USER MOD reduce.3.24.130724 H: found=0, std=0, add=936, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 933 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 45 SER OG : rot -178:sc= 0.159 USER MOD Set 1.2: A 62 ASN : amide:sc= -13! C(o=-13!,f=-23!) USER MOD Single : A 1 MET CE :methyl -161:sc= 0 (180deg=-0.411) USER MOD Single : A 1 MET N :NH3+ -138:sc= -4.18! (180deg=-7.89!) USER MOD Single : A 5 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 74:sc= 0.282 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 180:sc= 0.077 USER MOD Single : A 25 THR OG1 : rot -63:sc= 1.03 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 CYS SG : rot 180:sc= -2.72! USER MOD Single : A 32 THR OG1 : rot 180:sc= 0.0472 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0.013 USER MOD Single : A 37 LYS NZ :NH3+ -148:sc= -3.03! (180deg=-4.22!) USER MOD Single : A 38 MET CE :methyl 179:sc= 0 (180deg=-0.00127) USER MOD Single : A 39 SER OG : rot 180:sc= 0.0322 USER MOD Single : A 50 LYS NZ :NH3+ -149:sc= -0.0344 (180deg=-0.5) USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 54 HIS : no HD1:sc= -0.687 K(o=-0.69,f=-1.8!) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 THR OG1 : rot 42:sc= 0.793 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 SER OG : rot 180:sc= 0.252 USER MOD Single : A 72 GLN :FLIP amide:sc= -0.5 F(o=-1.3,f=-0.5) USER MOD Single : A 73 SER OG : rot 180:sc= 0.148 USER MOD Single : A 75 THR OG1 : rot -5:sc= -0.221 USER MOD Single : A 77 GLN :FLIP amide:sc= -6.42! C(o=-7.6!,f=-6.4!) USER MOD Single : A 84 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 THR OG1 : rot -129:sc= -0.266 USER MOD Single : A 90 MET CE :methyl 143:sc= -7.5! (180deg=-8.82!) USER MOD Single : A 91 GLN : amide:sc= -5.72! C(o=-5.7!,f=-11!) USER MOD Single : A 94 THR OG1 : rot -165:sc= -2.29! USER MOD Single : A 100 ASN : amide:sc= -1.54 K(o=-1.5,f=-3!) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ -144:sc= -0.131 (180deg=-1.03) USER MOD Single : A 118 SER OG : rot 180:sc=-0.00648 USER MOD Single : A 120 GLN : amide:sc= -0.161 K(o=-0.16,f=-1.2!) USER MOD Single : A 121 SER OG : rot 180:sc= -0.214 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 THR OG1 : rot 94:sc= -0.597! USER MOD Single : A 125 THR OG1 : rot 180:sc= 0.00859 USER MOD Single : A 130 SER OG : rot 180:sc= -0.164 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -8.139 44.261 -39.163 1.00 0.00 N ATOM 2 CA MET A 1 -7.414 43.773 -37.958 1.00 0.00 C ATOM 3 C MET A 1 -6.343 42.752 -38.364 1.00 0.00 C ATOM 4 O MET A 1 -5.201 42.870 -37.966 1.00 0.00 O ATOM 5 CB MET A 1 -8.409 43.112 -37.001 1.00 0.00 C ATOM 6 CG MET A 1 -8.615 44.011 -35.780 1.00 0.00 C ATOM 7 SD MET A 1 -8.859 42.986 -34.309 1.00 0.00 S ATOM 8 CE MET A 1 -10.378 42.170 -34.852 1.00 0.00 C ATOM 0 H1 MET A 1 -8.283 45.288 -39.089 1.00 0.00 H new ATOM 0 H2 MET A 1 -7.580 44.050 -40.014 1.00 0.00 H new ATOM 0 H3 MET A 1 -9.062 43.786 -39.229 1.00 0.00 H new ATOM 0 HA MET A 1 -6.932 44.617 -37.465 1.00 0.00 H new ATOM 0 HB2 MET A 1 -9.360 42.944 -37.507 1.00 0.00 H new ATOM 0 HB3 MET A 1 -8.037 42.136 -36.689 1.00 0.00 H new ATOM 0 HG2 MET A 1 -7.751 44.661 -35.644 1.00 0.00 H new ATOM 0 HG3 MET A 1 -9.479 44.658 -35.933 1.00 0.00 H new ATOM 0 HE1 MET A 1 -10.894 41.750 -33.989 1.00 0.00 H new ATOM 0 HE2 MET A 1 -11.025 42.896 -35.344 1.00 0.00 H new ATOM 0 HE3 MET A 1 -10.132 41.371 -35.551 1.00 0.00 H new ATOM 18 N PRO A 2 -6.744 41.775 -39.137 1.00 0.00 N ATOM 19 CA PRO A 2 -5.836 40.712 -39.602 1.00 0.00 C ATOM 20 C PRO A 2 -4.966 41.212 -40.761 1.00 0.00 C ATOM 21 O PRO A 2 -3.755 41.237 -40.672 1.00 0.00 O ATOM 22 CB PRO A 2 -6.785 39.605 -40.066 1.00 0.00 C ATOM 23 CG PRO A 2 -8.139 40.289 -40.369 1.00 0.00 C ATOM 24 CD PRO A 2 -8.134 41.635 -39.620 1.00 0.00 C ATOM 0 HA PRO A 2 -5.143 40.376 -38.831 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -6.395 39.106 -40.953 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -6.899 38.843 -39.295 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -8.263 40.443 -41.441 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -8.970 39.666 -40.038 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -8.412 42.458 -40.278 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -8.845 41.634 -38.794 1.00 0.00 H new ATOM 32 N ASP A 3 -5.572 41.607 -41.846 1.00 0.00 N ATOM 33 CA ASP A 3 -4.773 42.100 -43.004 1.00 0.00 C ATOM 34 C ASP A 3 -3.837 40.987 -43.484 1.00 0.00 C ATOM 35 O ASP A 3 -3.895 39.870 -43.011 1.00 0.00 O ATOM 36 CB ASP A 3 -3.946 43.313 -42.573 1.00 0.00 C ATOM 37 CG ASP A 3 -4.851 44.543 -42.485 1.00 0.00 C ATOM 38 OD1 ASP A 3 -5.780 44.627 -43.270 1.00 0.00 O ATOM 39 OD2 ASP A 3 -4.598 45.381 -41.634 1.00 0.00 O ATOM 0 H ASP A 3 -6.583 41.610 -41.981 1.00 0.00 H new ATOM 0 HA ASP A 3 -5.443 42.388 -43.814 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -3.478 43.123 -41.607 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -3.142 43.490 -43.287 1.00 0.00 H new ATOM 44 N LEU A 4 -2.975 41.281 -44.420 1.00 0.00 N ATOM 45 CA LEU A 4 -2.039 40.235 -44.923 1.00 0.00 C ATOM 46 C LEU A 4 -0.659 40.440 -44.293 1.00 0.00 C ATOM 47 O LEU A 4 -0.053 41.484 -44.430 1.00 0.00 O ATOM 48 CB LEU A 4 -1.920 40.340 -46.445 1.00 0.00 C ATOM 49 CG LEU A 4 -3.290 40.653 -47.049 1.00 0.00 C ATOM 50 CD1 LEU A 4 -3.176 40.701 -48.574 1.00 0.00 C ATOM 51 CD2 LEU A 4 -4.285 39.563 -46.646 1.00 0.00 C ATOM 0 H LEU A 4 -2.879 42.198 -44.857 1.00 0.00 H new ATOM 0 HA LEU A 4 -2.422 39.250 -44.655 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -1.208 41.121 -46.711 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -1.536 39.406 -46.855 1.00 0.00 H new ATOM 0 HG LEU A 4 -3.638 41.618 -46.680 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -4.152 40.924 -49.005 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -2.466 41.477 -48.862 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -2.828 39.736 -48.943 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -5.262 39.785 -47.076 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -3.937 38.598 -47.015 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -4.366 39.528 -45.560 1.00 0.00 H new ATOM 63 N ASN A 5 -0.157 39.451 -43.605 1.00 0.00 N ATOM 64 CA ASN A 5 1.184 39.591 -42.969 1.00 0.00 C ATOM 65 C ASN A 5 1.873 38.226 -42.930 1.00 0.00 C ATOM 66 O ASN A 5 3.047 38.105 -43.219 1.00 0.00 O ATOM 67 CB ASN A 5 1.020 40.123 -41.544 1.00 0.00 C ATOM 68 CG ASN A 5 2.400 40.372 -40.930 1.00 0.00 C ATOM 69 OD1 ASN A 5 3.176 41.151 -41.446 1.00 0.00 O ATOM 70 ND2 ASN A 5 2.739 39.738 -39.841 1.00 0.00 N ATOM 0 H ASN A 5 -0.617 38.553 -43.456 1.00 0.00 H new ATOM 0 HA ASN A 5 1.791 40.288 -43.547 1.00 0.00 H new ATOM 0 HB2 ASN A 5 0.442 41.047 -41.554 1.00 0.00 H new ATOM 0 HB3 ASN A 5 0.465 39.407 -40.939 1.00 0.00 H new ATOM 0 HD21 ASN A 5 3.656 39.897 -39.423 1.00 0.00 H new ATOM 0 HD22 ASN A 5 2.087 39.084 -39.408 1.00 0.00 H new ATOM 77 N SER A 6 1.154 37.197 -42.574 1.00 0.00 N ATOM 78 CA SER A 6 1.772 35.841 -42.518 1.00 0.00 C ATOM 79 C SER A 6 1.632 35.159 -43.881 1.00 0.00 C ATOM 80 O SER A 6 0.742 35.466 -44.649 1.00 0.00 O ATOM 81 CB SER A 6 1.064 35.003 -41.452 1.00 0.00 C ATOM 82 OG SER A 6 0.488 35.867 -40.482 1.00 0.00 O ATOM 0 H SER A 6 0.167 37.236 -42.320 1.00 0.00 H new ATOM 0 HA SER A 6 2.828 35.933 -42.266 1.00 0.00 H new ATOM 0 HB2 SER A 6 0.291 34.387 -41.911 1.00 0.00 H new ATOM 0 HB3 SER A 6 1.772 34.324 -40.977 1.00 0.00 H new ATOM 0 HG SER A 6 0.032 35.333 -39.798 1.00 0.00 H new ATOM 88 N SER A 7 2.505 34.237 -44.187 1.00 0.00 N ATOM 89 CA SER A 7 2.420 33.538 -45.501 1.00 0.00 C ATOM 90 C SER A 7 1.394 32.406 -45.413 1.00 0.00 C ATOM 91 O SER A 7 0.967 32.026 -44.340 1.00 0.00 O ATOM 92 CB SER A 7 3.789 32.957 -45.858 1.00 0.00 C ATOM 93 OG SER A 7 3.783 32.541 -47.217 1.00 0.00 O ATOM 0 H SER A 7 3.272 33.938 -43.585 1.00 0.00 H new ATOM 0 HA SER A 7 2.113 34.247 -46.270 1.00 0.00 H new ATOM 0 HB2 SER A 7 4.567 33.704 -45.698 1.00 0.00 H new ATOM 0 HB3 SER A 7 4.019 32.113 -45.208 1.00 0.00 H new ATOM 0 HG SER A 7 4.660 32.170 -47.449 1.00 0.00 H new ATOM 99 N THR A 8 0.993 31.865 -46.532 1.00 0.00 N ATOM 100 CA THR A 8 -0.006 30.758 -46.510 1.00 0.00 C ATOM 101 C THR A 8 0.710 29.426 -46.276 1.00 0.00 C ATOM 102 O THR A 8 1.883 29.388 -45.959 1.00 0.00 O ATOM 103 CB THR A 8 -0.745 30.710 -47.850 1.00 0.00 C ATOM 104 OG1 THR A 8 0.095 30.118 -48.830 1.00 0.00 O ATOM 105 CG2 THR A 8 -1.116 32.129 -48.283 1.00 0.00 C ATOM 0 H THR A 8 1.314 32.142 -47.460 1.00 0.00 H new ATOM 0 HA THR A 8 -0.721 30.932 -45.706 1.00 0.00 H new ATOM 0 HB THR A 8 -1.654 30.117 -47.743 1.00 0.00 H new ATOM 0 HG1 THR A 8 0.152 29.152 -48.672 1.00 0.00 H new ATOM 0 HG21 THR A 8 -1.642 32.093 -49.237 1.00 0.00 H new ATOM 0 HG22 THR A 8 -1.761 32.582 -47.530 1.00 0.00 H new ATOM 0 HG23 THR A 8 -0.210 32.725 -48.391 1.00 0.00 H new ATOM 113 N ASP A 9 0.013 28.333 -46.428 1.00 0.00 N ATOM 114 CA ASP A 9 0.653 27.004 -46.214 1.00 0.00 C ATOM 115 C ASP A 9 1.113 26.890 -44.759 1.00 0.00 C ATOM 116 O ASP A 9 1.191 27.870 -44.045 1.00 0.00 O ATOM 117 CB ASP A 9 1.859 26.861 -47.145 1.00 0.00 C ATOM 118 CG ASP A 9 1.411 27.054 -48.595 1.00 0.00 C ATOM 119 OD1 ASP A 9 1.419 28.185 -49.052 1.00 0.00 O ATOM 120 OD2 ASP A 9 1.065 26.067 -49.223 1.00 0.00 O ATOM 0 H ASP A 9 -0.972 28.303 -46.691 1.00 0.00 H new ATOM 0 HA ASP A 9 -0.066 26.214 -46.431 1.00 0.00 H new ATOM 0 HB2 ASP A 9 2.620 27.598 -46.887 1.00 0.00 H new ATOM 0 HB3 ASP A 9 2.313 25.878 -47.021 1.00 0.00 H new ATOM 125 N SER A 10 1.419 25.702 -44.315 1.00 0.00 N ATOM 126 CA SER A 10 1.874 25.526 -42.907 1.00 0.00 C ATOM 127 C SER A 10 0.769 25.986 -41.952 1.00 0.00 C ATOM 128 O SER A 10 1.023 26.322 -40.812 1.00 0.00 O ATOM 129 CB SER A 10 3.131 26.364 -42.671 1.00 0.00 C ATOM 130 OG SER A 10 3.953 25.719 -41.706 1.00 0.00 O ATOM 0 H SER A 10 1.374 24.845 -44.867 1.00 0.00 H new ATOM 0 HA SER A 10 2.097 24.475 -42.725 1.00 0.00 H new ATOM 0 HB2 SER A 10 3.678 26.490 -43.605 1.00 0.00 H new ATOM 0 HB3 SER A 10 2.858 27.361 -42.324 1.00 0.00 H new ATOM 0 HG SER A 10 4.760 26.254 -41.554 1.00 0.00 H new ATOM 136 N ALA A 11 -0.453 26.004 -42.408 1.00 0.00 N ATOM 137 CA ALA A 11 -1.570 26.445 -41.526 1.00 0.00 C ATOM 138 C ALA A 11 -2.612 25.329 -41.424 1.00 0.00 C ATOM 139 O ALA A 11 -2.933 24.863 -40.348 1.00 0.00 O ATOM 140 CB ALA A 11 -2.222 27.697 -42.118 1.00 0.00 C ATOM 0 H ALA A 11 -0.726 25.733 -43.352 1.00 0.00 H new ATOM 0 HA ALA A 11 -1.181 26.671 -40.533 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -3.039 28.021 -41.474 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -1.481 28.493 -42.192 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -2.611 27.470 -43.111 1.00 0.00 H new ATOM 146 N ALA A 12 -3.144 24.898 -42.534 1.00 0.00 N ATOM 147 CA ALA A 12 -4.167 23.815 -42.502 1.00 0.00 C ATOM 148 C ALA A 12 -3.474 22.451 -42.455 1.00 0.00 C ATOM 149 O ALA A 12 -2.772 22.069 -43.370 1.00 0.00 O ATOM 150 CB ALA A 12 -5.037 23.902 -43.758 1.00 0.00 C ATOM 0 H ALA A 12 -2.914 25.250 -43.464 1.00 0.00 H new ATOM 0 HA ALA A 12 -4.790 23.932 -41.616 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -5.786 23.111 -43.737 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -5.534 24.872 -43.790 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -4.411 23.786 -44.643 1.00 0.00 H new ATOM 156 N SER A 13 -3.669 21.713 -41.396 1.00 0.00 N ATOM 157 CA SER A 13 -3.025 20.372 -41.291 1.00 0.00 C ATOM 158 C SER A 13 -3.908 19.450 -40.445 1.00 0.00 C ATOM 159 O SER A 13 -4.697 19.900 -39.638 1.00 0.00 O ATOM 160 CB SER A 13 -1.653 20.512 -40.631 1.00 0.00 C ATOM 161 OG SER A 13 -0.645 20.133 -41.557 1.00 0.00 O ATOM 0 H SER A 13 -4.246 21.981 -40.599 1.00 0.00 H new ATOM 0 HA SER A 13 -2.904 19.948 -42.288 1.00 0.00 H new ATOM 0 HB2 SER A 13 -1.496 21.541 -40.306 1.00 0.00 H new ATOM 0 HB3 SER A 13 -1.599 19.885 -39.741 1.00 0.00 H new ATOM 0 HG SER A 13 0.236 20.223 -41.137 1.00 0.00 H new ATOM 167 N ALA A 14 -3.780 18.163 -40.623 1.00 0.00 N ATOM 168 CA ALA A 14 -4.614 17.216 -39.829 1.00 0.00 C ATOM 169 C ALA A 14 -3.768 16.009 -39.418 1.00 0.00 C ATOM 170 O ALA A 14 -4.225 14.884 -39.437 1.00 0.00 O ATOM 171 CB ALA A 14 -5.797 16.745 -40.675 1.00 0.00 C ATOM 0 H ALA A 14 -3.135 17.727 -41.282 1.00 0.00 H new ATOM 0 HA ALA A 14 -4.984 17.720 -38.936 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -6.407 16.053 -40.094 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -6.401 17.604 -40.966 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -5.428 16.242 -41.569 1.00 0.00 H new ATOM 177 N SER A 15 -2.537 16.232 -39.046 1.00 0.00 N ATOM 178 CA SER A 15 -1.668 15.095 -38.632 1.00 0.00 C ATOM 179 C SER A 15 -2.178 14.525 -37.307 1.00 0.00 C ATOM 180 O SER A 15 -2.448 15.252 -36.373 1.00 0.00 O ATOM 181 CB SER A 15 -0.232 15.589 -38.456 1.00 0.00 C ATOM 182 OG SER A 15 0.623 14.872 -39.336 1.00 0.00 O ATOM 0 H SER A 15 -2.096 17.151 -39.011 1.00 0.00 H new ATOM 0 HA SER A 15 -1.693 14.319 -39.397 1.00 0.00 H new ATOM 0 HB2 SER A 15 -0.175 16.657 -38.665 1.00 0.00 H new ATOM 0 HB3 SER A 15 0.089 15.448 -37.424 1.00 0.00 H new ATOM 0 HG SER A 15 1.544 15.188 -39.227 1.00 0.00 H new ATOM 188 N ALA A 16 -2.314 13.230 -37.220 1.00 0.00 N ATOM 189 CA ALA A 16 -2.810 12.621 -35.953 1.00 0.00 C ATOM 190 C ALA A 16 -1.993 11.369 -35.630 1.00 0.00 C ATOM 191 O ALA A 16 -1.314 11.305 -34.623 1.00 0.00 O ATOM 192 CB ALA A 16 -4.285 12.242 -36.115 1.00 0.00 C ATOM 0 H ALA A 16 -2.104 12.569 -37.968 1.00 0.00 H new ATOM 0 HA ALA A 16 -2.705 13.339 -35.140 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -4.650 11.796 -35.190 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -4.867 13.135 -36.342 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -4.389 11.524 -36.929 1.00 0.00 H new ATOM 198 N ALA A 17 -2.050 10.372 -36.469 1.00 0.00 N ATOM 199 CA ALA A 17 -1.275 9.128 -36.200 1.00 0.00 C ATOM 200 C ALA A 17 -1.498 8.697 -34.749 1.00 0.00 C ATOM 201 O ALA A 17 -0.594 8.717 -33.939 1.00 0.00 O ATOM 202 CB ALA A 17 0.214 9.397 -36.430 1.00 0.00 C ATOM 0 H ALA A 17 -2.599 10.365 -37.329 1.00 0.00 H new ATOM 0 HA ALA A 17 -1.609 8.336 -36.871 1.00 0.00 H new ATOM 0 HB1 ALA A 17 0.783 8.488 -36.234 1.00 0.00 H new ATOM 0 HB2 ALA A 17 0.372 9.708 -37.463 1.00 0.00 H new ATOM 0 HB3 ALA A 17 0.549 10.187 -35.758 1.00 0.00 H new ATOM 208 N SER A 18 -2.700 8.311 -34.414 1.00 0.00 N ATOM 209 CA SER A 18 -2.985 7.886 -33.014 1.00 0.00 C ATOM 210 C SER A 18 -2.111 6.683 -32.652 1.00 0.00 C ATOM 211 O SER A 18 -1.594 5.995 -33.509 1.00 0.00 O ATOM 212 CB SER A 18 -4.460 7.497 -32.891 1.00 0.00 C ATOM 213 OG SER A 18 -5.268 8.592 -33.301 1.00 0.00 O ATOM 0 H SER A 18 -3.497 8.272 -35.050 1.00 0.00 H new ATOM 0 HA SER A 18 -2.765 8.710 -32.335 1.00 0.00 H new ATOM 0 HB2 SER A 18 -4.671 6.623 -33.508 1.00 0.00 H new ATOM 0 HB3 SER A 18 -4.692 7.224 -31.862 1.00 0.00 H new ATOM 0 HG SER A 18 -6.214 8.347 -33.226 1.00 0.00 H new ATOM 219 N ASP A 19 -1.945 6.426 -31.382 1.00 0.00 N ATOM 220 CA ASP A 19 -1.107 5.270 -30.956 1.00 0.00 C ATOM 221 C ASP A 19 -1.864 3.967 -31.219 1.00 0.00 C ATOM 222 O ASP A 19 -2.656 3.525 -30.411 1.00 0.00 O ATOM 223 CB ASP A 19 -0.801 5.387 -29.462 1.00 0.00 C ATOM 224 CG ASP A 19 0.447 6.247 -29.261 1.00 0.00 C ATOM 225 OD1 ASP A 19 1.534 5.735 -29.475 1.00 0.00 O ATOM 226 OD2 ASP A 19 0.296 7.401 -28.898 1.00 0.00 O ATOM 0 H ASP A 19 -2.354 6.968 -30.621 1.00 0.00 H new ATOM 0 HA ASP A 19 -0.175 5.269 -31.520 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -1.649 5.831 -28.940 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -0.646 4.397 -29.033 1.00 0.00 H new ATOM 231 N VAL A 20 -1.627 3.349 -32.343 1.00 0.00 N ATOM 232 CA VAL A 20 -2.334 2.075 -32.653 1.00 0.00 C ATOM 233 C VAL A 20 -1.640 0.920 -31.932 1.00 0.00 C ATOM 234 O VAL A 20 -0.429 0.815 -31.924 1.00 0.00 O ATOM 235 CB VAL A 20 -2.302 1.829 -34.162 1.00 0.00 C ATOM 236 CG1 VAL A 20 -3.329 0.756 -34.526 1.00 0.00 C ATOM 237 CG2 VAL A 20 -2.640 3.128 -34.897 1.00 0.00 C ATOM 0 H VAL A 20 -0.976 3.670 -33.059 1.00 0.00 H new ATOM 0 HA VAL A 20 -3.369 2.142 -32.318 1.00 0.00 H new ATOM 0 HB VAL A 20 -1.307 1.493 -34.454 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -3.306 0.581 -35.602 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -3.090 -0.169 -34.002 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -4.324 1.091 -34.234 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -2.617 2.954 -35.973 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -3.635 3.463 -34.604 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -1.909 3.893 -34.638 1.00 0.00 H new ATOM 247 N SER A 21 -2.399 0.050 -31.327 1.00 0.00 N ATOM 248 CA SER A 21 -1.789 -1.102 -30.606 1.00 0.00 C ATOM 249 C SER A 21 -2.898 -1.971 -30.013 1.00 0.00 C ATOM 250 O SER A 21 -4.007 -1.521 -29.801 1.00 0.00 O ATOM 251 CB SER A 21 -0.893 -0.586 -29.481 1.00 0.00 C ATOM 252 OG SER A 21 0.255 -1.417 -29.375 1.00 0.00 O ATOM 0 H SER A 21 -3.418 0.087 -31.301 1.00 0.00 H new ATOM 0 HA SER A 21 -1.193 -1.692 -31.302 1.00 0.00 H new ATOM 0 HB2 SER A 21 -0.594 0.443 -29.682 1.00 0.00 H new ATOM 0 HB3 SER A 21 -1.440 -0.581 -28.538 1.00 0.00 H new ATOM 0 HG SER A 21 0.832 -1.087 -28.655 1.00 0.00 H new ATOM 258 N VAL A 22 -2.612 -3.213 -29.744 1.00 0.00 N ATOM 259 CA VAL A 22 -3.653 -4.105 -29.165 1.00 0.00 C ATOM 260 C VAL A 22 -3.424 -4.240 -27.658 1.00 0.00 C ATOM 261 O VAL A 22 -2.546 -4.954 -27.215 1.00 0.00 O ATOM 262 CB VAL A 22 -3.568 -5.484 -29.823 1.00 0.00 C ATOM 263 CG1 VAL A 22 -4.192 -5.424 -31.218 1.00 0.00 C ATOM 264 CG2 VAL A 22 -2.099 -5.899 -29.938 1.00 0.00 C ATOM 0 H VAL A 22 -1.703 -3.649 -29.900 1.00 0.00 H new ATOM 0 HA VAL A 22 -4.640 -3.680 -29.346 1.00 0.00 H new ATOM 0 HB VAL A 22 -4.107 -6.212 -29.217 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -4.131 -6.406 -31.686 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -5.237 -5.125 -31.137 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -3.653 -4.698 -31.827 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -2.034 -6.881 -30.406 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -1.562 -5.171 -30.546 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -1.654 -5.941 -28.944 1.00 0.00 H new ATOM 274 N GLU A 23 -4.208 -3.560 -26.866 1.00 0.00 N ATOM 275 CA GLU A 23 -4.034 -3.649 -25.388 1.00 0.00 C ATOM 276 C GLU A 23 -4.759 -4.890 -24.868 1.00 0.00 C ATOM 277 O GLU A 23 -5.959 -4.887 -24.680 1.00 0.00 O ATOM 278 CB GLU A 23 -4.625 -2.400 -24.729 1.00 0.00 C ATOM 279 CG GLU A 23 -3.903 -1.155 -25.250 1.00 0.00 C ATOM 280 CD GLU A 23 -3.504 -0.265 -24.070 1.00 0.00 C ATOM 281 OE1 GLU A 23 -4.297 -0.143 -23.151 1.00 0.00 O ATOM 282 OE2 GLU A 23 -2.413 0.278 -24.106 1.00 0.00 O ATOM 0 H GLU A 23 -4.961 -2.947 -27.178 1.00 0.00 H new ATOM 0 HA GLU A 23 -2.973 -3.718 -25.148 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -5.691 -2.332 -24.946 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -4.523 -2.465 -23.646 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -3.018 -1.445 -25.816 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -4.551 -0.604 -25.932 1.00 0.00 H new ATOM 289 N SER A 24 -4.042 -5.955 -24.633 1.00 0.00 N ATOM 290 CA SER A 24 -4.693 -7.195 -24.127 1.00 0.00 C ATOM 291 C SER A 24 -4.687 -7.190 -22.598 1.00 0.00 C ATOM 292 O SER A 24 -3.897 -6.513 -21.970 1.00 0.00 O ATOM 293 CB SER A 24 -3.926 -8.415 -24.637 1.00 0.00 C ATOM 294 OG SER A 24 -2.615 -8.020 -25.020 1.00 0.00 O ATOM 0 H SER A 24 -3.033 -6.019 -24.770 1.00 0.00 H new ATOM 0 HA SER A 24 -5.722 -7.236 -24.483 1.00 0.00 H new ATOM 0 HB2 SER A 24 -3.876 -9.178 -23.860 1.00 0.00 H new ATOM 0 HB3 SER A 24 -4.447 -8.858 -25.486 1.00 0.00 H new ATOM 0 HG SER A 24 -2.120 -8.801 -25.346 1.00 0.00 H new ATOM 300 N THR A 25 -5.565 -7.944 -21.992 1.00 0.00 N ATOM 301 CA THR A 25 -5.613 -7.987 -20.504 1.00 0.00 C ATOM 302 C THR A 25 -6.374 -9.238 -20.059 1.00 0.00 C ATOM 303 O THR A 25 -7.372 -9.159 -19.371 1.00 0.00 O ATOM 304 CB THR A 25 -6.324 -6.739 -19.979 1.00 0.00 C ATOM 305 OG1 THR A 25 -6.564 -6.883 -18.586 1.00 0.00 O ATOM 306 CG2 THR A 25 -7.654 -6.562 -20.714 1.00 0.00 C ATOM 0 H THR A 25 -6.251 -8.532 -22.465 1.00 0.00 H new ATOM 0 HA THR A 25 -4.599 -8.017 -20.106 1.00 0.00 H new ATOM 0 HB THR A 25 -5.698 -5.863 -20.150 1.00 0.00 H new ATOM 0 HG1 THR A 25 -7.165 -7.642 -18.434 1.00 0.00 H new ATOM 0 HG21 THR A 25 -8.161 -5.673 -20.340 1.00 0.00 H new ATOM 0 HG22 THR A 25 -7.467 -6.451 -21.782 1.00 0.00 H new ATOM 0 HG23 THR A 25 -8.283 -7.436 -20.544 1.00 0.00 H new ATOM 314 N ALA A 26 -5.907 -10.396 -20.446 1.00 0.00 N ATOM 315 CA ALA A 26 -6.601 -11.653 -20.047 1.00 0.00 C ATOM 316 C ALA A 26 -5.621 -12.555 -19.295 1.00 0.00 C ATOM 317 O ALA A 26 -5.716 -13.765 -19.334 1.00 0.00 O ATOM 318 CB ALA A 26 -7.108 -12.377 -21.294 1.00 0.00 C ATOM 0 H ALA A 26 -5.075 -10.524 -21.021 1.00 0.00 H new ATOM 0 HA ALA A 26 -7.446 -11.413 -19.401 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -7.615 -13.296 -21.000 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -7.805 -11.733 -21.830 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -6.266 -12.619 -21.942 1.00 0.00 H new ATOM 324 N GLU A 27 -4.688 -11.966 -18.602 1.00 0.00 N ATOM 325 CA GLU A 27 -3.699 -12.767 -17.834 1.00 0.00 C ATOM 326 C GLU A 27 -3.248 -11.969 -16.620 1.00 0.00 C ATOM 327 O GLU A 27 -2.277 -11.240 -16.658 1.00 0.00 O ATOM 328 CB GLU A 27 -2.496 -13.099 -18.712 1.00 0.00 C ATOM 329 CG GLU A 27 -2.745 -14.437 -19.400 1.00 0.00 C ATOM 330 CD GLU A 27 -1.922 -14.518 -20.686 1.00 0.00 C ATOM 331 OE1 GLU A 27 -0.707 -14.574 -20.586 1.00 0.00 O ATOM 332 OE2 GLU A 27 -2.520 -14.525 -21.750 1.00 0.00 O ATOM 0 H GLU A 27 -4.568 -10.955 -18.535 1.00 0.00 H new ATOM 0 HA GLU A 27 -4.161 -13.699 -17.510 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -2.343 -12.316 -19.454 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -1.590 -13.148 -18.108 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -2.475 -15.255 -18.733 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -3.805 -14.548 -19.628 1.00 0.00 H new ATOM 339 N ALA A 28 -3.959 -12.104 -15.543 1.00 0.00 N ATOM 340 CA ALA A 28 -3.598 -11.356 -14.307 1.00 0.00 C ATOM 341 C ALA A 28 -3.610 -9.856 -14.605 1.00 0.00 C ATOM 342 O ALA A 28 -3.498 -9.440 -15.741 1.00 0.00 O ATOM 343 CB ALA A 28 -2.200 -11.774 -13.846 1.00 0.00 C ATOM 0 H ALA A 28 -4.780 -12.703 -15.461 1.00 0.00 H new ATOM 0 HA ALA A 28 -4.319 -11.579 -13.521 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -1.936 -11.226 -12.941 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -2.190 -12.844 -13.638 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -1.476 -11.550 -14.630 1.00 0.00 H new ATOM 349 N THR A 29 -3.745 -9.039 -13.596 1.00 0.00 N ATOM 350 CA THR A 29 -3.763 -7.570 -13.832 1.00 0.00 C ATOM 351 C THR A 29 -2.771 -6.898 -12.886 1.00 0.00 C ATOM 352 O THR A 29 -2.711 -7.205 -11.712 1.00 0.00 O ATOM 353 CB THR A 29 -5.169 -7.023 -13.575 1.00 0.00 C ATOM 354 OG1 THR A 29 -5.817 -7.825 -12.599 1.00 0.00 O ATOM 355 CG2 THR A 29 -5.972 -7.043 -14.876 1.00 0.00 C ATOM 0 H THR A 29 -3.843 -9.325 -12.622 1.00 0.00 H new ATOM 0 HA THR A 29 -3.483 -7.363 -14.865 1.00 0.00 H new ATOM 0 HB THR A 29 -5.100 -5.998 -13.212 1.00 0.00 H new ATOM 0 HG1 THR A 29 -6.717 -7.474 -12.433 1.00 0.00 H new ATOM 0 HG21 THR A 29 -6.973 -6.653 -14.692 1.00 0.00 H new ATOM 0 HG22 THR A 29 -5.473 -6.424 -15.621 1.00 0.00 H new ATOM 0 HG23 THR A 29 -6.043 -8.067 -15.244 1.00 0.00 H new ATOM 363 N VAL A 30 -1.990 -5.985 -13.388 1.00 0.00 N ATOM 364 CA VAL A 30 -1.000 -5.296 -12.516 1.00 0.00 C ATOM 365 C VAL A 30 -1.464 -3.864 -12.254 1.00 0.00 C ATOM 366 O VAL A 30 -2.168 -3.269 -13.045 1.00 0.00 O ATOM 367 CB VAL A 30 0.370 -5.276 -13.211 1.00 0.00 C ATOM 368 CG1 VAL A 30 1.239 -4.146 -12.642 1.00 0.00 C ATOM 369 CG2 VAL A 30 1.075 -6.612 -12.983 1.00 0.00 C ATOM 0 H VAL A 30 -1.994 -5.686 -14.363 1.00 0.00 H new ATOM 0 HA VAL A 30 -0.916 -5.829 -11.569 1.00 0.00 H new ATOM 0 HB VAL A 30 0.221 -5.110 -14.278 1.00 0.00 H new ATOM 0 HG11 VAL A 30 2.207 -4.144 -13.143 1.00 0.00 H new ATOM 0 HG12 VAL A 30 0.744 -3.189 -12.805 1.00 0.00 H new ATOM 0 HG13 VAL A 30 1.385 -4.302 -11.573 1.00 0.00 H new ATOM 0 HG21 VAL A 30 2.047 -6.599 -13.476 1.00 0.00 H new ATOM 0 HG22 VAL A 30 1.212 -6.773 -11.914 1.00 0.00 H new ATOM 0 HG23 VAL A 30 0.469 -7.418 -13.397 1.00 0.00 H new ATOM 379 N CYS A 31 -1.057 -3.307 -11.151 1.00 0.00 N ATOM 380 CA CYS A 31 -1.453 -1.911 -10.830 1.00 0.00 C ATOM 381 C CYS A 31 -0.273 -1.196 -10.169 1.00 0.00 C ATOM 382 O CYS A 31 -0.153 -1.160 -8.960 1.00 0.00 O ATOM 383 CB CYS A 31 -2.650 -1.920 -9.876 1.00 0.00 C ATOM 384 SG CYS A 31 -3.801 -3.231 -10.359 1.00 0.00 S ATOM 0 H CYS A 31 -0.465 -3.760 -10.455 1.00 0.00 H new ATOM 0 HA CYS A 31 -1.732 -1.390 -11.746 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -2.311 -2.079 -8.852 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -3.153 -0.953 -9.899 1.00 0.00 H new ATOM 0 HG CYS A 31 -4.816 -3.238 -9.547 1.00 0.00 H new ATOM 390 N THR A 32 0.603 -0.626 -10.953 1.00 0.00 N ATOM 391 CA THR A 32 1.774 0.086 -10.372 1.00 0.00 C ATOM 392 C THR A 32 1.282 1.350 -9.661 1.00 0.00 C ATOM 393 O THR A 32 0.571 2.154 -10.230 1.00 0.00 O ATOM 394 CB THR A 32 2.741 0.460 -11.495 1.00 0.00 C ATOM 395 OG1 THR A 32 2.671 -0.524 -12.519 1.00 0.00 O ATOM 396 CG2 THR A 32 4.167 0.525 -10.946 1.00 0.00 C ATOM 0 H THR A 32 0.556 -0.624 -11.972 1.00 0.00 H new ATOM 0 HA THR A 32 2.289 -0.555 -9.656 1.00 0.00 H new ATOM 0 HB THR A 32 2.468 1.434 -11.902 1.00 0.00 H new ATOM 0 HG1 THR A 32 3.288 -0.288 -13.243 1.00 0.00 H new ATOM 0 HG21 THR A 32 4.854 0.792 -11.749 1.00 0.00 H new ATOM 0 HG22 THR A 32 4.220 1.277 -10.158 1.00 0.00 H new ATOM 0 HG23 THR A 32 4.445 -0.447 -10.539 1.00 0.00 H new ATOM 404 N VAL A 33 1.624 1.517 -8.410 1.00 0.00 N ATOM 405 CA VAL A 33 1.135 2.715 -7.664 1.00 0.00 C ATOM 406 C VAL A 33 2.220 3.287 -6.743 1.00 0.00 C ATOM 407 O VAL A 33 3.135 2.602 -6.341 1.00 0.00 O ATOM 408 CB VAL A 33 -0.052 2.316 -6.781 1.00 0.00 C ATOM 409 CG1 VAL A 33 -1.332 2.915 -7.348 1.00 0.00 C ATOM 410 CG2 VAL A 33 -0.196 0.790 -6.709 1.00 0.00 C ATOM 0 H VAL A 33 2.216 0.881 -7.876 1.00 0.00 H new ATOM 0 HA VAL A 33 0.852 3.466 -8.402 1.00 0.00 H new ATOM 0 HB VAL A 33 0.126 2.696 -5.775 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -2.176 2.631 -6.720 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -1.246 4.001 -7.371 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -1.491 2.542 -8.360 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -1.046 0.534 -6.076 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -0.357 0.392 -7.711 1.00 0.00 H new ATOM 0 HG23 VAL A 33 0.712 0.358 -6.289 1.00 0.00 H new ATOM 420 N THR A 34 2.083 4.536 -6.367 1.00 0.00 N ATOM 421 CA THR A 34 3.054 5.156 -5.428 1.00 0.00 C ATOM 422 C THR A 34 2.350 5.388 -4.091 1.00 0.00 C ATOM 423 O THR A 34 1.251 5.906 -4.048 1.00 0.00 O ATOM 424 CB THR A 34 3.541 6.503 -5.969 1.00 0.00 C ATOM 425 OG1 THR A 34 2.550 7.067 -6.815 1.00 0.00 O ATOM 426 CG2 THR A 34 4.858 6.327 -6.726 1.00 0.00 C ATOM 0 H THR A 34 1.332 5.153 -6.676 1.00 0.00 H new ATOM 0 HA THR A 34 3.912 4.494 -5.309 1.00 0.00 H new ATOM 0 HB THR A 34 3.716 7.180 -5.133 1.00 0.00 H new ATOM 0 HG1 THR A 34 2.865 7.930 -7.158 1.00 0.00 H new ATOM 0 HG21 THR A 34 5.192 7.293 -7.105 1.00 0.00 H new ATOM 0 HG22 THR A 34 5.613 5.921 -6.053 1.00 0.00 H new ATOM 0 HG23 THR A 34 4.709 5.642 -7.561 1.00 0.00 H new ATOM 434 N LEU A 35 2.952 5.008 -3.000 1.00 0.00 N ATOM 435 CA LEU A 35 2.267 5.220 -1.682 1.00 0.00 C ATOM 436 C LEU A 35 3.099 6.103 -0.771 1.00 0.00 C ATOM 437 O LEU A 35 3.607 5.647 0.227 1.00 0.00 O ATOM 438 CB LEU A 35 2.056 3.895 -0.993 1.00 0.00 C ATOM 439 CG LEU A 35 0.694 3.328 -1.382 1.00 0.00 C ATOM 440 CD1 LEU A 35 0.494 1.977 -0.699 1.00 0.00 C ATOM 441 CD2 LEU A 35 -0.403 4.296 -0.932 1.00 0.00 C ATOM 0 H LEU A 35 3.871 4.568 -2.955 1.00 0.00 H new ATOM 0 HA LEU A 35 1.311 5.704 -1.880 1.00 0.00 H new ATOM 0 HB2 LEU A 35 2.845 3.198 -1.274 1.00 0.00 H new ATOM 0 HB3 LEU A 35 2.113 4.022 0.088 1.00 0.00 H new ATOM 0 HG LEU A 35 0.645 3.199 -2.463 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -0.479 1.570 -0.975 1.00 0.00 H new ATOM 0 HD12 LEU A 35 1.278 1.290 -1.016 1.00 0.00 H new ATOM 0 HD13 LEU A 35 0.539 2.106 0.382 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -1.378 3.895 -1.208 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -0.356 4.422 0.150 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -0.258 5.261 -1.417 1.00 0.00 H new ATOM 453 N GLU A 36 3.212 7.358 -1.119 1.00 0.00 N ATOM 454 CA GLU A 36 4.012 8.347 -0.315 1.00 0.00 C ATOM 455 C GLU A 36 4.418 7.757 1.042 1.00 0.00 C ATOM 456 O GLU A 36 3.584 7.319 1.810 1.00 0.00 O ATOM 457 CB GLU A 36 3.173 9.607 -0.089 1.00 0.00 C ATOM 458 CG GLU A 36 3.019 10.358 -1.413 1.00 0.00 C ATOM 459 CD GLU A 36 2.732 11.836 -1.133 1.00 0.00 C ATOM 460 OE1 GLU A 36 2.154 12.121 -0.096 1.00 0.00 O ATOM 461 OE2 GLU A 36 3.095 12.656 -1.959 1.00 0.00 O ATOM 0 H GLU A 36 2.773 7.755 -1.950 1.00 0.00 H new ATOM 0 HA GLU A 36 4.919 8.590 -0.869 1.00 0.00 H new ATOM 0 HB2 GLU A 36 2.193 9.339 0.306 1.00 0.00 H new ATOM 0 HB3 GLU A 36 3.651 10.248 0.652 1.00 0.00 H new ATOM 0 HG2 GLU A 36 3.928 10.259 -2.007 1.00 0.00 H new ATOM 0 HG3 GLU A 36 2.208 9.924 -1.997 1.00 0.00 H new ATOM 468 N LYS A 37 5.689 7.719 1.336 1.00 0.00 N ATOM 469 CA LYS A 37 6.128 7.125 2.630 1.00 0.00 C ATOM 470 C LYS A 37 5.835 8.090 3.779 1.00 0.00 C ATOM 471 O LYS A 37 6.632 8.943 4.117 1.00 0.00 O ATOM 472 CB LYS A 37 7.633 6.852 2.576 1.00 0.00 C ATOM 473 CG LYS A 37 7.920 5.752 1.553 1.00 0.00 C ATOM 474 CD LYS A 37 9.124 6.148 0.699 1.00 0.00 C ATOM 475 CE LYS A 37 10.288 5.201 0.995 1.00 0.00 C ATOM 476 NZ LYS A 37 11.158 5.090 -0.209 1.00 0.00 N ATOM 0 H LYS A 37 6.438 8.071 0.740 1.00 0.00 H new ATOM 0 HA LYS A 37 5.585 6.195 2.796 1.00 0.00 H new ATOM 0 HB2 LYS A 37 8.168 7.762 2.306 1.00 0.00 H new ATOM 0 HB3 LYS A 37 7.993 6.551 3.560 1.00 0.00 H new ATOM 0 HG2 LYS A 37 8.118 4.809 2.063 1.00 0.00 H new ATOM 0 HG3 LYS A 37 7.048 5.594 0.919 1.00 0.00 H new ATOM 0 HD2 LYS A 37 8.864 6.104 -0.359 1.00 0.00 H new ATOM 0 HD3 LYS A 37 9.414 7.177 0.913 1.00 0.00 H new ATOM 0 HE2 LYS A 37 10.866 5.572 1.841 1.00 0.00 H new ATOM 0 HE3 LYS A 37 9.909 4.218 1.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 11.576 4.139 -0.249 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 10.590 5.254 -1.064 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 11.917 5.799 -0.156 1.00 0.00 H new ATOM 490 N MET A 38 4.689 7.945 4.388 1.00 0.00 N ATOM 491 CA MET A 38 4.316 8.824 5.529 1.00 0.00 C ATOM 492 C MET A 38 3.806 7.946 6.673 1.00 0.00 C ATOM 493 O MET A 38 3.763 6.736 6.561 1.00 0.00 O ATOM 494 CB MET A 38 3.208 9.787 5.092 1.00 0.00 C ATOM 495 CG MET A 38 3.829 11.037 4.465 1.00 0.00 C ATOM 496 SD MET A 38 2.553 11.961 3.571 1.00 0.00 S ATOM 497 CE MET A 38 1.845 12.818 5.000 1.00 0.00 C ATOM 0 H MET A 38 3.989 7.246 4.139 1.00 0.00 H new ATOM 0 HA MET A 38 5.182 9.400 5.856 1.00 0.00 H new ATOM 0 HB2 MET A 38 2.549 9.297 4.375 1.00 0.00 H new ATOM 0 HB3 MET A 38 2.595 10.065 5.950 1.00 0.00 H new ATOM 0 HG2 MET A 38 4.272 11.664 5.239 1.00 0.00 H new ATOM 0 HG3 MET A 38 4.633 10.755 3.785 1.00 0.00 H new ATOM 0 HE1 MET A 38 1.036 13.470 4.669 1.00 0.00 H new ATOM 0 HE2 MET A 38 1.455 12.086 5.707 1.00 0.00 H new ATOM 0 HE3 MET A 38 2.617 13.415 5.485 1.00 0.00 H new ATOM 507 N SER A 39 3.417 8.532 7.769 1.00 0.00 N ATOM 508 CA SER A 39 2.910 7.709 8.902 1.00 0.00 C ATOM 509 C SER A 39 4.061 6.873 9.482 1.00 0.00 C ATOM 510 O SER A 39 5.112 7.396 9.799 1.00 0.00 O ATOM 511 CB SER A 39 1.795 6.791 8.395 1.00 0.00 C ATOM 512 OG SER A 39 1.100 6.237 9.505 1.00 0.00 O ATOM 0 H SER A 39 3.427 9.539 7.930 1.00 0.00 H new ATOM 0 HA SER A 39 2.514 8.357 9.684 1.00 0.00 H new ATOM 0 HB2 SER A 39 1.106 7.352 7.763 1.00 0.00 H new ATOM 0 HB3 SER A 39 2.215 5.995 7.780 1.00 0.00 H new ATOM 0 HG SER A 39 0.384 5.650 9.183 1.00 0.00 H new ATOM 518 N ALA A 40 3.882 5.584 9.634 1.00 0.00 N ATOM 519 CA ALA A 40 4.978 4.750 10.203 1.00 0.00 C ATOM 520 C ALA A 40 5.348 3.627 9.229 1.00 0.00 C ATOM 521 O ALA A 40 6.155 2.772 9.537 1.00 0.00 O ATOM 522 CB ALA A 40 4.516 4.140 11.528 1.00 0.00 C ATOM 0 H ALA A 40 3.030 5.079 9.390 1.00 0.00 H new ATOM 0 HA ALA A 40 5.853 5.379 10.370 1.00 0.00 H new ATOM 0 HB1 ALA A 40 5.316 3.529 11.946 1.00 0.00 H new ATOM 0 HB2 ALA A 40 4.265 4.937 12.228 1.00 0.00 H new ATOM 0 HB3 ALA A 40 3.638 3.518 11.356 1.00 0.00 H new ATOM 528 N GLY A 41 4.771 3.613 8.056 1.00 0.00 N ATOM 529 CA GLY A 41 5.108 2.533 7.081 1.00 0.00 C ATOM 530 C GLY A 41 4.148 2.581 5.890 1.00 0.00 C ATOM 531 O GLY A 41 3.369 1.674 5.673 1.00 0.00 O ATOM 0 H GLY A 41 4.086 4.296 7.732 1.00 0.00 H new ATOM 0 HA2 GLY A 41 6.135 2.652 6.735 1.00 0.00 H new ATOM 0 HA3 GLY A 41 5.047 1.560 7.569 1.00 0.00 H new ATOM 535 N LEU A 42 4.203 3.629 5.111 1.00 0.00 N ATOM 536 CA LEU A 42 3.300 3.743 3.918 1.00 0.00 C ATOM 537 C LEU A 42 1.902 3.240 4.252 1.00 0.00 C ATOM 538 O LEU A 42 1.149 2.851 3.382 1.00 0.00 O ATOM 539 CB LEU A 42 3.852 2.931 2.742 1.00 0.00 C ATOM 540 CG LEU A 42 5.277 2.482 3.044 1.00 0.00 C ATOM 541 CD1 LEU A 42 5.769 1.569 1.926 1.00 0.00 C ATOM 542 CD2 LEU A 42 6.186 3.706 3.131 1.00 0.00 C ATOM 0 H LEU A 42 4.836 4.417 5.247 1.00 0.00 H new ATOM 0 HA LEU A 42 3.250 4.796 3.641 1.00 0.00 H new ATOM 0 HB2 LEU A 42 3.219 2.063 2.560 1.00 0.00 H new ATOM 0 HB3 LEU A 42 3.836 3.533 1.834 1.00 0.00 H new ATOM 0 HG LEU A 42 5.295 1.943 3.991 1.00 0.00 H new ATOM 0 HD11 LEU A 42 6.788 1.247 2.141 1.00 0.00 H new ATOM 0 HD12 LEU A 42 5.120 0.696 1.857 1.00 0.00 H new ATOM 0 HD13 LEU A 42 5.751 2.110 0.980 1.00 0.00 H new ATOM 0 HD21 LEU A 42 7.206 3.387 3.347 1.00 0.00 H new ATOM 0 HD22 LEU A 42 6.167 4.242 2.182 1.00 0.00 H new ATOM 0 HD23 LEU A 42 5.835 4.364 3.926 1.00 0.00 H new ATOM 554 N GLY A 43 1.541 3.252 5.497 1.00 0.00 N ATOM 555 CA GLY A 43 0.188 2.782 5.875 1.00 0.00 C ATOM 556 C GLY A 43 0.022 1.304 5.519 1.00 0.00 C ATOM 557 O GLY A 43 -1.051 0.750 5.659 1.00 0.00 O ATOM 0 H GLY A 43 2.125 3.568 6.271 1.00 0.00 H new ATOM 0 HA2 GLY A 43 0.031 2.926 6.944 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -0.568 3.375 5.359 1.00 0.00 H new ATOM 561 N PHE A 44 1.058 0.642 5.064 1.00 0.00 N ATOM 562 CA PHE A 44 0.892 -0.786 4.727 1.00 0.00 C ATOM 563 C PHE A 44 2.050 -1.602 5.297 1.00 0.00 C ATOM 564 O PHE A 44 3.133 -1.108 5.546 1.00 0.00 O ATOM 565 CB PHE A 44 0.771 -0.965 3.200 1.00 0.00 C ATOM 566 CG PHE A 44 2.126 -1.078 2.529 1.00 0.00 C ATOM 567 CD1 PHE A 44 2.950 -2.184 2.776 1.00 0.00 C ATOM 568 CD2 PHE A 44 2.543 -0.091 1.624 1.00 0.00 C ATOM 569 CE1 PHE A 44 4.184 -2.299 2.136 1.00 0.00 C ATOM 570 CE2 PHE A 44 3.778 -0.212 0.978 1.00 0.00 C ATOM 571 CZ PHE A 44 4.598 -1.315 1.236 1.00 0.00 C ATOM 0 H PHE A 44 1.990 1.028 4.917 1.00 0.00 H new ATOM 0 HA PHE A 44 -0.029 -1.154 5.179 1.00 0.00 H new ATOM 0 HB2 PHE A 44 0.185 -1.859 2.986 1.00 0.00 H new ATOM 0 HB3 PHE A 44 0.228 -0.119 2.778 1.00 0.00 H new ATOM 0 HD1 PHE A 44 2.628 -2.951 3.465 1.00 0.00 H new ATOM 0 HD2 PHE A 44 1.911 0.762 1.426 1.00 0.00 H new ATOM 0 HE1 PHE A 44 4.819 -3.149 2.337 1.00 0.00 H new ATOM 0 HE2 PHE A 44 4.098 0.547 0.280 1.00 0.00 H new ATOM 0 HZ PHE A 44 5.552 -1.406 0.739 1.00 0.00 H new ATOM 581 N SER A 45 1.799 -2.857 5.488 1.00 0.00 N ATOM 582 CA SER A 45 2.828 -3.796 6.034 1.00 0.00 C ATOM 583 C SER A 45 2.881 -5.010 5.111 1.00 0.00 C ATOM 584 O SER A 45 1.872 -5.420 4.565 1.00 0.00 O ATOM 585 CB SER A 45 2.429 -4.240 7.442 1.00 0.00 C ATOM 586 OG SER A 45 3.090 -5.458 7.754 1.00 0.00 O ATOM 0 H SER A 45 0.899 -3.293 5.285 1.00 0.00 H new ATOM 0 HA SER A 45 3.801 -3.308 6.086 1.00 0.00 H new ATOM 0 HB2 SER A 45 2.696 -3.472 8.168 1.00 0.00 H new ATOM 0 HB3 SER A 45 1.349 -4.373 7.502 1.00 0.00 H new ATOM 0 HG SER A 45 2.813 -5.762 8.644 1.00 0.00 H new ATOM 592 N LEU A 46 4.040 -5.567 4.895 1.00 0.00 N ATOM 593 CA LEU A 46 4.133 -6.718 3.949 1.00 0.00 C ATOM 594 C LEU A 46 4.231 -8.072 4.638 1.00 0.00 C ATOM 595 O LEU A 46 4.898 -8.233 5.642 1.00 0.00 O ATOM 596 CB LEU A 46 5.352 -6.534 3.059 1.00 0.00 C ATOM 597 CG LEU A 46 4.865 -6.132 1.680 1.00 0.00 C ATOM 598 CD1 LEU A 46 5.697 -4.958 1.171 1.00 0.00 C ATOM 599 CD2 LEU A 46 4.999 -7.323 0.736 1.00 0.00 C ATOM 0 H LEU A 46 4.919 -5.280 5.326 1.00 0.00 H new ATOM 0 HA LEU A 46 3.208 -6.721 3.372 1.00 0.00 H new ATOM 0 HB2 LEU A 46 6.012 -5.769 3.469 1.00 0.00 H new ATOM 0 HB3 LEU A 46 5.929 -7.457 3.006 1.00 0.00 H new ATOM 0 HG LEU A 46 3.819 -5.829 1.727 1.00 0.00 H new ATOM 0 HD11 LEU A 46 5.348 -4.668 0.180 1.00 0.00 H new ATOM 0 HD12 LEU A 46 5.592 -4.115 1.854 1.00 0.00 H new ATOM 0 HD13 LEU A 46 6.745 -5.252 1.115 1.00 0.00 H new ATOM 0 HD21 LEU A 46 4.650 -7.041 -0.257 1.00 0.00 H new ATOM 0 HD22 LEU A 46 6.044 -7.628 0.681 1.00 0.00 H new ATOM 0 HD23 LEU A 46 4.398 -8.152 1.109 1.00 0.00 H new ATOM 611 N GLU A 47 3.601 -9.069 4.058 1.00 0.00 N ATOM 612 CA GLU A 47 3.694 -10.437 4.628 1.00 0.00 C ATOM 613 C GLU A 47 3.956 -11.421 3.503 1.00 0.00 C ATOM 614 O GLU A 47 3.404 -11.317 2.426 1.00 0.00 O ATOM 615 CB GLU A 47 2.417 -10.836 5.345 1.00 0.00 C ATOM 616 CG GLU A 47 2.545 -10.474 6.822 1.00 0.00 C ATOM 617 CD GLU A 47 3.241 -11.613 7.571 1.00 0.00 C ATOM 618 OE1 GLU A 47 3.770 -12.494 6.911 1.00 0.00 O ATOM 619 OE2 GLU A 47 3.233 -11.584 8.790 1.00 0.00 O ATOM 0 H GLU A 47 3.030 -8.987 3.217 1.00 0.00 H new ATOM 0 HA GLU A 47 4.507 -10.448 5.354 1.00 0.00 H new ATOM 0 HB2 GLU A 47 1.562 -10.324 4.904 1.00 0.00 H new ATOM 0 HB3 GLU A 47 2.240 -11.906 5.233 1.00 0.00 H new ATOM 0 HG2 GLU A 47 3.114 -9.551 6.933 1.00 0.00 H new ATOM 0 HG3 GLU A 47 1.559 -10.293 7.249 1.00 0.00 H new ATOM 626 N GLY A 48 4.807 -12.365 3.736 1.00 0.00 N ATOM 627 CA GLY A 48 5.126 -13.343 2.683 1.00 0.00 C ATOM 628 C GLY A 48 6.545 -13.043 2.203 1.00 0.00 C ATOM 629 O GLY A 48 7.246 -12.244 2.786 1.00 0.00 O ATOM 0 H GLY A 48 5.299 -12.501 4.619 1.00 0.00 H new ATOM 0 HA2 GLY A 48 5.057 -14.360 3.069 1.00 0.00 H new ATOM 0 HA3 GLY A 48 4.417 -13.266 1.859 1.00 0.00 H new ATOM 633 N GLY A 49 6.971 -13.652 1.150 1.00 0.00 N ATOM 634 CA GLY A 49 8.354 -13.380 0.642 1.00 0.00 C ATOM 635 C GLY A 49 9.066 -14.684 0.254 1.00 0.00 C ATOM 636 O GLY A 49 9.200 -15.005 -0.911 1.00 0.00 O ATOM 0 H GLY A 49 6.433 -14.329 0.609 1.00 0.00 H new ATOM 0 HA2 GLY A 49 8.304 -12.718 -0.223 1.00 0.00 H new ATOM 0 HA3 GLY A 49 8.931 -12.861 1.408 1.00 0.00 H new ATOM 640 N LYS A 50 9.546 -15.423 1.222 1.00 0.00 N ATOM 641 CA LYS A 50 10.279 -16.700 0.906 1.00 0.00 C ATOM 642 C LYS A 50 9.406 -17.626 0.046 1.00 0.00 C ATOM 643 O LYS A 50 8.337 -17.261 -0.387 1.00 0.00 O ATOM 644 CB LYS A 50 10.655 -17.425 2.206 1.00 0.00 C ATOM 645 CG LYS A 50 12.174 -17.608 2.269 1.00 0.00 C ATOM 646 CD LYS A 50 12.858 -16.259 2.050 1.00 0.00 C ATOM 647 CE LYS A 50 13.875 -16.378 0.915 1.00 0.00 C ATOM 648 NZ LYS A 50 14.893 -17.410 1.266 1.00 0.00 N ATOM 0 H LYS A 50 9.466 -15.204 2.215 1.00 0.00 H new ATOM 0 HA LYS A 50 11.183 -16.447 0.352 1.00 0.00 H new ATOM 0 HB2 LYS A 50 10.311 -16.852 3.067 1.00 0.00 H new ATOM 0 HB3 LYS A 50 10.159 -18.395 2.250 1.00 0.00 H new ATOM 0 HG2 LYS A 50 12.462 -18.021 3.236 1.00 0.00 H new ATOM 0 HG3 LYS A 50 12.497 -18.320 1.509 1.00 0.00 H new ATOM 0 HD2 LYS A 50 12.116 -15.498 1.808 1.00 0.00 H new ATOM 0 HD3 LYS A 50 13.356 -15.939 2.966 1.00 0.00 H new ATOM 0 HE2 LYS A 50 13.371 -16.650 -0.012 1.00 0.00 H new ATOM 0 HE3 LYS A 50 14.360 -15.417 0.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 15.805 -17.159 0.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 15.000 -17.455 2.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 14.585 -18.337 0.909 1.00 0.00 H new ATOM 662 N GLY A 51 9.859 -18.824 -0.214 1.00 0.00 N ATOM 663 CA GLY A 51 9.049 -19.760 -1.047 1.00 0.00 C ATOM 664 C GLY A 51 9.765 -21.110 -1.147 1.00 0.00 C ATOM 665 O GLY A 51 10.763 -21.242 -1.828 1.00 0.00 O ATOM 0 H GLY A 51 10.752 -19.194 0.113 1.00 0.00 H new ATOM 0 HA2 GLY A 51 8.061 -19.893 -0.606 1.00 0.00 H new ATOM 0 HA3 GLY A 51 8.900 -19.341 -2.042 1.00 0.00 H new ATOM 669 N SER A 52 9.268 -22.116 -0.475 1.00 0.00 N ATOM 670 CA SER A 52 9.928 -23.451 -0.538 1.00 0.00 C ATOM 671 C SER A 52 8.904 -24.514 -0.943 1.00 0.00 C ATOM 672 O SER A 52 8.933 -25.026 -2.045 1.00 0.00 O ATOM 673 CB SER A 52 10.507 -23.799 0.833 1.00 0.00 C ATOM 674 OG SER A 52 11.824 -23.276 0.932 1.00 0.00 O ATOM 0 H SER A 52 8.436 -22.070 0.113 1.00 0.00 H new ATOM 0 HA SER A 52 10.730 -23.422 -1.276 1.00 0.00 H new ATOM 0 HB2 SER A 52 9.879 -23.385 1.622 1.00 0.00 H new ATOM 0 HB3 SER A 52 10.521 -24.880 0.971 1.00 0.00 H new ATOM 0 HG SER A 52 12.198 -23.496 1.811 1.00 0.00 H new ATOM 680 N LEU A 53 8.004 -24.858 -0.061 1.00 0.00 N ATOM 681 CA LEU A 53 6.989 -25.896 -0.404 1.00 0.00 C ATOM 682 C LEU A 53 5.923 -25.959 0.692 1.00 0.00 C ATOM 683 O LEU A 53 4.782 -25.591 0.487 1.00 0.00 O ATOM 684 CB LEU A 53 7.679 -27.256 -0.522 1.00 0.00 C ATOM 685 CG LEU A 53 7.164 -27.986 -1.763 1.00 0.00 C ATOM 686 CD1 LEU A 53 7.955 -29.281 -1.956 1.00 0.00 C ATOM 687 CD2 LEU A 53 5.681 -28.316 -1.579 1.00 0.00 C ATOM 0 H LEU A 53 7.928 -24.467 0.878 1.00 0.00 H new ATOM 0 HA LEU A 53 6.515 -25.640 -1.352 1.00 0.00 H new ATOM 0 HB2 LEU A 53 8.759 -27.123 -0.588 1.00 0.00 H new ATOM 0 HB3 LEU A 53 7.485 -27.852 0.370 1.00 0.00 H new ATOM 0 HG LEU A 53 7.289 -27.350 -2.639 1.00 0.00 H new ATOM 0 HD11 LEU A 53 7.589 -29.803 -2.840 1.00 0.00 H new ATOM 0 HD12 LEU A 53 9.012 -29.046 -2.085 1.00 0.00 H new ATOM 0 HD13 LEU A 53 7.829 -29.918 -1.081 1.00 0.00 H new ATOM 0 HD21 LEU A 53 5.312 -28.836 -2.463 1.00 0.00 H new ATOM 0 HD22 LEU A 53 5.556 -28.953 -0.704 1.00 0.00 H new ATOM 0 HD23 LEU A 53 5.118 -27.393 -1.439 1.00 0.00 H new ATOM 699 N HIS A 54 6.283 -26.424 1.857 1.00 0.00 N ATOM 700 CA HIS A 54 5.288 -26.513 2.967 1.00 0.00 C ATOM 701 C HIS A 54 5.069 -25.123 3.570 1.00 0.00 C ATOM 702 O HIS A 54 4.201 -24.924 4.396 1.00 0.00 O ATOM 703 CB HIS A 54 5.818 -27.459 4.047 1.00 0.00 C ATOM 704 CG HIS A 54 7.094 -26.902 4.617 1.00 0.00 C ATOM 705 ND1 HIS A 54 7.099 -25.913 5.587 1.00 0.00 N ATOM 706 CD2 HIS A 54 8.413 -27.185 4.363 1.00 0.00 C ATOM 707 CE1 HIS A 54 8.383 -25.638 5.879 1.00 0.00 C ATOM 708 NE2 HIS A 54 9.226 -26.385 5.161 1.00 0.00 N ATOM 0 H HIS A 54 7.222 -26.746 2.090 1.00 0.00 H new ATOM 0 HA HIS A 54 4.343 -26.893 2.580 1.00 0.00 H new ATOM 0 HB2 HIS A 54 5.076 -27.579 4.837 1.00 0.00 H new ATOM 0 HB3 HIS A 54 5.997 -28.448 3.624 1.00 0.00 H new ATOM 0 HD2 HIS A 54 8.766 -27.917 3.652 1.00 0.00 H new ATOM 0 HE1 HIS A 54 8.694 -24.902 6.606 1.00 0.00 H new ATOM 0 HE2 HIS A 54 10.245 -26.372 5.191 1.00 0.00 H new ATOM 716 N GLY A 55 5.847 -24.159 3.159 1.00 0.00 N ATOM 717 CA GLY A 55 5.679 -22.777 3.707 1.00 0.00 C ATOM 718 C GLY A 55 5.696 -21.774 2.553 1.00 0.00 C ATOM 719 O GLY A 55 6.572 -20.937 2.457 1.00 0.00 O ATOM 0 H GLY A 55 6.591 -24.265 2.469 1.00 0.00 H new ATOM 0 HA2 GLY A 55 4.740 -22.702 4.256 1.00 0.00 H new ATOM 0 HA3 GLY A 55 6.480 -22.552 4.412 1.00 0.00 H new ATOM 723 N ASP A 56 4.737 -21.857 1.672 1.00 0.00 N ATOM 724 CA ASP A 56 4.699 -20.913 0.521 1.00 0.00 C ATOM 725 C ASP A 56 4.456 -19.489 1.028 1.00 0.00 C ATOM 726 O ASP A 56 3.406 -19.177 1.555 1.00 0.00 O ATOM 727 CB ASP A 56 3.571 -21.313 -0.434 1.00 0.00 C ATOM 728 CG ASP A 56 3.854 -22.701 -1.011 1.00 0.00 C ATOM 729 OD1 ASP A 56 5.002 -22.965 -1.333 1.00 0.00 O ATOM 730 OD2 ASP A 56 2.920 -23.477 -1.121 1.00 0.00 O ATOM 0 H ASP A 56 3.978 -22.538 1.700 1.00 0.00 H new ATOM 0 HA ASP A 56 5.653 -20.951 -0.006 1.00 0.00 H new ATOM 0 HB2 ASP A 56 2.618 -21.315 0.094 1.00 0.00 H new ATOM 0 HB3 ASP A 56 3.487 -20.584 -1.240 1.00 0.00 H new ATOM 735 N LYS A 57 5.417 -18.622 0.864 1.00 0.00 N ATOM 736 CA LYS A 57 5.236 -17.208 1.331 1.00 0.00 C ATOM 737 C LYS A 57 5.590 -16.224 0.222 1.00 0.00 C ATOM 738 O LYS A 57 6.716 -15.792 0.119 1.00 0.00 O ATOM 739 CB LYS A 57 6.067 -16.932 2.598 1.00 0.00 C ATOM 740 CG LYS A 57 7.505 -17.454 2.473 1.00 0.00 C ATOM 741 CD LYS A 57 8.187 -17.418 3.846 1.00 0.00 C ATOM 742 CE LYS A 57 7.254 -17.995 4.911 1.00 0.00 C ATOM 743 NZ LYS A 57 7.988 -18.103 6.203 1.00 0.00 N ATOM 0 H LYS A 57 6.317 -18.825 0.430 1.00 0.00 H new ATOM 0 HA LYS A 57 4.185 -17.069 1.586 1.00 0.00 H new ATOM 0 HB2 LYS A 57 6.087 -15.859 2.791 1.00 0.00 H new ATOM 0 HB3 LYS A 57 5.585 -17.401 3.456 1.00 0.00 H new ATOM 0 HG2 LYS A 57 7.500 -18.472 2.085 1.00 0.00 H new ATOM 0 HG3 LYS A 57 8.063 -16.845 1.762 1.00 0.00 H new ATOM 0 HD2 LYS A 57 9.114 -17.990 3.815 1.00 0.00 H new ATOM 0 HD3 LYS A 57 8.453 -16.392 4.102 1.00 0.00 H new ATOM 0 HE2 LYS A 57 6.379 -17.356 5.029 1.00 0.00 H new ATOM 0 HE3 LYS A 57 6.893 -18.976 4.602 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 7.356 -18.495 6.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 8.810 -18.729 6.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 8.312 -17.160 6.498 1.00 0.00 H new ATOM 757 N PRO A 58 4.599 -15.866 -0.569 1.00 0.00 N ATOM 758 CA PRO A 58 4.773 -14.902 -1.670 1.00 0.00 C ATOM 759 C PRO A 58 4.669 -13.468 -1.131 1.00 0.00 C ATOM 760 O PRO A 58 4.012 -13.217 -0.143 1.00 0.00 O ATOM 761 CB PRO A 58 3.596 -15.200 -2.598 1.00 0.00 C ATOM 762 CG PRO A 58 2.513 -15.880 -1.724 1.00 0.00 C ATOM 763 CD PRO A 58 3.220 -16.393 -0.454 1.00 0.00 C ATOM 0 HA PRO A 58 5.740 -14.988 -2.166 1.00 0.00 H new ATOM 0 HB2 PRO A 58 3.214 -14.283 -3.047 1.00 0.00 H new ATOM 0 HB3 PRO A 58 3.902 -15.853 -3.416 1.00 0.00 H new ATOM 0 HG2 PRO A 58 1.724 -15.173 -1.468 1.00 0.00 H new ATOM 0 HG3 PRO A 58 2.042 -16.702 -2.263 1.00 0.00 H new ATOM 0 HD2 PRO A 58 2.729 -16.031 0.449 1.00 0.00 H new ATOM 0 HD3 PRO A 58 3.212 -17.482 -0.406 1.00 0.00 H new ATOM 771 N LEU A 59 5.305 -12.529 -1.774 1.00 0.00 N ATOM 772 CA LEU A 59 5.241 -11.113 -1.299 1.00 0.00 C ATOM 773 C LEU A 59 3.790 -10.629 -1.255 1.00 0.00 C ATOM 774 O LEU A 59 3.095 -10.667 -2.251 1.00 0.00 O ATOM 775 CB LEU A 59 5.979 -10.221 -2.279 1.00 0.00 C ATOM 776 CG LEU A 59 7.466 -10.211 -1.978 1.00 0.00 C ATOM 777 CD1 LEU A 59 8.169 -11.281 -2.818 1.00 0.00 C ATOM 778 CD2 LEU A 59 8.022 -8.832 -2.332 1.00 0.00 C ATOM 0 H LEU A 59 5.869 -12.679 -2.611 1.00 0.00 H new ATOM 0 HA LEU A 59 5.686 -11.067 -0.305 1.00 0.00 H new ATOM 0 HB2 LEU A 59 5.811 -10.573 -3.297 1.00 0.00 H new ATOM 0 HB3 LEU A 59 5.585 -9.206 -2.223 1.00 0.00 H new ATOM 0 HG LEU A 59 7.636 -10.423 -0.922 1.00 0.00 H new ATOM 0 HD11 LEU A 59 9.237 -11.271 -2.600 1.00 0.00 H new ATOM 0 HD12 LEU A 59 7.758 -12.261 -2.577 1.00 0.00 H new ATOM 0 HD13 LEU A 59 8.013 -11.073 -3.877 1.00 0.00 H new ATOM 0 HD21 LEU A 59 9.091 -8.806 -2.122 1.00 0.00 H new ATOM 0 HD22 LEU A 59 7.855 -8.633 -3.391 1.00 0.00 H new ATOM 0 HD23 LEU A 59 7.517 -8.072 -1.736 1.00 0.00 H new ATOM 790 N THR A 60 3.313 -10.163 -0.129 1.00 0.00 N ATOM 791 CA THR A 60 1.897 -9.684 -0.109 1.00 0.00 C ATOM 792 C THR A 60 1.639 -8.644 1.007 1.00 0.00 C ATOM 793 O THR A 60 2.322 -8.641 2.012 1.00 0.00 O ATOM 794 CB THR A 60 1.010 -10.888 0.094 1.00 0.00 C ATOM 795 OG1 THR A 60 1.692 -11.836 0.903 1.00 0.00 O ATOM 796 CG2 THR A 60 0.724 -11.465 -1.280 1.00 0.00 C ATOM 0 H THR A 60 3.823 -10.094 0.752 1.00 0.00 H new ATOM 0 HA THR A 60 1.681 -9.184 -1.053 1.00 0.00 H new ATOM 0 HB THR A 60 0.078 -10.623 0.593 1.00 0.00 H new ATOM 0 HG1 THR A 60 2.155 -11.372 1.631 1.00 0.00 H new ATOM 0 HG21 THR A 60 0.083 -12.341 -1.181 1.00 0.00 H new ATOM 0 HG22 THR A 60 0.222 -10.716 -1.892 1.00 0.00 H new ATOM 0 HG23 THR A 60 1.661 -11.753 -1.756 1.00 0.00 H new ATOM 804 N ILE A 61 0.630 -7.783 0.877 1.00 0.00 N ATOM 805 CA ILE A 61 0.353 -6.820 1.979 1.00 0.00 C ATOM 806 C ILE A 61 -0.654 -7.445 2.935 1.00 0.00 C ATOM 807 O ILE A 61 -1.661 -7.991 2.533 1.00 0.00 O ATOM 808 CB ILE A 61 -0.233 -5.517 1.463 1.00 0.00 C ATOM 809 CG1 ILE A 61 0.762 -4.789 0.572 1.00 0.00 C ATOM 810 CG2 ILE A 61 -0.510 -4.622 2.658 1.00 0.00 C ATOM 811 CD1 ILE A 61 0.097 -3.522 0.020 1.00 0.00 C ATOM 0 H ILE A 61 0.010 -7.719 0.069 1.00 0.00 H new ATOM 0 HA ILE A 61 1.299 -6.601 2.475 1.00 0.00 H new ATOM 0 HB ILE A 61 -1.136 -5.738 0.894 1.00 0.00 H new ATOM 0 HG12 ILE A 61 1.656 -4.530 1.139 1.00 0.00 H new ATOM 0 HG13 ILE A 61 1.079 -5.436 -0.246 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -0.932 -3.677 2.315 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -1.217 -5.115 3.325 1.00 0.00 H new ATOM 0 HG23 ILE A 61 0.420 -4.431 3.193 1.00 0.00 H new ATOM 0 HD11 ILE A 61 0.801 -2.991 -0.621 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -0.785 -3.797 -0.559 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -0.199 -2.876 0.847 1.00 0.00 H new ATOM 823 N ASN A 62 -0.380 -7.376 4.198 1.00 0.00 N ATOM 824 CA ASN A 62 -1.313 -7.976 5.200 1.00 0.00 C ATOM 825 C ASN A 62 -2.008 -6.907 6.040 1.00 0.00 C ATOM 826 O ASN A 62 -3.218 -6.877 6.145 1.00 0.00 O ATOM 827 CB ASN A 62 -0.538 -8.882 6.149 1.00 0.00 C ATOM 828 CG ASN A 62 0.848 -8.289 6.393 1.00 0.00 C ATOM 829 OD1 ASN A 62 1.689 -8.294 5.516 1.00 0.00 O ATOM 830 ND2 ASN A 62 1.125 -7.771 7.559 1.00 0.00 N ATOM 0 H ASN A 62 0.450 -6.931 4.590 1.00 0.00 H new ATOM 0 HA ASN A 62 -2.063 -8.537 4.643 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -1.074 -8.983 7.093 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -0.449 -9.882 5.724 1.00 0.00 H new ATOM 0 HD21 ASN A 62 2.047 -7.371 7.733 1.00 0.00 H new ATOM 0 HD22 ASN A 62 0.419 -7.766 8.296 1.00 0.00 H new ATOM 837 N ARG A 63 -1.258 -6.056 6.674 1.00 0.00 N ATOM 838 CA ARG A 63 -1.890 -5.024 7.544 1.00 0.00 C ATOM 839 C ARG A 63 -1.890 -3.665 6.853 1.00 0.00 C ATOM 840 O ARG A 63 -0.964 -2.890 6.985 1.00 0.00 O ATOM 841 CB ARG A 63 -1.127 -4.921 8.870 1.00 0.00 C ATOM 842 CG ARG A 63 -2.021 -5.412 10.012 1.00 0.00 C ATOM 843 CD ARG A 63 -1.192 -5.555 11.291 1.00 0.00 C ATOM 844 NE ARG A 63 -1.777 -6.626 12.145 1.00 0.00 N ATOM 845 CZ ARG A 63 -2.746 -6.345 12.974 1.00 0.00 C ATOM 846 NH1 ARG A 63 -2.472 -5.946 14.185 1.00 0.00 N ATOM 847 NH2 ARG A 63 -3.988 -6.462 12.593 1.00 0.00 N ATOM 0 H ARG A 63 -0.239 -6.027 6.630 1.00 0.00 H new ATOM 0 HA ARG A 63 -2.921 -5.322 7.737 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -0.216 -5.517 8.825 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -0.824 -3.889 9.049 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -2.839 -4.710 10.174 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -2.470 -6.370 9.749 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -0.159 -5.797 11.042 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -1.176 -4.610 11.834 1.00 0.00 H new ATOM 0 HE ARG A 63 -1.420 -7.580 12.082 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -1.501 -5.854 14.484 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -3.228 -5.726 14.833 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -4.204 -6.774 11.646 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -4.743 -6.242 13.242 1.00 0.00 H new ATOM 861 N ILE A 64 -2.931 -3.362 6.131 1.00 0.00 N ATOM 862 CA ILE A 64 -2.995 -2.046 5.455 1.00 0.00 C ATOM 863 C ILE A 64 -3.776 -1.076 6.325 1.00 0.00 C ATOM 864 O ILE A 64 -4.728 -1.438 6.989 1.00 0.00 O ATOM 865 CB ILE A 64 -3.669 -2.185 4.096 1.00 0.00 C ATOM 866 CG1 ILE A 64 -2.705 -2.934 3.176 1.00 0.00 C ATOM 867 CG2 ILE A 64 -3.985 -0.791 3.535 1.00 0.00 C ATOM 868 CD1 ILE A 64 -2.775 -2.391 1.747 1.00 0.00 C ATOM 0 H ILE A 64 -3.737 -3.970 5.982 1.00 0.00 H new ATOM 0 HA ILE A 64 -1.984 -1.668 5.303 1.00 0.00 H new ATOM 0 HB ILE A 64 -4.606 -2.735 4.177 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -1.687 -2.839 3.555 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -2.948 -3.997 3.177 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -4.467 -0.891 2.563 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -4.652 -0.266 4.219 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -3.060 -0.225 3.425 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -2.079 -2.942 1.114 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -3.788 -2.510 1.362 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -2.508 -1.334 1.746 1.00 0.00 H new ATOM 880 N PHE A 65 -3.368 0.151 6.335 1.00 0.00 N ATOM 881 CA PHE A 65 -4.071 1.162 7.177 1.00 0.00 C ATOM 882 C PHE A 65 -4.885 2.100 6.285 1.00 0.00 C ATOM 883 O PHE A 65 -4.760 2.088 5.077 1.00 0.00 O ATOM 884 CB PHE A 65 -3.039 1.963 7.979 1.00 0.00 C ATOM 885 CG PHE A 65 -1.998 1.008 8.547 1.00 0.00 C ATOM 886 CD1 PHE A 65 -2.333 -0.336 8.785 1.00 0.00 C ATOM 887 CD2 PHE A 65 -0.696 1.458 8.824 1.00 0.00 C ATOM 888 CE1 PHE A 65 -1.373 -1.222 9.299 1.00 0.00 C ATOM 889 CE2 PHE A 65 0.263 0.564 9.336 1.00 0.00 C ATOM 890 CZ PHE A 65 -0.079 -0.771 9.572 1.00 0.00 C ATOM 0 H PHE A 65 -2.577 0.507 5.798 1.00 0.00 H new ATOM 0 HA PHE A 65 -4.747 0.656 7.867 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -2.560 2.705 7.340 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -3.530 2.507 8.786 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -3.332 -0.688 8.572 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -0.431 2.489 8.644 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -1.635 -2.253 9.484 1.00 0.00 H new ATOM 0 HE2 PHE A 65 1.264 0.910 9.547 1.00 0.00 H new ATOM 0 HZ PHE A 65 0.658 -1.455 9.966 1.00 0.00 H new ATOM 900 N LYS A 66 -5.720 2.915 6.872 1.00 0.00 N ATOM 901 CA LYS A 66 -6.541 3.854 6.048 1.00 0.00 C ATOM 902 C LYS A 66 -5.903 5.243 6.089 1.00 0.00 C ATOM 903 O LYS A 66 -6.080 5.993 7.028 1.00 0.00 O ATOM 904 CB LYS A 66 -7.977 3.928 6.591 1.00 0.00 C ATOM 905 CG LYS A 66 -8.701 5.120 5.960 1.00 0.00 C ATOM 906 CD LYS A 66 -10.212 4.900 6.041 1.00 0.00 C ATOM 907 CE LYS A 66 -10.733 4.431 4.680 1.00 0.00 C ATOM 908 NZ LYS A 66 -12.164 4.818 4.536 1.00 0.00 N ATOM 0 H LYS A 66 -5.870 2.973 7.879 1.00 0.00 H new ATOM 0 HA LYS A 66 -6.576 3.492 5.021 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -8.510 3.004 6.366 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -7.962 4.031 7.676 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -8.428 6.040 6.477 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -8.395 5.236 4.920 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -10.442 4.158 6.806 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -10.710 5.824 6.334 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -10.142 4.876 3.879 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -10.627 3.350 4.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -12.518 4.500 3.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -12.722 4.373 5.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -12.252 5.852 4.603 1.00 0.00 H new ATOM 922 N GLY A 67 -5.157 5.588 5.077 1.00 0.00 N ATOM 923 CA GLY A 67 -4.499 6.923 5.052 1.00 0.00 C ATOM 924 C GLY A 67 -3.095 6.780 4.464 1.00 0.00 C ATOM 925 O GLY A 67 -2.790 5.811 3.797 1.00 0.00 O ATOM 0 H GLY A 67 -4.974 5.000 4.264 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -5.087 7.620 4.455 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -4.444 7.334 6.060 1.00 0.00 H new ATOM 929 N ALA A 68 -2.238 7.733 4.705 1.00 0.00 N ATOM 930 CA ALA A 68 -0.855 7.644 4.157 1.00 0.00 C ATOM 931 C ALA A 68 -0.916 7.185 2.699 1.00 0.00 C ATOM 932 O ALA A 68 -0.258 6.242 2.307 1.00 0.00 O ATOM 933 CB ALA A 68 -0.047 6.633 4.974 1.00 0.00 C ATOM 0 H ALA A 68 -2.435 8.568 5.257 1.00 0.00 H new ATOM 0 HA ALA A 68 -0.377 8.622 4.213 1.00 0.00 H new ATOM 0 HB1 ALA A 68 0.965 6.567 4.574 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -0.005 6.956 6.014 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -0.524 5.655 4.917 1.00 0.00 H new ATOM 939 N ALA A 69 -1.699 7.847 1.891 1.00 0.00 N ATOM 940 CA ALA A 69 -1.800 7.448 0.459 1.00 0.00 C ATOM 941 C ALA A 69 -2.169 8.670 -0.385 1.00 0.00 C ATOM 942 O ALA A 69 -2.756 9.618 0.099 1.00 0.00 O ATOM 943 CB ALA A 69 -2.879 6.374 0.302 1.00 0.00 C ATOM 0 H ALA A 69 -2.273 8.646 2.161 1.00 0.00 H new ATOM 0 HA ALA A 69 -0.842 7.050 0.124 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -2.952 6.083 -0.746 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -2.616 5.504 0.903 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -3.838 6.770 0.637 1.00 0.00 H new ATOM 949 N SER A 70 -1.827 8.657 -1.645 1.00 0.00 N ATOM 950 CA SER A 70 -2.155 9.819 -2.520 1.00 0.00 C ATOM 951 C SER A 70 -3.671 9.899 -2.716 1.00 0.00 C ATOM 952 O SER A 70 -4.438 9.525 -1.851 1.00 0.00 O ATOM 953 CB SER A 70 -1.475 9.644 -3.878 1.00 0.00 C ATOM 954 OG SER A 70 -1.431 10.898 -4.545 1.00 0.00 O ATOM 0 H SER A 70 -1.335 7.892 -2.106 1.00 0.00 H new ATOM 0 HA SER A 70 -1.800 10.737 -2.051 1.00 0.00 H new ATOM 0 HB2 SER A 70 -0.466 9.254 -3.745 1.00 0.00 H new ATOM 0 HB3 SER A 70 -2.021 8.918 -4.480 1.00 0.00 H new ATOM 0 HG SER A 70 -0.994 10.790 -5.416 1.00 0.00 H new ATOM 960 N GLU A 71 -4.110 10.386 -3.845 1.00 0.00 N ATOM 961 CA GLU A 71 -5.576 10.490 -4.091 1.00 0.00 C ATOM 962 C GLU A 71 -5.973 9.550 -5.230 1.00 0.00 C ATOM 963 O GLU A 71 -6.965 9.758 -5.900 1.00 0.00 O ATOM 964 CB GLU A 71 -5.930 11.930 -4.468 1.00 0.00 C ATOM 965 CG GLU A 71 -5.913 12.804 -3.211 1.00 0.00 C ATOM 966 CD GLU A 71 -6.805 14.028 -3.425 1.00 0.00 C ATOM 967 OE1 GLU A 71 -7.511 14.057 -4.420 1.00 0.00 O ATOM 968 OE2 GLU A 71 -6.767 14.918 -2.590 1.00 0.00 O ATOM 0 H GLU A 71 -3.517 10.716 -4.607 1.00 0.00 H new ATOM 0 HA GLU A 71 -6.116 10.209 -3.187 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -5.217 12.312 -5.199 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -6.915 11.964 -4.934 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -6.264 12.231 -2.353 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -4.893 13.119 -2.988 1.00 0.00 H new ATOM 975 N GLN A 72 -5.210 8.514 -5.454 1.00 0.00 N ATOM 976 CA GLN A 72 -5.553 7.561 -6.549 1.00 0.00 C ATOM 977 C GLN A 72 -6.584 6.551 -6.040 1.00 0.00 C ATOM 978 O GLN A 72 -6.530 6.111 -4.909 1.00 0.00 O ATOM 979 CB GLN A 72 -4.291 6.821 -7.002 1.00 0.00 C ATOM 980 CG GLN A 72 -3.655 7.566 -8.178 1.00 0.00 C ATOM 981 CD GLN A 72 -2.801 6.597 -8.998 1.00 0.00 C ATOM 982 OE1 GLN A 72 -1.780 6.011 -8.436 1.00 0.00 O flip ATOM 983 NE2 GLN A 72 -3.066 6.370 -10.161 1.00 0.00 N flip ATOM 0 H GLN A 72 -4.366 8.287 -4.928 1.00 0.00 H new ATOM 0 HA GLN A 72 -5.969 8.112 -7.392 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -3.582 6.750 -6.177 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -4.540 5.801 -7.296 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -4.431 8.004 -8.806 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -3.040 8.388 -7.811 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -3.864 6.828 -10.601 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -2.490 5.721 -10.698 1.00 0.00 H new ATOM 992 N SER A 73 -7.527 6.183 -6.865 1.00 0.00 N ATOM 993 CA SER A 73 -8.562 5.205 -6.426 1.00 0.00 C ATOM 994 C SER A 73 -7.892 4.033 -5.707 1.00 0.00 C ATOM 995 O SER A 73 -7.457 3.082 -6.323 1.00 0.00 O ATOM 996 CB SER A 73 -9.323 4.685 -7.646 1.00 0.00 C ATOM 997 OG SER A 73 -8.668 5.120 -8.830 1.00 0.00 O ATOM 0 H SER A 73 -7.625 6.518 -7.824 1.00 0.00 H new ATOM 0 HA SER A 73 -9.256 5.697 -5.745 1.00 0.00 H new ATOM 0 HB2 SER A 73 -9.370 3.596 -7.622 1.00 0.00 H new ATOM 0 HB3 SER A 73 -10.350 5.049 -7.630 1.00 0.00 H new ATOM 0 HG SER A 73 -9.153 4.786 -9.614 1.00 0.00 H new ATOM 1003 N GLU A 74 -7.811 4.095 -4.405 1.00 0.00 N ATOM 1004 CA GLU A 74 -7.175 2.984 -3.641 1.00 0.00 C ATOM 1005 C GLU A 74 -5.813 2.645 -4.250 1.00 0.00 C ATOM 1006 O GLU A 74 -5.721 1.963 -5.252 1.00 0.00 O ATOM 1007 CB GLU A 74 -8.077 1.748 -3.690 1.00 0.00 C ATOM 1008 CG GLU A 74 -9.123 1.834 -2.576 1.00 0.00 C ATOM 1009 CD GLU A 74 -10.069 3.005 -2.850 1.00 0.00 C ATOM 1010 OE1 GLU A 74 -10.530 3.119 -3.974 1.00 0.00 O ATOM 1011 OE2 GLU A 74 -10.315 3.768 -1.931 1.00 0.00 O ATOM 0 H GLU A 74 -8.158 4.868 -3.837 1.00 0.00 H new ATOM 0 HA GLU A 74 -7.037 3.296 -2.606 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -8.569 1.682 -4.661 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -7.479 0.844 -3.573 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -9.687 0.903 -2.520 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -8.632 1.968 -1.612 1.00 0.00 H new ATOM 1018 N THR A 75 -4.755 3.108 -3.646 1.00 0.00 N ATOM 1019 CA THR A 75 -3.398 2.808 -4.181 1.00 0.00 C ATOM 1020 C THR A 75 -2.785 1.664 -3.371 1.00 0.00 C ATOM 1021 O THR A 75 -1.585 1.574 -3.199 1.00 0.00 O ATOM 1022 CB THR A 75 -2.516 4.064 -4.094 1.00 0.00 C ATOM 1023 OG1 THR A 75 -1.151 3.688 -3.961 1.00 0.00 O ATOM 1024 CG2 THR A 75 -2.931 4.911 -2.890 1.00 0.00 C ATOM 0 H THR A 75 -4.771 3.682 -2.803 1.00 0.00 H new ATOM 0 HA THR A 75 -3.468 2.508 -5.227 1.00 0.00 H new ATOM 0 HB THR A 75 -2.643 4.648 -5.006 1.00 0.00 H new ATOM 0 HG1 THR A 75 -1.087 2.713 -3.880 1.00 0.00 H new ATOM 0 HG21 THR A 75 -2.301 5.799 -2.835 1.00 0.00 H new ATOM 0 HG22 THR A 75 -3.973 5.211 -2.998 1.00 0.00 H new ATOM 0 HG23 THR A 75 -2.815 4.327 -1.977 1.00 0.00 H new ATOM 1032 N VAL A 76 -3.605 0.779 -2.881 1.00 0.00 N ATOM 1033 CA VAL A 76 -3.083 -0.371 -2.091 1.00 0.00 C ATOM 1034 C VAL A 76 -4.104 -1.504 -2.125 1.00 0.00 C ATOM 1035 O VAL A 76 -5.267 -1.299 -2.413 1.00 0.00 O ATOM 1036 CB VAL A 76 -2.835 0.038 -0.632 1.00 0.00 C ATOM 1037 CG1 VAL A 76 -1.416 -0.362 -0.231 1.00 0.00 C ATOM 1038 CG2 VAL A 76 -2.997 1.552 -0.465 1.00 0.00 C ATOM 0 H VAL A 76 -4.619 0.802 -2.994 1.00 0.00 H new ATOM 0 HA VAL A 76 -2.139 -0.696 -2.528 1.00 0.00 H new ATOM 0 HB VAL A 76 -3.562 -0.468 0.004 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -1.236 -0.073 0.804 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -1.300 -1.441 -0.333 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -0.699 0.143 -0.879 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -2.818 1.825 0.575 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -2.280 2.067 -1.104 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -4.009 1.843 -0.747 1.00 0.00 H new ATOM 1048 N GLN A 77 -3.683 -2.699 -1.829 1.00 0.00 N ATOM 1049 CA GLN A 77 -4.632 -3.847 -1.841 1.00 0.00 C ATOM 1050 C GLN A 77 -4.249 -4.818 -0.721 1.00 0.00 C ATOM 1051 O GLN A 77 -3.083 -4.980 -0.420 1.00 0.00 O ATOM 1052 CB GLN A 77 -4.579 -4.574 -3.195 1.00 0.00 C ATOM 1053 CG GLN A 77 -3.359 -4.114 -4.002 1.00 0.00 C ATOM 1054 CD GLN A 77 -3.628 -2.733 -4.597 1.00 0.00 C ATOM 1055 OE1 GLN A 77 -2.647 -1.880 -4.701 1.00 0.00 O flip ATOM 1056 NE2 GLN A 77 -4.743 -2.425 -4.971 1.00 0.00 N flip ATOM 0 H GLN A 77 -2.722 -2.932 -1.579 1.00 0.00 H new ATOM 0 HA GLN A 77 -5.646 -3.477 -1.686 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -4.532 -5.651 -3.035 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -5.491 -4.375 -3.758 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -2.478 -4.079 -3.361 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -3.146 -4.828 -4.797 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -5.511 -3.092 -4.890 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -4.911 -1.500 -5.366 1.00 0.00 H new ATOM 1065 N PRO A 78 -5.244 -5.427 -0.125 1.00 0.00 N ATOM 1066 CA PRO A 78 -5.039 -6.379 0.978 1.00 0.00 C ATOM 1067 C PRO A 78 -4.596 -7.745 0.446 1.00 0.00 C ATOM 1068 O PRO A 78 -5.348 -8.443 -0.205 1.00 0.00 O ATOM 1069 CB PRO A 78 -6.421 -6.471 1.632 1.00 0.00 C ATOM 1070 CG PRO A 78 -7.444 -6.035 0.556 1.00 0.00 C ATOM 1071 CD PRO A 78 -6.662 -5.225 -0.495 1.00 0.00 C ATOM 0 HA PRO A 78 -4.260 -6.063 1.672 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -6.623 -7.487 1.971 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -6.480 -5.825 2.508 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -7.920 -6.903 0.100 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -8.237 -5.432 0.998 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -6.865 -5.581 -1.505 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -6.934 -4.170 -0.469 1.00 0.00 H new ATOM 1079 N GLY A 79 -3.387 -8.140 0.738 1.00 0.00 N ATOM 1080 CA GLY A 79 -2.905 -9.483 0.263 1.00 0.00 C ATOM 1081 C GLY A 79 -2.480 -9.444 -1.215 1.00 0.00 C ATOM 1082 O GLY A 79 -2.199 -10.473 -1.798 1.00 0.00 O ATOM 0 H GLY A 79 -2.712 -7.601 1.280 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -2.063 -9.805 0.876 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -3.696 -10.221 0.395 1.00 0.00 H new ATOM 1086 N ASP A 80 -2.420 -8.294 -1.843 1.00 0.00 N ATOM 1087 CA ASP A 80 -1.997 -8.290 -3.285 1.00 0.00 C ATOM 1088 C ASP A 80 -0.558 -8.807 -3.376 1.00 0.00 C ATOM 1089 O ASP A 80 0.170 -8.779 -2.408 1.00 0.00 O ATOM 1090 CB ASP A 80 -2.071 -6.884 -3.896 1.00 0.00 C ATOM 1091 CG ASP A 80 -2.609 -6.996 -5.324 1.00 0.00 C ATOM 1092 OD1 ASP A 80 -1.852 -7.401 -6.190 1.00 0.00 O ATOM 1093 OD2 ASP A 80 -3.769 -6.679 -5.527 1.00 0.00 O ATOM 0 H ASP A 80 -2.637 -7.383 -1.438 1.00 0.00 H new ATOM 0 HA ASP A 80 -2.677 -8.932 -3.845 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -2.720 -6.246 -3.297 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -1.084 -6.421 -3.899 1.00 0.00 H new ATOM 1098 N GLU A 81 -0.133 -9.284 -4.521 1.00 0.00 N ATOM 1099 CA GLU A 81 1.275 -9.807 -4.618 1.00 0.00 C ATOM 1100 C GLU A 81 2.250 -8.677 -5.013 1.00 0.00 C ATOM 1101 O GLU A 81 2.703 -8.618 -6.138 1.00 0.00 O ATOM 1102 CB GLU A 81 1.372 -10.923 -5.673 1.00 0.00 C ATOM 1103 CG GLU A 81 2.524 -11.862 -5.305 1.00 0.00 C ATOM 1104 CD GLU A 81 2.788 -12.822 -6.467 1.00 0.00 C ATOM 1105 OE1 GLU A 81 1.847 -13.131 -7.178 1.00 0.00 O ATOM 1106 OE2 GLU A 81 3.927 -13.231 -6.625 1.00 0.00 O ATOM 0 H GLU A 81 -0.683 -9.336 -5.378 1.00 0.00 H new ATOM 0 HA GLU A 81 1.544 -10.203 -3.639 1.00 0.00 H new ATOM 0 HB2 GLU A 81 0.435 -11.478 -5.720 1.00 0.00 H new ATOM 0 HB3 GLU A 81 1.538 -10.493 -6.661 1.00 0.00 H new ATOM 0 HG2 GLU A 81 3.422 -11.285 -5.084 1.00 0.00 H new ATOM 0 HG3 GLU A 81 2.277 -12.423 -4.404 1.00 0.00 H new ATOM 1113 N ILE A 82 2.597 -7.793 -4.103 1.00 0.00 N ATOM 1114 CA ILE A 82 3.566 -6.696 -4.457 1.00 0.00 C ATOM 1115 C ILE A 82 4.991 -7.267 -4.404 1.00 0.00 C ATOM 1116 O ILE A 82 5.411 -7.757 -3.389 1.00 0.00 O ATOM 1117 CB ILE A 82 3.432 -5.559 -3.444 1.00 0.00 C ATOM 1118 CG1 ILE A 82 1.952 -5.359 -3.104 1.00 0.00 C ATOM 1119 CG2 ILE A 82 4.000 -4.275 -4.051 1.00 0.00 C ATOM 1120 CD1 ILE A 82 1.764 -4.019 -2.391 1.00 0.00 C ATOM 0 H ILE A 82 2.257 -7.781 -3.141 1.00 0.00 H new ATOM 0 HA ILE A 82 3.355 -6.314 -5.456 1.00 0.00 H new ATOM 0 HB ILE A 82 3.982 -5.804 -2.536 1.00 0.00 H new ATOM 0 HG12 ILE A 82 1.353 -5.385 -4.014 1.00 0.00 H new ATOM 0 HG13 ILE A 82 1.602 -6.172 -2.469 1.00 0.00 H new ATOM 0 HG21 ILE A 82 3.907 -3.461 -3.332 1.00 0.00 H new ATOM 0 HG22 ILE A 82 5.051 -4.423 -4.297 1.00 0.00 H new ATOM 0 HG23 ILE A 82 3.447 -4.025 -4.956 1.00 0.00 H new ATOM 0 HD11 ILE A 82 0.710 -3.880 -2.150 1.00 0.00 H new ATOM 0 HD12 ILE A 82 2.350 -4.010 -1.472 1.00 0.00 H new ATOM 0 HD13 ILE A 82 2.098 -3.211 -3.042 1.00 0.00 H new ATOM 1132 N LEU A 83 5.738 -7.234 -5.483 1.00 0.00 N ATOM 1133 CA LEU A 83 7.120 -7.831 -5.439 1.00 0.00 C ATOM 1134 C LEU A 83 8.151 -6.872 -4.832 1.00 0.00 C ATOM 1135 O LEU A 83 9.029 -7.289 -4.105 1.00 0.00 O ATOM 1136 CB LEU A 83 7.585 -8.176 -6.848 1.00 0.00 C ATOM 1137 CG LEU A 83 6.716 -9.294 -7.430 1.00 0.00 C ATOM 1138 CD1 LEU A 83 6.705 -10.486 -6.471 1.00 0.00 C ATOM 1139 CD2 LEU A 83 5.285 -8.788 -7.627 1.00 0.00 C ATOM 0 H LEU A 83 5.462 -6.829 -6.377 1.00 0.00 H new ATOM 0 HA LEU A 83 7.053 -8.721 -4.814 1.00 0.00 H new ATOM 0 HB2 LEU A 83 7.529 -7.293 -7.484 1.00 0.00 H new ATOM 0 HB3 LEU A 83 8.629 -8.489 -6.828 1.00 0.00 H new ATOM 0 HG LEU A 83 7.126 -9.602 -8.392 1.00 0.00 H new ATOM 0 HD11 LEU A 83 6.086 -11.281 -6.886 1.00 0.00 H new ATOM 0 HD12 LEU A 83 7.722 -10.852 -6.334 1.00 0.00 H new ATOM 0 HD13 LEU A 83 6.299 -10.175 -5.509 1.00 0.00 H new ATOM 0 HD21 LEU A 83 4.670 -9.587 -8.041 1.00 0.00 H new ATOM 0 HD22 LEU A 83 4.874 -8.475 -6.667 1.00 0.00 H new ATOM 0 HD23 LEU A 83 5.290 -7.941 -8.313 1.00 0.00 H new ATOM 1151 N GLN A 84 8.095 -5.610 -5.143 1.00 0.00 N ATOM 1152 CA GLN A 84 9.124 -4.689 -4.586 1.00 0.00 C ATOM 1153 C GLN A 84 8.498 -3.325 -4.282 1.00 0.00 C ATOM 1154 O GLN A 84 7.359 -3.057 -4.608 1.00 0.00 O ATOM 1155 CB GLN A 84 10.283 -4.560 -5.601 1.00 0.00 C ATOM 1156 CG GLN A 84 10.231 -3.223 -6.354 1.00 0.00 C ATOM 1157 CD GLN A 84 11.484 -3.079 -7.223 1.00 0.00 C ATOM 1158 OE1 GLN A 84 11.483 -3.453 -8.378 1.00 0.00 O ATOM 1159 NE2 GLN A 84 12.560 -2.548 -6.710 1.00 0.00 N ATOM 0 H GLN A 84 7.395 -5.180 -5.748 1.00 0.00 H new ATOM 0 HA GLN A 84 9.517 -5.089 -3.651 1.00 0.00 H new ATOM 0 HB2 GLN A 84 11.236 -4.647 -5.079 1.00 0.00 H new ATOM 0 HB3 GLN A 84 10.235 -5.382 -6.315 1.00 0.00 H new ATOM 0 HG2 GLN A 84 9.337 -3.178 -6.976 1.00 0.00 H new ATOM 0 HG3 GLN A 84 10.169 -2.397 -5.646 1.00 0.00 H new ATOM 0 HE21 GLN A 84 12.561 -2.234 -5.740 1.00 0.00 H new ATOM 0 HE22 GLN A 84 13.400 -2.447 -7.279 1.00 0.00 H new ATOM 1168 N LEU A 85 9.251 -2.466 -3.663 1.00 0.00 N ATOM 1169 CA LEU A 85 8.738 -1.112 -3.328 1.00 0.00 C ATOM 1170 C LEU A 85 9.632 -0.078 -4.009 1.00 0.00 C ATOM 1171 O LEU A 85 10.693 -0.394 -4.509 1.00 0.00 O ATOM 1172 CB LEU A 85 8.795 -0.914 -1.811 1.00 0.00 C ATOM 1173 CG LEU A 85 8.007 0.325 -1.399 1.00 0.00 C ATOM 1174 CD1 LEU A 85 7.190 0.003 -0.150 1.00 0.00 C ATOM 1175 CD2 LEU A 85 8.991 1.456 -1.084 1.00 0.00 C ATOM 0 H LEU A 85 10.212 -2.645 -3.371 1.00 0.00 H new ATOM 0 HA LEU A 85 7.708 -1.001 -3.668 1.00 0.00 H new ATOM 0 HB2 LEU A 85 8.389 -1.792 -1.309 1.00 0.00 H new ATOM 0 HB3 LEU A 85 9.832 -0.814 -1.491 1.00 0.00 H new ATOM 0 HG LEU A 85 7.340 0.630 -2.205 1.00 0.00 H new ATOM 0 HD11 LEU A 85 6.623 0.884 0.151 1.00 0.00 H new ATOM 0 HD12 LEU A 85 6.502 -0.814 -0.366 1.00 0.00 H new ATOM 0 HD13 LEU A 85 7.860 -0.291 0.658 1.00 0.00 H new ATOM 0 HD21 LEU A 85 8.438 2.347 -0.788 1.00 0.00 H new ATOM 0 HD22 LEU A 85 9.649 1.150 -0.270 1.00 0.00 H new ATOM 0 HD23 LEU A 85 9.588 1.676 -1.969 1.00 0.00 H new ATOM 1187 N GLY A 86 9.221 1.154 -4.028 1.00 0.00 N ATOM 1188 CA GLY A 86 10.058 2.204 -4.667 1.00 0.00 C ATOM 1189 C GLY A 86 11.511 2.033 -4.221 1.00 0.00 C ATOM 1190 O GLY A 86 12.429 2.449 -4.899 1.00 0.00 O ATOM 0 H GLY A 86 8.341 1.482 -3.629 1.00 0.00 H new ATOM 0 HA2 GLY A 86 9.988 2.131 -5.752 1.00 0.00 H new ATOM 0 HA3 GLY A 86 9.695 3.194 -4.390 1.00 0.00 H new ATOM 1194 N GLY A 87 11.732 1.423 -3.085 1.00 0.00 N ATOM 1195 CA GLY A 87 13.145 1.237 -2.611 1.00 0.00 C ATOM 1196 C GLY A 87 13.265 -0.061 -1.803 1.00 0.00 C ATOM 1197 O GLY A 87 13.880 -0.090 -0.756 1.00 0.00 O ATOM 0 H GLY A 87 11.010 1.049 -2.470 1.00 0.00 H new ATOM 0 HA2 GLY A 87 13.822 1.207 -3.465 1.00 0.00 H new ATOM 0 HA3 GLY A 87 13.445 2.086 -1.996 1.00 0.00 H new ATOM 1201 N THR A 88 12.707 -1.141 -2.286 1.00 0.00 N ATOM 1202 CA THR A 88 12.824 -2.427 -1.548 1.00 0.00 C ATOM 1203 C THR A 88 12.324 -3.564 -2.443 1.00 0.00 C ATOM 1204 O THR A 88 11.326 -3.455 -3.114 1.00 0.00 O ATOM 1205 CB THR A 88 12.000 -2.393 -0.234 1.00 0.00 C ATOM 1206 OG1 THR A 88 12.542 -3.348 0.667 1.00 0.00 O ATOM 1207 CG2 THR A 88 10.533 -2.745 -0.506 1.00 0.00 C ATOM 0 H THR A 88 12.178 -1.185 -3.157 1.00 0.00 H new ATOM 0 HA THR A 88 13.870 -2.588 -1.287 1.00 0.00 H new ATOM 0 HB THR A 88 12.048 -1.390 0.190 1.00 0.00 H new ATOM 0 HG1 THR A 88 11.824 -3.922 1.007 1.00 0.00 H new ATOM 0 HG21 THR A 88 9.972 -2.715 0.428 1.00 0.00 H new ATOM 0 HG22 THR A 88 10.110 -2.025 -1.206 1.00 0.00 H new ATOM 0 HG23 THR A 88 10.472 -3.746 -0.934 1.00 0.00 H new ATOM 1215 N ALA A 89 13.004 -4.657 -2.455 1.00 0.00 N ATOM 1216 CA ALA A 89 12.543 -5.795 -3.279 1.00 0.00 C ATOM 1217 C ALA A 89 12.682 -7.061 -2.442 1.00 0.00 C ATOM 1218 O ALA A 89 13.705 -7.304 -1.835 1.00 0.00 O ATOM 1219 CB ALA A 89 13.372 -5.883 -4.546 1.00 0.00 C ATOM 0 H ALA A 89 13.863 -4.817 -1.929 1.00 0.00 H new ATOM 0 HA ALA A 89 11.502 -5.664 -3.576 1.00 0.00 H new ATOM 0 HB1 ALA A 89 13.027 -6.723 -5.149 1.00 0.00 H new ATOM 0 HB2 ALA A 89 13.265 -4.960 -5.116 1.00 0.00 H new ATOM 0 HB3 ALA A 89 14.420 -6.029 -4.285 1.00 0.00 H new ATOM 1225 N MET A 90 11.650 -7.847 -2.364 1.00 0.00 N ATOM 1226 CA MET A 90 11.736 -9.075 -1.507 1.00 0.00 C ATOM 1227 C MET A 90 12.302 -10.274 -2.272 1.00 0.00 C ATOM 1228 O MET A 90 13.146 -10.972 -1.752 1.00 0.00 O ATOM 1229 CB MET A 90 10.363 -9.441 -0.935 1.00 0.00 C ATOM 1230 CG MET A 90 10.546 -10.098 0.431 1.00 0.00 C ATOM 1231 SD MET A 90 8.922 -10.419 1.158 1.00 0.00 S ATOM 1232 CE MET A 90 8.483 -8.702 1.521 1.00 0.00 C ATOM 0 H MET A 90 10.762 -7.704 -2.844 1.00 0.00 H new ATOM 0 HA MET A 90 12.419 -8.837 -0.691 1.00 0.00 H new ATOM 0 HB2 MET A 90 9.745 -8.548 -0.842 1.00 0.00 H new ATOM 0 HB3 MET A 90 9.843 -10.120 -1.611 1.00 0.00 H new ATOM 0 HG2 MET A 90 11.102 -11.030 0.328 1.00 0.00 H new ATOM 0 HG3 MET A 90 11.129 -9.449 1.085 1.00 0.00 H new ATOM 0 HE1 MET A 90 7.417 -8.554 1.347 1.00 0.00 H new ATOM 0 HE2 MET A 90 8.715 -8.480 2.563 1.00 0.00 H new ATOM 0 HE3 MET A 90 9.052 -8.036 0.873 1.00 0.00 H new ATOM 1242 N GLN A 91 11.828 -10.570 -3.462 1.00 0.00 N ATOM 1243 CA GLN A 91 12.371 -11.797 -4.170 1.00 0.00 C ATOM 1244 C GLN A 91 13.875 -12.012 -3.894 1.00 0.00 C ATOM 1245 O GLN A 91 14.323 -13.140 -3.824 1.00 0.00 O ATOM 1246 CB GLN A 91 12.109 -11.748 -5.695 1.00 0.00 C ATOM 1247 CG GLN A 91 10.610 -11.909 -6.002 1.00 0.00 C ATOM 1248 CD GLN A 91 10.053 -10.562 -6.444 1.00 0.00 C ATOM 1249 OE1 GLN A 91 9.721 -9.734 -5.620 1.00 0.00 O ATOM 1250 NE2 GLN A 91 9.944 -10.306 -7.721 1.00 0.00 N ATOM 0 H GLN A 91 11.115 -10.043 -3.966 1.00 0.00 H new ATOM 0 HA GLN A 91 11.829 -12.648 -3.758 1.00 0.00 H new ATOM 0 HB2 GLN A 91 12.467 -10.801 -6.099 1.00 0.00 H new ATOM 0 HB3 GLN A 91 12.672 -12.539 -6.190 1.00 0.00 H new ATOM 0 HG2 GLN A 91 10.463 -12.654 -6.784 1.00 0.00 H new ATOM 0 HG3 GLN A 91 10.080 -12.265 -5.119 1.00 0.00 H new ATOM 0 HE21 GLN A 91 10.225 -11.006 -8.407 1.00 0.00 H new ATOM 0 HE22 GLN A 91 9.578 -9.406 -8.031 1.00 0.00 H new ATOM 1259 N GLY A 92 14.656 -10.986 -3.686 1.00 0.00 N ATOM 1260 CA GLY A 92 16.085 -11.213 -3.366 1.00 0.00 C ATOM 1261 C GLY A 92 16.285 -10.747 -1.933 1.00 0.00 C ATOM 1262 O GLY A 92 17.172 -9.973 -1.632 1.00 0.00 O ATOM 0 H GLY A 92 14.365 -10.009 -3.724 1.00 0.00 H new ATOM 0 HA2 GLY A 92 16.344 -12.267 -3.471 1.00 0.00 H new ATOM 0 HA3 GLY A 92 16.728 -10.657 -4.048 1.00 0.00 H new ATOM 1266 N LEU A 93 15.428 -11.187 -1.048 1.00 0.00 N ATOM 1267 CA LEU A 93 15.528 -10.740 0.356 1.00 0.00 C ATOM 1268 C LEU A 93 14.599 -11.596 1.220 1.00 0.00 C ATOM 1269 O LEU A 93 14.190 -12.673 0.834 1.00 0.00 O ATOM 1270 CB LEU A 93 15.099 -9.268 0.418 1.00 0.00 C ATOM 1271 CG LEU A 93 16.273 -8.417 0.907 1.00 0.00 C ATOM 1272 CD1 LEU A 93 16.195 -7.026 0.274 1.00 0.00 C ATOM 1273 CD2 LEU A 93 16.210 -8.285 2.430 1.00 0.00 C ATOM 0 H LEU A 93 14.666 -11.836 -1.245 1.00 0.00 H new ATOM 0 HA LEU A 93 16.548 -10.844 0.726 1.00 0.00 H new ATOM 0 HB2 LEU A 93 14.776 -8.930 -0.567 1.00 0.00 H new ATOM 0 HB3 LEU A 93 14.248 -9.154 1.089 1.00 0.00 H new ATOM 0 HG LEU A 93 17.210 -8.896 0.621 1.00 0.00 H new ATOM 0 HD11 LEU A 93 17.031 -6.420 0.623 1.00 0.00 H new ATOM 0 HD12 LEU A 93 16.240 -7.117 -0.811 1.00 0.00 H new ATOM 0 HD13 LEU A 93 15.258 -6.549 0.559 1.00 0.00 H new ATOM 0 HD21 LEU A 93 17.047 -7.679 2.778 1.00 0.00 H new ATOM 0 HD22 LEU A 93 15.273 -7.808 2.715 1.00 0.00 H new ATOM 0 HD23 LEU A 93 16.266 -9.275 2.884 1.00 0.00 H new ATOM 1285 N THR A 94 14.266 -11.124 2.382 1.00 0.00 N ATOM 1286 CA THR A 94 13.365 -11.897 3.281 1.00 0.00 C ATOM 1287 C THR A 94 12.161 -11.036 3.668 1.00 0.00 C ATOM 1288 O THR A 94 12.198 -9.824 3.591 1.00 0.00 O ATOM 1289 CB THR A 94 14.126 -12.304 4.544 1.00 0.00 C ATOM 1290 OG1 THR A 94 15.423 -11.725 4.521 1.00 0.00 O ATOM 1291 CG2 THR A 94 14.244 -13.827 4.601 1.00 0.00 C ATOM 0 H THR A 94 14.580 -10.228 2.754 1.00 0.00 H new ATOM 0 HA THR A 94 13.019 -12.790 2.761 1.00 0.00 H new ATOM 0 HB THR A 94 13.587 -11.951 5.424 1.00 0.00 H new ATOM 0 HG1 THR A 94 15.989 -12.164 5.190 1.00 0.00 H new ATOM 0 HG21 THR A 94 14.786 -14.116 5.501 1.00 0.00 H new ATOM 0 HG22 THR A 94 13.248 -14.269 4.620 1.00 0.00 H new ATOM 0 HG23 THR A 94 14.782 -14.183 3.723 1.00 0.00 H new ATOM 1299 N ARG A 95 11.090 -11.658 4.072 1.00 0.00 N ATOM 1300 CA ARG A 95 9.867 -10.881 4.454 1.00 0.00 C ATOM 1301 C ARG A 95 10.226 -9.694 5.352 1.00 0.00 C ATOM 1302 O ARG A 95 10.106 -8.551 4.957 1.00 0.00 O ATOM 1303 CB ARG A 95 8.869 -11.792 5.193 1.00 0.00 C ATOM 1304 CG ARG A 95 7.850 -10.944 5.948 1.00 0.00 C ATOM 1305 CD ARG A 95 6.767 -11.864 6.483 1.00 0.00 C ATOM 1306 NE ARG A 95 6.774 -11.837 7.973 1.00 0.00 N ATOM 1307 CZ ARG A 95 6.551 -12.933 8.645 1.00 0.00 C ATOM 1308 NH1 ARG A 95 7.048 -14.067 8.229 1.00 0.00 N ATOM 1309 NH2 ARG A 95 5.832 -12.896 9.732 1.00 0.00 N ATOM 0 H ARG A 95 11.003 -12.671 4.156 1.00 0.00 H new ATOM 0 HA ARG A 95 9.413 -10.503 3.538 1.00 0.00 H new ATOM 0 HB2 ARG A 95 8.359 -12.440 4.480 1.00 0.00 H new ATOM 0 HB3 ARG A 95 9.402 -12.440 5.889 1.00 0.00 H new ATOM 0 HG2 ARG A 95 8.333 -10.410 6.766 1.00 0.00 H new ATOM 0 HG3 ARG A 95 7.418 -10.192 5.288 1.00 0.00 H new ATOM 0 HD2 ARG A 95 5.793 -11.550 6.109 1.00 0.00 H new ATOM 0 HD3 ARG A 95 6.932 -12.881 6.128 1.00 0.00 H new ATOM 0 HE ARG A 95 6.953 -10.963 8.467 1.00 0.00 H new ATOM 0 HH11 ARG A 95 7.611 -14.096 7.379 1.00 0.00 H new ATOM 0 HH12 ARG A 95 6.874 -14.924 8.754 1.00 0.00 H new ATOM 0 HH21 ARG A 95 5.444 -12.010 10.057 1.00 0.00 H new ATOM 0 HH22 ARG A 95 5.658 -13.753 10.257 1.00 0.00 H new ATOM 1323 N PHE A 96 10.625 -9.948 6.563 1.00 0.00 N ATOM 1324 CA PHE A 96 10.939 -8.821 7.484 1.00 0.00 C ATOM 1325 C PHE A 96 12.031 -7.942 6.886 1.00 0.00 C ATOM 1326 O PHE A 96 11.913 -6.734 6.849 1.00 0.00 O ATOM 1327 CB PHE A 96 11.399 -9.369 8.836 1.00 0.00 C ATOM 1328 CG PHE A 96 10.355 -9.056 9.881 1.00 0.00 C ATOM 1329 CD1 PHE A 96 9.940 -7.734 10.081 1.00 0.00 C ATOM 1330 CD2 PHE A 96 9.800 -10.086 10.646 1.00 0.00 C ATOM 1331 CE1 PHE A 96 8.971 -7.442 11.048 1.00 0.00 C ATOM 1332 CE2 PHE A 96 8.831 -9.796 11.614 1.00 0.00 C ATOM 1333 CZ PHE A 96 8.417 -8.474 11.815 1.00 0.00 C ATOM 0 H PHE A 96 10.748 -10.881 6.956 1.00 0.00 H new ATOM 0 HA PHE A 96 10.040 -8.221 7.626 1.00 0.00 H new ATOM 0 HB2 PHE A 96 11.554 -10.446 8.771 1.00 0.00 H new ATOM 0 HB3 PHE A 96 12.355 -8.925 9.115 1.00 0.00 H new ATOM 0 HD1 PHE A 96 10.368 -6.939 9.489 1.00 0.00 H new ATOM 0 HD2 PHE A 96 10.119 -11.106 10.490 1.00 0.00 H new ATOM 0 HE1 PHE A 96 8.651 -6.422 11.202 1.00 0.00 H new ATOM 0 HE2 PHE A 96 8.403 -10.592 12.205 1.00 0.00 H new ATOM 0 HZ PHE A 96 7.670 -8.250 12.562 1.00 0.00 H new ATOM 1343 N GLU A 97 13.093 -8.527 6.420 1.00 0.00 N ATOM 1344 CA GLU A 97 14.177 -7.701 5.834 1.00 0.00 C ATOM 1345 C GLU A 97 13.592 -6.789 4.759 1.00 0.00 C ATOM 1346 O GLU A 97 13.952 -5.636 4.658 1.00 0.00 O ATOM 1347 CB GLU A 97 15.242 -8.606 5.217 1.00 0.00 C ATOM 1348 CG GLU A 97 15.655 -9.671 6.234 1.00 0.00 C ATOM 1349 CD GLU A 97 15.991 -8.999 7.567 1.00 0.00 C ATOM 1350 OE1 GLU A 97 16.781 -8.070 7.557 1.00 0.00 O ATOM 1351 OE2 GLU A 97 15.450 -9.424 8.574 1.00 0.00 O ATOM 0 H GLU A 97 13.257 -9.534 6.419 1.00 0.00 H new ATOM 0 HA GLU A 97 14.634 -7.096 6.617 1.00 0.00 H new ATOM 0 HB2 GLU A 97 14.854 -9.080 4.315 1.00 0.00 H new ATOM 0 HB3 GLU A 97 16.109 -8.016 4.920 1.00 0.00 H new ATOM 0 HG2 GLU A 97 14.848 -10.391 6.371 1.00 0.00 H new ATOM 0 HG3 GLU A 97 16.518 -10.225 5.866 1.00 0.00 H new ATOM 1358 N ALA A 98 12.696 -7.292 3.950 1.00 0.00 N ATOM 1359 CA ALA A 98 12.107 -6.442 2.876 1.00 0.00 C ATOM 1360 C ALA A 98 11.309 -5.288 3.479 1.00 0.00 C ATOM 1361 O ALA A 98 11.654 -4.133 3.326 1.00 0.00 O ATOM 1362 CB ALA A 98 11.184 -7.292 2.003 1.00 0.00 C ATOM 0 H ALA A 98 12.349 -8.250 3.987 1.00 0.00 H new ATOM 0 HA ALA A 98 12.917 -6.032 2.273 1.00 0.00 H new ATOM 0 HB1 ALA A 98 10.753 -6.671 1.217 1.00 0.00 H new ATOM 0 HB2 ALA A 98 11.755 -8.103 1.552 1.00 0.00 H new ATOM 0 HB3 ALA A 98 10.385 -7.708 2.616 1.00 0.00 H new ATOM 1368 N TRP A 99 10.238 -5.591 4.144 1.00 0.00 N ATOM 1369 CA TRP A 99 9.396 -4.504 4.743 1.00 0.00 C ATOM 1370 C TRP A 99 10.248 -3.587 5.642 1.00 0.00 C ATOM 1371 O TRP A 99 9.859 -2.475 5.938 1.00 0.00 O ATOM 1372 CB TRP A 99 8.270 -5.145 5.564 1.00 0.00 C ATOM 1373 CG TRP A 99 7.484 -4.101 6.286 1.00 0.00 C ATOM 1374 CD1 TRP A 99 7.052 -4.213 7.562 1.00 0.00 C ATOM 1375 CD2 TRP A 99 7.015 -2.809 5.806 1.00 0.00 C ATOM 1376 NE1 TRP A 99 6.345 -3.075 7.897 1.00 0.00 N ATOM 1377 CE2 TRP A 99 6.294 -2.180 6.849 1.00 0.00 C ATOM 1378 CE3 TRP A 99 7.141 -2.128 4.582 1.00 0.00 C ATOM 1379 CZ2 TRP A 99 5.719 -0.924 6.683 1.00 0.00 C ATOM 1380 CZ3 TRP A 99 6.563 -0.860 4.414 1.00 0.00 C ATOM 1381 CH2 TRP A 99 5.853 -0.260 5.463 1.00 0.00 C ATOM 0 H TRP A 99 9.901 -6.540 4.304 1.00 0.00 H new ATOM 0 HA TRP A 99 8.973 -3.895 3.944 1.00 0.00 H new ATOM 0 HB2 TRP A 99 7.612 -5.713 4.907 1.00 0.00 H new ATOM 0 HB3 TRP A 99 8.691 -5.850 6.280 1.00 0.00 H new ATOM 0 HD1 TRP A 99 7.231 -5.056 8.214 1.00 0.00 H new ATOM 0 HE1 TRP A 99 5.914 -2.916 8.808 1.00 0.00 H new ATOM 0 HE3 TRP A 99 7.685 -2.583 3.767 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 5.172 -0.466 7.494 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 6.666 -0.344 3.471 1.00 0.00 H new ATOM 0 HH2 TRP A 99 5.410 0.716 5.327 1.00 0.00 H new ATOM 1392 N ASN A 100 11.397 -4.034 6.086 1.00 0.00 N ATOM 1393 CA ASN A 100 12.240 -3.168 6.968 1.00 0.00 C ATOM 1394 C ASN A 100 13.035 -2.141 6.136 1.00 0.00 C ATOM 1395 O ASN A 100 13.055 -0.970 6.456 1.00 0.00 O ATOM 1396 CB ASN A 100 13.209 -4.043 7.769 1.00 0.00 C ATOM 1397 CG ASN A 100 12.428 -4.848 8.809 1.00 0.00 C ATOM 1398 OD1 ASN A 100 11.358 -4.450 9.226 1.00 0.00 O ATOM 1399 ND2 ASN A 100 12.922 -5.972 9.251 1.00 0.00 N ATOM 0 H ASN A 100 11.786 -4.954 5.878 1.00 0.00 H new ATOM 0 HA ASN A 100 11.584 -2.625 7.648 1.00 0.00 H new ATOM 0 HB2 ASN A 100 13.746 -4.716 7.100 1.00 0.00 H new ATOM 0 HB3 ASN A 100 13.956 -3.420 8.261 1.00 0.00 H new ATOM 0 HD21 ASN A 100 12.410 -6.516 9.946 1.00 0.00 H new ATOM 0 HD22 ASN A 100 13.820 -6.307 8.902 1.00 0.00 H new ATOM 1406 N ILE A 101 13.692 -2.556 5.078 1.00 0.00 N ATOM 1407 CA ILE A 101 14.474 -1.585 4.255 1.00 0.00 C ATOM 1408 C ILE A 101 13.610 -0.378 3.927 1.00 0.00 C ATOM 1409 O ILE A 101 14.074 0.745 3.886 1.00 0.00 O ATOM 1410 CB ILE A 101 14.861 -2.238 2.936 1.00 0.00 C ATOM 1411 CG1 ILE A 101 15.765 -3.432 3.182 1.00 0.00 C ATOM 1412 CG2 ILE A 101 15.557 -1.228 2.034 1.00 0.00 C ATOM 1413 CD1 ILE A 101 15.058 -4.658 2.620 1.00 0.00 C ATOM 0 H ILE A 101 13.719 -3.522 4.752 1.00 0.00 H new ATOM 0 HA ILE A 101 15.358 -1.284 4.816 1.00 0.00 H new ATOM 0 HB ILE A 101 13.954 -2.585 2.440 1.00 0.00 H new ATOM 0 HG12 ILE A 101 16.731 -3.289 2.697 1.00 0.00 H new ATOM 0 HG13 ILE A 101 15.958 -3.555 4.248 1.00 0.00 H new ATOM 0 HG21 ILE A 101 15.829 -1.707 1.093 1.00 0.00 H new ATOM 0 HG22 ILE A 101 14.884 -0.394 1.835 1.00 0.00 H new ATOM 0 HG23 ILE A 101 16.457 -0.859 2.527 1.00 0.00 H new ATOM 0 HD11 ILE A 101 15.678 -5.540 2.778 1.00 0.00 H new ATOM 0 HD12 ILE A 101 14.102 -4.791 3.127 1.00 0.00 H new ATOM 0 HD13 ILE A 101 14.887 -4.522 1.552 1.00 0.00 H new ATOM 1425 N ILE A 102 12.356 -0.602 3.669 1.00 0.00 N ATOM 1426 CA ILE A 102 11.458 0.528 3.316 1.00 0.00 C ATOM 1427 C ILE A 102 11.434 1.539 4.461 1.00 0.00 C ATOM 1428 O ILE A 102 11.842 2.675 4.316 1.00 0.00 O ATOM 1429 CB ILE A 102 10.064 -0.032 3.105 1.00 0.00 C ATOM 1430 CG1 ILE A 102 9.997 -0.763 1.794 1.00 0.00 C ATOM 1431 CG2 ILE A 102 9.016 1.078 3.139 1.00 0.00 C ATOM 1432 CD1 ILE A 102 9.949 -2.255 2.117 1.00 0.00 C ATOM 0 H ILE A 102 11.913 -1.520 3.687 1.00 0.00 H new ATOM 0 HA ILE A 102 11.810 1.026 2.413 1.00 0.00 H new ATOM 0 HB ILE A 102 9.850 -0.727 3.916 1.00 0.00 H new ATOM 0 HG12 ILE A 102 9.115 -0.462 1.229 1.00 0.00 H new ATOM 0 HG13 ILE A 102 10.865 -0.530 1.177 1.00 0.00 H new ATOM 0 HG21 ILE A 102 8.026 0.649 2.985 1.00 0.00 H new ATOM 0 HG22 ILE A 102 9.048 1.579 4.107 1.00 0.00 H new ATOM 0 HG23 ILE A 102 9.225 1.800 2.350 1.00 0.00 H new ATOM 0 HD11 ILE A 102 9.899 -2.827 1.190 1.00 0.00 H new ATOM 0 HD12 ILE A 102 10.845 -2.537 2.670 1.00 0.00 H new ATOM 0 HD13 ILE A 102 9.068 -2.468 2.722 1.00 0.00 H new ATOM 1444 N LYS A 103 10.950 1.129 5.596 1.00 0.00 N ATOM 1445 CA LYS A 103 10.881 2.056 6.767 1.00 0.00 C ATOM 1446 C LYS A 103 12.193 2.826 6.895 1.00 0.00 C ATOM 1447 O LYS A 103 12.240 3.920 7.422 1.00 0.00 O ATOM 1448 CB LYS A 103 10.655 1.248 8.046 1.00 0.00 C ATOM 1449 CG LYS A 103 9.317 0.518 7.963 1.00 0.00 C ATOM 1450 CD LYS A 103 8.909 0.035 9.356 1.00 0.00 C ATOM 1451 CE LYS A 103 9.355 -1.417 9.547 1.00 0.00 C ATOM 1452 NZ LYS A 103 9.745 -1.635 10.969 1.00 0.00 N ATOM 0 H LYS A 103 10.596 0.188 5.769 1.00 0.00 H new ATOM 0 HA LYS A 103 10.058 2.755 6.618 1.00 0.00 H new ATOM 0 HB2 LYS A 103 11.464 0.530 8.182 1.00 0.00 H new ATOM 0 HB3 LYS A 103 10.666 1.909 8.912 1.00 0.00 H new ATOM 0 HG2 LYS A 103 8.553 1.182 7.559 1.00 0.00 H new ATOM 0 HG3 LYS A 103 9.395 -0.329 7.282 1.00 0.00 H new ATOM 0 HD2 LYS A 103 9.362 0.668 10.119 1.00 0.00 H new ATOM 0 HD3 LYS A 103 7.829 0.113 9.477 1.00 0.00 H new ATOM 0 HE2 LYS A 103 8.547 -2.096 9.272 1.00 0.00 H new ATOM 0 HE3 LYS A 103 10.196 -1.640 8.890 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 10.048 -2.621 11.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 10.528 -0.997 11.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 8.931 -1.439 11.586 1.00 0.00 H new ATOM 1466 N ALA A 104 13.257 2.246 6.436 1.00 0.00 N ATOM 1467 CA ALA A 104 14.588 2.912 6.540 1.00 0.00 C ATOM 1468 C ALA A 104 14.775 3.936 5.415 1.00 0.00 C ATOM 1469 O ALA A 104 15.805 4.572 5.316 1.00 0.00 O ATOM 1470 CB ALA A 104 15.685 1.855 6.433 1.00 0.00 C ATOM 0 H ALA A 104 13.268 1.330 5.988 1.00 0.00 H new ATOM 0 HA ALA A 104 14.645 3.428 7.498 1.00 0.00 H new ATOM 0 HB1 ALA A 104 16.661 2.335 6.508 1.00 0.00 H new ATOM 0 HB2 ALA A 104 15.573 1.131 7.240 1.00 0.00 H new ATOM 0 HB3 ALA A 104 15.605 1.343 5.474 1.00 0.00 H new ATOM 1476 N LEU A 105 13.803 4.098 4.564 1.00 0.00 N ATOM 1477 CA LEU A 105 13.956 5.079 3.449 1.00 0.00 C ATOM 1478 C LEU A 105 13.388 6.442 3.875 1.00 0.00 C ATOM 1479 O LEU A 105 12.846 6.571 4.954 1.00 0.00 O ATOM 1480 CB LEU A 105 13.190 4.547 2.236 1.00 0.00 C ATOM 1481 CG LEU A 105 14.166 3.856 1.283 1.00 0.00 C ATOM 1482 CD1 LEU A 105 13.641 2.460 0.942 1.00 0.00 C ATOM 1483 CD2 LEU A 105 14.303 4.678 -0.002 1.00 0.00 C ATOM 0 H LEU A 105 12.914 3.599 4.589 1.00 0.00 H new ATOM 0 HA LEU A 105 15.009 5.207 3.199 1.00 0.00 H new ATOM 0 HB2 LEU A 105 12.420 3.846 2.557 1.00 0.00 H new ATOM 0 HB3 LEU A 105 12.683 5.365 1.725 1.00 0.00 H new ATOM 0 HG LEU A 105 15.141 3.773 1.763 1.00 0.00 H new ATOM 0 HD11 LEU A 105 14.336 1.966 0.263 1.00 0.00 H new ATOM 0 HD12 LEU A 105 13.548 1.873 1.856 1.00 0.00 H new ATOM 0 HD13 LEU A 105 12.665 2.545 0.464 1.00 0.00 H new ATOM 0 HD21 LEU A 105 14.999 4.182 -0.678 1.00 0.00 H new ATOM 0 HD22 LEU A 105 13.329 4.765 -0.484 1.00 0.00 H new ATOM 0 HD23 LEU A 105 14.678 5.672 0.240 1.00 0.00 H new ATOM 1495 N PRO A 106 13.526 7.420 3.008 1.00 0.00 N ATOM 1496 CA PRO A 106 13.031 8.784 3.266 1.00 0.00 C ATOM 1497 C PRO A 106 11.527 8.886 2.978 1.00 0.00 C ATOM 1498 O PRO A 106 10.888 7.924 2.599 1.00 0.00 O ATOM 1499 CB PRO A 106 13.837 9.648 2.295 1.00 0.00 C ATOM 1500 CG PRO A 106 14.319 8.707 1.164 1.00 0.00 C ATOM 1501 CD PRO A 106 14.208 7.268 1.704 1.00 0.00 C ATOM 0 HA PRO A 106 13.153 9.090 4.305 1.00 0.00 H new ATOM 0 HB2 PRO A 106 13.224 10.455 1.893 1.00 0.00 H new ATOM 0 HB3 PRO A 106 14.684 10.112 2.800 1.00 0.00 H new ATOM 0 HG2 PRO A 106 13.708 8.833 0.270 1.00 0.00 H new ATOM 0 HG3 PRO A 106 15.347 8.936 0.882 1.00 0.00 H new ATOM 0 HD2 PRO A 106 13.637 6.632 1.028 1.00 0.00 H new ATOM 0 HD3 PRO A 106 15.190 6.809 1.819 1.00 0.00 H new ATOM 1509 N ASP A 107 10.959 10.049 3.162 1.00 0.00 N ATOM 1510 CA ASP A 107 9.502 10.230 2.912 1.00 0.00 C ATOM 1511 C ASP A 107 9.284 10.796 1.508 1.00 0.00 C ATOM 1512 O ASP A 107 9.309 11.994 1.299 1.00 0.00 O ATOM 1513 CB ASP A 107 8.925 11.205 3.943 1.00 0.00 C ATOM 1514 CG ASP A 107 9.686 11.071 5.264 1.00 0.00 C ATOM 1515 OD1 ASP A 107 9.933 9.948 5.671 1.00 0.00 O ATOM 1516 OD2 ASP A 107 10.008 12.094 5.845 1.00 0.00 O ATOM 0 H ASP A 107 11.448 10.887 3.477 1.00 0.00 H new ATOM 0 HA ASP A 107 9.002 9.265 2.996 1.00 0.00 H new ATOM 0 HB2 ASP A 107 8.999 12.227 3.572 1.00 0.00 H new ATOM 0 HB3 ASP A 107 7.866 10.999 4.100 1.00 0.00 H new ATOM 1521 N GLY A 108 9.066 9.946 0.546 1.00 0.00 N ATOM 1522 CA GLY A 108 8.839 10.437 -0.849 1.00 0.00 C ATOM 1523 C GLY A 108 7.835 9.523 -1.560 1.00 0.00 C ATOM 1524 O GLY A 108 7.051 8.850 -0.921 1.00 0.00 O ATOM 0 H GLY A 108 9.034 8.933 0.660 1.00 0.00 H new ATOM 0 HA2 GLY A 108 8.463 11.460 -0.828 1.00 0.00 H new ATOM 0 HA3 GLY A 108 9.781 10.454 -1.397 1.00 0.00 H new ATOM 1528 N PRO A 109 7.893 9.530 -2.868 1.00 0.00 N ATOM 1529 CA PRO A 109 7.002 8.710 -3.712 1.00 0.00 C ATOM 1530 C PRO A 109 7.469 7.255 -3.725 1.00 0.00 C ATOM 1531 O PRO A 109 8.364 6.882 -4.458 1.00 0.00 O ATOM 1532 CB PRO A 109 7.142 9.342 -5.100 1.00 0.00 C ATOM 1533 CG PRO A 109 8.493 10.095 -5.103 1.00 0.00 C ATOM 1534 CD PRO A 109 8.856 10.353 -3.629 1.00 0.00 C ATOM 0 HA PRO A 109 5.971 8.693 -3.359 1.00 0.00 H new ATOM 0 HB2 PRO A 109 7.121 8.579 -5.878 1.00 0.00 H new ATOM 0 HB3 PRO A 109 6.316 10.025 -5.301 1.00 0.00 H new ATOM 0 HG2 PRO A 109 9.265 9.503 -5.594 1.00 0.00 H new ATOM 0 HG3 PRO A 109 8.413 11.033 -5.652 1.00 0.00 H new ATOM 0 HD2 PRO A 109 9.884 10.062 -3.415 1.00 0.00 H new ATOM 0 HD3 PRO A 109 8.765 11.409 -3.375 1.00 0.00 H new ATOM 1542 N VAL A 110 6.855 6.430 -2.927 1.00 0.00 N ATOM 1543 CA VAL A 110 7.234 4.997 -2.891 1.00 0.00 C ATOM 1544 C VAL A 110 6.408 4.273 -3.936 1.00 0.00 C ATOM 1545 O VAL A 110 5.211 4.134 -3.805 1.00 0.00 O ATOM 1546 CB VAL A 110 6.942 4.427 -1.503 1.00 0.00 C ATOM 1547 CG1 VAL A 110 5.713 5.096 -0.921 1.00 0.00 C ATOM 1548 CG2 VAL A 110 6.668 2.920 -1.577 1.00 0.00 C ATOM 0 H VAL A 110 6.100 6.692 -2.293 1.00 0.00 H new ATOM 0 HA VAL A 110 8.297 4.873 -3.099 1.00 0.00 H new ATOM 0 HB VAL A 110 7.815 4.611 -0.877 1.00 0.00 H new ATOM 0 HG11 VAL A 110 5.510 4.686 0.068 1.00 0.00 H new ATOM 0 HG12 VAL A 110 5.887 6.169 -0.840 1.00 0.00 H new ATOM 0 HG13 VAL A 110 4.858 4.915 -1.572 1.00 0.00 H new ATOM 0 HG21 VAL A 110 6.463 2.538 -0.577 1.00 0.00 H new ATOM 0 HG22 VAL A 110 5.806 2.738 -2.219 1.00 0.00 H new ATOM 0 HG23 VAL A 110 7.540 2.411 -1.988 1.00 0.00 H new ATOM 1558 N THR A 111 7.034 3.828 -4.974 1.00 0.00 N ATOM 1559 CA THR A 111 6.273 3.136 -6.045 1.00 0.00 C ATOM 1560 C THR A 111 6.159 1.641 -5.739 1.00 0.00 C ATOM 1561 O THR A 111 7.127 0.969 -5.445 1.00 0.00 O ATOM 1562 CB THR A 111 6.983 3.328 -7.386 1.00 0.00 C ATOM 1563 OG1 THR A 111 7.612 4.601 -7.407 1.00 0.00 O ATOM 1564 CG2 THR A 111 5.960 3.242 -8.520 1.00 0.00 C ATOM 0 H THR A 111 8.038 3.910 -5.133 1.00 0.00 H new ATOM 0 HA THR A 111 5.272 3.564 -6.094 1.00 0.00 H new ATOM 0 HB THR A 111 7.735 2.550 -7.517 1.00 0.00 H new ATOM 0 HG1 THR A 111 8.069 4.726 -8.265 1.00 0.00 H new ATOM 0 HG21 THR A 111 6.465 3.379 -9.476 1.00 0.00 H new ATOM 0 HG22 THR A 111 5.477 2.265 -8.501 1.00 0.00 H new ATOM 0 HG23 THR A 111 5.208 4.021 -8.392 1.00 0.00 H new ATOM 1572 N ILE A 112 4.963 1.134 -5.809 1.00 0.00 N ATOM 1573 CA ILE A 112 4.708 -0.301 -5.533 1.00 0.00 C ATOM 1574 C ILE A 112 4.244 -0.994 -6.813 1.00 0.00 C ATOM 1575 O ILE A 112 3.729 -0.367 -7.717 1.00 0.00 O ATOM 1576 CB ILE A 112 3.602 -0.412 -4.482 1.00 0.00 C ATOM 1577 CG1 ILE A 112 2.683 0.809 -4.563 1.00 0.00 C ATOM 1578 CG2 ILE A 112 4.215 -0.504 -3.083 1.00 0.00 C ATOM 1579 CD1 ILE A 112 1.586 0.688 -3.512 1.00 0.00 C ATOM 0 H ILE A 112 4.130 1.671 -6.053 1.00 0.00 H new ATOM 0 HA ILE A 112 5.622 -0.773 -5.173 1.00 0.00 H new ATOM 0 HB ILE A 112 3.020 -1.313 -4.676 1.00 0.00 H new ATOM 0 HG12 ILE A 112 3.257 1.721 -4.402 1.00 0.00 H new ATOM 0 HG13 ILE A 112 2.243 0.881 -5.557 1.00 0.00 H new ATOM 0 HG21 ILE A 112 3.420 -0.583 -2.342 1.00 0.00 H new ATOM 0 HG22 ILE A 112 4.855 -1.384 -3.023 1.00 0.00 H new ATOM 0 HG23 ILE A 112 4.808 0.389 -2.886 1.00 0.00 H new ATOM 0 HD11 ILE A 112 0.931 1.557 -3.568 1.00 0.00 H new ATOM 0 HD12 ILE A 112 1.006 -0.217 -3.694 1.00 0.00 H new ATOM 0 HD13 ILE A 112 2.036 0.637 -2.521 1.00 0.00 H new ATOM 1591 N VAL A 113 4.391 -2.290 -6.892 1.00 0.00 N ATOM 1592 CA VAL A 113 3.925 -3.011 -8.104 1.00 0.00 C ATOM 1593 C VAL A 113 3.064 -4.177 -7.640 1.00 0.00 C ATOM 1594 O VAL A 113 3.563 -5.188 -7.190 1.00 0.00 O ATOM 1595 CB VAL A 113 5.109 -3.553 -8.908 1.00 0.00 C ATOM 1596 CG1 VAL A 113 4.838 -3.364 -10.404 1.00 0.00 C ATOM 1597 CG2 VAL A 113 6.392 -2.807 -8.528 1.00 0.00 C ATOM 0 H VAL A 113 4.812 -2.875 -6.171 1.00 0.00 H new ATOM 0 HA VAL A 113 3.365 -2.329 -8.744 1.00 0.00 H new ATOM 0 HB VAL A 113 5.233 -4.613 -8.685 1.00 0.00 H new ATOM 0 HG11 VAL A 113 5.681 -3.750 -10.978 1.00 0.00 H new ATOM 0 HG12 VAL A 113 3.933 -3.904 -10.681 1.00 0.00 H new ATOM 0 HG13 VAL A 113 4.708 -2.303 -10.619 1.00 0.00 H new ATOM 0 HG21 VAL A 113 7.227 -3.202 -9.107 1.00 0.00 H new ATOM 0 HG22 VAL A 113 6.272 -1.745 -8.742 1.00 0.00 H new ATOM 0 HG23 VAL A 113 6.591 -2.943 -7.465 1.00 0.00 H new ATOM 1607 N ILE A 114 1.779 -4.037 -7.721 1.00 0.00 N ATOM 1608 CA ILE A 114 0.893 -5.134 -7.254 1.00 0.00 C ATOM 1609 C ILE A 114 0.242 -5.829 -8.448 1.00 0.00 C ATOM 1610 O ILE A 114 -0.294 -5.197 -9.337 1.00 0.00 O ATOM 1611 CB ILE A 114 -0.187 -4.560 -6.329 1.00 0.00 C ATOM 1612 CG1 ILE A 114 -1.250 -3.830 -7.154 1.00 0.00 C ATOM 1613 CG2 ILE A 114 0.457 -3.574 -5.353 1.00 0.00 C ATOM 1614 CD1 ILE A 114 -2.342 -4.818 -7.562 1.00 0.00 C ATOM 0 H ILE A 114 1.301 -3.214 -8.089 1.00 0.00 H new ATOM 0 HA ILE A 114 1.487 -5.865 -6.706 1.00 0.00 H new ATOM 0 HB ILE A 114 -0.657 -5.375 -5.779 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -1.681 -3.014 -6.573 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -0.797 -3.385 -8.040 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -0.307 -3.163 -4.693 1.00 0.00 H new ATOM 0 HG22 ILE A 114 1.210 -4.090 -4.758 1.00 0.00 H new ATOM 0 HG23 ILE A 114 0.928 -2.765 -5.911 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -3.100 -4.300 -8.150 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -1.904 -5.618 -8.159 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -2.802 -5.241 -6.669 1.00 0.00 H new ATOM 1626 N ARG A 115 0.271 -7.133 -8.459 1.00 0.00 N ATOM 1627 CA ARG A 115 -0.361 -7.890 -9.577 1.00 0.00 C ATOM 1628 C ARG A 115 -1.337 -8.894 -8.966 1.00 0.00 C ATOM 1629 O ARG A 115 -0.940 -9.835 -8.308 1.00 0.00 O ATOM 1630 CB ARG A 115 0.707 -8.636 -10.395 1.00 0.00 C ATOM 1631 CG ARG A 115 0.041 -9.740 -11.227 1.00 0.00 C ATOM 1632 CD ARG A 115 0.871 -10.007 -12.484 1.00 0.00 C ATOM 1633 NE ARG A 115 2.143 -10.682 -12.105 1.00 0.00 N ATOM 1634 CZ ARG A 115 3.175 -9.969 -11.749 1.00 0.00 C ATOM 1635 NH1 ARG A 115 3.456 -8.867 -12.386 1.00 0.00 N ATOM 1636 NH2 ARG A 115 3.930 -10.362 -10.758 1.00 0.00 N ATOM 0 H ARG A 115 0.707 -7.709 -7.739 1.00 0.00 H new ATOM 0 HA ARG A 115 -0.880 -7.203 -10.246 1.00 0.00 H new ATOM 0 HB2 ARG A 115 1.230 -7.939 -11.050 1.00 0.00 H new ATOM 0 HB3 ARG A 115 1.453 -9.069 -9.729 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -0.046 -10.652 -10.636 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -0.970 -9.441 -11.503 1.00 0.00 H new ATOM 0 HD2 ARG A 115 0.309 -10.631 -13.178 1.00 0.00 H new ATOM 0 HD3 ARG A 115 1.083 -9.070 -12.998 1.00 0.00 H new ATOM 0 HE ARG A 115 2.207 -11.700 -12.124 1.00 0.00 H new ATOM 0 HH11 ARG A 115 2.869 -8.563 -13.162 1.00 0.00 H new ATOM 0 HH12 ARG A 115 4.263 -8.309 -12.108 1.00 0.00 H new ATOM 0 HH21 ARG A 115 3.712 -11.227 -10.263 1.00 0.00 H new ATOM 0 HH22 ARG A 115 4.737 -9.804 -10.480 1.00 0.00 H new ATOM 1650 N ARG A 116 -2.607 -8.700 -9.165 1.00 0.00 N ATOM 1651 CA ARG A 116 -3.593 -9.647 -8.577 1.00 0.00 C ATOM 1652 C ARG A 116 -4.088 -10.605 -9.664 1.00 0.00 C ATOM 1653 O ARG A 116 -4.380 -10.202 -10.771 1.00 0.00 O ATOM 1654 CB ARG A 116 -4.779 -8.863 -8.011 1.00 0.00 C ATOM 1655 CG ARG A 116 -5.029 -9.290 -6.562 1.00 0.00 C ATOM 1656 CD ARG A 116 -6.162 -10.318 -6.519 1.00 0.00 C ATOM 1657 NE ARG A 116 -6.363 -10.777 -5.114 1.00 0.00 N ATOM 1658 CZ ARG A 116 -7.473 -11.373 -4.774 1.00 0.00 C ATOM 1659 NH1 ARG A 116 -8.614 -10.753 -4.905 1.00 0.00 N ATOM 1660 NH2 ARG A 116 -7.441 -12.589 -4.300 1.00 0.00 N ATOM 0 H ARG A 116 -3.005 -7.932 -9.706 1.00 0.00 H new ATOM 0 HA ARG A 116 -3.119 -10.216 -7.777 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -4.576 -7.793 -8.056 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -5.669 -9.044 -8.613 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -4.121 -9.716 -6.136 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -5.288 -8.422 -5.956 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -7.082 -9.878 -6.904 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -5.922 -11.167 -7.159 1.00 0.00 H new ATOM 0 HE ARG A 116 -5.632 -10.625 -4.419 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -8.638 -9.802 -5.273 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -9.481 -11.219 -4.639 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -6.549 -13.072 -4.196 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -8.308 -13.056 -4.034 1.00 0.00 H new ATOM 1674 N LYS A 117 -4.186 -11.870 -9.361 1.00 0.00 N ATOM 1675 CA LYS A 117 -4.663 -12.844 -10.384 1.00 0.00 C ATOM 1676 C LYS A 117 -6.096 -13.268 -10.057 1.00 0.00 C ATOM 1677 O LYS A 117 -6.321 -14.193 -9.302 1.00 0.00 O ATOM 1678 CB LYS A 117 -3.755 -14.073 -10.384 1.00 0.00 C ATOM 1679 CG LYS A 117 -2.410 -13.713 -11.017 1.00 0.00 C ATOM 1680 CD LYS A 117 -1.335 -13.648 -9.931 1.00 0.00 C ATOM 1681 CE LYS A 117 -0.245 -14.678 -10.229 1.00 0.00 C ATOM 1682 NZ LYS A 117 -0.862 -16.028 -10.372 1.00 0.00 N ATOM 0 H LYS A 117 -3.957 -12.271 -8.452 1.00 0.00 H new ATOM 0 HA LYS A 117 -4.638 -12.376 -11.368 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -3.606 -14.428 -9.364 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -4.224 -14.885 -10.939 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -2.139 -14.456 -11.768 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -2.483 -12.754 -11.529 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -0.904 -12.648 -9.891 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -1.778 -13.844 -8.954 1.00 0.00 H new ATOM 0 HE2 LYS A 117 0.284 -14.409 -11.144 1.00 0.00 H new ATOM 0 HE3 LYS A 117 0.492 -14.686 -9.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -0.221 -16.746 -9.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -1.767 -16.052 -9.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -1.029 -16.229 -11.379 1.00 0.00 H new ATOM 1696 N SER A 118 -7.066 -12.601 -10.620 1.00 0.00 N ATOM 1697 CA SER A 118 -8.482 -12.968 -10.341 1.00 0.00 C ATOM 1698 C SER A 118 -8.833 -14.254 -11.093 1.00 0.00 C ATOM 1699 O SER A 118 -7.967 -14.973 -11.552 1.00 0.00 O ATOM 1700 CB SER A 118 -9.402 -11.836 -10.803 1.00 0.00 C ATOM 1701 OG SER A 118 -9.543 -11.893 -12.217 1.00 0.00 O ATOM 0 H SER A 118 -6.939 -11.818 -11.261 1.00 0.00 H new ATOM 0 HA SER A 118 -8.613 -13.127 -9.271 1.00 0.00 H new ATOM 0 HB2 SER A 118 -10.377 -11.926 -10.325 1.00 0.00 H new ATOM 0 HB3 SER A 118 -8.989 -10.872 -10.506 1.00 0.00 H new ATOM 0 HG SER A 118 -10.133 -11.170 -12.516 1.00 0.00 H new ATOM 1707 N LEU A 119 -10.098 -14.552 -11.222 1.00 0.00 N ATOM 1708 CA LEU A 119 -10.506 -15.792 -11.941 1.00 0.00 C ATOM 1709 C LEU A 119 -9.752 -15.884 -13.270 1.00 0.00 C ATOM 1710 O LEU A 119 -9.560 -14.900 -13.956 1.00 0.00 O ATOM 1711 CB LEU A 119 -12.013 -15.759 -12.203 1.00 0.00 C ATOM 1712 CG LEU A 119 -12.758 -16.197 -10.941 1.00 0.00 C ATOM 1713 CD1 LEU A 119 -12.495 -15.192 -9.818 1.00 0.00 C ATOM 1714 CD2 LEU A 119 -14.260 -16.256 -11.228 1.00 0.00 C ATOM 0 H LEU A 119 -10.867 -13.989 -10.860 1.00 0.00 H new ATOM 0 HA LEU A 119 -10.266 -16.662 -11.330 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -12.321 -14.754 -12.490 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -12.263 -16.419 -13.034 1.00 0.00 H new ATOM 0 HG LEU A 119 -12.406 -17.183 -10.637 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -13.026 -15.504 -8.919 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -11.426 -15.149 -9.611 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -12.846 -14.206 -10.123 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -14.790 -16.568 -10.328 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -14.611 -15.270 -11.533 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -14.450 -16.972 -12.028 1.00 0.00 H new ATOM 1726 N GLN A 120 -9.321 -17.062 -13.637 1.00 0.00 N ATOM 1727 CA GLN A 120 -8.577 -17.216 -14.918 1.00 0.00 C ATOM 1728 C GLN A 120 -8.564 -18.685 -15.334 1.00 0.00 C ATOM 1729 O GLN A 120 -9.043 -19.052 -16.388 1.00 0.00 O ATOM 1730 CB GLN A 120 -7.139 -16.729 -14.731 1.00 0.00 C ATOM 1731 CG GLN A 120 -6.489 -16.515 -16.100 1.00 0.00 C ATOM 1732 CD GLN A 120 -5.029 -16.100 -15.912 1.00 0.00 C ATOM 1733 OE1 GLN A 120 -4.644 -15.659 -14.847 1.00 0.00 O ATOM 1734 NE2 GLN A 120 -4.193 -16.223 -16.905 1.00 0.00 N ATOM 0 H GLN A 120 -9.453 -17.922 -13.105 1.00 0.00 H new ATOM 0 HA GLN A 120 -9.067 -16.626 -15.693 1.00 0.00 H new ATOM 0 HB2 GLN A 120 -7.130 -15.799 -14.163 1.00 0.00 H new ATOM 0 HB3 GLN A 120 -6.569 -17.459 -14.156 1.00 0.00 H new ATOM 0 HG2 GLN A 120 -6.545 -17.431 -16.688 1.00 0.00 H new ATOM 0 HG3 GLN A 120 -7.028 -15.747 -16.654 1.00 0.00 H new ATOM 0 HE21 GLN A 120 -4.515 -16.593 -17.800 1.00 0.00 H new ATOM 0 HE22 GLN A 120 -3.217 -15.949 -16.787 1.00 0.00 H new ATOM 1743 N SER A 121 -8.015 -19.525 -14.510 1.00 0.00 N ATOM 1744 CA SER A 121 -7.961 -20.976 -14.845 1.00 0.00 C ATOM 1745 C SER A 121 -7.508 -21.142 -16.299 1.00 0.00 C ATOM 1746 O SER A 121 -8.312 -21.196 -17.207 1.00 0.00 O ATOM 1747 CB SER A 121 -9.347 -21.594 -14.668 1.00 0.00 C ATOM 1748 OG SER A 121 -10.214 -20.640 -14.068 1.00 0.00 O ATOM 0 H SER A 121 -7.598 -19.272 -13.614 1.00 0.00 H new ATOM 0 HA SER A 121 -7.256 -21.478 -14.182 1.00 0.00 H new ATOM 0 HB2 SER A 121 -9.744 -21.907 -15.634 1.00 0.00 H new ATOM 0 HB3 SER A 121 -9.283 -22.486 -14.045 1.00 0.00 H new ATOM 0 HG SER A 121 -11.105 -21.033 -13.955 1.00 0.00 H new ATOM 1754 N LYS A 122 -6.225 -21.219 -16.526 1.00 0.00 N ATOM 1755 CA LYS A 122 -5.724 -21.377 -17.920 1.00 0.00 C ATOM 1756 C LYS A 122 -5.767 -22.854 -18.318 1.00 0.00 C ATOM 1757 O LYS A 122 -4.781 -23.419 -18.749 1.00 0.00 O ATOM 1758 CB LYS A 122 -4.285 -20.865 -18.007 1.00 0.00 C ATOM 1759 CG LYS A 122 -3.395 -21.676 -17.062 1.00 0.00 C ATOM 1760 CD LYS A 122 -2.376 -20.748 -16.400 1.00 0.00 C ATOM 1761 CE LYS A 122 -1.007 -20.941 -17.055 1.00 0.00 C ATOM 1762 NZ LYS A 122 -0.042 -19.961 -16.480 1.00 0.00 N ATOM 0 H LYS A 122 -5.503 -21.179 -15.807 1.00 0.00 H new ATOM 0 HA LYS A 122 -6.355 -20.802 -18.598 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -3.919 -20.950 -19.030 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -4.247 -19.808 -17.742 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -4.004 -22.166 -16.302 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -2.881 -22.463 -17.615 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -2.695 -19.711 -16.499 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -2.314 -20.962 -15.333 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -0.652 -21.958 -16.889 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -1.084 -20.802 -18.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 0.890 -20.090 -16.924 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -0.380 -18.994 -16.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 0.039 -20.114 -15.455 1.00 0.00 H new ATOM 1776 N GLU A 123 -6.901 -23.485 -18.180 1.00 0.00 N ATOM 1777 CA GLU A 123 -7.005 -24.924 -18.555 1.00 0.00 C ATOM 1778 C GLU A 123 -7.291 -25.034 -20.055 1.00 0.00 C ATOM 1779 O GLU A 123 -6.827 -25.938 -20.721 1.00 0.00 O ATOM 1780 CB GLU A 123 -8.141 -25.579 -17.767 1.00 0.00 C ATOM 1781 CG GLU A 123 -8.123 -25.069 -16.324 1.00 0.00 C ATOM 1782 CD GLU A 123 -9.226 -25.761 -15.521 1.00 0.00 C ATOM 1783 OE1 GLU A 123 -10.052 -26.421 -16.132 1.00 0.00 O ATOM 1784 OE2 GLU A 123 -9.226 -25.622 -14.309 1.00 0.00 O ATOM 0 H GLU A 123 -7.760 -23.066 -17.824 1.00 0.00 H new ATOM 0 HA GLU A 123 -6.068 -25.431 -18.323 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -9.100 -25.350 -18.233 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -8.030 -26.663 -17.782 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -7.151 -25.265 -15.870 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -8.270 -23.989 -16.307 1.00 0.00 H new ATOM 1791 N THR A 124 -8.047 -24.114 -20.590 1.00 0.00 N ATOM 1792 CA THR A 124 -8.360 -24.156 -22.047 1.00 0.00 C ATOM 1793 C THR A 124 -9.428 -25.218 -22.322 1.00 0.00 C ATOM 1794 O THR A 124 -9.341 -25.964 -23.277 1.00 0.00 O ATOM 1795 CB THR A 124 -7.091 -24.494 -22.833 1.00 0.00 C ATOM 1796 OG1 THR A 124 -5.952 -24.086 -22.087 1.00 0.00 O ATOM 1797 CG2 THR A 124 -7.111 -23.766 -24.177 1.00 0.00 C ATOM 0 H THR A 124 -8.462 -23.334 -20.080 1.00 0.00 H new ATOM 0 HA THR A 124 -8.735 -23.182 -22.359 1.00 0.00 H new ATOM 0 HB THR A 124 -7.046 -25.569 -23.007 1.00 0.00 H new ATOM 0 HG1 THR A 124 -5.621 -24.841 -21.557 1.00 0.00 H new ATOM 0 HG21 THR A 124 -6.207 -24.008 -24.735 1.00 0.00 H new ATOM 0 HG22 THR A 124 -7.985 -24.080 -24.748 1.00 0.00 H new ATOM 0 HG23 THR A 124 -7.156 -22.690 -24.007 1.00 0.00 H new ATOM 1805 N THR A 125 -10.438 -25.291 -21.497 1.00 0.00 N ATOM 1806 CA THR A 125 -11.507 -26.304 -21.724 1.00 0.00 C ATOM 1807 C THR A 125 -11.900 -26.297 -23.203 1.00 0.00 C ATOM 1808 O THR A 125 -11.712 -27.266 -23.911 1.00 0.00 O ATOM 1809 CB THR A 125 -12.728 -25.959 -20.869 1.00 0.00 C ATOM 1810 OG1 THR A 125 -12.318 -25.743 -19.527 1.00 0.00 O ATOM 1811 CG2 THR A 125 -13.731 -27.114 -20.919 1.00 0.00 C ATOM 0 H THR A 125 -10.568 -24.695 -20.679 1.00 0.00 H new ATOM 0 HA THR A 125 -11.140 -27.292 -21.447 1.00 0.00 H new ATOM 0 HB THR A 125 -13.199 -25.055 -21.255 1.00 0.00 H new ATOM 0 HG1 THR A 125 -13.099 -25.520 -18.978 1.00 0.00 H new ATOM 0 HG21 THR A 125 -14.600 -26.867 -20.310 1.00 0.00 H new ATOM 0 HG22 THR A 125 -14.045 -27.279 -21.950 1.00 0.00 H new ATOM 0 HG23 THR A 125 -13.263 -28.020 -20.533 1.00 0.00 H new ATOM 1819 N ALA A 126 -12.439 -25.206 -23.674 1.00 0.00 N ATOM 1820 CA ALA A 126 -12.840 -25.131 -25.108 1.00 0.00 C ATOM 1821 C ALA A 126 -14.034 -26.057 -25.358 1.00 0.00 C ATOM 1822 O ALA A 126 -14.388 -26.334 -26.486 1.00 0.00 O ATOM 1823 CB ALA A 126 -11.665 -25.564 -25.987 1.00 0.00 C ATOM 0 H ALA A 126 -12.619 -24.363 -23.128 1.00 0.00 H new ATOM 0 HA ALA A 126 -13.121 -24.107 -25.353 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -11.956 -25.510 -27.036 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -10.816 -24.903 -25.811 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -11.384 -26.588 -25.741 1.00 0.00 H new ATOM 1829 N ALA A 127 -14.656 -26.538 -24.315 1.00 0.00 N ATOM 1830 CA ALA A 127 -15.825 -27.445 -24.500 1.00 0.00 C ATOM 1831 C ALA A 127 -17.119 -26.672 -24.236 1.00 0.00 C ATOM 1832 O ALA A 127 -17.118 -25.638 -23.596 1.00 0.00 O ATOM 1833 CB ALA A 127 -15.723 -28.614 -23.517 1.00 0.00 C ATOM 0 H ALA A 127 -14.406 -26.343 -23.346 1.00 0.00 H new ATOM 0 HA ALA A 127 -15.830 -27.826 -25.521 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -16.577 -29.278 -23.651 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -14.802 -29.166 -23.703 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -15.718 -28.232 -22.496 1.00 0.00 H new ATOM 1839 N GLY A 128 -18.227 -27.164 -24.722 1.00 0.00 N ATOM 1840 CA GLY A 128 -19.519 -26.455 -24.497 1.00 0.00 C ATOM 1841 C GLY A 128 -19.373 -24.990 -24.909 1.00 0.00 C ATOM 1842 O GLY A 128 -18.916 -24.164 -24.146 1.00 0.00 O ATOM 0 H GLY A 128 -18.293 -28.025 -25.264 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -20.312 -26.929 -25.075 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -19.805 -26.522 -23.447 1.00 0.00 H new ATOM 1846 N ASP A 129 -19.761 -24.660 -26.111 1.00 0.00 N ATOM 1847 CA ASP A 129 -19.642 -23.246 -26.567 1.00 0.00 C ATOM 1848 C ASP A 129 -20.849 -22.449 -26.070 1.00 0.00 C ATOM 1849 O ASP A 129 -21.960 -22.940 -26.037 1.00 0.00 O ATOM 1850 CB ASP A 129 -19.594 -23.206 -28.097 1.00 0.00 C ATOM 1851 CG ASP A 129 -18.141 -23.078 -28.560 1.00 0.00 C ATOM 1852 OD1 ASP A 129 -17.259 -23.256 -27.735 1.00 0.00 O ATOM 1853 OD2 ASP A 129 -17.934 -22.804 -29.730 1.00 0.00 O ATOM 0 H ASP A 129 -20.154 -25.306 -26.795 1.00 0.00 H new ATOM 0 HA ASP A 129 -18.728 -22.808 -26.165 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -20.039 -24.111 -28.509 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -20.180 -22.365 -28.468 1.00 0.00 H new ATOM 1858 N SER A 130 -20.641 -21.220 -25.683 1.00 0.00 N ATOM 1859 CA SER A 130 -21.777 -20.392 -25.187 1.00 0.00 C ATOM 1860 C SER A 130 -21.262 -19.009 -24.785 1.00 0.00 C ATOM 1861 O SER A 130 -20.812 -18.870 -23.660 1.00 0.00 O ATOM 1862 CB SER A 130 -22.412 -21.074 -23.975 1.00 0.00 C ATOM 1863 OG SER A 130 -21.424 -21.837 -23.294 1.00 0.00 O ATOM 1864 OXT SER A 130 -21.326 -18.112 -25.610 1.00 0.00 O ATOM 0 H SER A 130 -19.734 -20.754 -25.689 1.00 0.00 H new ATOM 0 HA SER A 130 -22.522 -20.286 -25.975 1.00 0.00 H new ATOM 0 HB2 SER A 130 -22.837 -20.327 -23.305 1.00 0.00 H new ATOM 0 HB3 SER A 130 -23.231 -21.719 -24.294 1.00 0.00 H new ATOM 0 HG SER A 130 -21.828 -22.274 -22.515 1.00 0.00 H new TER 1870 SER A 130