608 -13.559 5.252 1.00 10.00 H new ATOM 0 HB3 PHE A 36 1.117 -13.573 4.946 1.00 10.00 H new ATOM 0 HD1 PHE A 36 -2.201 -13.036 3.274 1.00 10.00 H new ATOM 0 HD2 PHE A 36 2.046 -12.348 3.175 1.00 10.00 H new ATOM 0 HE1 PHE A 36 -2.474 -11.610 1.258 1.00 10.00 H new ATOM 0 HE2 PHE A 36 1.743 -10.764 1.291 1.00 10.00 H new ATOM 0 HZ PHE A 36 -0.509 -10.435 0.298 1.00 10.00 H new ATOM 557 N GLY A 37 0.079 -17.473 5.185 1.00 10.00 N ATOM 558 CA GLY A 37 0.224 -18.513 6.198 1.00 10.00 C ATOM 559 C GLY A 37 -0.526 -19.779 5.790 1.00 10.00 C ATOM 560 O GLY A 37 0.018 -20.877 5.893 1.00 10.00 O ATOM 0 H GLY A 37 -0.325 -17.826 4.317 1.00 10.00 H new ATOM 0 HA2 GLY A 37 1.280 -18.741 6.342 1.00 10.00 H new ATOM 0 HA3 GLY A 37 -0.157 -18.152 7.153 1.00 10.00 H new ATOM 564 N ARG A 38 -1.751 -19.629 5.261 1.00 10.00 N ATOM 565 CA ARG A 38 -2.457 -20.731 4.591 1.00 10.00 C ATOM 566 C ARG A 38 -1.984 -20.924 3.148 1.00 10.00 C ATOM 567 O ARG A 38 -1.462 -20.018 2.497 1.00 10.00 O ATOM 568 CB ARG A 38 -3.982 -20.525 4.606 1.00 10.00 C ATOM 569 CG ARG A 38 -4.590 -20.767 5.999 1.00 10.00 C ATOM 570 CD ARG A 38 -6.130 -20.777 5.975 1.00 10.00 C ATOM 571 NE ARG A 38 -6.679 -21.757 5.017 1.00 10.00 N ATOM 572 CZ ARG A 38 -6.530 -23.081 5.058 1.00 10.00 C ATOM 573 NH1 ARG A 38 -6.009 -23.709 6.084 1.00 10.00 N ATOM 574 NH2 ARG A 38 -6.876 -23.834 4.045 1.00 10.00 N ATOM 0 H ARG A 38 -2.273 -18.753 5.285 1.00 10.00 H new ATOM 0 HA ARG A 38 -2.217 -21.631 5.158 1.00 10.00 H new ATOM 0 HB2 ARG A 38 -4.213 -19.510 4.283 1.00 10.00 H new ATOM 0 HB3 ARG A 38 -4.445 -21.201 3.887 1.00 10.00 H new ATOM 0 HG2 ARG A 38 -4.229 -21.719 6.389 1.00 10.00 H new ATOM 0 HG3 ARG A 38 -4.245 -19.991 6.683 1.00 10.00 H new ATOM 0 HD2 ARG A 38 -6.503 -21.003 6.974 1.00 10.00 H new ATOM 0 HD3 ARG A 38 -6.492 -19.782 5.717 1.00 10.00 H new ATOM 0 HE ARG A 38 -7.229 -21.382 4.244 1.00 10.00 H new ATOM 0 HH11 ARG A 38 -5.696 -23.182 6.899 1.00 10.00 H new ATOM 0 HH12 ARG A 38 -5.916 -24.725 6.067 1.00 10.00 H new ATOM 0 HH21 ARG A 38 -7.268 -23.409 3.204 1.00 10.00 H new ATOM 0 HH22 ARG A 38 -6.754 -24.845 4.096 1.00 10.00 H new ATOM 588 N LYS A 39 -2.255 -22.130 2.645 1.00 10.00 N ATOM 589 CA LYS A 39 -2.138 -22.540 1.244 1.00 10.00 C ATOM 590 C LYS A 39 -3.229 -21.879 0.383 1.00 10.00 C ATOM 591 O LYS A 39 -4.158 -21.253 0.897 1.00 10.00 O ATOM 592 CB LYS A 39 -2.256 -24.074 1.163 1.00 10.00 C ATOM 593 CG LYS A 39 -1.213 -24.812 2.028 1.00 10.00 C ATOM 594 CD LYS A 39 -1.466 -26.324 2.114 1.00 10.00 C ATOM 595 CE LYS A 39 -2.747 -26.561 2.921 1.00 10.00 C ATOM 596 NZ LYS A 39 -3.021 -27.984 3.218 1.00 10.00 N ATOM 0 H LYS A 39 -2.581 -22.892 3.240 1.00 10.00 H new ATOM 0 HA LYS A 39 -1.170 -22.220 0.858 1.00 10.00 H new ATOM 0 HB2 LYS A 39 -3.256 -24.372 1.479 1.00 10.00 H new ATOM 0 HB3 LYS A 39 -2.143 -24.386 0.125 1.00 10.00 H new ATOM 0 HG2 LYS A 39 -0.219 -24.638 1.616 1.00 10.00 H new ATOM 0 HG3 LYS A 39 -1.219 -24.390 3.033 1.00 10.00 H new ATOM 0 HD2 LYS A 39 -1.565 -26.748 1.115 1.00 10.00 H new ATOM 0 HD3 LYS A 39 -0.621 -26.822 2.590 1.00 10.00 H new ATOM 0 HE2 LYS A 39 -2.678 -26.012 3.860 1.00 10.00 H new ATOM 0 HE3 LYS A 39 -3.592 -26.147 2.371 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 -3.902 -28.061 3.765 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 -3.119 -28.512 2.327 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 -2.234 -28.381 3.771 1.00 10.00 H new ATOM 610 N THR A 40 -3.136 -22.086 -0.931 1.00 10.00 N ATOM 611 CA THR A 40 -4.235 -21.993 -1.910 1.00 10.00 C ATOM 612 C THR A 40 -5.275 -23.120 -1.698 1.00 10.00 C ATOM 613 O THR A 40 -5.014 -24.074 -0.963 1.00 10.00 O ATOM 614 CB THR A 40 -3.622 -22.025 -3.330 1.00 10.00 C ATOM 615 OG1 THR A 40 -4.612 -22.037 -4.334 1.00 10.00 O ATOM 616 CG2 THR A 40 -2.688 -23.219 -3.566 1.00 10.00 C ATOM 0 H THR A 40 -2.250 -22.336 -1.370 1.00 10.00 H new ATOM 0 HA THR A 40 -4.777 -21.057 -1.775 1.00 10.00 H new ATOM 0 HB THR A 40 -3.036 -21.108 -3.392 1.00 10.00 H new ATOM 0 HG1 THR A 40 -5.382 -21.507 -4.040 1.00 10.00 H new ATOM 0 HG21 THR A 40 -2.294 -23.178 -4.582 1.00 10.00 H new ATOM 0 HG22 THR A 40 -1.863 -23.181 -2.855 1.00 10.00 H new ATOM 0 HG23 THR A 40 -3.243 -24.147 -3.429 1.00 10.00 H new ATOM 624 N GLY A 41 -6.445 -23.043 -2.353 1.00 10.00 N ATOM 625 CA GLY A 41 -7.324 -24.200 -2.582 1.00 10.00 C ATOM 626 C GLY A 41 -8.445 -24.449 -1.575 1.00 10.00 C ATOM 627 O GLY A 41 -9.033 -25.526 -1.582 1.00 10.00 O ATOM 0 H GLY A 41 -6.809 -22.172 -2.740 1.00 10.00 H new ATOM 0 HA2 GLY A 41 -7.777 -24.088 -3.567 1.00 10.00 H new ATOM 0 HA3 GLY A 41 -6.700 -25.093 -2.618 1.00 10.00 H new ATOM 631 N GLN A 42 -8.745 -23.460 -0.740 1.00 10.00 N ATOM 632 CA GLN A 42 -9.437 -23.573 0.548 1.00 10.00 C ATOM 633 C GLN A 42 -10.966 -23.408 0.489 1.00 10.00 C ATOM 634 O GLN A 42 -11.671 -24.090 1.227 1.00 10.00 O ATOM 635 CB GLN A 42 -8.885 -22.530 1.552 1.00 10.00 C ATOM 636 CG GLN A 42 -7.490 -21.920 1.281 1.00 10.00 C ATOM 637 CD GLN A 42 -7.488 -20.872 0.161 1.00 10.00 C ATOM 638 OE1 GLN A 42 -8.410 -20.764 -0.633 1.00 10.00 O ATOM 639 NE2 GLN A 42 -6.439 -20.102 0.026 1.00 10.00 N ATOM 0 H GLN A 42 -8.497 -22.494 -0.955 1.00 10.00 H new ATOM 0 HA GLN A 42 -9.240 -24.596 0.868 1.00 10.00 H new ATOM 0 HB2 GLN A 42 -9.601 -21.710 1.608 1.00 10.00 H new ATOM 0 HB3 GLN A 42 -8.858 -22.997 2.536 1.00 10.00 H new ATOM 0 HG2 GLN A 42 -7.118 -21.462 2.197 1.00 10.00 H new ATOM 0 HG3 GLN A 42 -6.797 -22.720 1.021 1.00 10.00 H new ATOM 0 HE21 GLN A 42 -5.661 -20.180 0.681 1.00 10.00 H new ATOM 0 HE22 GLN A 42 -6.399 -19.423 -0.734 1.00 10.00 H new ATOM 648 N ALA A 43 -11.469 -22.461 -0.317 1.00 10.00 N ATOM 649 CA ALA A 43 -12.844 -21.946 -0.261 1.00 10.00 C ATOM 650 C ALA A 43 -13.937 -23.037 -0.384 1.00 10.00 C ATOM 651 O ALA A 43 -14.102 -23.617 -1.461 1.00 10.00 O ATOM 652 CB ALA A 43 -13.001 -20.868 -1.331 1.00 10.00 C ATOM 0 H ALA A 43 -10.912 -22.019 -1.048 1.00 10.00 H new ATOM 0 HA ALA A 43 -12.999 -21.523 0.732 1.00 10.00 H new ATOM 0 HB1 ALA A 43 -14.017 -20.474 -1.304 1.00 10.00 H new ATOM 0 HB2 ALA A 43 -12.293 -20.061 -1.141 1.00 10.00 H new ATOM 0 HB3 ALA A 43 -12.805 -21.299 -2.313 1.00 10.00 H new ATOM 658 N PRO A 44 -14.710 -23.332 0.683 1.00 10.00 N ATOM 659 CA PRO A 44 -15.671 -24.434 0.674 1.00 10.00 C ATOM 660 C PRO A 44 -16.882 -24.139 -0.226 1.00 10.00 C ATOM 661 O PRO A 44 -17.495 -23.076 -0.144 1.00 10.00 O ATOM 662 CB PRO A 44 -16.066 -24.646 2.138 1.00 10.00 C ATOM 663 CG PRO A 44 -15.865 -23.270 2.767 1.00 10.00 C ATOM 664 CD PRO A 44 -14.670 -22.707 1.998 1.00 10.00 C ATOM 0 HA PRO A 44 -15.235 -25.339 0.251 1.00 10.00 H new ATOM 0 HB2 PRO A 44 -17.099 -24.982 2.230 1.00 10.00 H new ATOM 0 HB3 PRO A 44 -15.442 -25.401 2.616 1.00 10.00 H new ATOM 0 HG2 PRO A 44 -16.749 -22.642 2.654 1.00 10.00 H new ATOM 0 HG3 PRO A 44 -15.659 -23.341 3.835 1.00 10.00 H new ATOM 0 HD2 PRO A 44 -14.734 -21.622 1.917 1.00 10.00 H new ATOM 0 HD3 PRO A 44 -13.735 -22.934 2.510 1.00 10.00 H new ATOM 672 N GLY A 45 -17.234 -25.090 -1.099 1.00 10.00 N ATOM 673 CA GLY A 45 -18.364 -24.967 -2.030 1.00 10.00 C ATOM 674 C GLY A 45 -18.107 -24.061 -3.243 1.00 10.00 C ATOM 675 O GLY A 45 -19.005 -23.878 -4.059 1.00 10.00 O ATOM 0 H GLY A 45 -16.737 -25.977 -1.181 1.00 10.00 H new ATOM 0 HA2 GLY A 45 -18.631 -25.961 -2.388 1.00 10.00 H new ATOM 0 HA3 GLY A 45 -19.226 -24.583 -1.484 1.00 10.00 H new ATOM 679 N PHE A 46 -16.900 -23.501 -3.375 1.00 10.00 N ATOM 680 CA PHE A 46 -16.425 -22.832 -4.587 1.00 10.00 C ATOM 681 C PHE A 46 -16.102 -23.861 -5.701 1.00 10.00 C ATOM 682 O PHE A 46 -16.277 -25.071 -5.536 1.00 10.00 O ATOM 683 CB PHE A 46 -15.227 -21.961 -4.168 1.00 10.00 C ATOM 684 CG PHE A 46 -14.509 -21.180 -5.246 1.00 10.00 C ATOM 685 CD1 PHE A 46 -15.226 -20.477 -6.229 1.00 10.00 C ATOM 686 CD2 PHE A 46 -13.104 -21.193 -5.286 1.00 10.00 C ATOM 687 CE1 PHE A 46 -14.531 -19.875 -7.289 1.00 10.00 C ATOM 688 CE2 PHE A 46 -12.419 -20.529 -6.316 1.00 10.00 C ATOM 689 CZ PHE A 46 -13.134 -19.898 -7.339 1.00 10.00 C ATOM 0 H PHE A 46 -16.211 -23.501 -2.623 1.00 10.00 H new ATOM 0 HA PHE A 46 -17.189 -22.192 -5.028 1.00 10.00 H new ATOM 0 HB2 PHE A 46 -15.575 -21.252 -3.417 1.00 10.00 H new ATOM 0 HB3 PHE A 46 -14.497 -22.608 -3.681 1.00 10.00 H new ATOM 0 HD1 PHE A 46 -16.302 -20.401 -6.169 1.00 10.00 H new ATOM 0 HD2 PHE A 46 -12.549 -21.716 -4.521 1.00 10.00 H new ATOM 0 HE1 PHE A 46 -15.084 -19.387 -8.078 1.00 10.00 H new ATOM 0 HE2 PHE A 46 -11.339 -20.505 -6.318 1.00 10.00 H new ATOM 0 HZ PHE A 46 -12.611 -19.432 -8.161 1.00 10.00 H new ATOM 699 N THR A 47 -15.668 -23.413 -6.885 1.00 10.00 N ATOM 700 CA THR A 47 -15.250 -24.275 -8.002 1.00 10.00 C ATOM 701 C THR A 47 -14.257 -23.520 -8.891 1.00 10.00 C ATOM 702 O THR A 47 -14.626 -22.831 -9.839 1.00 10.00 O ATOM 703 CB THR A 47 -16.458 -24.812 -8.791 1.00 10.00 C ATOM 704 OG1 THR A 47 -17.265 -25.589 -7.931 1.00 10.00 O ATOM 705 CG2 THR A 47 -16.054 -25.742 -9.939 1.00 10.00 C ATOM 0 H THR A 47 -15.595 -22.419 -7.100 1.00 10.00 H new ATOM 0 HA THR A 47 -14.744 -25.153 -7.600 1.00 10.00 H new ATOM 0 HB THR A 47 -16.973 -23.939 -9.192 1.00 10.00 H new ATOM 0 HG1 THR A 47 -16.800 -25.724 -7.079 1.00 10.00 H new ATOM 0 HG21 THR A 47 -16.948 -26.089 -10.458 1.00 10.00 H new ATOM 0 HG22 THR A 47 -15.415 -25.202 -10.637 1.00 10.00 H new ATOM 0 HG23 THR A 47 -15.511 -26.599 -9.539 1.00 10.00 H new ATOM 713 N TYR A 48 -12.985 -23.655 -8.527 1.00 10.00 N ATOM 714 CA TYR A 48 -11.782 -23.206 -9.232 1.00 10.00 C ATOM 715 C TYR A 48 -11.319 -24.216 -10.298 1.00 10.00 C ATOM 716 O TYR A 48 -11.819 -25.341 -10.362 1.00 10.00 O ATOM 717 CB TYR A 48 -10.678 -23.025 -8.172 1.00 10.00 C ATOM 718 CG TYR A 48 -10.731 -23.945 -6.950 1.00 10.00 C ATOM 719 CD1 TYR A 48 -10.877 -25.344 -7.084 1.00 10.00 C ATOM 720 CD2 TYR A 48 -10.605 -23.388 -5.662 1.00 10.00 C ATOM 721 CE1 TYR A 48 -10.817 -26.177 -5.950 1.00 10.00 C ATOM 722 CE2 TYR A 48 -10.512 -24.218 -4.526 1.00 10.00 C ATOM 723 CZ TYR A 48 -10.572 -25.622 -4.675 1.00 10.00 C ATOM 724 OH TYR A 48 -10.320 -26.457 -3.627 1.00 10.00 O ATOM 0 H TYR A 48 -12.745 -24.123 -7.653 1.00 10.00 H new ATOM 0 HA TYR A 48 -11.998 -22.275 -9.757 1.00 10.00 H new ATOM 0 HB2 TYR A 48 -9.713 -23.165 -8.660 1.00 10.00 H new ATOM 0 HB3 TYR A 48 -10.711 -21.994 -7.821 1.00 10.00 H new ATOM 0 HD1 TYR A 48 -11.035 -25.777 -8.061 1.00 10.00 H new ATOM 0 HD2 TYR A 48 -10.579 -22.315 -5.544 1.00 10.00 H new ATOM 0 HE1 TYR A 48 -10.959 -27.242 -6.056 1.00 10.00 H new ATOM 0 HE2 TYR A 48 -10.395 -23.782 -3.545 1.00 10.00 H new ATOM 0 HH TYR A 48 -10.186 -25.929 -2.813 1.00 10.00 H new ATOM 734 N THR A 49 -10.305 -23.855 -11.098 1.00 10.00 N ATOM 735 CA THR A 49 -9.548 -24.843 -11.888 1.00 10.00 C ATOM 736 C THR A 49 -8.664 -25.702 -10.971 1.00 10.00 C ATOM 737 O THR A 49 -8.101 -25.185 -10.004 1.00 10.00 O ATOM 738 CB THR A 49 -8.695 -24.164 -12.984 1.00 10.00 C ATOM 739 OG1 THR A 49 -7.646 -23.366 -12.467 1.00 10.00 O ATOM 740 CG2 THR A 49 -9.561 -23.282 -13.887 1.00 10.00 C ATOM 0 H THR A 49 -9.990 -22.892 -11.216 1.00 10.00 H new ATOM 0 HA THR A 49 -10.270 -25.490 -12.386 1.00 10.00 H new ATOM 0 HB THR A 49 -8.254 -24.984 -13.551 1.00 10.00 H new ATOM 0 HG1 THR A 49 -6.974 -23.217 -13.165 1.00 10.00 H new ATOM 0 HG21 THR A 49 -8.936 -22.817 -14.649 1.00 10.00 H new ATOM 0 HG22 THR A 49 -10.325 -23.893 -14.368 1.00 10.00 H new ATOM 0 HG23 THR A 49 -10.040 -22.507 -13.288 1.00 10.00 H new ATOM 748 N ASP A 50 -8.483 -27.004 -11.254 1.00 10.00 N ATOM 749 CA ASP A 50 -7.423 -27.796 -10.601 1.00 10.00 C ATOM 750 C ASP A 50 -6.043 -27.474 -11.197 1.00 10.00 C ATOM 751 O ASP A 50 -5.393 -28.306 -11.822 1.00 10.00 O ATOM 752 CB ASP A 50 -7.735 -29.302 -10.524 1.00 10.00 C ATOM 753 CG ASP A 50 -6.790 -29.991 -9.520 1.00 10.00 C ATOM 754 OD1 ASP A 50 -6.859 -29.642 -8.317 1.00 10.00 O ATOM 755 OD2 ASP A 50 -5.952 -30.817 -9.937 1.00 10.00 O ATOM 0 H ASP A 50 -9.049 -27.526 -11.922 1.00 10.00 H new ATOM 0 HA ASP A 50 -7.392 -27.486 -9.557 1.00 10.00 H new ATOM 0 HB2 ASP A 50 -8.771 -29.451 -10.220 1.00 10.00 H new ATOM 0 HB3 ASP A 50 -7.623 -29.755 -11.509 1.00 10.00 H new ATOM 760 N ALA A 51 -5.603 -26.230 -10.997 1.00 10.00 N ATOM 761 CA ALA A 51 -4.307 -25.736 -11.449 1.00 10.00 C ATOM 762 C ALA A 51 -3.667 -24.853 -10.376 1.00 10.00 C ATOM 763 O ALA A 51 -2.619 -25.201 -9.842 1.00 10.00 O ATOM 764 CB ALA A 51 -4.476 -25.024 -12.792 1.00 10.00 C ATOM 0 H ALA A 51 -6.152 -25.525 -10.505 1.00 10.00 H new ATOM 0 HA ALA A 51 -3.621 -26.568 -11.606 1.00 10.00 H new ATOM 0 HB1 ALA A 51 -3.509 -24.654 -13.132 1.00 10.00 H new ATOM 0 HB2 ALA A 51 -4.876 -25.723 -13.527 1.00 10.00 H new ATOM 0 HB3 ALA A 51 -5.164 -24.187 -12.676 1.00 10.00 H new ATOM 770 N ASN A 52 -4.345 -23.766 -9.992 1.00 10.00 N ATOM 771 CA ASN A 52 -3.965 -22.854 -8.912 1.00 10.00 C ATOM 772 C ASN A 52 -3.757 -23.617 -7.581 1.00 10.00 C ATOM 773 O ASN A 52 -2.631 -23.837 -7.138 1.00 10.00 O ATOM 774 CB ASN A 52 -5.014 -21.712 -8.843 1.00 10.00 C ATOM 775 CG ASN A 52 -6.443 -22.209 -8.702 1.00 10.00 C ATOM 776 OD1 ASN A 52 -6.944 -22.389 -7.605 1.00 10.00 O ATOM 777 ND2 ASN A 52 -7.090 -22.595 -9.777 1.00 10.00 N ATOM 0 H ASN A 52 -5.214 -23.487 -10.448 1.00 10.00 H new ATOM 0 HA ASN A 52 -2.997 -22.395 -9.113 1.00 10.00 H new ATOM 0 HB2 ASN A 52 -4.778 -21.064 -7.999 1.00 10.00 H new ATOM 0 HB3 ASN A 52 -4.937 -21.103 -9.744 1.00 10.00 H new ATOM 0 HD21 ASN A 52 -8.003 -23.041 -9.690 1.00 10.00 H new ATOM 0 HD22 ASN A 52 -6.680 -22.449 -10.699 1.00 10.00 H new ATOM 784 N LYS A 53 -4.860 -24.105 -7.011 1.00 10.00 N ATOM 785 CA LYS A 53 -5.022 -25.005 -5.873 1.00 10.00 C ATOM 786 C LYS A 53 -4.451 -26.408 -6.064 1.00 10.00 C ATOM 787 O LYS A 53 -4.432 -27.189 -5.114 1.00 10.00 O ATOM 788 CB LYS A 53 -6.509 -25.046 -5.558 1.00 10.00 C ATOM 789 CG LYS A 53 -7.483 -25.477 -6.654 1.00 10.00 C ATOM 790 CD LYS A 53 -7.562 -26.968 -6.977 1.00 10.00 C ATOM 791 CE LYS A 53 -7.735 -27.908 -5.775 1.00 10.00 C ATOM 792 NZ LYS A 53 -6.651 -28.915 -5.754 1.00 10.00 N ATOM 0 H LYS A 53 -5.772 -23.844 -7.385 1.00 10.00 H new ATOM 0 HA LYS A 53 -4.435 -24.613 -5.043 1.00 10.00 H new ATOM 0 HB2 LYS A 53 -6.648 -25.717 -4.710 1.00 10.00 H new ATOM 0 HB3 LYS A 53 -6.804 -24.050 -5.228 1.00 10.00 H new ATOM 0 HG2 LYS A 53 -8.480 -25.140 -6.370 1.00 10.00 H new ATOM 0 HG3 LYS A 53 -7.216 -24.948 -7.569 1.00 10.00 H new ATOM 0 HD2 LYS A 53 -8.395 -27.128 -7.661 1.00 10.00 H new ATOM 0 HD3 LYS A 53 -6.654 -27.253 -7.509 1.00 10.00 H new ATOM 0 HE2 LYS A 53 -7.725 -27.332 -4.849 1.00 10.00 H new ATOM 0 HE3 LYS A 53 -8.703 -28.406 -5.830 1.00 10.00 H new ATOM 0 HZ1 LYS A 53 -6.915 -29.696 -5.119 1.00 10.00 H new ATOM 0 HZ2 LYS A 53 -6.502 -29.285 -6.715 1.00 10.00 H new ATOM 0 HZ3 LYS A 53 -5.773 -28.473 -5.413 1.00 10.00 H new ATOM 806 N ASN A 54 -4.101 -26.803 -7.291 1.00 10.00 N ATOM 807 CA ASN A 54 -3.186 -27.912 -7.525 1.00 10.00 C ATOM 808 C ASN A 54 -1.743 -27.550 -7.116 1.00 10.00 C ATOM 809 O ASN A 54 -1.148 -28.227 -6.283 1.00 10.00 O ATOM 810 CB ASN A 54 -3.331 -28.415 -8.973 1.00 10.00 C ATOM 811 CG ASN A 54 -2.589 -29.718 -9.229 1.00 10.00 C ATOM 812 OD1 ASN A 54 -1.370 -29.768 -9.183 1.00 10.00 O ATOM 813 ND2 ASN A 54 -3.284 -30.796 -9.523 1.00 10.00 N ATOM 0 H ASN A 54 -4.445 -26.362 -8.144 1.00 10.00 H new ATOM 0 HA ASN A 54 -3.453 -28.750 -6.881 1.00 10.00 H new ATOM 0 HB2 ASN A 54 -4.388 -28.555 -9.198 1.00 10.00 H new ATOM 0 HB3 ASN A 54 -2.958 -27.651 -9.656 1.00 10.00 H new ATOM 0 HD21 ASN A 54 -2.804 -31.676 -9.713 1.00 10.00 H new ATOM 0 HD22 ASN A 54 -4.302 -30.752 -9.561 1.00 10.00 H new ATOM 820 N LYS A 55 -1.203 -26.461 -7.692 1.00 10.00 N ATOM 821 CA LYS A 55 0.205 -26.033 -7.605 1.00 10.00 C ATOM 822 C LYS A 55 0.745 -25.831 -6.186 1.00 10.00 C ATOM 823 O LYS A 55 1.949 -25.957 -5.986 1.00 10.00 O ATOM 824 CB LYS A 55 0.411 -24.745 -8.435 1.00 10.00 C ATOM 825 CG LYS A 55 1.262 -24.977 -9.689 1.00 10.00 C ATOM 826 CD LYS A 55 2.746 -25.152 -9.338 1.00 10.00 C ATOM 827 CE LYS A 55 3.555 -25.409 -10.610 1.00 10.00 C ATOM 828 NZ LYS A 55 4.999 -25.540 -10.312 1.00 10.00 N ATOM 0 H LYS A 55 -1.764 -25.825 -8.258 1.00 10.00 H new ATOM 0 HA LYS A 55 0.782 -26.863 -8.012 1.00 10.00 H new ATOM 0 HB2 LYS A 55 -0.561 -24.348 -8.729 1.00 10.00 H new ATOM 0 HB3 LYS A 55 0.889 -23.989 -7.812 1.00 10.00 H new ATOM 0 HG2 LYS A 55 0.904 -25.863 -10.214 1.00 10.00 H new ATOM 0 HG3 LYS A 55 1.145 -24.134 -10.370 1.00 10.00 H new ATOM 0 HD2 LYS A 55 3.117 -24.259 -8.835 1.00 10.00 H new ATOM 0 HD3 LYS A 55 2.869 -25.984 -8.644 1.00 10.00 H new ATOM 0 HE2 LYS A 55 3.197 -26.318 -11.093 1.00 10.00 H new ATOM 0 HE3 LYS A 55 3.399 -24.591 -11.314 1.00 10.00 H new ATOM 0 HZ1 LYS A 55 5.521 -25.714 -11.194 1.00 10.00 H new ATOM 0 HZ2 LYS A 55 5.344 -24.663 -9.873 1.00 10.00 H new ATOM 0 HZ3 LYS A 55 5.148 -26.336 -9.659 1.00 10.00 H new ATOM 842 N GLY A 56 -0.112 -25.489 -5.221 1.00 10.00 N ATOM 843 CA GLY A 56 0.220 -25.495 -3.787 1.00 10.00 C ATOM 844 C GLY A 56 1.187 -24.396 -3.315 1.00 10.00 C ATOM 845 O GLY A 56 1.578 -24.390 -2.148 1.00 10.00 O ATOM 0 H GLY A 56 -1.070 -25.196 -5.412 1.00 10.00 H new ATOM 0 HA2 GLY A 56 -0.706 -25.405 -3.219 1.00 10.00 H new ATOM 0 HA3 GLY A 56 0.653 -26.464 -3.539 1.00 10.00 H new ATOM 849 N ILE A 57 1.533 -23.445 -4.194 1.00 10.00 N ATOM 850 CA ILE A 57 2.552 -22.380 -4.074 1.00 10.00 C ATOM 851 C ILE A 57 2.422 -21.411 -2.877 1.00 10.00 C ATOM 852 O ILE A 57 3.207 -20.473 -2.774 1.00 10.00 O ATOM 853 CB ILE A 57 2.671 -21.613 -5.415 1.00 10.00 C ATOM 854 CG1 ILE A 57 1.337 -21.143 -6.039 1.00 10.00 C ATOM 855 CG2 ILE A 57 3.417 -22.483 -6.439 1.00 10.00 C ATOM 856 CD1 ILE A 57 0.504 -20.224 -5.142 1.00 10.00 C ATOM 0 H ILE A 57 1.063 -23.393 -5.098 1.00 10.00 H new ATOM 0 HA ILE A 57 3.475 -22.913 -3.846 1.00 10.00 H new ATOM 0 HB ILE A 57 3.217 -20.702 -5.169 1.00 10.00 H new ATOM 0 HG12 ILE A 57 1.551 -20.622 -6.972 1.00 10.00 H new ATOM 0 HG13 ILE A 57 0.741 -22.019 -6.293 1.00 10.00 H new ATOM 0 HG21 ILE A 57 3.501 -21.944 -7.382 1.00 10.00 H new ATOM 0 HG22 ILE A 57 4.414 -22.713 -6.063 1.00 10.00 H new ATOM 0 HG23 ILE A 57 2.866 -23.410 -6.599 1.00 10.00 H new ATOM 0 HD11 ILE A 57 -0.413 -19.944 -5.660 1.00 10.00 H new ATOM 0 HD12 ILE A 57 0.254 -20.746 -4.218 1.00 10.00 H new ATOM 0 HD13 ILE A 57 1.077 -19.327 -4.908 1.00 10.00 H new ATOM 868 N THR A 58 1.478 -21.668 -1.966 1.00 10.00 N ATOM 869 CA THR A 58 1.351 -21.127 -0.607 1.00 10.00 C ATOM 870 C THR A 58 1.446 -19.601 -0.543 1.00 10.00 C ATOM 871 O THR A 58 2.506 -19.003 -0.364 1.00 10.00 O ATOM 872 CB THR A 58 2.278 -21.881 0.358 1.00 10.00 C ATOM 873 OG1 THR A 58 1.920 -23.253 0.327 1.00 10.00 O ATOM 874 CG2 THR A 58 2.113 -21.428 1.811 1.00 10.00 C ATOM 0 H THR A 58 0.718 -22.315 -2.178 1.00 10.00 H new ATOM 0 HA THR A 58 0.334 -21.313 -0.262 1.00 10.00 H new ATOM 0 HB THR A 58 3.303 -21.689 0.040 1.00 10.00 H new ATOM 0 HG1 THR A 58 1.949 -23.578 -0.597 1.00 10.00 H new ATOM 0 HG21 THR A 58 2.792 -21.994 2.448 1.00 10.00 H new ATOM 0 HG22 THR A 58 2.343 -20.365 1.889 1.00 10.00 H new ATOM 0 HG23 THR A 58 1.086 -21.601 2.132 1.00 10.00 H new ATOM 882 N TRP A 59 0.274 -18.987 -0.713 1.00 10.00 N ATOM 883 CA TRP A 59 0.035 -17.562 -0.886 1.00 10.00 C ATOM 884 C TRP A 59 0.621 -16.671 0.210 1.00 10.00 C ATOM 885 O TRP A 59 0.324 -16.838 1.393 1.00 10.00 O ATOM 886 CB TRP A 59 -1.474 -17.372 -0.972 1.00 10.00 C ATOM 887 CG TRP A 59 -2.111 -17.766 -2.272 1.00 10.00 C ATOM 888 CD1 TRP A 59 -3.281 -18.431 -2.370 1.00 10.00 C ATOM 889 CD2 TRP A 59 -1.683 -17.521 -3.657 1.00 10.00 C ATOM 890 NE1 TRP A 59 -3.582 -18.639 -3.697 1.00 10.00 N ATOM 891 CE2 TRP A 59 -2.638 -18.108 -4.539 1.00 10.00 C ATOM 892 CE3 TRP A 59 -0.603 -16.851 -4.270 1.00 10.00 C ATOM 893 CZ2 TRP A 59 -2.531 -18.056 -5.937 1.00 10.00 C ATOM 894 CZ3 TRP A 59 -0.471 -16.795 -5.670 1.00 10.00 C ATOM 895 CH2 TRP A 59 -1.426 -17.403 -6.502 1.00 10.00 C ATOM 0 H TRP A 59 -0.597 -19.518 -0.734 1.00 10.00 H new ATOM 0 HA TRP A 59 0.551 -17.246 -1.793 1.00 10.00 H new ATOM 0 HB2 TRP A 59 -1.939 -17.948 -0.172 1.00 10.00 H new ATOM 0 HB3 TRP A 59 -1.700 -16.323 -0.782 1.00 10.00 H new ATOM 0 HD1 TRP A 59 -3.888 -18.751 -1.536 1.00 10.00 H new ATOM 0 HE1 TRP A 59 -4.414 -19.133 -4.019 1.00 10.00 H new ATOM 0 HE3 TRP A 59 0.139 -16.370 -3.650 1.00 10.00 H new ATOM 0 HZ2 TRP A 59 -3.284 -18.509 -6.565 1.00 10.00 H new ATOM 0 HZ3 TRP A 59 0.371 -16.280 -6.108 1.00 10.00 H new ATOM 0 HH2 TRP A 59 -1.309 -17.368 -7.575 1.00 10.00 H new ATOM 906 N LYS A 60 1.430 -15.698 -0.231 1.00 10.00 N ATOM 907 CA LYS A 60 2.242 -14.768 0.552 1.00 10.00 C ATOM 908 C LYS A 60 2.694 -13.605 -0.347 1.00 10.00 C ATOM 909 O LYS A 60 2.392 -13.584 -1.541 1.00 10.00 O ATOM 910 CB LYS A 60 3.432 -15.539 1.161 1.00 10.00 C ATOM 911 CG LYS A 60 4.356 -16.167 0.103 1.00 10.00 C ATOM 912 CD LYS A 60 5.491 -16.959 0.756 1.00 10.00 C ATOM 913 CE LYS A 60 6.181 -17.837 -0.293 1.00 10.00 C ATOM 914 NZ LYS A 60 7.510 -18.284 0.178 1.00 10.00 N ATOM 0 H LYS A 60 1.539 -15.531 -1.231 1.00 10.00 H new ATOM 0 HA LYS A 60 1.666 -14.339 1.372 1.00 10.00 H new ATOM 0 HB2 LYS A 60 4.014 -14.861 1.785 1.00 10.00 H new ATOM 0 HB3 LYS A 60 3.051 -16.325 1.813 1.00 10.00 H new ATOM 0 HG2 LYS A 60 3.776 -16.825 -0.545 1.00 10.00 H new ATOM 0 HG3 LYS A 60 4.773 -15.384 -0.530 1.00 10.00 H new ATOM 0 HD2 LYS A 60 6.213 -16.276 1.204 1.00 10.00 H new ATOM 0 HD3 LYS A 60 5.098 -17.579 1.561 1.00 10.00 H new ATOM 0 HE2 LYS A 60 5.559 -18.705 -0.512 1.00 10.00 H new ATOM 0 HE3 LYS A 60 6.290 -17.280 -1.223 1.00 10.00 H new ATOM 0 HZ1 LYS A 60 7.815 -19.110 -0.376 1.00 10.00 H new ATOM 0 HZ2 LYS A 60 8.198 -17.513 0.058 1.00 10.00 H new ATOM 0 HZ3 LYS A 60 7.453 -18.544 1.183 1.00 10.00 H new ATOM 928 N GLU A 61 3.435 -12.639 0.194 1.00 10.00 N ATOM 929 CA GLU A 61 3.938 -11.485 -0.565 1.00 10.00 C ATOM 930 C GLU A 61 4.807 -11.894 -1.762 1.00 10.00 C ATOM 931 O GLU A 61 4.645 -11.346 -2.852 1.00 10.00 O ATOM 932 CB GLU A 61 4.644 -10.459 0.347 1.00 10.00 C ATOM 933 CG GLU A 61 5.641 -11.011 1.377 1.00 10.00 C ATOM 934 CD GLU A 61 4.925 -11.412 2.671 1.00 10.00 C ATOM 935 OE1 GLU A 61 4.791 -10.554 3.571 1.00 10.00 O ATOM 936 OE2 GLU A 61 4.422 -12.554 2.729 1.00 10.00 O ATOM 0 H GLU A 61 3.707 -12.631 1.177 1.00 10.00 H new ATOM 0 HA GLU A 61 3.063 -10.988 -0.985 1.00 10.00 H new ATOM 0 HB2 GLU A 61 5.172 -9.748 -0.288 1.00 10.00 H new ATOM 0 HB3 GLU A 61 3.878 -9.899 0.883 1.00 10.00 H new ATOM 0 HG2 GLU A 61 6.159 -11.875 0.961 1.00 10.00 H new ATOM 0 HG3 GLU A 61 6.399 -10.259 1.594 1.00 10.00 H new ATOM 943 N GLU A 62 5.642 -12.922 -1.586 1.00 10.00 N ATOM 944 CA GLU A 62 6.562 -13.480 -2.586 1.00 10.00 C ATOM 945 C GLU A 62 5.888 -14.190 -3.775 1.00 10.00 C ATOM 946 O GLU A 62 6.573 -14.824 -4.574 1.00 10.00 O ATOM 947 CB GLU A 62 7.544 -14.453 -1.904 1.00 10.00 C ATOM 948 CG GLU A 62 8.269 -13.900 -0.670 1.00 10.00 C ATOM 949 CD GLU A 62 9.263 -14.936 -0.129 1.00 10.00 C ATOM 950 OE1 GLU A 62 8.787 -15.983 0.368 1.00 10.00 O ATOM 951 OE2 GLU A 62 10.484 -14.699 -0.248 1.00 10.00 O ATOM 0 H GLU A 62 5.699 -13.415 -0.695 1.00 10.00 H new ATOM 0 HA GLU A 62 7.078 -12.619 -3.011 1.00 10.00 H new ATOM 0 HB2 GLU A 62 6.997 -15.349 -1.611 1.00 10.00 H new ATOM 0 HB3 GLU A 62 8.291 -14.761 -2.636 1.00 10.00 H new ATOM 0 HG2 GLU A 62 8.796 -12.982 -0.930 1.00 10.00 H new ATOM 0 HG3 GLU A 62 7.544 -13.644 0.102 1.00 10.00 H new ATOM 958 N THR A 63 4.566 -14.076 -3.934 1.00 10.00 N ATOM 959 CA THR A 63 3.753 -14.912 -4.835 1.00 10.00 C ATOM 960 C THR A 63 2.443 -14.229 -5.197 1.00 10.00 C ATOM 961 O THR A 63 2.059 -14.314 -6.359 1.00 10.00 O ATOM 962 CB THR A 63 3.429 -16.299 -4.220 1.00 10.00 C ATOM 963 OG1 THR A 63 2.636 -16.232 -3.054 1.00 10.00 O ATOM 964 CG2 THR A 63 4.646 -17.125 -3.799 1.00 10.00 C ATOM 0 H THR A 63 4.014 -13.383 -3.429 1.00 10.00 H new ATOM 0 HA THR A 63 4.357 -15.054 -5.731 1.00 10.00 H new ATOM 0 HB THR A 63 2.907 -16.773 -5.051 1.00 10.00 H new ATOM 0 HG1 THR A 63 2.702 -15.335 -2.665 1.00 10.00 H new ATOM 0 HG21 THR A 63 4.314 -18.076 -3.382 1.00 10.00 H new ATOM 0 HG22 THR A 63 5.278 -17.311 -4.668 1.00 10.00 H new ATOM 0 HG23 THR A 63 5.215 -16.578 -3.047 1.00 10.00 H new ATOM 972 N LEU A 64 1.827 -13.433 -4.316 1.00 10.00 N ATOM 973 CA LEU A 64 0.721 -12.553 -4.696 1.00 10.00 C ATOM 974 C LEU A 64 1.184 -11.358 -5.533 1.00 10.00 C ATOM 975 O LEU A 64 0.399 -10.868 -6.349 1.00 10.00 O ATOM 976 CB LEU A 64 -0.064 -12.061 -3.460 1.00 10.00 C ATOM 977 CG LEU A 64 -1.304 -12.914 -3.127 1.00 10.00 C ATOM 978 CD1 LEU A 64 -0.944 -14.024 -2.152 1.00 10.00 C ATOM 979 CD2 LEU A 64 -2.396 -12.056 -2.478 1.00 10.00 C ATOM 0 H LEU A 64 2.079 -13.382 -3.329 1.00 10.00 H new ATOM 0 HA LEU A 64 0.056 -13.155 -5.316 1.00 10.00 H new ATOM 0 HB2 LEU A 64 0.603 -12.054 -2.598 1.00 10.00 H new ATOM 0 HB3 LEU A 64 -0.378 -11.031 -3.628 1.00 10.00 H new ATOM 0 HG LEU A 64 -1.667 -13.337 -4.064 1.00 10.00 H new ATOM 0 HD11 LEU A 64 -1.832 -14.615 -1.929 1.00 10.00 H new ATOM 0 HD12 LEU A 64 -0.183 -14.666 -2.596 1.00 10.00 H new ATOM 0 HD13 LEU A 64 -0.558 -13.588 -1.231 1.00 10.00 H new ATOM 0 HD21 LEU A 64 -3.261 -12.679 -2.252 1.00 10.00 H new ATOM 0 HD22 LEU A 64 -2.014 -11.617 -1.556 1.00 10.00 H new ATOM 0 HD23 LEU A 64 -2.690 -11.261 -3.164 1.00 10.00 H new ATOM 991 N MET A 65 2.420 -10.876 -5.357 1.00 10.00 N ATOM 992 CA MET A 65 2.937 -9.792 -6.198 1.00 10.00 C ATOM 993 C MET A 65 3.224 -10.263 -7.615 1.00 10.00 C ATOM 994 O MET A 65 2.838 -9.570 -8.547 1.00 10.00 O ATOM 995 CB MET A 65 4.146 -9.091 -5.564 1.00 10.00 C ATOM 996 CG MET A 65 3.695 -8.268 -4.353 1.00 10.00 C ATOM 997 SD MET A 65 4.906 -7.078 -3.726 1.00 10.00 S ATOM 998 CE MET A 65 6.018 -8.224 -2.881 1.00 10.00 C ATOM 0 H MET A 65 3.072 -11.214 -4.650 1.00 10.00 H new ATOM 0 HA MET A 65 2.148 -9.043 -6.267 1.00 10.00 H new ATOM 0 HB2 MET A 65 4.886 -9.830 -5.257 1.00 10.00 H new ATOM 0 HB3 MET A 65 4.627 -8.443 -6.297 1.00 10.00 H new ATOM 0 HG2 MET A 65 2.786 -7.729 -4.620 1.00 10.00 H new ATOM 0 HG3 MET A 65 3.434 -8.953 -3.547 1.00 10.00 H new ATOM 0 HE1 MET A 65 6.601 -7.682 -2.136 1.00 10.00 H new ATOM 0 HE2 MET A 65 5.434 -9.002 -2.389 1.00 10.00 H new ATOM 0 HE3 MET A 65 6.691 -8.680 -3.607 1.00 10.00 H new ATOM 1008 N GLU A 66 3.778 -11.469 -7.782 1.00 10.00 N ATOM 1009 CA GLU A 66 3.853 -12.115 -9.095 1.00 10.00 C ATOM 1010 C GLU A 66 2.439 -12.351 -9.626 1.00 10.00 C ATOM 1011 O GLU A 66 2.108 -11.969 -10.747 1.00 10.00 O ATOM 1012 CB GLU A 66 4.616 -13.455 -8.989 1.00 10.00 C ATOM 1013 CG GLU A 66 5.855 -13.521 -9.894 1.00 10.00 C ATOM 1014 CD GLU A 66 5.507 -13.532 -11.392 1.00 10.00 C ATOM 1015 OE1 GLU A 66 5.313 -12.431 -11.950 1.00 10.00 O ATOM 1016 OE2 GLU A 66 5.451 -14.644 -11.968 1.00 10.00 O ATOM 0 H GLU A 66 4.181 -12.017 -7.022 1.00 10.00 H new ATOM 0 HA GLU A 66 4.392 -11.466 -9.785 1.00 10.00 H new ATOM 0 HB2 GLU A 66 4.922 -13.610 -7.954 1.00 10.00 H new ATOM 0 HB3 GLU A 66 3.941 -14.271 -9.248 1.00 10.00 H new ATOM 0 HG2 GLU A 66 6.498 -12.667 -9.683 1.00 10.00 H new ATOM 0 HG3 GLU A 66 6.426 -14.417 -9.653 1.00 10.00 H new ATOM 1023 N TYR A 67 1.579 -12.957 -8.800 1.00 10.00 N ATOM 1024 CA TYR A 67 0.280 -13.409 -9.267 1.00 10.00 C ATOM 1025 C TYR A 67 -0.648 -12.261 -9.691 1.00 10.00 C ATOM 1026 O TYR A 67 -1.261 -12.363 -10.741 1.00 10.00 O ATOM 1027 CB TYR A 67 -0.359 -14.293 -8.206 1.00 10.00 C ATOM 1028 CG TYR A 67 -1.769 -14.729 -8.529 1.00 10.00 C ATOM 1029 CD1 TYR A 67 -1.988 -15.672 -9.549 1.00 10.00 C ATOM 1030 CD2 TYR A 67 -2.859 -14.186 -7.823 1.00 10.00 C ATOM 1031 CE1 TYR A 67 -3.295 -16.090 -9.848 1.00 10.00 C ATOM 1032 CE2 TYR A 67 -4.170 -14.578 -8.143 1.00 10.00 C ATOM 1033 CZ TYR A 67 -4.392 -15.545 -9.148 1.00 10.00 C ATOM 1034 OH TYR A 67 -5.655 -15.950 -9.443 1.00 10.00 O ATOM 0 H TYR A 67 1.764 -13.141 -7.814 1.00 10.00 H new ATOM 0 HA TYR A 67 0.439 -13.992 -10.174 1.00 10.00 H new ATOM 0 HB2 TYR A 67 0.260 -15.179 -8.067 1.00 10.00 H new ATOM 0 HB3 TYR A 67 -0.365 -13.756 -7.257 1.00 10.00 H new ATOM 0 HD1 TYR A 67 -1.152 -16.074 -10.102 1.00 10.00 H new ATOM 0 HD2 TYR A 67 -2.688 -13.468 -7.035 1.00 10.00 H new ATOM 0 HE1 TYR A 67 -3.461 -16.831 -10.616 1.00 10.00 H new ATOM 0 HE2 TYR A 67 -5.008 -14.140 -7.621 1.00 10.00 H new ATOM 0 HH TYR A 67 -6.196 -15.174 -9.700 1.00 10.00 H new ATOM 1044 N LEU A 68 -0.771 -11.159 -8.940 1.00 10.00 N ATOM 1045 CA LEU A 68 -1.607 -10.038 -9.419 1.00 10.00 C ATOM 1046 C LEU A 68 -0.973 -9.242 -10.562 1.00 10.00 C ATOM 1047 O LEU A 68 -1.712 -8.573 -11.282 1.00 10.00 O ATOM 1048 CB LEU A 68 -1.990 -9.087 -8.275 1.00 10.00 C ATOM 1049 CG LEU A 68 -3.390 -9.296 -7.671 1.00 10.00 C ATOM 1050 CD1 LEU A 68 -4.483 -8.832 -8.637 1.00 10.00 C ATOM 1051 CD2 LEU A 68 -3.646 -10.742 -7.243 1.00 10.00 C ATOM 0 H LEU A 68 -0.325 -11.016 -8.034 1.00 10.00 H new ATOM 0 HA LEU A 68 -2.507 -10.507 -9.816 1.00 10.00 H new ATOM 0 HB2 LEU A 68 -1.252 -9.191 -7.479 1.00 10.00 H new ATOM 0 HB3 LEU A 68 -1.922 -8.063 -8.641 1.00 10.00 H new ATOM 0 HG LEU A 68 -3.424 -8.683 -6.770 1.00 10.00 H new ATOM 0 HD11 LEU A 68 -5.461 -8.992 -8.183 1.00 10.00 H new ATOM 0 HD12 LEU A 68 -4.352 -7.772 -8.853 1.00 10.00 H new ATOM 0 HD13 LEU A 68 -4.415 -9.402 -9.564 1.00 10.00 H new ATOM 0 HD21 LEU A 68 -4.649 -10.826 -6.825 1.00 10.00 H new ATOM 0 HD22 LEU A 68 -3.558 -11.399 -8.108 1.00 10.00 H new ATOM 0 HD23 LEU A 68 -2.914 -11.034 -6.490 1.00 10.00 H new ATOM 1063 N GLU A 69 0.354 -9.273 -10.728 1.00 10.00 N ATOM 1064 CA GLU A 69 1.018 -8.599 -11.842 1.00 10.00 C ATOM 1065 C GLU A 69 1.089 -9.431 -13.131 1.00 10.00 C ATOM 1066 O GLU A 69 1.153 -8.843 -14.212 1.00 10.00 O ATOM 1067 CB GLU A 69 2.399 -8.140 -11.374 1.00 10.00 C ATOM 1068 CG GLU A 69 2.206 -6.971 -10.383 1.00 10.00 C ATOM 1069 CD GLU A 69 3.479 -6.277 -9.896 1.00 10.00 C ATOM 1070 OE1 GLU A 69 4.569 -6.433 -10.497 1.00 10.00 O ATOM 1071 OE2 GLU A 69 3.369 -5.461 -8.948 1.00 10.00 O ATOM 0 H GLU A 69 0.990 -9.762 -10.098 1.00 10.00 H new ATOM 0 HA GLU A 69 0.411 -7.738 -12.123 1.00 10.00 H new ATOM 0 HB2 GLU A 69 2.931 -8.962 -10.894 1.00 10.00 H new ATOM 0 HB3 GLU A 69 3.003 -7.823 -12.224 1.00 10.00 H new ATOM 0 HG2 GLU A 69 1.569 -6.224 -10.856 1.00 10.00 H new ATOM 0 HG3 GLU A 69 1.667 -7.346 -9.513 1.00 10.00 H new ATOM 1078 N ASN A 70 1.023 -10.765 -13.046 1.00 10.00 N ATOM 1079 CA ASN A 70 1.117 -11.687 -14.187 1.00 10.00 C ATOM 1080 C ASN A 70 0.556 -13.095 -13.829 1.00 10.00 C ATOM 1081 O ASN A 70 1.279 -14.095 -13.848 1.00 10.00 O ATOM 1082 CB ASN A 70 2.595 -11.695 -14.682 1.00 10.00 C ATOM 1083 CG ASN A 70 2.756 -11.186 -16.108 1.00 10.00 C ATOM 1084 OD1 ASN A 70 3.311 -11.847 -16.977 1.00 10.00 O ATOM 1085 ND2 ASN A 70 2.293 -9.988 -16.397 1.00 10.00 N ATOM 0 H ASN A 70 0.899 -11.248 -12.156 1.00 10.00 H new ATOM 0 HA ASN A 70 0.489 -11.349 -15.012 1.00 10.00 H new ATOM 0 HB2 ASN A 70 3.198 -11.080 -14.014 1.00 10.00 H new ATOM 0 HB3 ASN A 70 2.986 -12.711 -14.620 1.00 10.00 H new ATOM 0 HD21 ASN A 70 2.397 -9.615 -17.341 1.00 10.00 H new ATOM 0 HD22 ASN A 70 1.830 -9.433 -15.677 1.00 10.00 H new ATOM 1092 N PRO A 71 -0.763 -13.226 -13.554 1.00 10.00 N ATOM 1093 CA PRO A 71 -1.330 -14.414 -12.903 1.00 10.00 C ATOM 1094 C PRO A 71 -1.144 -15.689 -13.712 1.00 10.00 C ATOM 1095 O PRO A 71 -0.649 -16.689 -13.198 1.00 10.00 O ATOM 1096 CB PRO A 71 -2.819 -14.123 -12.658 1.00 10.00 C ATOM 1097 CG PRO A 71 -3.130 -12.886 -13.492 1.00 10.00 C ATOM 1098 CD PRO A 71 -1.784 -12.201 -13.737 1.00 10.00 C ATOM 0 HA PRO A 71 -0.802 -14.598 -11.967 1.00 10.00 H new ATOM 0 HB2 PRO A 71 -3.439 -14.967 -12.960 1.00 10.00 H new ATOM 0 HB3 PRO A 71 -3.016 -13.944 -11.601 1.00 10.00 H new ATOM 0 HG2 PRO A 71 -3.607 -13.159 -14.433 1.00 10.00 H new ATOM 0 HG3 PRO A 71 -3.817 -12.222 -12.967 1.00 10.00 H new ATOM 0 HD2 PRO A 71 -1.738 -11.782 -14.742 1.00 10.00 H new ATOM 0 HD3 PRO A 71 -1.635 -11.376 -13.041 1.00 10.00 H new ATOM 1106 N LYS A 72 -1.541 -15.632 -14.985 1.00 10.00 N ATOM 1107 CA LYS A 72 -1.597 -16.750 -15.920 1.00 10.00 C ATOM 1108 C LYS A 72 -0.206 -17.236 -16.347 1.00 10.00 C ATOM 1109 O LYS A 72 -0.064 -18.374 -16.783 1.00 10.00 O ATOM 1110 CB LYS A 72 -2.472 -16.346 -17.121 1.00 10.00 C ATOM 1111 CG LYS A 72 -3.720 -15.535 -16.713 1.00 10.00 C ATOM 1112 CD LYS A 72 -4.780 -15.394 -17.809 1.00 10.00 C ATOM 1113 CE LYS A 72 -5.988 -14.692 -17.178 1.00 10.00 C ATOM 1114 NZ LYS A 72 -7.105 -14.519 -18.131 1.00 10.00 N ATOM 0 H LYS A 72 -1.848 -14.757 -15.411 1.00 10.00 H new ATOM 0 HA LYS A 72 -2.050 -17.605 -15.419 1.00 10.00 H new ATOM 0 HB2 LYS A 72 -1.874 -15.757 -17.817 1.00 10.00 H new ATOM 0 HB3 LYS A 72 -2.787 -17.244 -17.652 1.00 10.00 H new ATOM 0 HG2 LYS A 72 -4.176 -16.010 -15.844 1.00 10.00 H new ATOM 0 HG3 LYS A 72 -3.404 -14.539 -16.403 1.00 10.00 H new ATOM 0 HD2 LYS A 72 -4.393 -14.815 -18.648 1.00 10.00 H new ATOM 0 HD3 LYS A 72 -5.063 -16.371 -18.200 1.00 10.00 H new ATOM 0 HE2 LYS A 72 -6.333 -15.270 -16.321 1.00 10.00 H new ATOM 0 HE3 LYS A 72 -5.681 -13.716 -16.802 1.00 10.00 H new ATOM 0 HZ1 LYS A 72 -7.195 -13.514 -18.382 1.00 10.00 H new ATOM 0 HZ2 LYS A 72 -6.918 -15.075 -18.990 1.00 10.00 H new ATOM 0 HZ3 LYS A 72 -7.989 -14.847 -17.693 1.00 10.00 H new ATOM 1128 N LYS A 73 0.813 -16.377 -16.196 1.00 10.00 N ATOM 1129 CA LYS A 73 2.234 -16.734 -16.219 1.00 10.00 C ATOM 1130 C LYS A 73 2.657 -17.398 -14.909 1.00 10.00 C ATOM 1131 O LYS A 73 3.215 -18.490 -14.952 1.00 10.00 O ATOM 1132 CB LYS A 73 3.080 -15.488 -16.512 1.00 10.00 C ATOM 1133 CG LYS A 73 4.567 -15.835 -16.712 1.00 10.00 C ATOM 1134 CD LYS A 73 5.400 -14.583 -17.009 1.00 10.00 C ATOM 1135 CE LYS A 73 5.158 -14.077 -18.437 1.00 10.00 C ATOM 1136 NZ LYS A 73 5.403 -12.623 -18.530 1.00 10.00 N ATOM 0 H LYS A 73 0.662 -15.379 -16.049 1.00 10.00 H new ATOM 0 HA LYS A 73 2.399 -17.460 -17.015 1.00 10.00 H new ATOM 0 HB2 LYS A 73 2.700 -14.993 -17.406 1.00 10.00 H new ATOM 0 HB3 LYS A 73 2.980 -14.780 -15.689 1.00 10.00 H new ATOM 0 HG2 LYS A 73 4.951 -16.325 -15.817 1.00 10.00 H new ATOM 0 HG3 LYS A 73 4.669 -16.545 -17.533 1.00 10.00 H new ATOM 0 HD2 LYS A 73 5.148 -13.798 -16.296 1.00 10.00 H new ATOM 0 HD3 LYS A 73 6.458 -14.808 -16.875 1.00 10.00 H new ATOM 0 HE2 LYS A 73 5.813 -14.605 -19.130 1.00 10.00 H new ATOM 0 HE3 LYS A 73 4.133 -14.297 -18.736 1.00 10.00 H new ATOM 0 HZ1 LYS A 73 5.366 -12.328 -19.527 1.00 10.00 H new ATOM 0 HZ2 LYS A 73 4.675 -12.113 -17.990 1.00 10.00 H new ATOM 0 HZ3 LYS A 73 6.341 -12.403 -18.139 1.00 10.00 H new ATOM 1150 N TYR A 74 2.406 -16.736 -13.768 1.00 10.00 N ATOM 1151 CA TYR A 74 2.838 -17.213 -12.453 1.00 10.00 C ATOM 1152 C TYR A 74 2.311 -18.620 -12.141 1.00 10.00 C ATOM 1153 O TYR A 74 3.065 -19.490 -11.706 1.00 10.00 O ATOM 1154 CB TYR A 74 2.456 -16.231 -11.340 1.00 10.00 C ATOM 1155 CG TYR A 74 2.958 -16.727 -9.995 1.00 10.00 C ATOM 1156 CD1 TYR A 74 4.341 -16.917 -9.795 1.00 10.00 C ATOM 1157 CD2 TYR A 74 2.049 -17.113 -8.993 1.00 10.00 C ATOM 1158 CE1 TYR A 74 4.811 -17.526 -8.620 1.00 10.00 C ATOM 1159 CE2 TYR A 74 2.517 -17.698 -7.803 1.00 10.00 C ATOM 1160 CZ TYR A 74 3.896 -17.940 -7.633 1.00 10.00 C ATOM 1161 OH TYR A 74 4.344 -18.604 -6.537 1.00 10.00 O ATOM 0 H TYR A 74 1.896 -15.853 -13.736 1.00 10.00 H new ATOM 0 HA TYR A 74 3.926 -17.274 -12.491 1.00 10.00 H new ATOM 0 HB2 TYR A 74 2.879 -15.249 -11.553 1.00 10.00 H new ATOM 0 HB3 TYR A 74 1.373 -16.112 -11.309 1.00 10.00 H new ATOM 0 HD1 TYR A 74 5.042 -16.592 -10.549 1.00 10.00 H new ATOM 0 HD2 TYR A 74 0.990 -16.960 -9.138 1.00 10.00 H new ATOM 0 HE1 TYR A 74 5.870 -17.676 -8.474 1.00 10.00 H new ATOM 0 HE2 TYR A 74 1.821 -17.962 -7.020 1.00 10.00 H new ATOM 0 HH TYR A 74 3.636 -18.633 -5.860 1.00 10.00 H new ATOM 1171 N ILE A 75 1.020 -18.847 -12.405 1.00 10.00 N ATOM 1172 CA ILE A 75 0.382 -20.160 -12.360 1.00 10.00 C ATOM 1173 C ILE A 75 -0.480 -20.361 -13.621 1.00 10.00 C ATOM 1174 O ILE A 75 -1.491 -19.673 -13.789 1.00 10.00 O ATOM 1175 CB ILE A 75 -0.400 -20.390 -11.045 1.00 10.00 C ATOM 1176 CG1 ILE A 75 -1.235 -19.169 -10.591 1.00 10.00 C ATOM 1177 CG2 ILE A 75 0.580 -20.817 -9.934 1.00 10.00 C ATOM 1178 CD1 ILE A 75 -2.234 -19.520 -9.487 1.00 10.00 C ATOM 0 H ILE A 75 0.375 -18.100 -12.663 1.00 10.00 H new ATOM 0 HA ILE A 75 1.158 -20.926 -12.361 1.00 10.00 H new ATOM 0 HB ILE A 75 -1.122 -21.183 -11.242 1.00 10.00 H new ATOM 0 HG12 ILE A 75 -0.565 -18.387 -10.235 1.00 10.00 H new ATOM 0 HG13 ILE A 75 -1.773 -18.762 -11.447 1.00 10.00 H new ATOM 0 HG21 ILE A 75 0.030 -20.979 -9.007 1.00 10.00 H new ATOM 0 HG22 ILE A 75 1.081 -21.740 -10.226 1.00 10.00 H new ATOM 0 HG23 ILE A 75 1.323 -20.034 -9.783 1.00 10.00 H new ATOM 0 HD11 ILE A 75 -2.794 -18.628 -9.206 1.00 10.00 H new ATOM 0 HD12 ILE A 75 -2.924 -20.282 -9.850 1.00 10.00 H new ATOM 0 HD13 ILE A 75 -1.697 -19.901 -8.618 1.00 10.00 H new ATOM 1190 N PRO A 76 -0.104 -21.282 -14.534 1.00 10.00 N ATOM 1191 CA PRO A 76 -0.931 -21.596 -15.695 1.00 10.00 C ATOM 1192 C PRO A 76 -2.245 -22.252 -15.251 1.00 10.00 C ATOM 1193 O PRO A 76 -2.362 -22.755 -14.134 1.00 10.00 O ATOM 1194 CB PRO A 76 -0.076 -22.519 -16.569 1.00 10.00 C ATOM 1195 CG PRO A 76 0.809 -23.235 -15.553 1.00 10.00 C ATOM 1196 CD PRO A 76 1.054 -22.167 -14.489 1.00 10.00 C ATOM 0 HA PRO A 76 -1.223 -20.708 -16.255 1.00 10.00 H new ATOM 0 HB2 PRO A 76 -0.689 -23.220 -17.135 1.00 10.00 H new ATOM 0 HB3 PRO A 76 0.514 -21.956 -17.292 1.00 10.00 H new ATOM 0 HG2 PRO A 76 0.315 -24.113 -15.136 1.00 10.00 H new ATOM 0 HG3 PRO A 76 1.741 -23.577 -16.002 1.00 10.00 H new ATOM 0 HD2 PRO A 76 1.163 -22.617 -13.502 1.00 10.00 H new ATOM 0 HD3 PRO A 76 1.973 -21.618 -14.692 1.00 10.00 H new ATOM 1204 N GLY A 77 -3.252 -22.244 -16.127 1.00 10.00 N ATOM 1205 CA GLY A 77 -4.576 -22.787 -15.812 1.00 10.00 C ATOM 1206 C GLY A 77 -5.442 -21.891 -14.914 1.00 10.00 C ATOM 1207 O GLY A 77 -6.538 -22.310 -14.544 1.00 10.00 O ATOM 0 H GLY A 77 -3.174 -21.863 -17.070 1.00 10.00 H new ATOM 0 HA2 GLY A 77 -5.110 -22.968 -16.745 1.00 10.00 H new ATOM 0 HA3 GLY A 77 -4.450 -23.754 -15.324 1.00 10.00 H new ATOM 1211 N THR A 78 -5.006 -20.667 -14.585 1.00 10.00 N ATOM 1212 CA THR A 78 -5.862 -19.625 -13.999 1.00 10.00 C ATOM 1213 C THR A 78 -6.430 -18.714 -15.088 1.00 10.00 C ATOM 1214 O THR A 78 -5.686 -18.089 -15.842 1.00 10.00 O ATOM 1215 CB THR A 78 -5.118 -18.820 -12.916 1.00 10.00 C ATOM 1216 OG1 THR A 78 -5.212 -19.530 -11.705 1.00 10.00 O ATOM 1217 CG2 THR A 78 -5.727 -17.442 -12.646 1.00 10.00 C ATOM 0 H THR A 78 -4.040 -20.369 -14.719 1.00 10.00 H new ATOM 0 HA THR A 78 -6.699 -20.119 -13.507 1.00 10.00 H new ATOM 0 HB THR A 78 -4.098 -18.684 -13.276 1.00 10.00 H new ATOM 0 HG1 THR A 78 -6.127 -19.467 -11.359 1.00 10.00 H new ATOM 0 HG21 THR A 78 -5.150 -16.935 -11.873 1.00 10.00 H new ATOM 0 HG22 THR A 78 -5.707 -16.850 -13.561 1.00 10.00 H new ATOM 0 HG23 THR A 78 -6.758 -17.559 -12.312 1.00 10.00 H new ATOM 1225 N LYS A 79 -7.765 -18.626 -15.162 1.00 10.00 N ATOM 1226 CA LYS A 79 -8.486 -17.769 -16.120 1.00 10.00 C ATOM 1227 C LYS A 79 -8.702 -16.320 -15.647 1.00 10.00 C ATOM 1228 O LYS A 79 -9.082 -15.495 -16.477 1.00 10.00 O ATOM 1229 CB LYS A 79 -9.822 -18.426 -16.526 1.00 10.00 C ATOM 1230 CG LYS A 79 -9.727 -19.908 -16.955 1.00 10.00 C ATOM 1231 CD LYS A 79 -8.827 -20.212 -18.172 1.00 10.00 C ATOM 1232 CE LYS A 79 -9.588 -20.332 -19.502 1.00 10.00 C ATOM 1233 NZ LYS A 79 -10.165 -19.045 -19.950 1.00 10.00 N ATOM 0 H LYS A 79 -8.386 -19.155 -14.550 1.00 10.00 H new ATOM 0 HA LYS A 79 -7.837 -17.686 -16.992 1.00 10.00 H new ATOM 0 HB2 LYS A 79 -10.514 -18.352 -15.687 1.00 10.00 H new ATOM 0 HB3 LYS A 79 -10.254 -17.854 -17.347 1.00 10.00 H new ATOM 0 HG2 LYS A 79 -9.362 -20.487 -16.107 1.00 10.00 H new ATOM 0 HG3 LYS A 79 -10.733 -20.265 -17.176 1.00 10.00 H new ATOM 0 HD2 LYS A 79 -8.080 -19.424 -18.263 1.00 10.00 H new ATOM 0 HD3 LYS A 79 -8.289 -21.142 -17.989 1.00 10.00 H new ATOM 0 HE2 LYS A 79 -8.912 -20.709 -20.270 1.00 10.00 H new ATOM 0 HE3 LYS A 79 -10.387 -21.065 -19.393 1.00 10.00 H new ATOM 0 HZ1 LYS A 79 -10.637 -19.177 -20.867 1.00 10.00 H new ATOM 0 HZ2 LYS A 79 -10.857 -18.712 -19.249 1.00 10.00 H new ATOM 0 HZ3 LYS A 79 -9.407 -18.340 -20.049 1.00 10.00 H new ATOM 1247 N MET A 80 -8.426 -16.002 -14.369 1.00 10.00 N ATOM 1248 CA MET A 80 -8.688 -14.735 -13.650 1.00 10.00 C ATOM 1249 C MET A 80 -8.868 -13.500 -14.557 1.00 10.00 C ATOM 1250 O MET A 80 -7.901 -12.891 -15.029 1.00 10.00 O ATOM 1251 CB MET A 80 -7.638 -14.524 -12.542 1.00 10.00 C ATOM 1252 CG MET A 80 -7.789 -13.174 -11.828 1.00 10.00 C ATOM 1253 SD MET A 80 -6.978 -13.073 -10.210 1.00 10.00 S ATOM 1254 CE MET A 80 -6.564 -11.314 -10.190 1.00 10.00 C ATOM 0 H MET A 80 -7.975 -16.682 -13.757 1.00 10.00 H new ATOM 0 HA MET A 80 -9.667 -14.842 -13.182 1.00 10.00 H new ATOM 0 HB2 MET A 80 -7.722 -15.328 -11.811 1.00 10.00 H new ATOM 0 HB3 MET A 80 -6.640 -14.591 -12.976 1.00 10.00 H new ATOM 0 HG2 MET A 80 -7.384 -12.392 -12.471 1.00 10.00 H new ATOM 0 HG3 MET A 80 -8.851 -12.964 -11.700 1.00 10.00 H new ATOM 0 HE1 MET A 80 -6.235 -11.029 -9.191 1.00 10.00 H new ATOM 0 HE2 MET A 80 -5.764 -11.120 -10.905 1.00 10.00 H new ATOM 0 HE3 MET A 80 -7.443 -10.730 -10.462 1.00 10.00 H new ATOM 1264 N ILE A 81 -10.136 -13.155 -14.817 1.00 10.00 N ATOM 1265 CA ILE A 81 -10.563 -12.132 -15.773 1.00 10.00 C ATOM 1266 C ILE A 81 -10.421 -10.734 -15.144 1.00 10.00 C ATOM 1267 O ILE A 81 -11.397 -10.053 -14.835 1.00 10.00 O ATOM 1268 CB ILE A 81 -11.982 -12.425 -16.332 1.00 10.00 C ATOM 1269 CG1 ILE A 81 -12.179 -13.874 -16.852 1.00 10.00 C ATOM 1270 CG2 ILE A 81 -12.261 -11.481 -17.520 1.00 10.00 C ATOM 1271 CD1 ILE A 81 -12.551 -14.916 -15.785 1.00 10.00 C ATOM 0 H ILE A 81 -10.923 -13.601 -14.346 1.00 10.00 H new ATOM 0 HA ILE A 81 -9.906 -12.157 -16.643 1.00 10.00 H new ATOM 0 HB ILE A 81 -12.663 -12.275 -15.494 1.00 10.00 H new ATOM 0 HG12 ILE A 81 -12.959 -13.865 -17.613 1.00 10.00 H new ATOM 0 HG13 ILE A 81 -11.259 -14.194 -17.342 1.00 10.00 H new ATOM 0 HG21 ILE A 81 -13.256 -11.681 -17.918 1.00 10.00 H new ATOM 0 HG22 ILE A 81 -12.206 -10.446 -17.183 1.00 10.00 H new ATOM 0 HG23 ILE A 81 -11.518 -11.648 -18.300 1.00 10.00 H new ATOM 0 HD11 ILE A 81 -12.665 -15.893 -16.255 1.00 10.00 H new ATOM 0 HD12 ILE A 81 -11.763 -14.964 -15.033 1.00 10.00 H new ATOM 0 HD13 ILE A 81 -13.489 -14.631 -15.309 1.00 10.00 H new ATOM 1283 N PHE A 82 -9.163 -10.325 -14.960 1.00 10.00 N ATOM 1284 CA PHE A 82 -8.742 -8.975 -14.567 1.00 10.00 C ATOM 1285 C PHE A 82 -7.242 -8.751 -14.823 1.00 10.00 C ATOM 1286 O PHE A 82 -6.851 -7.679 -15.268 1.00 10.00 O ATOM 1287 CB PHE A 82 -9.046 -8.735 -13.082 1.00 10.00 C ATOM 1288 CG PHE A 82 -8.811 -7.310 -12.628 1.00 10.00 C ATOM 1289 CD1 PHE A 82 -9.429 -6.227 -13.283 1.00 10.00 C ATOM 1290 CD2 PHE A 82 -7.951 -7.075 -11.547 1.00 10.00 C ATOM 1291 CE1 PHE A 82 -9.155 -4.910 -12.876 1.00 10.00 C ATOM 1292 CE2 PHE A 82 -7.684 -5.758 -11.134 1.00 10.00 C ATOM 1293 CZ PHE A 82 -8.279 -4.674 -11.802 1.00 10.00 C ATOM 0 H PHE A 82 -8.371 -10.956 -15.087 1.00 10.00 H new ATOM 0 HA PHE A 82 -9.303 -8.268 -15.178 1.00 10.00 H new ATOM 0 HB2 PHE A 82 -10.085 -9.001 -12.887 1.00 10.00 H new ATOM 0 HB3 PHE A 82 -8.428 -9.403 -12.482 1.00 10.00 H new ATOM 0 HD1 PHE A 82 -10.114 -6.409 -14.098 1.00 10.00 H new ATOM 0 HD2 PHE A 82 -7.493 -7.906 -11.031 1.00 10.00 H new ATOM 0 HE1 PHE A 82 -9.617 -4.079 -13.388 1.00 10.00 H new ATOM 0 HE2 PHE A 82 -7.020 -5.579 -10.301 1.00 10.00 H new ATOM 0 HZ PHE A 82 -8.064 -3.662 -11.491 1.00 10.00 H new ATOM 1303 N ALA A 83 -6.429 -9.790 -14.593 1.00 10.00 N ATOM 1304 CA ALA A 83 -4.988 -9.943 -14.835 1.00 10.00 C ATOM 1305 C ALA A 83 -3.991 -8.831 -14.420 1.00 10.00 C ATOM 1306 O ALA A 83 -2.793 -9.104 -14.455 1.00 10.00 O ATOM 1307 CB ALA A 83 -4.802 -10.346 -16.303 1.00 10.00 C ATOM 0 H ALA A 83 -6.810 -10.644 -14.185 1.00 10.00 H new ATOM 0 HA ALA A 83 -4.692 -10.708 -14.117 1.00 10.00 H new ATOM 0 HB1 ALA A 83 -3.740 -10.468 -16.515 1.00 10.00 H new ATOM 0 HB2 ALA A 83 -5.320 -11.287 -16.490 1.00 10.00 H new ATOM 0 HB3 ALA A 83 -5.214 -9.570 -16.948 1.00 10.00 H new ATOM 1313 N GLY A 84 -4.422 -7.638 -13.992 1.00 10.00 N ATOM 1314 CA GLY A 84 -3.523 -6.568 -13.554 1.00 10.00 C ATOM 1315 C GLY A 84 -4.250 -5.374 -12.932 1.00 10.00 C ATOM 1316 O GLY A 84 -5.012 -4.692 -13.610 1.00 10.00 O ATOM 0 H GLY A 84 -5.410 -7.389 -13.940 1.00 10.00 H new ATOM 0 HA2 GLY A 84 -2.818 -6.972 -12.828 1.00 10.00 H new ATOM 0 HA3 GLY A 84 -2.939 -6.223 -14.407 1.00 10.00 H new ATOM 1320 N ILE A 85 -3.968 -5.071 -11.655 1.00 10.00 N ATOM 1321 CA ILE A 85 -4.563 -3.947 -10.902 1.00 10.00 C ATOM 1322 C ILE A 85 -4.173 -2.538 -11.400 1.00 10.00 C ATOM 1323 O ILE A 85 -4.687 -1.549 -10.879 1.00 10.00 O ATOM 1324 CB ILE A 85 -4.314 -4.136 -9.383 1.00 10.00 C ATOM 1325 CG1 ILE A 85 -5.287 -3.278 -8.538 1.00 10.00 C ATOM 1326 CG2 ILE A 85 -2.844 -3.874 -9.002 1.00 10.00 C ATOM 1327 CD1 ILE A 85 -5.371 -3.702 -7.074 1.00 10.00 C ATOM 0 H ILE A 85 -3.304 -5.612 -11.101 1.00 10.00 H new ATOM 0 HA ILE A 85 -5.635 -3.986 -11.096 1.00 10.00 H new ATOM 0 HB ILE A 85 -4.518 -5.182 -9.153 1.00 10.00 H new ATOM 0 HG12 ILE A 85 -4.973 -2.235 -8.587 1.00 10.00 H new ATOM 0 HG13 ILE A 85 -6.282 -3.333 -8.980 1.00 10.00 H new ATOM 0 HG21 ILE A 85 -2.715 -4.018 -7.929 1.00 10.00 H new ATOM 0 HG22 ILE A 85 -2.199 -4.568 -9.541 1.00 10.00 H new ATOM 0 HG23 ILE A 85 -2.577 -2.851 -9.266 1.00 10.00 H new ATOM 0 HD11 ILE A 85 -6.072 -3.054 -6.547 1.00 10.00 H new ATOM 0 HD12 ILE A 85 -5.715 -4.735 -7.013 1.00 10.00 H new ATOM 0 HD13 ILE A 85 -4.386 -3.620 -6.614 1.00 10.00 H new ATOM 1339 N LYS A 86 -3.317 -2.435 -12.430 1.00 10.00 N ATOM 1340 CA LYS A 86 -2.792 -1.181 -13.001 1.00 10.00 C ATOM 1341 C LYS A 86 -1.805 -0.494 -12.033 1.00 10.00 C ATOM 1342 O LYS A 86 -1.526 -1.013 -10.954 1.00 10.00 O ATOM 1343 CB LYS A 86 -3.986 -0.290 -13.411 1.00 10.00 C ATOM 1344 CG LYS A 86 -3.821 0.511 -14.707 1.00 10.00 C ATOM 1345 CD LYS A 86 -5.139 1.267 -14.926 1.00 10.00 C ATOM 1346 CE LYS A 86 -5.138 2.122 -16.190 1.00 10.00 C ATOM 1347 NZ LYS A 86 -6.252 3.093 -16.128 1.00 10.00 N ATOM 0 H LYS A 86 -2.955 -3.259 -12.910 1.00 10.00 H new ATOM 0 HA LYS A 86 -2.206 -1.386 -13.897 1.00 10.00 H new ATOM 0 HB2 LYS A 86 -4.868 -0.923 -13.510 1.00 10.00 H new ATOM 0 HB3 LYS A 86 -4.186 0.410 -12.599 1.00 10.00 H new ATOM 0 HG2 LYS A 86 -2.984 1.205 -14.630 1.00 10.00 H new ATOM 0 HG3 LYS A 86 -3.610 -0.151 -15.547 1.00 10.00 H new ATOM 0 HD2 LYS A 86 -5.957 0.549 -14.981 1.00 10.00 H new ATOM 0 HD3 LYS A 86 -5.332 1.905 -14.064 1.00 10.00 H new ATOM 0 HE2 LYS A 86 -4.188 2.648 -16.286 1.00 10.00 H new ATOM 0 HE3 LYS A 86 -5.242 1.488 -17.071 1.00 10.00 H new ATOM 0 HZ1 LYS A 86 -6.252 3.676 -16.989 1.00 10.00 H new ATOM 0 HZ2 LYS A 86 -7.155 2.582 -16.056 1.00 10.00 H new ATOM 0 HZ3 LYS A 86 -6.133 3.705 -15.295 1.00 10.00 H new ATOM 1361 N LYS A 87 -1.228 0.641 -12.464 1.00 10.00 N ATOM 1362 CA LYS A 87 -0.150 1.408 -11.804 1.00 10.00 C ATOM 1363 C LYS A 87 0.855 0.510 -11.057 1.00 10.00 C ATOM 1364 O LYS A 87 1.655 -0.123 -11.746 1.00 10.00 O ATOM 1365 CB LYS A 87 -0.724 2.575 -10.980 1.00 10.00 C ATOM 1366 CG LYS A 87 -1.162 3.755 -11.865 1.00 10.00 C ATOM 1367 CD LYS A 87 -1.507 5.001 -11.034 1.00 10.00 C ATOM 1368 CE LYS A 87 -2.792 4.814 -10.220 1.00 10.00 C ATOM 1369 NZ LYS A 87 -3.986 5.355 -10.904 1.00 10.00 N ATOM 0 H LYS A 87 -1.519 1.078 -13.339 1.00 10.00 H new ATOM 0 HA LYS A 87 0.458 1.873 -12.580 1.00 10.00 H new ATOM 0 HB2 LYS A 87 -1.577 2.222 -10.400 1.00 10.00 H new ATOM 0 HB3 LYS A 87 0.026 2.917 -10.267 1.00 10.00 H new ATOM 0 HG2 LYS A 87 -0.364 3.997 -12.567 1.00 10.00 H new ATOM 0 HG3 LYS A 87 -2.029 3.462 -12.457 1.00 10.00 H new ATOM 0 HD2 LYS A 87 -0.681 5.226 -10.360 1.00 10.00 H new ATOM 0 HD3 LYS A 87 -1.620 5.859 -11.697 1.00 10.00 H new ATOM 0 HE2 LYS A 87 -2.941 3.752 -10.023 1.00 10.00 H new ATOM 0 HE3 LYS A 87 -2.679 5.304 -9.253 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 -4.826 5.202 -10.310 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 -3.860 6.374 -11.069 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 -4.114 4.870 -11.815 1.00 10.00 H new ATOM 1383 N LYS A 88 0.836 0.436 -9.710 1.00 10.00 N ATOM 1384 CA LYS A 88 1.632 -0.527 -8.912 1.00 10.00 C ATOM 1385 C LYS A 88 1.408 -0.421 -7.405 1.00 10.00 C ATOM 1386 O LYS A 88 1.309 -1.452 -6.744 1.00 10.00 O ATOM 1387 CB LYS A 88 3.156 -0.430 -9.186 1.00 10.00 C ATOM 1388 CG LYS A 88 3.695 -1.806 -9.609 1.00 10.00 C ATOM 1389 CD LYS A 88 5.203 -1.771 -9.892 1.00 10.00 C ATOM 1390 CE LYS A 88 5.682 -3.098 -10.493 1.00 10.00 C ATOM 1391 NZ LYS A 88 5.616 -4.217 -9.526 1.00 10.00 N ATOM 0 H LYS A 88 0.260 1.051 -9.135 1.00 10.00 H new ATOM 0 HA LYS A 88 1.262 -1.495 -9.249 1.00 10.00 H new ATOM 0 HB2 LYS A 88 3.348 0.303 -9.969 1.00 10.00 H new ATOM 0 HB3 LYS A 88 3.675 -0.085 -8.292 1.00 10.00 H new ATOM 0 HG2 LYS A 88 3.491 -2.533 -8.823 1.00 10.00 H new ATOM 0 HG3 LYS A 88 3.167 -2.144 -10.501 1.00 10.00 H new ATOM 0 HD2 LYS A 88 5.429 -0.955 -10.578 1.00 10.00 H new ATOM 0 HD3 LYS A 88 5.745 -1.570 -8.968 1.00 10.00 H new ATOM 0 HE2 LYS A 88 5.073 -3.339 -11.364 1.00 10.00 H new ATOM 0 HE3 LYS A 88 6.708 -2.985 -10.843 1.00 10.00 H new ATOM 0 HZ1 LYS A 88 5.803 -5.113 -10.019 1.00 10.00 H new ATOM 0 HZ2 LYS A 88 6.329 -4.076 -8.782 1.00 10.00 H new ATOM 0 HZ3 LYS A 88 4.669 -4.249 -9.096 1.00 10.00 H new ATOM 1405 N THR A 89 1.346 0.799 -6.859 1.00 10.00 N ATOM 1406 CA THR A 89 1.195 1.064 -5.417 1.00 10.00 C ATOM 1407 C THR A 89 -0.019 0.341 -4.831 1.00 10.00 C ATOM 1408 O THR A 89 0.039 -0.182 -3.726 1.00 10.00 O ATOM 1409 CB THR A 89 1.090 2.575 -5.158 1.00 10.00 C ATOM 1410 OG1 THR A 89 2.163 3.232 -5.792 1.00 10.00 O ATOM 1411 CG2 THR A 89 1.159 2.925 -3.670 1.00 10.00 C ATOM 0 H THR A 89 1.400 1.651 -7.417 1.00 10.00 H new ATOM 0 HA THR A 89 2.083 0.677 -4.918 1.00 10.00 H new ATOM 0 HB THR A 89 0.124 2.893 -5.549 1.00 10.00 H new ATOM 0 HG1 THR A 89 2.098 4.196 -5.630 1.00 10.00 H new ATOM 0 HG21 THR A 89 1.080 4.005 -3.546 1.00 10.00 H new ATOM 0 HG22 THR A 89 0.338 2.438 -3.143 1.00 10.00 H new ATOM 0 HG23 THR A 89 2.108 2.581 -3.259 1.00 10.00 H new ATOM 1419 N GLU A 90 -1.086 0.218 -5.619 1.00 10.00 N ATOM 1420 CA GLU A 90 -2.297 -0.548 -5.350 1.00 10.00 C ATOM 1421 C GLU A 90 -1.981 -1.997 -4.949 1.00 10.00 C ATOM 1422 O GLU A 90 -2.584 -2.531 -4.019 1.00 10.00 O ATOM 1423 CB GLU A 90 -3.175 -0.541 -6.618 1.00 10.00 C ATOM 1424 CG GLU A 90 -3.620 0.846 -7.122 1.00 10.00 C ATOM 1425 CD GLU A 90 -2.545 1.703 -7.824 1.00 10.00 C ATOM 1426 OE1 GLU A 90 -1.425 1.207 -8.112 1.00 10.00 O ATOM 1427 OE2 GLU A 90 -2.854 2.892 -8.058 1.00 10.00 O ATOM 0 H GLU A 90 -1.128 0.685 -6.525 1.00 10.00 H new ATOM 0 HA GLU A 90 -2.821 -0.085 -4.514 1.00 10.00 H new ATOM 0 HB2 GLU A 90 -2.627 -1.038 -7.418 1.00 10.00 H new ATOM 0 HB3 GLU A 90 -4.066 -1.138 -6.423 1.00 10.00 H new ATOM 0 HG2 GLU A 90 -4.450 0.707 -7.814 1.00 10.00 H new ATOM 0 HG3 GLU A 90 -4.004 1.410 -6.272 1.00 10.00 H new ATOM 1434 N ARG A 91 -1.014 -2.627 -5.630 1.00 10.00 N ATOM 1435 CA ARG A 91 -0.593 -4.012 -5.417 1.00 10.00 C ATOM 1436 C ARG A 91 0.120 -4.164 -4.067 1.00 10.00 C ATOM 1437 O ARG A 91 -0.219 -5.083 -3.318 1.00 10.00 O ATOM 1438 CB ARG A 91 0.258 -4.471 -6.630 1.00 10.00 C ATOM 1439 CG ARG A 91 -0.084 -5.869 -7.187 1.00 10.00 C ATOM 1440 CD ARG A 91 0.613 -7.035 -6.476 1.00 10.00 C ATOM 1441 NE ARG A 91 0.167 -7.165 -5.081 1.00 10.00 N ATOM 1442 CZ ARG A 91 -0.734 -7.962 -4.532 1.00 10.00 C ATOM 1443 NH1 ARG A 91 -1.165 -9.078 -5.047 1.00 10.00 N ATOM 1444 NH2 ARG A 91 -1.235 -7.616 -3.383 1.00 10.00 N ATOM 0 H ARG A 91 -0.486 -2.166 -6.371 1.00 10.00 H new ATOM 0 HA ARG A 91 -1.460 -4.671 -5.360 1.00 10.00 H new ATOM 0 HB2 ARG A 91 0.142 -3.741 -7.431 1.00 10.00 H new ATOM 0 HB3 ARG A 91 1.309 -4.461 -6.340 1.00 10.00 H new ATOM 0 HG2 ARG A 91 -1.162 -6.016 -7.123 1.00 10.00 H new ATOM 0 HG3 ARG A 91 0.180 -5.897 -8.244 1.00 10.00 H new ATOM 0 HD2 ARG A 91 0.409 -7.962 -7.011 1.00 10.00 H new ATOM 0 HD3 ARG A 91 1.692 -6.884 -6.501 1.00 10.00 H new ATOM 0 HE ARG A 91 0.631 -6.534 -4.427 1.00 10.00 H new ATOM 0 HH11 ARG A 91 -0.803 -9.398 -5.945 1.00 10.00 H new ATOM 0 HH12 ARG A 91 -1.864 -9.632 -4.552 1.00 10.00 H new ATOM 0 HH21 ARG A 91 -0.931 -6.753 -2.933 1.00 10.00 H new ATOM 0 HH22 ARG A 91 -1.932 -8.208 -2.932 1.00 10.00 H new ATOM 1458 N GLU A 92 1.095 -3.311 -3.737 1.00 10.00 N ATOM 1459 CA GLU A 92 1.747 -3.358 -2.416 1.00 10.00 C ATOM 1460 C GLU A 92 0.801 -2.934 -1.276 1.00 10.00 C ATOM 1461 O GLU A 92 0.866 -3.506 -0.188 1.00 10.00 O ATOM 1462 CB GLU A 92 3.059 -2.555 -2.392 1.00 10.00 C ATOM 1463 CG GLU A 92 2.890 -1.097 -2.825 1.00 10.00 C ATOM 1464 CD GLU A 92 4.048 -0.217 -2.374 1.00 10.00 C ATOM 1465 OE1 GLU A 92 3.939 0.272 -1.225 1.00 10.00 O ATOM 1466 OE2 GLU A 92 4.983 -0.015 -3.177 1.00 10.00 O ATOM 0 H GLU A 92 1.451 -2.584 -4.358 1.00 10.00 H new ATOM 0 HA GLU A 92 2.003 -4.402 -2.239 1.00 10.00 H new ATOM 0 HB2 GLU A 92 3.473 -2.581 -1.384 1.00 10.00 H new ATOM 0 HB3 GLU A 92 3.784 -3.039 -3.047 1.00 10.00 H new ATOM 0 HG2 GLU A 92 2.805 -1.051 -3.911 1.00 10.00 H new ATOM 0 HG3 GLU A 92 1.959 -0.705 -2.415 1.00 10.00 H new ATOM 1473 N ASP A 93 -0.131 -2.004 -1.520 1.00 10.00 N ATOM 1474 CA ASP A 93 -1.213 -1.706 -0.581 1.00 10.00 C ATOM 1475 C ASP A 93 -2.096 -2.934 -0.336 1.00 10.00 C ATOM 1476 O ASP A 93 -2.372 -3.251 0.815 1.00 10.00 O ATOM 1477 CB ASP A 93 -2.037 -0.507 -1.065 1.00 10.00 C ATOM 1478 CG ASP A 93 -1.878 0.676 -0.117 1.00 10.00 C ATOM 1479 OD1 ASP A 93 -0.832 1.357 -0.238 1.00 10.00 O ATOM 1480 OD2 ASP A 93 -2.796 0.894 0.706 1.00 10.00 O ATOM 0 H ASP A 93 -0.154 -1.441 -2.370 1.00 10.00 H new ATOM 0 HA ASP A 93 -0.764 -1.438 0.376 1.00 10.00 H new ATOM 0 HB2 ASP A 93 -1.718 -0.221 -2.067 1.00 10.00 H new ATOM 0 HB3 ASP A 93 -3.089 -0.786 -1.133 1.00 10.00 H new ATOM 1485 N LEU A 94 -2.482 -3.678 -1.383 1.00 10.00 N ATOM 1486 CA LEU A 94 -3.175 -4.964 -1.236 1.00 10.00 C ATOM 1487 C LEU A 94 -2.390 -6.008 -0.432 1.00 10.00 C ATOM 1488 O LEU A 94 -3.015 -6.785 0.290 1.00 10.00 O ATOM 1489 CB LEU A 94 -3.529 -5.542 -2.614 1.00 10.00 C ATOM 1490 CG LEU A 94 -4.995 -5.422 -3.019 1.00 10.00 C ATOM 1491 CD1 LEU A 94 -5.536 -4.004 -2.958 1.00 10.00 C ATOM 1492 CD2 LEU A 94 -5.117 -5.945 -4.446 1.00 10.00 C ATOM 0 H LEU A 94 -2.323 -3.405 -2.353 1.00 10.00 H new ATOM 0 HA LEU A 94 -4.079 -4.747 -0.668 1.00 10.00 H new ATOM 0 HB2 LEU A 94 -2.920 -5.041 -3.366 1.00 10.00 H new ATOM 0 HB3 LEU A 94 -3.251 -6.596 -2.629 1.00 10.00 H new ATOM 0 HG LEU A 94 -5.587 -5.999 -2.308 1.00 10.00 H new ATOM 0 HD11 LEU A 94 -6.583 -4.001 -3.260 1.00 10.00 H new ATOM 0 HD12 LEU A 94 -5.451 -3.626 -1.939 1.00 10.00 H new ATOM 0 HD13 LEU A 94 -4.962 -3.366 -3.631 1.00 10.00 H new ATOM 0 HD21 LEU A 94 -6.155 -5.875 -4.772 1.00 10.00 H new ATOM 0 HD22 LEU A 94 -4.488 -5.349 -5.107 1.00 10.00 H new ATOM 0 HD23 LEU A 94 -4.795 -6.986 -4.481 1.00 10.00 H new ATOM 1504 N ILE A 95 -1.055 -6.049 -0.553 1.00 10.00 N ATOM 1505 CA ILE A 95 -0.205 -6.903 0.297 1.00 10.00 C ATOM 1506 C ILE A 95 -0.408 -6.514 1.762 1.00 10.00 C ATOM 1507 O ILE A 95 -0.736 -7.375 2.577 1.00 10.00 O ATOM 1508 CB ILE A 95 1.294 -6.868 -0.108 1.00 10.00 C ATOM 1509 CG1 ILE A 95 1.583 -7.543 -1.465 1.00 10.00 C ATOM 1510 CG2 ILE A 95 2.197 -7.489 0.974 1.00 10.00 C ATOM 1511 CD1 ILE A 95 1.117 -9.000 -1.594 1.00 10.00 C ATOM 0 H ILE A 95 -0.536 -5.497 -1.236 1.00 10.00 H new ATOM 0 HA ILE A 95 -0.514 -7.938 0.151 1.00 10.00 H new ATOM 0 HB ILE A 95 1.529 -5.809 -0.211 1.00 10.00 H new ATOM 0 HG12 ILE A 95 1.106 -6.957 -2.251 1.00 10.00 H new ATOM 0 HG13 ILE A 95 2.657 -7.506 -1.647 1.00 10.00 H new ATOM 0 HG21 ILE A 95 3.237 -7.444 0.650 1.00 10.00 H new ATOM 0 HG22 ILE A 95 2.083 -6.935 1.905 1.00 10.00 H new ATOM 0 HG23 ILE A 95 1.911 -8.529 1.133 1.00 10.00 H new ATOM 0 HD11 ILE A 95 1.369 -9.376 -2.585 1.00 10.00 H new ATOM 0 HD12 ILE A 95 1.612 -9.609 -0.838 1.00 10.00 H new ATOM 0 HD13 ILE A 95 0.038 -9.051 -1.451 1.00 10.00 H new ATOM 1523 N ALA A 96 -0.253 -5.227 2.089 1.00 10.00 N ATOM 1524 CA ALA A 96 -0.453 -4.724 3.446 1.00 10.00 C ATOM 1525 C ALA A 96 -1.884 -4.992 3.948 1.00 10.00 C ATOM 1526 O ALA A 96 -2.068 -5.553 5.030 1.00 10.00 O ATOM 1527 CB ALA A 96 -0.089 -3.238 3.474 1.00 10.00 C ATOM 0 H ALA A 96 0.015 -4.507 1.418 1.00 10.00 H new ATOM 0 HA ALA A 96 0.201 -5.258 4.135 1.00 10.00 H new ATOM 0 HB1 ALA A 96 -0.233 -2.847 4.481 1.00 10.00 H new ATOM 0 HB2 ALA A 96 0.954 -3.113 3.182 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -0.728 -2.694 2.779 1.00 10.00 H new ATOM 1533 N TYR A 97 -2.892 -4.643 3.140 1.00 10.00 N ATOM 1534 CA TYR A 97 -4.306 -4.891 3.405 1.00 10.00 C ATOM 1535 C TYR A 97 -4.606 -6.368 3.670 1.00 10.00 C ATOM 1536 O TYR A 97 -5.230 -6.645 4.686 1.00 10.00 O ATOM 1537 CB TYR A 97 -5.190 -4.284 2.299 1.00 10.00 C ATOM 1538 CG TYR A 97 -6.463 -5.055 2.004 1.00 10.00 C ATOM 1539 CD1 TYR A 97 -7.512 -5.100 2.940 1.00 10.00 C ATOM 1540 CD2 TYR A 97 -6.541 -5.841 0.844 1.00 10.00 C ATOM 1541 CE1 TYR A 97 -8.633 -5.922 2.723 1.00 10.00 C ATOM 1542 CE2 TYR A 97 -7.642 -6.682 0.639 1.00 10.00 C ATOM 1543 CZ TYR A 97 -8.700 -6.722 1.565 1.00 10.00 C ATOM 1544 OH TYR A 97 -9.752 -7.555 1.351 1.00 10.00 O ATOM 0 H TYR A 97 -2.735 -4.163 2.253 1.00 10.00 H new ATOM 0 HA TYR A 97 -4.560 -4.378 4.333 1.00 10.00 H new ATOM 0 HB2 TYR A 97 -5.457 -3.266 2.585 1.00 10.00 H new ATOM 0 HB3 TYR A 97 -4.604 -4.215 1.383 1.00 10.00 H new ATOM 0 HD1 TYR A 97 -7.456 -4.497 3.834 1.00 10.00 H new ATOM 0 HD2 TYR A 97 -5.751 -5.797 0.109 1.00 10.00 H new ATOM 0 HE1 TYR A 97 -9.439 -5.940 3.441 1.00 10.00 H new ATOM 0 HE2 TYR A 97 -7.679 -7.307 -0.241 1.00 10.00 H new ATOM 0 HH TYR A 97 -10.148 -7.364 0.475 1.00 10.00 H new ATOM 1554 N LEU A 98 -4.179 -7.319 2.826 1.00 10.00 N ATOM 1555 CA LEU A 98 -4.451 -8.739 3.085 1.00 10.00 C ATOM 1556 C LEU A 98 -3.602 -9.294 4.235 1.00 10.00 C ATOM 1557 O LEU A 98 -4.096 -10.127 4.997 1.00 10.00 O ATOM 1558 CB LEU A 98 -4.288 -9.571 1.802 1.00 10.00 C ATOM 1559 CG LEU A 98 -5.437 -9.321 0.811 1.00 10.00 C ATOM 1560 CD1 LEU A 98 -5.068 -9.699 -0.619 1.00 10.00 C ATOM 1561 CD2 LEU A 98 -6.715 -10.075 1.202 1.00 10.00 C ATOM 0 H LEU A 98 -3.653 -7.135 1.972 1.00 10.00 H new ATOM 0 HA LEU A 98 -5.490 -8.817 3.406 1.00 10.00 H new ATOM 0 HB2 LEU A 98 -3.338 -9.325 1.327 1.00 10.00 H new ATOM 0 HB3 LEU A 98 -4.252 -10.630 2.057 1.00 10.00 H new ATOM 0 HG LEU A 98 -5.623 -8.248 0.857 1.00 10.00 H new ATOM 0 HD11 LEU A 98 -5.914 -9.503 -1.277 1.00 10.00 H new ATOM 0 HD12 LEU A 98 -4.212 -9.107 -0.942 1.00 10.00 H new ATOM 0 HD13 LEU A 98 -4.814 -10.758 -0.661 1.00 10.00 H new ATOM 0 HD21 LEU A 98 -7.498 -9.867 0.472 1.00 10.00 H new ATOM 0 HD22 LEU A 98 -6.514 -11.146 1.223 1.00 10.00 H new ATOM 0 HD23 LEU A 98 -7.043 -9.748 2.189 1.00 10.00 H new ATOM 1573 N LYS A 99 -2.367 -8.806 4.430 1.00 10.00 N ATOM 1574 CA LYS A 99 -1.559 -9.133 5.612 1.00 10.00 C ATOM 1575 C LYS A 99 -2.263 -8.720 6.909 1.00 10.00 C ATOM 1576 O LYS A 99 -2.238 -9.477 7.877 1.00 10.00 O ATOM 1577 CB LYS A 99 -0.156 -8.518 5.471 1.00 10.00 C ATOM 1578 CG LYS A 99 0.786 -8.785 6.658 1.00 10.00 C ATOM 1579 CD LYS A 99 1.122 -10.267 6.910 1.00 10.00 C ATOM 1580 CE LYS A 99 1.962 -10.885 5.786 1.00 10.00 C ATOM 1581 NZ LYS A 99 3.321 -10.303 5.728 1.00 10.00 N ATOM 0 H LYS A 99 -1.903 -8.176 3.775 1.00 10.00 H new ATOM 0 HA LYS A 99 -1.441 -10.215 5.673 1.00 10.00 H new ATOM 0 HB2 LYS A 99 0.306 -8.906 4.563 1.00 10.00 H new ATOM 0 HB3 LYS A 99 -0.258 -7.441 5.341 1.00 10.00 H new ATOM 0 HG2 LYS A 99 1.716 -8.242 6.492 1.00 10.00 H new ATOM 0 HG3 LYS A 99 0.333 -8.374 7.560 1.00 10.00 H new ATOM 0 HD2 LYS A 99 1.662 -10.357 7.853 1.00 10.00 H new ATOM 0 HD3 LYS A 99 0.196 -10.832 7.018 1.00 10.00 H new ATOM 0 HE2 LYS A 99 2.035 -11.962 5.937 1.00 10.00 H new ATOM 0 HE3 LYS A 99 1.460 -10.731 4.831 1.00 10.00 H new ATOM 0 HZ1 LYS A 99 3.851 -10.735 4.944 1.00 10.00 H new ATOM 0 HZ2 LYS A 99 3.253 -9.277 5.575 1.00 10.00 H new ATOM 0 HZ3 LYS A 99 3.816 -10.487 6.624 1.00 10.00 H new ATOM 1595 N LYS A 100 -2.938 -7.565 6.906 1.00 10.00 N ATOM 1596 CA LYS A 100 -3.933 -7.189 7.917 1.00 10.00 C ATOM 1597 C LYS A 100 -5.158 -8.105 7.871 1.00 10.00 C ATOM 1598 O LYS A 100 -5.277 -8.922 8.764 1.00 10.00 O ATOM 1599 CB LYS A 100 -4.312 -5.695 7.818 1.00 10.00 C ATOM 1600 CG LYS A 100 -3.385 -4.742 8.587 1.00 10.00 C ATOM 1601 CD LYS A 100 -3.264 -5.094 10.081 1.00 10.00 C ATOM 1602 CE LYS A 100 -2.976 -3.872 10.963 1.00 10.00 C ATOM 1603 NZ LYS A 100 -4.219 -3.145 11.322 1.00 10.00 N ATOM 0 H LYS A 100 -2.806 -6.853 6.188 1.00 10.00 H new ATOM 0 HA LYS A 100 -3.473 -7.330 8.895 1.00 10.00 H new ATOM 0 HB2 LYS A 100 -4.317 -5.405 6.767 1.00 10.00 H new ATOM 0 HB3 LYS A 100 -5.329 -5.568 8.189 1.00 10.00 H new ATOM 0 HG2 LYS A 100 -2.394 -4.763 8.133 1.00 10.00 H new ATOM 0 HG3 LYS A 100 -3.759 -3.723 8.489 1.00 10.00 H new ATOM 0 HD2 LYS A 100 -4.189 -5.566 10.414 1.00 10.00 H new ATOM 0 HD3 LYS A 100 -2.467 -5.826 10.213 1.00 10.00 H new ATOM 0 HE2 LYS A 100 -2.467 -4.192 11.872 1.00 10.00 H new ATOM 0 HE3 LYS A 100 -2.299 -3.197 10.439 1.00 10.00 H new ATOM 0 HZ1 LYS A 100 -3.981 -2.317 11.904 1.00 10.00 H new ATOM 0 HZ2 LYS A 100 -4.701 -2.832 10.455 1.00 10.00 H new ATOM 0 HZ3 LYS A 100 -4.848 -3.776 11.859 1.00 10.00 H new ATOM 1617 N ALA A 101 -6.028 -8.048 6.861 1.00 10.00 N ATOM 1618 CA ALA A 101 -7.365 -8.668 6.839 1.00 10.00 C ATOM 1619 C ALA A 101 -7.411 -10.195 7.067 1.00 10.00 C ATOM 1620 O ALA A 101 -8.450 -10.737 7.435 1.00 10.00 O ATOM 1621 CB ALA A 101 -8.046 -8.289 5.518 1.00 10.00 C ATOM 0 H ALA A 101 -5.816 -7.549 5.997 1.00 10.00 H new ATOM 0 HA ALA A 101 -7.900 -8.272 7.702 1.00 10.00 H new ATOM 0 HB1 ALA A 101 -9.039 -8.737 5.479 1.00 10.00 H new ATOM 0 HB2 ALA A 101 -8.135 -7.205 5.452 1.00 10.00 H new ATOM 0 HB3 ALA A 101 -7.449 -8.655 4.683 1.00 10.00 H new ATOM 1627 N THR A 102 -6.281 -10.891 6.910 1.00 10.00 N ATOM 1628 CA THR A 102 -6.074 -12.291 7.326 1.00 10.00 C ATOM 1629 C THR A 102 -5.866 -12.474 8.845 1.00 10.00 C ATOM 1630 O THR A 102 -5.748 -13.610 9.302 1.00 10.00 O ATOM 1631 CB THR A 102 -4.910 -12.914 6.534 1.00 10.00 C ATOM 1632 OG1 THR A 102 -3.764 -12.094 6.586 1.00 10.00 O ATOM 1633 CG2 THR A 102 -5.300 -13.105 5.065 1.00 10.00 C ATOM 0 H THR A 102 -5.453 -10.485 6.475 1.00 10.00 H new ATOM 0 HA THR A 102 -7.000 -12.817 7.095 1.00 10.00 H new ATOM 0 HB THR A 102 -4.688 -13.879 6.990 1.00 10.00 H new ATOM 0 HG1 THR A 102 -3.725 -11.536 5.782 1.00 10.00 H new ATOM 0 HG21 THR A 102 -4.465 -13.546 4.521 1.00 10.00 H new ATOM 0 HG22 THR A 102 -6.164 -13.766 5.001 1.00 10.00 H new ATOM 0 HG23 THR A 102 -5.549 -12.139 4.626 1.00 10.00 H new ATOM 1641 N ASN A 103 -5.881 -11.385 9.628 1.00 10.00 N ATOM 1642 CA ASN A 103 -5.678 -11.315 11.080 1.00 10.00 C ATOM 1643 C ASN A 103 -6.379 -10.119 11.783 1.00 10.00 C ATOM 1644 O ASN A 103 -6.615 -10.202 12.985 1.00 10.00 O ATOM 1645 CB ASN A 103 -4.155 -11.332 11.363 1.00 10.00 C ATOM 1646 CG ASN A 103 -3.463 -9.985 11.563 1.00 10.00 C ATOM 1647 OD1 ASN A 103 -3.368 -9.472 12.665 1.00 10.00 O ATOM 1648 ND2 ASN A 103 -2.857 -9.396 10.556 1.00 10.00 N ATOM 0 H ASN A 103 -6.048 -10.461 9.231 1.00 10.00 H new ATOM 0 HA ASN A 103 -6.162 -12.189 11.516 1.00 10.00 H new ATOM 0 HB2 ASN A 103 -3.985 -11.934 12.256 1.00 10.00 H new ATOM 0 HB3 ASN A 103 -3.664 -11.843 10.535 1.00 10.00 H new ATOM 0 HD21 ASN A 103 -2.328 -8.537 10.710 1.00 10.00 H new ATOM 0 HD22 ASN A 103 -2.915 -9.798 9.620 1.00 10.00 H new ATOM 1655 N GLU A 104 -6.748 -9.055 11.050 1.00 10.00 N ATOM 1656 CA GLU A 104 -7.269 -7.760 11.521 1.00 10.00 C ATOM 1657 C GLU A 104 -7.956 -6.993 10.373 1.00 10.00 C ATOM 1658 O GLU A 104 -7.256 -6.616 9.404 1.00 10.00 O ATOM 1659 CB GLU A 104 -6.097 -6.909 12.066 1.00 10.00 C ATOM 1660 CG GLU A 104 -6.114 -6.624 13.577 1.00 10.00 C ATOM 1661 CD GLU A 104 -6.230 -5.120 13.876 1.00 10.00 C ATOM 1662 OE1 GLU A 104 -5.385 -4.356 13.343 1.00 10.00 O ATOM 1663 OE2 GLU A 104 -7.147 -4.729 14.625 1.00 10.00 O ATOM 1664 OXT GLU A 104 -9.179 -6.773 10.480 1.00 10.00 O ATOM 0 H GLU A 104 -6.685 -9.080 10.032 1.00 10.00 H new ATOM 0 HA GLU A 104 -8.002 -7.945 12.306 1.00 10.00 H new ATOM 0 HB2 GLU A 104 -5.163 -7.416 11.823 1.00 10.00 H new ATOM 0 HB3 GLU A 104 -6.090 -5.956 11.537 1.00 10.00 H new ATOM 0 HG2 GLU A 104 -6.950 -7.151 14.036 1.00 10.00 H new ATOM 0 HG3 GLU A 104 -5.203 -7.015 14.030 1.00 10.00 H new TER 1671 GLU A 104 HETATM 1672 FE HEC A 105 -8.793 -13.056 -8.232 1.00 10.00 FE HETATM 1673 CHA HEC A 105 -8.043 -16.324 -7.415 1.00 10.00 C HETATM 1674 CHB HEC A 105 -6.880 -11.991 -5.657 1.00 10.00 C HETATM 1675 CHC HEC A 105 -9.704 -9.869 -8.914 1.00 10.00 C HETATM 1676 CHD HEC A 105 -11.082 -14.199 -10.460 1.00 10.00 C HETATM 1677 NA HEC A 105 -7.641 -13.971 -6.872 1.00 10.00 N HETATM 1678 C1A HEC A 105 -7.437 -15.326 -6.666 1.00 10.00 C HETATM 1679 C2A HEC A 105 -6.528 -15.550 -5.546 1.00 10.00 C HETATM 1680 C3A HEC A 105 -6.201 -14.323 -5.065 1.00 10.00 C HETATM 1681 C4A HEC A 105 -6.929 -13.355 -5.868 1.00 10.00 C HETATM 1682 CMA HEC A 105 -5.250 -13.977 -3.932 1.00 10.00 C HETATM 1683 CAA HEC A 105 -6.028 -16.893 -5.047 1.00 10.00 C HETATM 1684 CBA HEC A 105 -7.106 -17.812 -4.427 1.00 10.00 C HETATM 1685 CGA HEC A 105 -6.540 -18.898 -3.515 1.00 10.00 C HETATM 1686 O1A HEC A 105 -6.082 -19.936 -4.044 1.00 10.00 O HETATM 1687 O2A HEC A 105 -6.494 -18.646 -2.294 1.00 10.00 O HETATM 1688 NB HEC A 105 -8.343 -11.285 -7.479 1.00 10.00 N HETATM 1689 C1B HEC A 105 -7.556 -11.033 -6.386 1.00 10.00 C HETATM 1690 C2B HEC A 105 -7.508 -9.615 -6.091 1.00 10.00 C HETATM 1691 C3B HEC A 105 -8.307 -8.990 -7.004 1.00 10.00 C HETATM 1692 C4B HEC A 105 -8.810 -10.049 -7.874 1.00 10.00 C HETATM 1693 CMB HEC A 105 -6.667 -9.017 -4.984 1.00 10.00 C HETATM 1694 CAB HEC A 105 -8.563 -7.493 -7.185 1.00 10.00 C HETATM 1695 CBB HEC A 105 -7.357 -6.831 -7.846 1.00 10.00 C HETATM 1696 NC HEC A 105 -10.167 -12.232 -9.334 1.00 10.00 N HETATM 1697 C1C HEC A 105 -10.382 -10.892 -9.550 1.00 10.00 C HETATM 1698 C2C HEC A 105 -11.564 -10.680 -10.367 1.00 10.00 C HETATM 1699 C3C HEC A 105 -12.105 -11.908 -10.565 1.00 10.00 C HETATM 1700 C4C HEC A 105 -11.108 -12.860 -10.115 1.00 10.00 C HETATM 1701 CMC HEC A 105 -12.158 -9.327 -10.684 1.00 10.00 C HETATM 1702 CAC HEC A 105 -13.489 -12.266 -11.071 1.00 10.00 C HETATM 1703 CBC HEC A 105 -13.636 -12.093 -12.589 1.00 10.00 C HETATM 1704 ND HEC A 105 -9.404 -14.871 -8.831 1.00 10.00 N HETATM 1705 C1D HEC A 105 -10.260 -15.141 -9.876 1.00 10.00 C HETATM 1706 C2D HEC A 105 -10.317 -16.567 -10.160 1.00 10.00 C HETATM 1707 C3D HEC A 105 -9.677 -17.175 -9.133 1.00 10.00 C HETATM 1708 C4D HEC A 105 -8.980 -16.117 -8.414 1.00 10.00 C HETATM 1709 CMD HEC A 105 -11.086 -17.218 -11.291 1.00 10.00 C HETATM 1710 CAD HEC A 105 -9.700 -18.645 -8.762 1.00 10.00 C HETATM 1711 CBD HEC A 105 -8.517 -19.503 -9.239 1.00 10.00 C HETATM 1712 CGD HEC A 105 -8.677 -20.084 -10.643 1.00 10.00 C HETATM 1713 O1D HEC A 105 -9.558 -20.957 -10.822 1.00 10.00 O HETATM 1714 O2D HEC A 105 -7.864 -19.684 -11.504 1.00 10.00 O HETATM 0 HMD3 HEC A 105 -12.147 -16.989 -11.189 1.00 10.00 H new HETATM 0 HMD2 HEC A 105 -10.723 -16.836 -12.245 1.00 10.00 H new HETATM 0 HMD1 HEC A 105 -10.942 -18.298 -11.254 1.00 10.00 H new HETATM 0 HMC3 HEC A 105 -12.444 -8.829 -9.758 1.00 10.00 H new HETATM 0 HMC2 HEC A 105 -11.421 -8.720 -11.210 1.00 10.00 H new HETATM 0 HMC1 HEC A 105 -13.038 -9.455 -11.314 1.00 10.00 H new HETATM 0 HMB3 HEC A 105 -6.974 -9.437 -4.026 1.00 10.00 H new HETATM 0 HMB2 HEC A 105 -5.616 -9.247 -5.161 1.00 10.00 H new HETATM 0 HMB1 HEC A 105 -6.804 -7.936 -4.967 1.00 10.00 H new HETATM 0 HMA3 HEC A 105 -5.599 -14.441 -3.010 1.00 10.00 H new HETATM 0 HMA2 HEC A 105 -4.252 -14.346 -4.169 1.00 10.00 H new HETATM 0 HMA1 HEC A 105 -5.216 -12.895 -3.803 1.00 10.00 H new HETATM 0 HBD2 HEC A 105 -7.612 -18.897 -9.212 1.00 10.00 H new HETATM 0 HBD1 HEC A 105 -8.373 -20.323 -8.535 1.00 10.00 H new HETATM 0 HBC3 HEC A 105 -13.444 -11.054 -12.857 1.00 10.00 H new HETATM 0 HBC2 HEC A 105 -12.920 -12.737 -13.100 1.00 10.00 H new HETATM 0 HBC1 HEC A 105 -14.648 -12.365 -12.890 1.00 10.00 H new HETATM 0 HBB3 HEC A 105 -6.476 -6.970 -7.219 1.00 10.00 H new HETATM 0 HBB2 HEC A 105 -7.182 -7.284 -8.822 1.00 10.00 H new HETATM 0 HBB1 HEC A 105 -7.550 -5.765 -7.970 1.00 10.00 H new HETATM 0 HBA2 HEC A 105 -7.807 -17.201 -3.858 1.00 10.00 H new HETATM 0 HBA1 HEC A 105 -7.673 -18.284 -5.229 1.00 10.00 H new HETATM 0 HAD2 HEC A 105 -9.757 -18.720 -7.676 1.00 10.00 H new HETATM 0 HAD1 HEC A 105 -10.617 -19.081 -9.160 1.00 10.00 H new HETATM 0 HAA2 HEC A 105 -5.560 -17.420 -5.879 1.00 10.00 H new HETATM 0 HAA1 HEC A 105 -5.251 -16.719 -4.303 1.00 10.00 H new HETATM 0 HHD HEC A 105 -11.757 -14.533 -11.248 1.00 10.00 H new HETATM 0 HHC HEC A 105 -9.886 -8.850 -9.256 1.00 10.00 H new HETATM 0 HHB HEC A 105 -6.250 -11.639 -4.840 1.00 10.00 H new HETATM 0 HHA HEC A 105 -7.759 -17.354 -7.200 1.00 10.00 H new HETATM 0 H2D HEC A 105 -8.350 -19.398 -12.305 1.00 10.00 H new HETATM 0 H2A HEC A 105 -5.584 -18.375 -2.050 1.00 10.00 H new