USER MOD reduce.3.24.130724 H: found=0, std=0, add=831, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 831 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 15 GLN : amide:sc= -2.24! K(o=-2.2!,f=0.23) USER MOD Set 1.2: A 16 THR OG1 : rot 180:sc=-0.00106 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -162:sc= -0.0896 (180deg=-0.485) USER MOD Single : A 3 HIS : no HD1:sc= -0.367 X(o=-0.37,f=-0.81) USER MOD Single : A 4 HIS : no HD1:sc= -0.135 X(o=-0.14,f=0) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 6 HIS : no HD1:sc= -0.53 X(o=-0.53,f=-0.43) USER MOD Single : A 7 HIS : no HD1:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 8 HIS : no HD1:sc= -0.0745 X(o=-0.074,f=-0.058) USER MOD Single : A 9 MET CE :methyl -136:sc= -0.173 (180deg=-0.806) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0.121 USER MOD Single : A 17 GLN : amide:sc= -0.543 X(o=-0.54,f=-0.097) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 THR OG1 : rot 180:sc= -0.207 USER MOD Single : A 42 THR OG1 : rot -129:sc= 0.522 USER MOD Single : A 45 GLN : amide:sc=-0.00389 X(o=-0.0039,f=0) USER MOD Single : A 47 GLN : amide:sc= -0.732 X(o=-0.73,f=-1) USER MOD Single : A 52 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00237) USER MOD Single : A 54 THR OG1 : rot -38:sc= 0.586 USER MOD Single : A 58 SER OG : rot 118:sc= -0.621 USER MOD Single : A 59 SER OG : rot -75:sc= 1.13 USER MOD Single : A 61 GLN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 168:sc= -0.037 (180deg=-0.188) USER MOD Single : A 73 LYS NZ :NH3+ 171:sc= -0.433 (180deg=-0.454) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ 153:sc= -4.87! (180deg=-7.65!) USER MOD Single : A 84 THR OG1 : rot 180:sc= -0.0867 USER MOD Single : A 86 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 60:sc= 1.29 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= -0.999 X(o=-1,f=-1.4) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -31.489 -38.406 -35.726 1.00 42.33 N ATOM 2 CA MET A 1 -32.614 -37.969 -36.585 1.00 64.05 C ATOM 3 C MET A 1 -32.202 -36.725 -37.367 1.00 13.42 C ATOM 4 O MET A 1 -32.268 -35.605 -36.852 1.00 71.30 O ATOM 5 CB MET A 1 -33.856 -37.671 -35.730 1.00 34.21 C ATOM 6 CG MET A 1 -34.315 -38.849 -34.883 1.00 22.10 C ATOM 7 SD MET A 1 -35.686 -38.429 -33.790 1.00 51.33 S ATOM 8 CE MET A 1 -35.882 -39.969 -32.891 1.00 62.53 C ATOM 0 H1 MET A 1 -31.639 -39.393 -35.433 1.00 42.33 H new ATOM 0 H2 MET A 1 -30.598 -38.334 -36.258 1.00 42.33 H new ATOM 0 H3 MET A 1 -31.439 -37.799 -34.883 1.00 42.33 H new ATOM 0 HA MET A 1 -32.862 -38.768 -37.283 1.00 64.05 H new ATOM 0 HB2 MET A 1 -33.641 -36.827 -35.075 1.00 34.21 H new ATOM 0 HB3 MET A 1 -34.672 -37.367 -36.385 1.00 34.21 H new ATOM 0 HG2 MET A 1 -34.616 -39.667 -35.538 1.00 22.10 H new ATOM 0 HG3 MET A 1 -33.477 -39.210 -34.286 1.00 22.10 H new ATOM 0 HE1 MET A 1 -36.696 -39.870 -32.173 1.00 62.53 H new ATOM 0 HE2 MET A 1 -36.112 -40.772 -33.591 1.00 62.53 H new ATOM 0 HE3 MET A 1 -34.958 -40.202 -32.362 1.00 62.53 H new ATOM 20 N ALA A 2 -31.751 -36.930 -38.602 1.00 15.35 N ATOM 21 CA ALA A 2 -31.226 -35.847 -39.423 1.00 62.22 C ATOM 22 C ALA A 2 -32.236 -35.414 -40.481 1.00 54.21 C ATOM 23 O ALA A 2 -32.872 -36.249 -41.132 1.00 13.45 O ATOM 24 CB ALA A 2 -29.924 -36.278 -40.087 1.00 15.21 C ATOM 0 H ALA A 2 -31.740 -37.843 -39.057 1.00 15.35 H new ATOM 0 HA ALA A 2 -31.033 -34.994 -38.773 1.00 62.22 H new ATOM 0 HB1 ALA A 2 -29.540 -35.462 -40.698 1.00 15.21 H new ATOM 0 HB2 ALA A 2 -29.192 -36.533 -39.321 1.00 15.21 H new ATOM 0 HB3 ALA A 2 -30.108 -37.148 -40.717 1.00 15.21 H new ATOM 30 N HIS A 3 -32.374 -34.105 -40.638 1.00 62.30 N ATOM 31 CA HIS A 3 -33.208 -33.511 -41.681 1.00 61.24 C ATOM 32 C HIS A 3 -32.587 -32.182 -42.112 1.00 75.23 C ATOM 33 O HIS A 3 -32.596 -31.206 -41.359 1.00 31.12 O ATOM 34 CB HIS A 3 -34.654 -33.313 -41.188 1.00 53.45 C ATOM 35 CG HIS A 3 -34.787 -32.416 -39.989 1.00 10.41 C ATOM 36 ND1 HIS A 3 -35.137 -31.085 -40.079 1.00 44.13 N ATOM 37 CD2 HIS A 3 -34.626 -32.667 -38.667 1.00 54.24 C ATOM 38 CE1 HIS A 3 -35.184 -30.560 -38.871 1.00 44.22 C ATOM 39 NE2 HIS A 3 -34.879 -31.497 -37.997 1.00 52.33 N ATOM 0 H HIS A 3 -31.909 -33.419 -40.044 1.00 62.30 H new ATOM 0 HA HIS A 3 -33.251 -34.184 -42.537 1.00 61.24 H new ATOM 0 HB2 HIS A 3 -35.249 -32.900 -42.003 1.00 53.45 H new ATOM 0 HB3 HIS A 3 -35.078 -34.287 -40.946 1.00 53.45 H new ATOM 0 HD2 HIS A 3 -34.350 -33.612 -38.223 1.00 54.24 H new ATOM 0 HE1 HIS A 3 -35.431 -29.535 -38.637 1.00 44.22 H new ATOM 0 HE2 HIS A 3 -34.838 -31.373 -36.985 1.00 52.33 H new ATOM 48 N HIS A 4 -32.023 -32.157 -43.313 1.00 45.44 N ATOM 49 CA HIS A 4 -31.256 -31.005 -43.779 1.00 14.04 C ATOM 50 C HIS A 4 -31.329 -30.886 -45.296 1.00 24.20 C ATOM 51 O HIS A 4 -31.668 -31.846 -45.987 1.00 32.41 O ATOM 52 CB HIS A 4 -29.787 -31.139 -43.343 1.00 31.14 C ATOM 53 CG HIS A 4 -29.087 -32.338 -43.922 1.00 25.40 C ATOM 54 ND1 HIS A 4 -28.020 -32.247 -44.794 1.00 41.35 N ATOM 55 CD2 HIS A 4 -29.306 -33.665 -43.742 1.00 61.12 C ATOM 56 CE1 HIS A 4 -27.621 -33.461 -45.128 1.00 25.52 C ATOM 57 NE2 HIS A 4 -28.382 -34.335 -44.502 1.00 63.11 N ATOM 0 H HIS A 4 -32.082 -32.922 -43.985 1.00 45.44 H new ATOM 0 HA HIS A 4 -31.686 -30.107 -43.336 1.00 14.04 H new ATOM 0 HB2 HIS A 4 -29.247 -30.239 -43.636 1.00 31.14 H new ATOM 0 HB3 HIS A 4 -29.745 -31.196 -42.255 1.00 31.14 H new ATOM 0 HD2 HIS A 4 -30.066 -34.110 -43.117 1.00 61.12 H new ATOM 0 HE1 HIS A 4 -26.809 -33.697 -45.800 1.00 25.52 H new ATOM 0 HE2 HIS A 4 -28.297 -35.349 -44.572 1.00 63.11 H new ATOM 66 N HIS A 5 -30.990 -29.705 -45.804 1.00 43.15 N ATOM 67 CA HIS A 5 -30.981 -29.447 -47.241 1.00 52.04 C ATOM 68 C HIS A 5 -29.641 -28.856 -47.657 1.00 31.33 C ATOM 69 O HIS A 5 -29.429 -27.646 -47.583 1.00 44.54 O ATOM 70 CB HIS A 5 -32.127 -28.507 -47.640 1.00 13.13 C ATOM 71 CG HIS A 5 -33.479 -29.154 -47.584 1.00 51.14 C ATOM 72 ND1 HIS A 5 -34.391 -28.905 -46.586 1.00 45.22 N ATOM 73 CD2 HIS A 5 -34.072 -30.037 -48.422 1.00 75.11 C ATOM 74 CE1 HIS A 5 -35.486 -29.604 -46.811 1.00 22.22 C ATOM 75 NE2 HIS A 5 -35.321 -30.299 -47.921 1.00 71.23 N ATOM 0 H HIS A 5 -30.715 -28.904 -45.236 1.00 43.15 H new ATOM 0 HA HIS A 5 -31.127 -30.394 -47.760 1.00 52.04 H new ATOM 0 HB2 HIS A 5 -32.121 -27.639 -46.980 1.00 13.13 H new ATOM 0 HB3 HIS A 5 -31.950 -28.140 -48.651 1.00 13.13 H new ATOM 0 HD2 HIS A 5 -33.641 -30.457 -49.319 1.00 75.11 H new ATOM 0 HE1 HIS A 5 -36.370 -29.607 -46.191 1.00 22.22 H new ATOM 0 HE2 HIS A 5 -36.009 -30.927 -48.337 1.00 71.23 H new ATOM 84 N HIS A 6 -28.737 -29.737 -48.066 1.00 45.44 N ATOM 85 CA HIS A 6 -27.394 -29.365 -48.509 1.00 65.41 C ATOM 86 C HIS A 6 -26.745 -30.547 -49.212 1.00 61.41 C ATOM 87 O HIS A 6 -26.373 -31.530 -48.564 1.00 42.22 O ATOM 88 CB HIS A 6 -26.499 -28.918 -47.334 1.00 63.14 C ATOM 89 CG HIS A 6 -26.590 -27.455 -47.005 1.00 1.11 C ATOM 90 ND1 HIS A 6 -26.740 -26.972 -45.723 1.00 42.22 N ATOM 91 CD2 HIS A 6 -26.526 -26.369 -47.807 1.00 65.43 C ATOM 92 CE1 HIS A 6 -26.765 -25.652 -45.753 1.00 42.01 C ATOM 93 NE2 HIS A 6 -26.635 -25.261 -47.006 1.00 73.25 N ATOM 0 H HIS A 6 -28.915 -30.741 -48.101 1.00 45.44 H new ATOM 0 HA HIS A 6 -27.494 -28.522 -49.193 1.00 65.41 H new ATOM 0 HB2 HIS A 6 -26.768 -29.494 -46.449 1.00 63.14 H new ATOM 0 HB3 HIS A 6 -25.463 -29.161 -47.570 1.00 63.14 H new ATOM 0 HD2 HIS A 6 -26.410 -26.373 -48.881 1.00 65.43 H new ATOM 0 HE1 HIS A 6 -26.873 -25.003 -44.897 1.00 42.01 H new ATOM 0 HE2 HIS A 6 -26.618 -24.293 -47.327 1.00 73.25 H new ATOM 102 N HIS A 7 -26.620 -30.462 -50.531 1.00 41.25 N ATOM 103 CA HIS A 7 -25.943 -31.504 -51.298 1.00 71.21 C ATOM 104 C HIS A 7 -24.443 -31.470 -50.999 1.00 1.31 C ATOM 105 O HIS A 7 -23.723 -32.442 -51.237 1.00 43.01 O ATOM 106 CB HIS A 7 -26.189 -31.332 -52.803 1.00 4.24 C ATOM 107 CG HIS A 7 -25.720 -32.506 -53.617 1.00 51.54 C ATOM 108 ND1 HIS A 7 -24.452 -32.603 -54.150 1.00 41.15 N ATOM 109 CD2 HIS A 7 -26.358 -33.649 -53.971 1.00 64.14 C ATOM 110 CE1 HIS A 7 -24.330 -33.749 -54.794 1.00 54.14 C ATOM 111 NE2 HIS A 7 -25.472 -34.399 -54.701 1.00 55.45 N ATOM 0 H HIS A 7 -26.976 -29.687 -51.091 1.00 41.25 H new ATOM 0 HA HIS A 7 -26.350 -32.471 -51.002 1.00 71.21 H new ATOM 0 HB2 HIS A 7 -27.255 -31.181 -52.976 1.00 4.24 H new ATOM 0 HB3 HIS A 7 -25.679 -30.432 -53.148 1.00 4.24 H new ATOM 0 HD2 HIS A 7 -27.374 -33.918 -53.724 1.00 64.14 H new ATOM 0 HE1 HIS A 7 -23.446 -34.094 -55.309 1.00 54.14 H new ATOM 0 HE2 HIS A 7 -25.666 -35.314 -55.107 1.00 55.45 H new ATOM 120 N HIS A 8 -23.982 -30.329 -50.488 1.00 21.43 N ATOM 121 CA HIS A 8 -22.615 -30.182 -50.003 1.00 5.40 C ATOM 122 C HIS A 8 -22.636 -29.397 -48.695 1.00 12.40 C ATOM 123 O HIS A 8 -23.246 -28.328 -48.616 1.00 22.00 O ATOM 124 CB HIS A 8 -21.723 -29.485 -51.047 1.00 32.05 C ATOM 125 CG HIS A 8 -22.069 -28.046 -51.321 1.00 21.35 C ATOM 126 ND1 HIS A 8 -22.968 -27.655 -52.294 1.00 12.31 N ATOM 127 CD2 HIS A 8 -21.607 -26.899 -50.762 1.00 33.13 C ATOM 128 CE1 HIS A 8 -23.038 -26.336 -52.323 1.00 71.32 C ATOM 129 NE2 HIS A 8 -22.223 -25.854 -51.403 1.00 14.55 N ATOM 0 H HIS A 8 -24.546 -29.484 -50.400 1.00 21.43 H new ATOM 0 HA HIS A 8 -22.190 -31.171 -49.828 1.00 5.40 H new ATOM 0 HB2 HIS A 8 -20.688 -29.536 -50.710 1.00 32.05 H new ATOM 0 HB3 HIS A 8 -21.782 -30.041 -51.982 1.00 32.05 H new ATOM 0 HD2 HIS A 8 -20.887 -26.823 -49.960 1.00 33.13 H new ATOM 0 HE1 HIS A 8 -23.657 -25.751 -52.987 1.00 71.32 H new ATOM 0 HE2 HIS A 8 -22.075 -24.865 -51.201 1.00 14.55 H new ATOM 138 N MET A 9 -21.995 -29.943 -47.669 1.00 14.33 N ATOM 139 CA MET A 9 -21.968 -29.313 -46.350 1.00 10.20 C ATOM 140 C MET A 9 -21.137 -28.034 -46.393 1.00 4.43 C ATOM 141 O MET A 9 -21.529 -27.004 -45.843 1.00 62.05 O ATOM 142 CB MET A 9 -21.412 -30.302 -45.309 1.00 34.12 C ATOM 143 CG MET A 9 -21.353 -29.761 -43.881 1.00 74.25 C ATOM 144 SD MET A 9 -20.052 -28.532 -43.634 1.00 10.14 S ATOM 145 CE MET A 9 -18.582 -29.511 -43.952 1.00 71.55 C ATOM 0 H MET A 9 -21.484 -30.824 -47.723 1.00 14.33 H new ATOM 0 HA MET A 9 -22.983 -29.044 -46.059 1.00 10.20 H new ATOM 0 HB2 MET A 9 -22.028 -31.201 -45.317 1.00 34.12 H new ATOM 0 HB3 MET A 9 -20.408 -30.601 -45.612 1.00 34.12 H new ATOM 0 HG2 MET A 9 -22.316 -29.316 -43.629 1.00 74.25 H new ATOM 0 HG3 MET A 9 -21.195 -30.591 -43.192 1.00 74.25 H new ATOM 0 HE1 MET A 9 -17.828 -29.291 -43.196 1.00 71.55 H new ATOM 0 HE2 MET A 9 -18.835 -30.570 -43.915 1.00 71.55 H new ATOM 0 HE3 MET A 9 -18.188 -29.267 -44.939 1.00 71.55 H new ATOM 155 N GLY A 10 -19.999 -28.112 -47.072 1.00 32.43 N ATOM 156 CA GLY A 10 -19.108 -26.975 -47.199 1.00 33.53 C ATOM 157 C GLY A 10 -17.992 -27.262 -48.179 1.00 23.23 C ATOM 158 O GLY A 10 -17.681 -28.427 -48.444 1.00 62.21 O ATOM 0 H GLY A 10 -19.674 -28.956 -47.543 1.00 32.43 H new ATOM 0 HA2 GLY A 10 -19.672 -26.103 -47.531 1.00 33.53 H new ATOM 0 HA3 GLY A 10 -18.686 -26.730 -46.224 1.00 33.53 H new ATOM 162 N THR A 11 -17.399 -26.211 -48.736 1.00 34.53 N ATOM 163 CA THR A 11 -16.318 -26.360 -49.702 1.00 13.23 C ATOM 164 C THR A 11 -15.110 -25.503 -49.314 1.00 32.22 C ATOM 165 O THR A 11 -14.104 -26.023 -48.823 1.00 32.32 O ATOM 166 CB THR A 11 -16.790 -25.988 -51.130 1.00 72.22 C ATOM 167 OG1 THR A 11 -17.431 -24.704 -51.115 1.00 34.23 O ATOM 168 CG2 THR A 11 -17.756 -27.032 -51.688 1.00 74.25 C ATOM 0 H THR A 11 -17.651 -25.243 -48.533 1.00 34.53 H new ATOM 0 HA THR A 11 -16.019 -27.408 -49.696 1.00 13.23 H new ATOM 0 HB THR A 11 -15.911 -25.955 -51.774 1.00 72.22 H new ATOM 0 HG1 THR A 11 -17.725 -24.475 -52.021 1.00 34.23 H new ATOM 0 HG21 THR A 11 -18.067 -26.740 -52.691 1.00 74.25 H new ATOM 0 HG22 THR A 11 -17.260 -28.001 -51.730 1.00 74.25 H new ATOM 0 HG23 THR A 11 -18.631 -27.100 -51.042 1.00 74.25 H new ATOM 176 N LEU A 12 -15.225 -24.192 -49.510 1.00 71.50 N ATOM 177 CA LEU A 12 -14.116 -23.268 -49.268 1.00 51.12 C ATOM 178 C LEU A 12 -14.535 -22.158 -48.307 1.00 2.41 C ATOM 179 O LEU A 12 -15.700 -21.749 -48.286 1.00 51.53 O ATOM 180 CB LEU A 12 -13.641 -22.657 -50.598 1.00 41.54 C ATOM 181 CG LEU A 12 -13.124 -23.666 -51.640 1.00 1.12 C ATOM 182 CD1 LEU A 12 -12.733 -22.953 -52.935 1.00 2.03 C ATOM 183 CD2 LEU A 12 -11.950 -24.468 -51.080 1.00 4.44 C ATOM 0 H LEU A 12 -16.080 -23.742 -49.838 1.00 71.50 H new ATOM 0 HA LEU A 12 -13.297 -23.826 -48.815 1.00 51.12 H new ATOM 0 HB2 LEU A 12 -14.467 -22.098 -51.037 1.00 41.54 H new ATOM 0 HB3 LEU A 12 -12.848 -21.940 -50.386 1.00 41.54 H new ATOM 0 HG LEU A 12 -13.929 -24.364 -51.870 1.00 1.12 H new ATOM 0 HD11 LEU A 12 -12.370 -23.684 -53.658 1.00 2.03 H new ATOM 0 HD12 LEU A 12 -13.603 -22.439 -53.344 1.00 2.03 H new ATOM 0 HD13 LEU A 12 -11.947 -22.227 -52.728 1.00 2.03 H new ATOM 0 HD21 LEU A 12 -11.600 -25.175 -51.833 1.00 4.44 H new ATOM 0 HD22 LEU A 12 -11.139 -23.789 -50.815 1.00 4.44 H new ATOM 0 HD23 LEU A 12 -12.272 -25.013 -50.192 1.00 4.44 H new ATOM 195 N GLU A 13 -13.578 -21.665 -47.525 1.00 71.43 N ATOM 196 CA GLU A 13 -13.830 -20.585 -46.574 1.00 21.04 C ATOM 197 C GLU A 13 -13.570 -19.226 -47.217 1.00 44.32 C ATOM 198 O GLU A 13 -13.612 -18.195 -46.544 1.00 71.34 O ATOM 199 CB GLU A 13 -12.952 -20.750 -45.326 1.00 3.43 C ATOM 200 CG GLU A 13 -13.262 -21.999 -44.513 1.00 72.42 C ATOM 201 CD GLU A 13 -12.457 -22.063 -43.226 1.00 50.02 C ATOM 202 OE1 GLU A 13 -11.339 -22.623 -43.238 1.00 62.43 O ATOM 203 OE2 GLU A 13 -12.933 -21.531 -42.196 1.00 21.45 O ATOM 0 H GLU A 13 -12.614 -21.999 -47.532 1.00 71.43 H new ATOM 0 HA GLU A 13 -14.878 -20.635 -46.277 1.00 21.04 H new ATOM 0 HB2 GLU A 13 -11.906 -20.778 -45.631 1.00 3.43 H new ATOM 0 HB3 GLU A 13 -13.075 -19.874 -44.689 1.00 3.43 H new ATOM 0 HG2 GLU A 13 -14.326 -22.021 -44.275 1.00 72.42 H new ATOM 0 HG3 GLU A 13 -13.052 -22.883 -45.115 1.00 72.42 H new ATOM 210 N ALA A 14 -13.306 -19.238 -48.525 1.00 72.45 N ATOM 211 CA ALA A 14 -13.086 -18.012 -49.294 1.00 22.35 C ATOM 212 C ALA A 14 -14.213 -17.004 -49.060 1.00 63.12 C ATOM 213 O ALA A 14 -14.009 -15.793 -49.150 1.00 72.22 O ATOM 214 CB ALA A 14 -12.963 -18.336 -50.781 1.00 2.03 C ATOM 0 H ALA A 14 -13.239 -20.092 -49.078 1.00 72.45 H new ATOM 0 HA ALA A 14 -12.155 -17.560 -48.952 1.00 22.35 H new ATOM 0 HB1 ALA A 14 -12.800 -17.416 -51.342 1.00 2.03 H new ATOM 0 HB2 ALA A 14 -12.121 -19.011 -50.938 1.00 2.03 H new ATOM 0 HB3 ALA A 14 -13.880 -18.813 -51.126 1.00 2.03 H new ATOM 220 N GLN A 15 -15.405 -17.518 -48.767 1.00 2.04 N ATOM 221 CA GLN A 15 -16.559 -16.674 -48.462 1.00 24.44 C ATOM 222 C GLN A 15 -16.313 -15.899 -47.166 1.00 22.42 C ATOM 223 O GLN A 15 -16.529 -14.689 -47.097 1.00 65.33 O ATOM 224 CB GLN A 15 -17.829 -17.546 -48.350 1.00 35.54 C ATOM 225 CG GLN A 15 -19.145 -16.770 -48.199 1.00 1.34 C ATOM 226 CD GLN A 15 -19.391 -16.209 -46.800 1.00 30.44 C ATOM 227 OE1 GLN A 15 -20.028 -15.167 -46.639 1.00 73.05 O ATOM 228 NE2 GLN A 15 -18.908 -16.901 -45.781 1.00 13.14 N ATOM 0 H GLN A 15 -15.598 -18.519 -48.734 1.00 2.04 H new ATOM 0 HA GLN A 15 -16.704 -15.954 -49.268 1.00 24.44 H new ATOM 0 HB2 GLN A 15 -17.897 -18.176 -49.237 1.00 35.54 H new ATOM 0 HB3 GLN A 15 -17.719 -18.212 -47.494 1.00 35.54 H new ATOM 0 HG2 GLN A 15 -19.151 -15.947 -48.913 1.00 1.34 H new ATOM 0 HG3 GLN A 15 -19.973 -17.428 -48.464 1.00 1.34 H new ATOM 0 HE21 GLN A 15 -18.385 -17.760 -45.950 1.00 13.14 H new ATOM 0 HE22 GLN A 15 -19.059 -16.575 -44.826 1.00 13.14 H new ATOM 237 N THR A 16 -15.834 -16.606 -46.151 1.00 51.14 N ATOM 238 CA THR A 16 -15.638 -16.028 -44.831 1.00 52.51 C ATOM 239 C THR A 16 -14.287 -15.314 -44.754 1.00 40.13 C ATOM 240 O THR A 16 -13.251 -15.944 -44.516 1.00 51.13 O ATOM 241 CB THR A 16 -15.711 -17.122 -43.741 1.00 11.31 C ATOM 242 OG1 THR A 16 -16.856 -17.960 -43.968 1.00 65.40 O ATOM 243 CG2 THR A 16 -15.793 -16.510 -42.345 1.00 41.52 C ATOM 0 H THR A 16 -15.572 -17.589 -46.220 1.00 51.14 H new ATOM 0 HA THR A 16 -16.434 -15.303 -44.658 1.00 52.51 H new ATOM 0 HB THR A 16 -14.800 -17.718 -43.799 1.00 11.31 H new ATOM 0 HG1 THR A 16 -16.897 -18.652 -43.276 1.00 65.40 H new ATOM 0 HG21 THR A 16 -15.843 -17.305 -41.601 1.00 41.52 H new ATOM 0 HG22 THR A 16 -14.909 -15.899 -42.163 1.00 41.52 H new ATOM 0 HG23 THR A 16 -16.685 -15.888 -42.272 1.00 41.52 H new ATOM 251 N GLN A 17 -14.296 -14.009 -45.009 1.00 32.42 N ATOM 252 CA GLN A 17 -13.087 -13.192 -44.917 1.00 51.23 C ATOM 253 C GLN A 17 -13.133 -12.331 -43.656 1.00 30.41 C ATOM 254 O GLN A 17 -13.849 -11.327 -43.595 1.00 31.24 O ATOM 255 CB GLN A 17 -12.938 -12.315 -46.168 1.00 54.23 C ATOM 256 CG GLN A 17 -12.850 -13.107 -47.470 1.00 74.01 C ATOM 257 CD GLN A 17 -11.674 -14.074 -47.498 1.00 13.51 C ATOM 258 OE1 GLN A 17 -10.567 -13.714 -47.910 1.00 30.33 O ATOM 259 NE2 GLN A 17 -11.903 -15.308 -47.078 1.00 74.31 N ATOM 0 H GLN A 17 -15.131 -13.491 -45.282 1.00 32.42 H new ATOM 0 HA GLN A 17 -12.220 -13.850 -44.857 1.00 51.23 H new ATOM 0 HB2 GLN A 17 -13.787 -11.633 -46.225 1.00 54.23 H new ATOM 0 HB3 GLN A 17 -12.043 -11.702 -46.066 1.00 54.23 H new ATOM 0 HG2 GLN A 17 -13.776 -13.665 -47.613 1.00 74.01 H new ATOM 0 HG3 GLN A 17 -12.763 -12.413 -48.306 1.00 74.01 H new ATOM 0 HE21 GLN A 17 -12.831 -15.569 -46.744 1.00 74.31 H new ATOM 0 HE22 GLN A 17 -11.152 -15.998 -47.088 1.00 74.31 H new ATOM 268 N GLY A 18 -12.392 -12.756 -42.637 1.00 45.01 N ATOM 269 CA GLY A 18 -12.365 -12.043 -41.372 1.00 32.05 C ATOM 270 C GLY A 18 -13.510 -12.455 -40.465 1.00 22.41 C ATOM 271 O GLY A 18 -14.286 -13.346 -40.815 1.00 30.02 O ATOM 0 H GLY A 18 -11.805 -13.589 -42.666 1.00 45.01 H new ATOM 0 HA2 GLY A 18 -11.417 -12.233 -40.869 1.00 32.05 H new ATOM 0 HA3 GLY A 18 -12.418 -10.970 -41.559 1.00 32.05 H new ATOM 275 N PRO A 19 -13.652 -11.813 -39.293 1.00 55.32 N ATOM 276 CA PRO A 19 -14.726 -12.128 -38.329 1.00 11.14 C ATOM 277 C PRO A 19 -16.108 -11.604 -38.766 1.00 0.34 C ATOM 278 O PRO A 19 -16.960 -11.299 -37.927 1.00 64.54 O ATOM 279 CB PRO A 19 -14.249 -11.419 -37.053 1.00 61.35 C ATOM 280 CG PRO A 19 -13.449 -10.262 -37.546 1.00 20.44 C ATOM 281 CD PRO A 19 -12.758 -10.745 -38.794 1.00 71.31 C ATOM 0 HA PRO A 19 -14.875 -13.202 -38.218 1.00 11.14 H new ATOM 0 HB2 PRO A 19 -15.091 -11.089 -36.444 1.00 61.35 H new ATOM 0 HB3 PRO A 19 -13.647 -12.082 -36.432 1.00 61.35 H new ATOM 0 HG2 PRO A 19 -14.089 -9.406 -37.760 1.00 20.44 H new ATOM 0 HG3 PRO A 19 -12.725 -9.940 -36.798 1.00 20.44 H new ATOM 0 HD2 PRO A 19 -12.643 -9.944 -39.524 1.00 71.31 H new ATOM 0 HD3 PRO A 19 -11.760 -11.126 -38.578 1.00 71.31 H new ATOM 289 N GLY A 20 -16.331 -11.519 -40.079 1.00 10.05 N ATOM 290 CA GLY A 20 -17.619 -11.083 -40.596 1.00 74.10 C ATOM 291 C GLY A 20 -17.842 -9.590 -40.447 1.00 65.13 C ATOM 292 O GLY A 20 -18.910 -9.157 -40.013 1.00 74.44 O ATOM 0 H GLY A 20 -15.640 -11.745 -40.794 1.00 10.05 H new ATOM 0 HA2 GLY A 20 -17.692 -11.352 -41.650 1.00 74.10 H new ATOM 0 HA3 GLY A 20 -18.413 -11.617 -40.075 1.00 74.10 H new ATOM 296 N SER A 21 -16.836 -8.804 -40.816 1.00 30.53 N ATOM 297 CA SER A 21 -16.937 -7.344 -40.774 1.00 4.43 C ATOM 298 C SER A 21 -15.949 -6.701 -41.763 1.00 25.13 C ATOM 299 O SER A 21 -16.361 -5.899 -42.601 1.00 5.22 O ATOM 300 CB SER A 21 -16.719 -6.806 -39.345 1.00 44.22 C ATOM 301 OG SER A 21 -16.945 -5.403 -39.269 1.00 33.34 O ATOM 0 H SER A 21 -15.937 -9.152 -41.149 1.00 30.53 H new ATOM 0 HA SER A 21 -17.948 -7.071 -41.076 1.00 4.43 H new ATOM 0 HB2 SER A 21 -17.390 -7.320 -38.657 1.00 44.22 H new ATOM 0 HB3 SER A 21 -15.701 -7.028 -39.024 1.00 44.22 H new ATOM 0 HG SER A 21 -16.799 -5.098 -38.349 1.00 33.34 H new ATOM 307 N PRO A 22 -14.635 -7.045 -41.711 1.00 74.53 N ATOM 308 CA PRO A 22 -13.638 -6.490 -42.639 1.00 53.05 C ATOM 309 C PRO A 22 -13.669 -7.180 -44.005 1.00 14.45 C ATOM 310 O PRO A 22 -12.684 -7.169 -44.742 1.00 2.32 O ATOM 311 CB PRO A 22 -12.287 -6.743 -41.926 1.00 32.50 C ATOM 312 CG PRO A 22 -12.631 -7.346 -40.598 1.00 73.23 C ATOM 313 CD PRO A 22 -13.994 -7.958 -40.758 1.00 50.00 C ATOM 0 HA PRO A 22 -13.823 -5.437 -42.850 1.00 53.05 H new ATOM 0 HB2 PRO A 22 -11.657 -7.415 -42.509 1.00 32.50 H new ATOM 0 HB3 PRO A 22 -11.731 -5.814 -41.801 1.00 32.50 H new ATOM 0 HG2 PRO A 22 -11.897 -8.099 -40.310 1.00 73.23 H new ATOM 0 HG3 PRO A 22 -12.634 -6.588 -39.815 1.00 73.23 H new ATOM 0 HD2 PRO A 22 -13.940 -8.976 -41.143 1.00 50.00 H new ATOM 0 HD3 PRO A 22 -14.533 -8.003 -39.812 1.00 50.00 H new ATOM 321 N GLU A 23 -14.808 -7.774 -44.335 1.00 31.13 N ATOM 322 CA GLU A 23 -14.991 -8.424 -45.623 1.00 2.43 C ATOM 323 C GLU A 23 -15.326 -7.377 -46.681 1.00 50.22 C ATOM 324 O GLU A 23 -15.789 -6.284 -46.350 1.00 63.33 O ATOM 325 CB GLU A 23 -16.076 -9.514 -45.525 1.00 32.34 C ATOM 326 CG GLU A 23 -17.442 -9.033 -45.025 1.00 31.05 C ATOM 327 CD GLU A 23 -18.241 -8.284 -46.081 1.00 11.01 C ATOM 328 OE1 GLU A 23 -18.549 -8.885 -47.132 1.00 72.13 O ATOM 329 OE2 GLU A 23 -18.562 -7.094 -45.870 1.00 31.24 O ATOM 0 H GLU A 23 -15.623 -7.818 -43.723 1.00 31.13 H new ATOM 0 HA GLU A 23 -14.066 -8.918 -45.920 1.00 2.43 H new ATOM 0 HB2 GLU A 23 -16.205 -9.964 -46.509 1.00 32.34 H new ATOM 0 HB3 GLU A 23 -15.720 -10.300 -44.859 1.00 32.34 H new ATOM 0 HG2 GLU A 23 -18.019 -9.892 -44.684 1.00 31.05 H new ATOM 0 HG3 GLU A 23 -17.297 -8.384 -44.161 1.00 31.05 H new ATOM 336 N GLY A 24 -15.050 -7.685 -47.938 1.00 33.14 N ATOM 337 CA GLY A 24 -15.315 -6.742 -49.011 1.00 73.02 C ATOM 338 C GLY A 24 -14.055 -6.034 -49.461 1.00 74.44 C ATOM 339 O GLY A 24 -13.979 -5.540 -50.585 1.00 72.20 O ATOM 0 H GLY A 24 -14.646 -8.572 -48.238 1.00 33.14 H new ATOM 0 HA2 GLY A 24 -15.758 -7.268 -49.856 1.00 73.02 H new ATOM 0 HA3 GLY A 24 -16.046 -6.006 -48.676 1.00 73.02 H new ATOM 343 N VAL A 25 -13.065 -5.981 -48.575 1.00 72.40 N ATOM 344 CA VAL A 25 -11.770 -5.392 -48.895 1.00 22.33 C ATOM 345 C VAL A 25 -10.738 -6.495 -49.117 1.00 61.30 C ATOM 346 O VAL A 25 -10.879 -7.595 -48.574 1.00 30.12 O ATOM 347 CB VAL A 25 -11.273 -4.446 -47.766 1.00 54.23 C ATOM 348 CG1 VAL A 25 -12.289 -3.341 -47.499 1.00 44.42 C ATOM 349 CG2 VAL A 25 -10.969 -5.225 -46.484 1.00 24.31 C ATOM 0 H VAL A 25 -13.137 -6.342 -47.624 1.00 72.40 H new ATOM 0 HA VAL A 25 -11.892 -4.804 -49.804 1.00 22.33 H new ATOM 0 HB VAL A 25 -10.345 -3.983 -48.103 1.00 54.23 H new ATOM 0 HG11 VAL A 25 -11.920 -2.691 -46.705 1.00 44.42 H new ATOM 0 HG12 VAL A 25 -12.438 -2.756 -48.407 1.00 44.42 H new ATOM 0 HG13 VAL A 25 -13.237 -3.784 -47.194 1.00 44.42 H new ATOM 0 HG21 VAL A 25 -10.624 -4.536 -45.713 1.00 24.31 H new ATOM 0 HG22 VAL A 25 -11.873 -5.729 -46.142 1.00 24.31 H new ATOM 0 HG23 VAL A 25 -10.194 -5.965 -46.683 1.00 24.31 H new ATOM 359 N PRO A 26 -9.705 -6.236 -49.938 1.00 53.20 N ATOM 360 CA PRO A 26 -8.586 -7.167 -50.103 1.00 53.23 C ATOM 361 C PRO A 26 -7.882 -7.420 -48.763 1.00 63.22 C ATOM 362 O PRO A 26 -7.407 -6.474 -48.127 1.00 4.41 O ATOM 363 CB PRO A 26 -7.651 -6.442 -51.089 1.00 71.45 C ATOM 364 CG PRO A 26 -8.523 -5.459 -51.795 1.00 61.30 C ATOM 365 CD PRO A 26 -9.555 -5.036 -50.786 1.00 20.30 C ATOM 0 HA PRO A 26 -8.900 -8.147 -50.463 1.00 53.23 H new ATOM 0 HB2 PRO A 26 -6.836 -5.942 -50.565 1.00 71.45 H new ATOM 0 HB3 PRO A 26 -7.197 -7.142 -51.790 1.00 71.45 H new ATOM 0 HG2 PRO A 26 -7.945 -4.604 -52.147 1.00 61.30 H new ATOM 0 HG3 PRO A 26 -8.992 -5.909 -52.670 1.00 61.30 H new ATOM 0 HD2 PRO A 26 -9.224 -4.173 -50.208 1.00 20.30 H new ATOM 0 HD3 PRO A 26 -10.495 -4.759 -51.263 1.00 20.30 H new ATOM 373 N PRO A 27 -7.828 -8.691 -48.308 1.00 22.12 N ATOM 374 CA PRO A 27 -7.239 -9.049 -47.010 1.00 12.14 C ATOM 375 C PRO A 27 -5.809 -8.527 -46.851 1.00 32.44 C ATOM 376 O PRO A 27 -4.922 -8.841 -47.652 1.00 51.44 O ATOM 377 CB PRO A 27 -7.271 -10.594 -46.994 1.00 2.02 C ATOM 378 CG PRO A 27 -7.558 -11.002 -48.404 1.00 33.14 C ATOM 379 CD PRO A 27 -8.343 -9.874 -49.015 1.00 24.33 C ATOM 0 HA PRO A 27 -7.791 -8.602 -46.183 1.00 12.14 H new ATOM 0 HB2 PRO A 27 -6.320 -11.003 -46.653 1.00 2.02 H new ATOM 0 HB3 PRO A 27 -8.039 -10.964 -46.314 1.00 2.02 H new ATOM 0 HG2 PRO A 27 -6.634 -11.176 -48.955 1.00 33.14 H new ATOM 0 HG3 PRO A 27 -8.126 -11.932 -48.432 1.00 33.14 H new ATOM 0 HD2 PRO A 27 -8.179 -9.804 -50.090 1.00 24.33 H new ATOM 0 HD3 PRO A 27 -9.415 -10.000 -48.863 1.00 24.33 H new ATOM 387 N THR A 28 -5.602 -7.713 -45.823 1.00 45.53 N ATOM 388 CA THR A 28 -4.294 -7.147 -45.523 1.00 23.35 C ATOM 389 C THR A 28 -3.357 -8.218 -44.948 1.00 32.41 C ATOM 390 O THR A 28 -3.814 -9.222 -44.391 1.00 52.34 O ATOM 391 CB THR A 28 -4.441 -5.983 -44.515 1.00 42.45 C ATOM 392 OG1 THR A 28 -5.529 -5.138 -44.917 1.00 3.44 O ATOM 393 CG2 THR A 28 -3.157 -5.158 -44.420 1.00 14.13 C ATOM 0 H THR A 28 -6.336 -7.427 -45.175 1.00 45.53 H new ATOM 0 HA THR A 28 -3.862 -6.770 -46.450 1.00 23.35 H new ATOM 0 HB THR A 28 -4.641 -6.408 -43.531 1.00 42.45 H new ATOM 0 HG1 THR A 28 -5.624 -4.401 -44.278 1.00 3.44 H new ATOM 0 HG21 THR A 28 -3.296 -4.349 -43.703 1.00 14.13 H new ATOM 0 HG22 THR A 28 -2.337 -5.797 -44.091 1.00 14.13 H new ATOM 0 HG23 THR A 28 -2.921 -4.739 -45.398 1.00 14.13 H new ATOM 401 N ASP A 29 -2.052 -8.003 -45.105 1.00 43.22 N ATOM 402 CA ASP A 29 -1.032 -8.912 -44.565 1.00 33.15 C ATOM 403 C ASP A 29 -1.191 -9.014 -43.053 1.00 10.15 C ATOM 404 O ASP A 29 -1.156 -10.100 -42.470 1.00 40.43 O ATOM 405 CB ASP A 29 0.393 -8.402 -44.870 1.00 41.45 C ATOM 406 CG ASP A 29 0.499 -7.625 -46.171 1.00 41.33 C ATOM 407 OD1 ASP A 29 -0.035 -6.495 -46.227 1.00 72.33 O ATOM 408 OD2 ASP A 29 1.145 -8.107 -47.121 1.00 53.41 O ATOM 0 H ASP A 29 -1.670 -7.201 -45.606 1.00 43.22 H new ATOM 0 HA ASP A 29 -1.169 -9.885 -45.036 1.00 33.15 H new ATOM 0 HB2 ASP A 29 0.725 -7.766 -44.049 1.00 41.45 H new ATOM 0 HB3 ASP A 29 1.073 -9.253 -44.909 1.00 41.45 H new ATOM 413 N ARG A 30 -1.381 -7.849 -42.439 1.00 41.34 N ATOM 414 CA ARG A 30 -1.456 -7.720 -40.989 1.00 50.12 C ATOM 415 C ARG A 30 -2.754 -8.321 -40.459 1.00 1.41 C ATOM 416 O ARG A 30 -3.730 -8.463 -41.199 1.00 73.43 O ATOM 417 CB ARG A 30 -1.350 -6.237 -40.577 1.00 54.12 C ATOM 418 CG ARG A 30 0.037 -5.618 -40.791 1.00 21.54 C ATOM 419 CD ARG A 30 0.428 -5.511 -42.265 1.00 40.24 C ATOM 420 NE ARG A 30 1.786 -4.982 -42.427 1.00 70.52 N ATOM 421 CZ ARG A 30 2.436 -4.893 -43.592 1.00 52.34 C ATOM 422 NH1 ARG A 30 1.851 -5.269 -44.720 1.00 32.25 N ATOM 423 NH2 ARG A 30 3.675 -4.416 -43.625 1.00 22.53 N ATOM 0 H ARG A 30 -1.488 -6.965 -42.937 1.00 41.34 H new ATOM 0 HA ARG A 30 -0.620 -8.268 -40.554 1.00 50.12 H new ATOM 0 HB2 ARG A 30 -2.083 -5.662 -41.143 1.00 54.12 H new ATOM 0 HB3 ARG A 30 -1.617 -6.145 -39.524 1.00 54.12 H new ATOM 0 HG2 ARG A 30 0.057 -4.624 -40.343 1.00 21.54 H new ATOM 0 HG3 ARG A 30 0.781 -6.219 -40.267 1.00 21.54 H new ATOM 0 HD2 ARG A 30 0.362 -6.494 -42.732 1.00 40.24 H new ATOM 0 HD3 ARG A 30 -0.279 -4.864 -42.783 1.00 40.24 H new ATOM 0 HE ARG A 30 2.270 -4.658 -41.590 1.00 70.52 H new ATOM 0 HH11 ARG A 30 0.897 -5.630 -44.704 1.00 32.25 H new ATOM 0 HH12 ARG A 30 2.355 -5.198 -45.604 1.00 32.25 H new ATOM 0 HH21 ARG A 30 4.130 -4.118 -42.762 1.00 22.53 H new ATOM 0 HH22 ARG A 30 4.172 -4.348 -44.513 1.00 22.53 H new ATOM 437 N PHE A 31 -2.746 -8.672 -39.178 1.00 5.02 N ATOM 438 CA PHE A 31 -3.906 -9.270 -38.522 1.00 30.21 C ATOM 439 C PHE A 31 -5.047 -8.256 -38.409 1.00 11.12 C ATOM 440 O PHE A 31 -4.803 -7.050 -38.360 1.00 60.42 O ATOM 441 CB PHE A 31 -3.519 -9.765 -37.120 1.00 54.15 C ATOM 442 CG PHE A 31 -2.347 -10.714 -37.109 1.00 41.22 C ATOM 443 CD1 PHE A 31 -2.529 -12.065 -37.365 1.00 64.33 C ATOM 444 CD2 PHE A 31 -1.064 -10.253 -36.840 1.00 24.24 C ATOM 445 CE1 PHE A 31 -1.456 -12.935 -37.356 1.00 34.10 C ATOM 446 CE2 PHE A 31 0.011 -11.120 -36.830 1.00 62.10 C ATOM 447 CZ PHE A 31 -0.186 -12.463 -37.086 1.00 23.03 C ATOM 0 H PHE A 31 -1.939 -8.551 -38.566 1.00 5.02 H new ATOM 0 HA PHE A 31 -4.244 -10.112 -39.126 1.00 30.21 H new ATOM 0 HB2 PHE A 31 -3.283 -8.905 -36.494 1.00 54.15 H new ATOM 0 HB3 PHE A 31 -4.379 -10.260 -36.670 1.00 54.15 H new ATOM 0 HD1 PHE A 31 -3.520 -12.441 -37.574 1.00 64.33 H new ATOM 0 HD2 PHE A 31 -0.906 -9.204 -36.636 1.00 24.24 H new ATOM 0 HE1 PHE A 31 -1.610 -13.984 -37.560 1.00 34.10 H new ATOM 0 HE2 PHE A 31 1.004 -10.749 -36.622 1.00 62.10 H new ATOM 0 HZ PHE A 31 0.652 -13.144 -37.075 1.00 23.03 H new ATOM 457 N PRO A 32 -6.309 -8.730 -38.358 1.00 23.40 N ATOM 458 CA PRO A 32 -7.477 -7.853 -38.167 1.00 61.21 C ATOM 459 C PRO A 32 -7.510 -7.253 -36.757 1.00 12.12 C ATOM 460 O PRO A 32 -8.306 -6.362 -36.461 1.00 45.31 O ATOM 461 CB PRO A 32 -8.670 -8.792 -38.393 1.00 34.33 C ATOM 462 CG PRO A 32 -8.146 -10.151 -38.066 1.00 12.11 C ATOM 463 CD PRO A 32 -6.702 -10.149 -38.499 1.00 51.11 C ATOM 0 HA PRO A 32 -7.471 -6.997 -38.842 1.00 61.21 H new ATOM 0 HB2 PRO A 32 -9.511 -8.526 -37.752 1.00 34.33 H new ATOM 0 HB3 PRO A 32 -9.025 -8.741 -39.422 1.00 34.33 H new ATOM 0 HG2 PRO A 32 -8.234 -10.358 -36.999 1.00 12.11 H new ATOM 0 HG3 PRO A 32 -8.710 -10.924 -38.588 1.00 12.11 H new ATOM 0 HD2 PRO A 32 -6.093 -10.800 -37.872 1.00 51.11 H new ATOM 0 HD3 PRO A 32 -6.589 -10.498 -39.525 1.00 51.11 H new ATOM 471 N LEU A 33 -6.635 -7.762 -35.893 1.00 21.14 N ATOM 472 CA LEU A 33 -6.514 -7.276 -34.524 1.00 43.40 C ATOM 473 C LEU A 33 -5.128 -6.671 -34.314 1.00 31.24 C ATOM 474 O LEU A 33 -4.115 -7.316 -34.587 1.00 3.30 O ATOM 475 CB LEU A 33 -6.744 -8.419 -33.523 1.00 65.01 C ATOM 476 CG LEU A 33 -8.122 -9.100 -33.604 1.00 10.43 C ATOM 477 CD1 LEU A 33 -8.218 -10.261 -32.614 1.00 12.42 C ATOM 478 CD2 LEU A 33 -9.239 -8.084 -33.366 1.00 72.02 C ATOM 0 H LEU A 33 -5.993 -8.520 -36.123 1.00 21.14 H new ATOM 0 HA LEU A 33 -7.272 -6.511 -34.355 1.00 43.40 H new ATOM 0 HB2 LEU A 33 -5.974 -9.175 -33.678 1.00 65.01 H new ATOM 0 HB3 LEU A 33 -6.609 -8.029 -32.514 1.00 65.01 H new ATOM 0 HG LEU A 33 -8.241 -9.508 -34.608 1.00 10.43 H new ATOM 0 HD11 LEU A 33 -9.201 -10.725 -32.691 1.00 12.42 H new ATOM 0 HD12 LEU A 33 -7.449 -10.999 -32.843 1.00 12.42 H new ATOM 0 HD13 LEU A 33 -8.072 -9.888 -31.600 1.00 12.42 H new ATOM 0 HD21 LEU A 33 -10.205 -8.585 -33.427 1.00 72.02 H new ATOM 0 HD22 LEU A 33 -9.122 -7.640 -32.377 1.00 72.02 H new ATOM 0 HD23 LEU A 33 -9.187 -7.302 -34.123 1.00 72.02 H new ATOM 490 N LEU A 34 -5.093 -5.432 -33.834 1.00 14.54 N ATOM 491 CA LEU A 34 -3.835 -4.718 -33.601 1.00 1.15 C ATOM 492 C LEU A 34 -3.732 -4.258 -32.146 1.00 23.24 C ATOM 493 O LEU A 34 -2.817 -3.518 -31.775 1.00 75.43 O ATOM 494 CB LEU A 34 -3.716 -3.528 -34.579 1.00 54.33 C ATOM 495 CG LEU A 34 -4.999 -2.690 -34.798 1.00 63.34 C ATOM 496 CD1 LEU A 34 -5.418 -1.952 -33.527 1.00 52.15 C ATOM 497 CD2 LEU A 34 -4.809 -1.708 -35.955 1.00 55.35 C ATOM 0 H LEU A 34 -5.927 -4.895 -33.596 1.00 14.54 H new ATOM 0 HA LEU A 34 -3.003 -5.398 -33.786 1.00 1.15 H new ATOM 0 HB2 LEU A 34 -2.931 -2.864 -34.216 1.00 54.33 H new ATOM 0 HB3 LEU A 34 -3.388 -3.911 -35.545 1.00 54.33 H new ATOM 0 HG LEU A 34 -5.802 -3.381 -35.054 1.00 63.34 H new ATOM 0 HD11 LEU A 34 -6.322 -1.376 -33.722 1.00 52.15 H new ATOM 0 HD12 LEU A 34 -5.612 -2.674 -32.734 1.00 52.15 H new ATOM 0 HD13 LEU A 34 -4.619 -1.279 -33.217 1.00 52.15 H new ATOM 0 HD21 LEU A 34 -5.721 -1.128 -36.094 1.00 55.35 H new ATOM 0 HD22 LEU A 34 -3.982 -1.035 -35.729 1.00 55.35 H new ATOM 0 HD23 LEU A 34 -4.588 -2.260 -36.868 1.00 55.35 H new ATOM 509 N ALA A 35 -4.677 -4.711 -31.329 1.00 40.20 N ATOM 510 CA ALA A 35 -4.713 -4.372 -29.911 1.00 32.23 C ATOM 511 C ALA A 35 -4.314 -5.584 -29.077 1.00 54.11 C ATOM 512 O ALA A 35 -4.883 -6.666 -29.232 1.00 20.41 O ATOM 513 CB ALA A 35 -6.102 -3.881 -29.515 1.00 0.34 C ATOM 0 H ALA A 35 -5.437 -5.321 -31.630 1.00 40.20 H new ATOM 0 HA ALA A 35 -4.002 -3.568 -29.722 1.00 32.23 H new ATOM 0 HB1 ALA A 35 -6.111 -3.632 -28.454 1.00 0.34 H new ATOM 0 HB2 ALA A 35 -6.354 -2.995 -30.097 1.00 0.34 H new ATOM 0 HB3 ALA A 35 -6.834 -4.664 -29.710 1.00 0.34 H new ATOM 519 N LEU A 36 -3.328 -5.402 -28.207 1.00 11.44 N ATOM 520 CA LEU A 36 -2.821 -6.488 -27.377 1.00 70.21 C ATOM 521 C LEU A 36 -3.709 -6.674 -26.148 1.00 54.41 C ATOM 522 O LEU A 36 -3.970 -5.721 -25.407 1.00 32.22 O ATOM 523 CB LEU A 36 -1.365 -6.218 -26.951 1.00 21.24 C ATOM 524 CG LEU A 36 -0.310 -6.254 -28.077 1.00 12.54 C ATOM 525 CD1 LEU A 36 -0.356 -7.590 -28.818 1.00 32.02 C ATOM 526 CD2 LEU A 36 -0.492 -5.087 -29.049 1.00 4.31 C ATOM 0 H LEU A 36 -2.861 -4.507 -28.058 1.00 11.44 H new ATOM 0 HA LEU A 36 -2.839 -7.406 -27.965 1.00 70.21 H new ATOM 0 HB2 LEU A 36 -1.323 -5.239 -26.473 1.00 21.24 H new ATOM 0 HB3 LEU A 36 -1.086 -6.953 -26.196 1.00 21.24 H new ATOM 0 HG LEU A 36 0.672 -6.150 -27.616 1.00 12.54 H new ATOM 0 HD11 LEU A 36 0.396 -7.594 -29.607 1.00 32.02 H new ATOM 0 HD12 LEU A 36 -0.152 -8.401 -28.119 1.00 32.02 H new ATOM 0 HD13 LEU A 36 -1.344 -7.729 -29.257 1.00 32.02 H new ATOM 0 HD21 LEU A 36 0.267 -5.142 -29.830 1.00 4.31 H new ATOM 0 HD22 LEU A 36 -1.482 -5.141 -29.501 1.00 4.31 H new ATOM 0 HD23 LEU A 36 -0.390 -4.145 -28.510 1.00 4.31 H new ATOM 538 N LEU A 37 -4.180 -7.901 -25.947 1.00 13.52 N ATOM 539 CA LEU A 37 -5.023 -8.224 -24.799 1.00 21.25 C ATOM 540 C LEU A 37 -4.261 -8.040 -23.486 1.00 14.11 C ATOM 541 O LEU A 37 -3.027 -7.968 -23.476 1.00 53.31 O ATOM 542 CB LEU A 37 -5.583 -9.659 -24.927 1.00 71.04 C ATOM 543 CG LEU A 37 -4.564 -10.769 -25.275 1.00 45.01 C ATOM 544 CD1 LEU A 37 -3.630 -11.072 -24.102 1.00 73.25 C ATOM 545 CD2 LEU A 37 -5.287 -12.039 -25.720 1.00 10.31 C ATOM 0 H LEU A 37 -3.992 -8.690 -26.565 1.00 13.52 H new ATOM 0 HA LEU A 37 -5.865 -7.531 -24.787 1.00 21.25 H new ATOM 0 HB2 LEU A 37 -6.066 -9.922 -23.986 1.00 71.04 H new ATOM 0 HB3 LEU A 37 -6.359 -9.656 -25.693 1.00 71.04 H new ATOM 0 HG LEU A 37 -3.951 -10.403 -26.098 1.00 45.01 H new ATOM 0 HD11 LEU A 37 -2.930 -11.857 -24.388 1.00 73.25 H new ATOM 0 HD12 LEU A 37 -3.077 -10.172 -23.836 1.00 73.25 H new ATOM 0 HD13 LEU A 37 -4.217 -11.404 -23.246 1.00 73.25 H new ATOM 0 HD21 LEU A 37 -4.554 -12.809 -25.961 1.00 10.31 H new ATOM 0 HD22 LEU A 37 -5.933 -12.391 -24.915 1.00 10.31 H new ATOM 0 HD23 LEU A 37 -5.891 -11.824 -26.602 1.00 10.31 H new ATOM 557 N ARG A 38 -4.999 -7.956 -22.382 1.00 2.14 N ATOM 558 CA ARG A 38 -4.396 -7.786 -21.066 1.00 45.54 C ATOM 559 C ARG A 38 -4.553 -9.044 -20.221 1.00 2.05 C ATOM 560 O ARG A 38 -5.197 -10.013 -20.635 1.00 21.04 O ATOM 561 CB ARG A 38 -4.991 -6.576 -20.340 1.00 41.41 C ATOM 562 CG ARG A 38 -4.448 -5.247 -20.850 1.00 14.00 C ATOM 563 CD ARG A 38 -4.855 -4.094 -19.948 1.00 71.31 C ATOM 564 NE ARG A 38 -6.300 -3.859 -19.972 1.00 2.14 N ATOM 565 CZ ARG A 38 -7.044 -3.622 -18.893 1.00 52.02 C ATOM 566 NH1 ARG A 38 -6.499 -3.645 -17.682 1.00 34.34 N ATOM 567 NH2 ARG A 38 -8.337 -3.380 -19.028 1.00 41.24 N ATOM 0 H ARG A 38 -6.018 -8.003 -22.374 1.00 2.14 H new ATOM 0 HA ARG A 38 -3.331 -7.607 -21.214 1.00 45.54 H new ATOM 0 HB2 ARG A 38 -6.075 -6.587 -20.456 1.00 41.41 H new ATOM 0 HB3 ARG A 38 -4.783 -6.661 -19.273 1.00 41.41 H new ATOM 0 HG2 ARG A 38 -3.361 -5.296 -20.910 1.00 14.00 H new ATOM 0 HG3 ARG A 38 -4.815 -5.067 -21.860 1.00 14.00 H new ATOM 0 HD2 ARG A 38 -4.539 -4.305 -18.926 1.00 71.31 H new ATOM 0 HD3 ARG A 38 -4.336 -3.188 -20.261 1.00 71.31 H new ATOM 0 HE ARG A 38 -6.769 -3.878 -20.877 1.00 2.14 H new ATOM 0 HH11 ARG A 38 -5.505 -3.845 -17.574 1.00 34.34 H new ATOM 0 HH12 ARG A 38 -7.075 -3.463 -16.860 1.00 34.34 H new ATOM 0 HH21 ARG A 38 -8.761 -3.375 -19.956 1.00 41.24 H new ATOM 0 HH22 ARG A 38 -8.911 -3.198 -18.204 1.00 41.24 H new ATOM 581 N ARG A 39 -3.976 -8.999 -19.030 1.00 13.43 N ATOM 582 CA ARG A 39 -3.902 -10.152 -18.134 1.00 31.22 C ATOM 583 C ARG A 39 -5.217 -10.382 -17.371 1.00 12.54 C ATOM 584 O ARG A 39 -5.224 -10.566 -16.153 1.00 64.51 O ATOM 585 CB ARG A 39 -2.762 -9.937 -17.139 1.00 71.22 C ATOM 586 CG ARG A 39 -2.954 -8.721 -16.238 1.00 25.23 C ATOM 587 CD ARG A 39 -2.219 -8.909 -14.934 1.00 12.21 C ATOM 588 NE ARG A 39 -2.530 -7.865 -13.957 1.00 64.14 N ATOM 589 CZ ARG A 39 -3.242 -8.072 -12.851 1.00 40.21 C ATOM 590 NH1 ARG A 39 -3.751 -9.277 -12.602 1.00 72.51 N ATOM 591 NH2 ARG A 39 -3.437 -7.080 -11.994 1.00 72.23 N ATOM 0 H ARG A 39 -3.542 -8.157 -18.652 1.00 13.43 H new ATOM 0 HA ARG A 39 -3.720 -11.038 -18.742 1.00 31.22 H new ATOM 0 HB2 ARG A 39 -2.662 -10.827 -16.517 1.00 71.22 H new ATOM 0 HB3 ARG A 39 -1.828 -9.826 -17.689 1.00 71.22 H new ATOM 0 HG2 ARG A 39 -2.589 -7.826 -16.742 1.00 25.23 H new ATOM 0 HG3 ARG A 39 -4.016 -8.568 -16.045 1.00 25.23 H new ATOM 0 HD2 ARG A 39 -2.474 -9.882 -14.514 1.00 12.21 H new ATOM 0 HD3 ARG A 39 -1.146 -8.916 -15.124 1.00 12.21 H new ATOM 0 HE ARG A 39 -2.181 -6.923 -14.134 1.00 64.14 H new ATOM 0 HH11 ARG A 39 -3.596 -10.042 -13.259 1.00 72.51 H new ATOM 0 HH12 ARG A 39 -4.296 -9.435 -11.755 1.00 72.51 H new ATOM 0 HH21 ARG A 39 -3.042 -6.159 -12.182 1.00 72.23 H new ATOM 0 HH22 ARG A 39 -3.982 -7.238 -11.147 1.00 72.23 H new ATOM 605 N THR A 40 -6.315 -10.390 -18.093 1.00 21.32 N ATOM 606 CA THR A 40 -7.640 -10.586 -17.496 1.00 31.44 C ATOM 607 C THR A 40 -8.067 -12.056 -17.561 1.00 32.23 C ATOM 608 O THR A 40 -7.407 -12.878 -18.196 1.00 70.14 O ATOM 609 CB THR A 40 -8.709 -9.706 -18.185 1.00 25.32 C ATOM 610 OG1 THR A 40 -9.982 -9.872 -17.536 1.00 2.42 O ATOM 611 CG2 THR A 40 -8.832 -10.040 -19.670 1.00 5.33 C ATOM 0 H THR A 40 -6.328 -10.263 -19.105 1.00 21.32 H new ATOM 0 HA THR A 40 -7.563 -10.286 -16.451 1.00 31.44 H new ATOM 0 HB THR A 40 -8.393 -8.666 -18.098 1.00 25.32 H new ATOM 0 HG1 THR A 40 -10.651 -9.309 -17.979 1.00 2.42 H new ATOM 0 HG21 THR A 40 -9.592 -9.404 -20.124 1.00 5.33 H new ATOM 0 HG22 THR A 40 -7.874 -9.870 -20.162 1.00 5.33 H new ATOM 0 HG23 THR A 40 -9.118 -11.085 -19.785 1.00 5.33 H new ATOM 619 N LEU A 41 -9.180 -12.376 -16.900 1.00 51.33 N ATOM 620 CA LEU A 41 -9.707 -13.744 -16.861 1.00 34.14 C ATOM 621 C LEU A 41 -11.217 -13.731 -17.057 1.00 43.22 C ATOM 622 O LEU A 41 -11.967 -13.523 -16.101 1.00 22.33 O ATOM 623 CB LEU A 41 -9.372 -14.443 -15.519 1.00 61.14 C ATOM 624 CG LEU A 41 -8.544 -15.737 -15.619 1.00 40.42 C ATOM 625 CD1 LEU A 41 -7.189 -15.468 -16.267 1.00 4.32 C ATOM 626 CD2 LEU A 41 -8.377 -16.369 -14.240 1.00 50.44 C ATOM 0 H LEU A 41 -9.740 -11.701 -16.379 1.00 51.33 H new ATOM 0 HA LEU A 41 -9.234 -14.302 -17.669 1.00 34.14 H new ATOM 0 HB2 LEU A 41 -8.830 -13.737 -14.890 1.00 61.14 H new ATOM 0 HB3 LEU A 41 -10.307 -14.672 -15.009 1.00 61.14 H new ATOM 0 HG LEU A 41 -9.081 -16.441 -16.254 1.00 40.42 H new ATOM 0 HD11 LEU A 41 -6.623 -16.398 -16.326 1.00 4.32 H new ATOM 0 HD12 LEU A 41 -7.338 -15.070 -17.271 1.00 4.32 H new ATOM 0 HD13 LEU A 41 -6.636 -14.744 -15.668 1.00 4.32 H new ATOM 0 HD21 LEU A 41 -7.789 -17.283 -14.327 1.00 50.44 H new ATOM 0 HD22 LEU A 41 -7.865 -15.670 -13.579 1.00 50.44 H new ATOM 0 HD23 LEU A 41 -9.358 -16.606 -13.827 1.00 50.44 H new ATOM 638 N THR A 42 -11.657 -13.922 -18.296 1.00 31.45 N ATOM 639 CA THR A 42 -13.077 -14.071 -18.582 1.00 23.21 C ATOM 640 C THR A 42 -13.531 -15.469 -18.161 1.00 63.23 C ATOM 641 O THR A 42 -12.698 -16.301 -17.788 1.00 44.05 O ATOM 642 CB THR A 42 -13.392 -13.832 -20.081 1.00 20.41 C ATOM 643 OG1 THR A 42 -14.811 -13.763 -20.278 1.00 73.40 O ATOM 644 CG2 THR A 42 -12.808 -14.936 -20.961 1.00 34.51 C ATOM 0 H THR A 42 -11.052 -13.977 -19.115 1.00 31.45 H new ATOM 0 HA THR A 42 -13.622 -13.317 -18.014 1.00 23.21 H new ATOM 0 HB THR A 42 -12.932 -12.887 -20.370 1.00 20.41 H new ATOM 0 HG1 THR A 42 -15.071 -14.370 -21.002 1.00 73.40 H new ATOM 0 HG21 THR A 42 -13.049 -14.735 -22.005 1.00 34.51 H new ATOM 0 HG22 THR A 42 -11.725 -14.965 -20.837 1.00 34.51 H new ATOM 0 HG23 THR A 42 -13.233 -15.897 -20.669 1.00 34.51 H new ATOM 652 N GLU A 43 -14.834 -15.739 -18.234 1.00 15.15 N ATOM 653 CA GLU A 43 -15.374 -17.011 -17.751 1.00 71.31 C ATOM 654 C GLU A 43 -14.703 -18.197 -18.444 1.00 12.12 C ATOM 655 O GLU A 43 -14.479 -19.232 -17.825 1.00 32.21 O ATOM 656 CB GLU A 43 -16.890 -17.076 -17.959 1.00 43.41 C ATOM 657 CG GLU A 43 -17.560 -18.222 -17.205 1.00 4.44 C ATOM 658 CD GLU A 43 -17.399 -18.096 -15.696 1.00 44.01 C ATOM 659 OE1 GLU A 43 -18.047 -17.209 -15.106 1.00 20.13 O ATOM 660 OE2 GLU A 43 -16.629 -18.875 -15.093 1.00 43.34 O ATOM 0 H GLU A 43 -15.530 -15.101 -18.619 1.00 15.15 H new ATOM 0 HA GLU A 43 -15.163 -17.070 -16.683 1.00 71.31 H new ATOM 0 HB2 GLU A 43 -17.333 -16.133 -17.639 1.00 43.41 H new ATOM 0 HB3 GLU A 43 -17.098 -17.181 -19.024 1.00 43.41 H new ATOM 0 HG2 GLU A 43 -18.621 -18.246 -17.454 1.00 4.44 H new ATOM 0 HG3 GLU A 43 -17.134 -19.169 -17.535 1.00 4.44 H new ATOM 667 N GLU A 44 -14.360 -18.035 -19.724 1.00 24.15 N ATOM 668 CA GLU A 44 -13.713 -19.105 -20.482 1.00 42.15 C ATOM 669 C GLU A 44 -12.403 -19.494 -19.802 1.00 51.42 C ATOM 670 O GLU A 44 -12.075 -20.676 -19.656 1.00 31.32 O ATOM 671 CB GLU A 44 -13.440 -18.664 -21.928 1.00 42.11 C ATOM 672 CG GLU A 44 -14.686 -18.220 -22.689 1.00 54.42 C ATOM 673 CD GLU A 44 -14.410 -17.951 -24.163 1.00 75.51 C ATOM 674 OE1 GLU A 44 -13.991 -16.824 -24.505 1.00 0.14 O ATOM 675 OE2 GLU A 44 -14.612 -18.866 -24.992 1.00 13.55 O ATOM 0 H GLU A 44 -14.519 -17.178 -20.254 1.00 24.15 H new ATOM 0 HA GLU A 44 -14.381 -19.966 -20.507 1.00 42.15 H new ATOM 0 HB2 GLU A 44 -12.722 -17.844 -21.917 1.00 42.11 H new ATOM 0 HB3 GLU A 44 -12.973 -19.489 -22.466 1.00 42.11 H new ATOM 0 HG2 GLU A 44 -15.453 -18.989 -22.602 1.00 54.42 H new ATOM 0 HG3 GLU A 44 -15.086 -17.317 -22.228 1.00 54.42 H new ATOM 682 N GLN A 45 -11.679 -18.474 -19.358 1.00 31.04 N ATOM 683 CA GLN A 45 -10.395 -18.656 -18.700 1.00 14.15 C ATOM 684 C GLN A 45 -10.599 -19.302 -17.332 1.00 53.01 C ATOM 685 O GLN A 45 -9.871 -20.212 -16.950 1.00 14.13 O ATOM 686 CB GLN A 45 -9.688 -17.305 -18.551 1.00 51.21 C ATOM 687 CG GLN A 45 -9.609 -16.503 -19.846 1.00 30.54 C ATOM 688 CD GLN A 45 -8.776 -17.184 -20.921 1.00 41.25 C ATOM 689 OE1 GLN A 45 -9.295 -17.949 -21.735 1.00 64.40 O ATOM 690 NE2 GLN A 45 -7.483 -16.911 -20.931 1.00 1.34 N ATOM 0 H GLN A 45 -11.967 -17.499 -19.445 1.00 31.04 H new ATOM 0 HA GLN A 45 -9.771 -19.312 -19.308 1.00 14.15 H new ATOM 0 HB2 GLN A 45 -10.211 -16.713 -17.800 1.00 51.21 H new ATOM 0 HB3 GLN A 45 -8.678 -17.474 -18.177 1.00 51.21 H new ATOM 0 HG2 GLN A 45 -10.617 -16.338 -20.226 1.00 30.54 H new ATOM 0 HG3 GLN A 45 -9.184 -15.522 -19.633 1.00 30.54 H new ATOM 0 HE21 GLN A 45 -7.091 -16.272 -20.239 1.00 1.34 H new ATOM 0 HE22 GLN A 45 -6.877 -17.340 -21.630 1.00 1.34 H new ATOM 699 N VAL A 46 -11.616 -18.830 -16.610 1.00 64.44 N ATOM 700 CA VAL A 46 -11.953 -19.376 -15.297 1.00 2.55 C ATOM 701 C VAL A 46 -12.262 -20.871 -15.404 1.00 12.42 C ATOM 702 O VAL A 46 -11.741 -21.685 -14.634 1.00 73.15 O ATOM 703 CB VAL A 46 -13.168 -18.637 -14.671 1.00 31.43 C ATOM 704 CG1 VAL A 46 -13.555 -19.251 -13.323 1.00 64.04 C ATOM 705 CG2 VAL A 46 -12.870 -17.146 -14.521 1.00 15.10 C ATOM 0 H VAL A 46 -12.222 -18.068 -16.915 1.00 64.44 H new ATOM 0 HA VAL A 46 -11.089 -19.230 -14.649 1.00 2.55 H new ATOM 0 HB VAL A 46 -14.016 -18.753 -15.345 1.00 31.43 H new ATOM 0 HG11 VAL A 46 -14.408 -18.713 -12.910 1.00 64.04 H new ATOM 0 HG12 VAL A 46 -13.820 -20.299 -13.463 1.00 64.04 H new ATOM 0 HG13 VAL A 46 -12.713 -19.179 -12.635 1.00 64.04 H new ATOM 0 HG21 VAL A 46 -13.732 -16.645 -14.081 1.00 15.10 H new ATOM 0 HG22 VAL A 46 -12.003 -17.012 -13.874 1.00 15.10 H new ATOM 0 HG23 VAL A 46 -12.662 -16.716 -15.501 1.00 15.10 H new ATOM 715 N GLN A 47 -13.090 -21.225 -16.381 1.00 74.22 N ATOM 716 CA GLN A 47 -13.464 -22.616 -16.601 1.00 73.34 C ATOM 717 C GLN A 47 -12.261 -23.430 -17.046 1.00 25.01 C ATOM 718 O GLN A 47 -12.136 -24.603 -16.701 1.00 54.32 O ATOM 719 CB GLN A 47 -14.589 -22.723 -17.631 1.00 71.34 C ATOM 720 CG GLN A 47 -15.826 -21.922 -17.248 1.00 23.23 C ATOM 721 CD GLN A 47 -17.116 -22.577 -17.716 1.00 21.44 C ATOM 722 OE1 GLN A 47 -17.720 -23.379 -17.003 1.00 4.54 O ATOM 723 NE2 GLN A 47 -17.542 -22.246 -18.922 1.00 3.44 N ATOM 0 H GLN A 47 -13.515 -20.566 -17.034 1.00 74.22 H new ATOM 0 HA GLN A 47 -13.827 -23.020 -15.656 1.00 73.34 H new ATOM 0 HB2 GLN A 47 -14.223 -22.376 -18.597 1.00 71.34 H new ATOM 0 HB3 GLN A 47 -14.865 -23.771 -17.752 1.00 71.34 H new ATOM 0 HG2 GLN A 47 -15.856 -21.803 -16.165 1.00 23.23 H new ATOM 0 HG3 GLN A 47 -15.754 -20.923 -17.677 1.00 23.23 H new ATOM 0 HE21 GLN A 47 -17.014 -21.578 -19.484 1.00 3.44 H new ATOM 0 HE22 GLN A 47 -18.398 -22.659 -19.291 1.00 3.44 H new ATOM 732 N GLU A 48 -11.382 -22.808 -17.813 1.00 35.04 N ATOM 733 CA GLU A 48 -10.127 -23.438 -18.197 1.00 64.51 C ATOM 734 C GLU A 48 -9.304 -23.769 -16.949 1.00 55.04 C ATOM 735 O GLU A 48 -8.783 -24.882 -16.808 1.00 73.40 O ATOM 736 CB GLU A 48 -9.353 -22.525 -19.166 1.00 43.20 C ATOM 737 CG GLU A 48 -7.848 -22.510 -18.951 1.00 42.23 C ATOM 738 CD GLU A 48 -7.102 -21.810 -20.075 1.00 41.42 C ATOM 739 OE1 GLU A 48 -7.020 -20.567 -20.064 1.00 51.14 O ATOM 740 OE2 GLU A 48 -6.595 -22.500 -20.989 1.00 52.21 O ATOM 0 H GLU A 48 -11.513 -21.867 -18.183 1.00 35.04 H new ATOM 0 HA GLU A 48 -10.333 -24.374 -18.717 1.00 64.51 H new ATOM 0 HB2 GLU A 48 -9.558 -22.844 -20.188 1.00 43.20 H new ATOM 0 HB3 GLU A 48 -9.732 -21.508 -19.067 1.00 43.20 H new ATOM 0 HG2 GLU A 48 -7.625 -22.012 -18.007 1.00 42.23 H new ATOM 0 HG3 GLU A 48 -7.487 -23.535 -18.864 1.00 42.23 H new ATOM 747 N VAL A 49 -9.227 -22.808 -16.032 1.00 34.21 N ATOM 748 CA VAL A 49 -8.493 -22.990 -14.784 1.00 32.22 C ATOM 749 C VAL A 49 -9.065 -24.158 -13.985 1.00 34.13 C ATOM 750 O VAL A 49 -8.325 -25.034 -13.540 1.00 25.13 O ATOM 751 CB VAL A 49 -8.514 -21.707 -13.911 1.00 3.23 C ATOM 752 CG1 VAL A 49 -7.811 -21.955 -12.579 1.00 62.33 C ATOM 753 CG2 VAL A 49 -7.866 -20.536 -14.642 1.00 71.11 C ATOM 0 H VAL A 49 -9.666 -21.893 -16.131 1.00 34.21 H new ATOM 0 HA VAL A 49 -7.459 -23.206 -15.052 1.00 32.22 H new ATOM 0 HB VAL A 49 -9.555 -21.451 -13.715 1.00 3.23 H new ATOM 0 HG11 VAL A 49 -7.835 -21.045 -11.980 1.00 62.33 H new ATOM 0 HG12 VAL A 49 -8.320 -22.756 -12.043 1.00 62.33 H new ATOM 0 HG13 VAL A 49 -6.775 -22.241 -12.762 1.00 62.33 H new ATOM 0 HG21 VAL A 49 -7.894 -19.650 -14.007 1.00 71.11 H new ATOM 0 HG22 VAL A 49 -6.830 -20.782 -14.876 1.00 71.11 H new ATOM 0 HG23 VAL A 49 -8.410 -20.338 -15.566 1.00 71.11 H new ATOM 763 N VAL A 50 -10.387 -24.182 -13.825 1.00 60.22 N ATOM 764 CA VAL A 50 -11.041 -25.239 -13.051 1.00 11.40 C ATOM 765 C VAL A 50 -10.945 -26.581 -13.775 1.00 72.34 C ATOM 766 O VAL A 50 -10.813 -27.632 -13.146 1.00 53.42 O ATOM 767 CB VAL A 50 -12.525 -24.894 -12.744 1.00 41.25 C ATOM 768 CG1 VAL A 50 -12.634 -23.474 -12.207 1.00 15.52 C ATOM 769 CG2 VAL A 50 -13.431 -25.079 -13.955 1.00 15.52 C ATOM 0 H VAL A 50 -11.023 -23.488 -14.217 1.00 60.22 H new ATOM 0 HA VAL A 50 -10.515 -25.316 -12.100 1.00 11.40 H new ATOM 0 HB VAL A 50 -12.868 -25.595 -11.983 1.00 41.25 H new ATOM 0 HG11 VAL A 50 -13.678 -23.244 -11.996 1.00 15.52 H new ATOM 0 HG12 VAL A 50 -12.050 -23.386 -11.291 1.00 15.52 H new ATOM 0 HG13 VAL A 50 -12.251 -22.774 -12.950 1.00 15.52 H new ATOM 0 HG21 VAL A 50 -14.456 -24.824 -13.685 1.00 15.52 H new ATOM 0 HG22 VAL A 50 -13.096 -24.428 -14.763 1.00 15.52 H new ATOM 0 HG23 VAL A 50 -13.390 -26.117 -14.285 1.00 15.52 H new ATOM 779 N ALA A 51 -10.989 -26.529 -15.103 1.00 31.45 N ATOM 780 CA ALA A 51 -10.867 -27.720 -15.932 1.00 42.34 C ATOM 781 C ALA A 51 -9.493 -28.352 -15.755 1.00 31.41 C ATOM 782 O ALA A 51 -9.350 -29.573 -15.779 1.00 25.24 O ATOM 783 CB ALA A 51 -11.114 -27.383 -17.400 1.00 44.10 C ATOM 0 H ALA A 51 -11.110 -25.665 -15.631 1.00 31.45 H new ATOM 0 HA ALA A 51 -11.623 -28.438 -15.614 1.00 42.34 H new ATOM 0 HB1 ALA A 51 -11.018 -28.287 -18.002 1.00 44.10 H new ATOM 0 HB2 ALA A 51 -12.118 -26.975 -17.516 1.00 44.10 H new ATOM 0 HB3 ALA A 51 -10.382 -26.646 -17.732 1.00 44.10 H new ATOM 789 N LYS A 52 -8.476 -27.512 -15.605 1.00 53.45 N ATOM 790 CA LYS A 52 -7.127 -27.990 -15.329 1.00 42.14 C ATOM 791 C LYS A 52 -6.993 -28.406 -13.854 1.00 3.33 C ATOM 792 O LYS A 52 -6.375 -29.423 -13.539 1.00 33.40 O ATOM 793 CB LYS A 52 -6.080 -26.923 -15.697 1.00 40.33 C ATOM 794 CG LYS A 52 -4.649 -27.463 -15.729 1.00 30.34 C ATOM 795 CD LYS A 52 -4.501 -28.608 -16.732 1.00 44.14 C ATOM 796 CE LYS A 52 -3.131 -29.271 -16.653 1.00 31.32 C ATOM 797 NZ LYS A 52 -2.030 -28.341 -17.014 1.00 11.24 N ATOM 0 H LYS A 52 -8.560 -26.498 -15.670 1.00 53.45 H new ATOM 0 HA LYS A 52 -6.942 -28.867 -15.949 1.00 42.14 H new ATOM 0 HB2 LYS A 52 -6.325 -26.506 -16.674 1.00 40.33 H new ATOM 0 HB3 LYS A 52 -6.136 -26.106 -14.978 1.00 40.33 H new ATOM 0 HG2 LYS A 52 -3.962 -26.658 -15.991 1.00 30.34 H new ATOM 0 HG3 LYS A 52 -4.369 -27.811 -14.735 1.00 30.34 H new ATOM 0 HD2 LYS A 52 -5.274 -29.353 -16.546 1.00 44.14 H new ATOM 0 HD3 LYS A 52 -4.661 -28.228 -17.741 1.00 44.14 H new ATOM 0 HE2 LYS A 52 -2.970 -29.646 -15.642 1.00 31.32 H new ATOM 0 HE3 LYS A 52 -3.108 -30.133 -17.320 1.00 31.32 H new ATOM 0 HZ1 LYS A 52 -1.121 -28.843 -16.962 1.00 11.24 H new ATOM 0 HZ2 LYS A 52 -2.176 -27.989 -17.982 1.00 11.24 H new ATOM 0 HZ3 LYS A 52 -2.022 -27.539 -16.352 1.00 11.24 H new ATOM 811 N LEU A 53 -7.604 -27.616 -12.963 1.00 5.45 N ATOM 812 CA LEU A 53 -7.535 -27.851 -11.513 1.00 72.44 C ATOM 813 C LEU A 53 -8.056 -29.241 -11.132 1.00 43.14 C ATOM 814 O LEU A 53 -7.596 -29.833 -10.150 1.00 30.51 O ATOM 815 CB LEU A 53 -8.325 -26.771 -10.741 1.00 61.32 C ATOM 816 CG LEU A 53 -7.543 -25.503 -10.341 1.00 62.23 C ATOM 817 CD1 LEU A 53 -8.398 -24.606 -9.462 1.00 3.31 C ATOM 818 CD2 LEU A 53 -6.242 -25.870 -9.627 1.00 15.34 C ATOM 0 H LEU A 53 -8.158 -26.800 -13.223 1.00 5.45 H new ATOM 0 HA LEU A 53 -6.483 -27.795 -11.235 1.00 72.44 H new ATOM 0 HB2 LEU A 53 -9.176 -26.469 -11.351 1.00 61.32 H new ATOM 0 HB3 LEU A 53 -8.727 -27.224 -9.835 1.00 61.32 H new ATOM 0 HG LEU A 53 -7.290 -24.958 -11.250 1.00 62.23 H new ATOM 0 HD11 LEU A 53 -7.831 -23.716 -9.189 1.00 3.31 H new ATOM 0 HD12 LEU A 53 -9.295 -24.311 -10.006 1.00 3.31 H new ATOM 0 HD13 LEU A 53 -8.682 -25.146 -8.559 1.00 3.31 H new ATOM 0 HD21 LEU A 53 -5.707 -24.960 -9.354 1.00 15.34 H new ATOM 0 HD22 LEU A 53 -6.470 -26.441 -8.727 1.00 15.34 H new ATOM 0 HD23 LEU A 53 -5.620 -26.471 -10.290 1.00 15.34 H new ATOM 830 N THR A 54 -9.010 -29.764 -11.902 1.00 2.31 N ATOM 831 CA THR A 54 -9.604 -31.067 -11.601 1.00 74.25 C ATOM 832 C THR A 54 -8.662 -32.218 -11.985 1.00 12.24 C ATOM 833 O THR A 54 -9.047 -33.391 -11.934 1.00 11.50 O ATOM 834 CB THR A 54 -10.984 -31.243 -12.291 1.00 54.25 C ATOM 835 OG1 THR A 54 -11.646 -32.420 -11.797 1.00 2.43 O ATOM 836 CG2 THR A 54 -10.849 -31.336 -13.808 1.00 33.32 C ATOM 0 H THR A 54 -9.386 -29.309 -12.734 1.00 2.31 H new ATOM 0 HA THR A 54 -9.760 -31.100 -10.523 1.00 74.25 H new ATOM 0 HB THR A 54 -11.579 -30.361 -12.053 1.00 54.25 H new ATOM 0 HG1 THR A 54 -10.986 -33.129 -11.650 1.00 2.43 H new ATOM 0 HG21 THR A 54 -11.836 -31.459 -14.254 1.00 33.32 H new ATOM 0 HG22 THR A 54 -10.389 -30.424 -14.189 1.00 33.32 H new ATOM 0 HG23 THR A 54 -10.225 -32.192 -14.066 1.00 33.32 H new ATOM 844 N ASP A 55 -7.433 -31.882 -12.381 1.00 13.25 N ATOM 845 CA ASP A 55 -6.381 -32.879 -12.595 1.00 1.54 C ATOM 846 C ASP A 55 -5.294 -32.716 -11.532 1.00 20.51 C ATOM 847 O ASP A 55 -4.273 -32.068 -11.772 1.00 75.23 O ATOM 848 CB ASP A 55 -5.776 -32.756 -14.007 1.00 3.22 C ATOM 849 CG ASP A 55 -6.630 -33.415 -15.081 1.00 40.30 C ATOM 850 OD1 ASP A 55 -7.614 -32.796 -15.541 1.00 74.12 O ATOM 851 OD2 ASP A 55 -6.315 -34.555 -15.484 1.00 52.23 O ATOM 0 H ASP A 55 -7.140 -30.922 -12.561 1.00 13.25 H new ATOM 0 HA ASP A 55 -6.822 -33.872 -12.509 1.00 1.54 H new ATOM 0 HB2 ASP A 55 -5.647 -31.701 -14.250 1.00 3.22 H new ATOM 0 HB3 ASP A 55 -4.784 -33.208 -14.012 1.00 3.22 H new ATOM 856 N PRO A 56 -5.499 -33.310 -10.333 1.00 62.43 N ATOM 857 CA PRO A 56 -4.596 -33.124 -9.186 1.00 43.13 C ATOM 858 C PRO A 56 -3.182 -33.621 -9.472 1.00 2.34 C ATOM 859 O PRO A 56 -2.203 -33.094 -8.934 1.00 53.10 O ATOM 860 CB PRO A 56 -5.250 -33.952 -8.064 1.00 74.10 C ATOM 861 CG PRO A 56 -6.127 -34.927 -8.772 1.00 74.41 C ATOM 862 CD PRO A 56 -6.618 -34.213 -10.004 1.00 55.11 C ATOM 0 HA PRO A 56 -4.477 -32.071 -8.932 1.00 43.13 H new ATOM 0 HB2 PRO A 56 -4.500 -34.461 -7.460 1.00 74.10 H new ATOM 0 HB3 PRO A 56 -5.826 -33.319 -7.390 1.00 74.10 H new ATOM 0 HG2 PRO A 56 -5.576 -35.830 -9.036 1.00 74.41 H new ATOM 0 HG3 PRO A 56 -6.960 -35.235 -8.140 1.00 74.41 H new ATOM 0 HD2 PRO A 56 -6.828 -34.908 -10.817 1.00 55.11 H new ATOM 0 HD3 PRO A 56 -7.538 -33.662 -9.811 1.00 55.11 H new ATOM 870 N GLU A 57 -3.083 -34.639 -10.327 1.00 53.21 N ATOM 871 CA GLU A 57 -1.839 -35.207 -10.727 1.00 31.20 C ATOM 872 C GLU A 57 -0.950 -34.159 -11.396 1.00 11.32 C ATOM 873 O GLU A 57 0.271 -34.170 -11.237 1.00 40.10 O ATOM 874 CB GLU A 57 -2.168 -36.349 -11.675 1.00 11.23 C ATOM 875 CG GLU A 57 -2.952 -35.933 -12.918 1.00 74.52 C ATOM 876 CD GLU A 57 -3.221 -37.096 -13.859 1.00 43.42 C ATOM 877 OE1 GLU A 57 -2.350 -37.402 -14.701 1.00 10.41 O ATOM 878 OE2 GLU A 57 -4.298 -37.718 -13.752 1.00 15.41 O ATOM 0 H GLU A 57 -3.893 -35.085 -10.757 1.00 53.21 H new ATOM 0 HA GLU A 57 -1.279 -35.574 -9.867 1.00 31.20 H new ATOM 0 HB2 GLU A 57 -1.238 -36.823 -11.989 1.00 11.23 H new ATOM 0 HB3 GLU A 57 -2.742 -37.101 -11.133 1.00 11.23 H new ATOM 0 HG2 GLU A 57 -3.901 -35.491 -12.613 1.00 74.52 H new ATOM 0 HG3 GLU A 57 -2.397 -35.161 -13.451 1.00 74.52 H new ATOM 885 N SER A 58 -1.583 -33.253 -12.138 1.00 43.04 N ATOM 886 CA SER A 58 -0.876 -32.171 -12.802 1.00 14.11 C ATOM 887 C SER A 58 -0.337 -31.183 -11.770 1.00 64.34 C ATOM 888 O SER A 58 0.847 -30.840 -11.784 1.00 15.34 O ATOM 889 CB SER A 58 -1.808 -31.467 -13.799 1.00 53.34 C ATOM 890 OG SER A 58 -1.117 -30.494 -14.564 1.00 0.11 O ATOM 0 H SER A 58 -2.591 -33.251 -12.292 1.00 43.04 H new ATOM 0 HA SER A 58 -0.031 -32.583 -13.354 1.00 14.11 H new ATOM 0 HB2 SER A 58 -2.253 -32.206 -14.466 1.00 53.34 H new ATOM 0 HB3 SER A 58 -2.627 -30.991 -13.259 1.00 53.34 H new ATOM 0 HG SER A 58 -1.149 -30.740 -15.512 1.00 0.11 H new ATOM 896 N SER A 59 -1.208 -30.766 -10.849 1.00 11.31 N ATOM 897 CA SER A 59 -0.865 -29.769 -9.839 1.00 64.13 C ATOM 898 C SER A 59 0.416 -30.153 -9.100 1.00 74.10 C ATOM 899 O SER A 59 1.377 -29.380 -9.040 1.00 53.43 O ATOM 900 CB SER A 59 -2.017 -29.627 -8.839 1.00 5.10 C ATOM 901 OG SER A 59 -3.258 -29.460 -9.503 1.00 31.55 O ATOM 0 H SER A 59 -2.166 -31.109 -10.784 1.00 11.31 H new ATOM 0 HA SER A 59 -0.697 -28.817 -10.342 1.00 64.13 H new ATOM 0 HB2 SER A 59 -2.059 -30.510 -8.202 1.00 5.10 H new ATOM 0 HB3 SER A 59 -1.833 -28.773 -8.188 1.00 5.10 H new ATOM 0 HG SER A 59 -3.316 -28.551 -9.864 1.00 31.55 H new ATOM 907 N ALA A 60 0.434 -31.378 -8.590 1.00 52.35 N ATOM 908 CA ALA A 60 1.541 -31.870 -7.777 1.00 44.05 C ATOM 909 C ALA A 60 2.844 -31.986 -8.576 1.00 65.01 C ATOM 910 O ALA A 60 3.889 -32.312 -8.010 1.00 55.43 O ATOM 911 CB ALA A 60 1.178 -33.215 -7.161 1.00 33.33 C ATOM 0 H ALA A 60 -0.315 -32.057 -8.727 1.00 52.35 H new ATOM 0 HA ALA A 60 1.714 -31.141 -6.986 1.00 44.05 H new ATOM 0 HB1 ALA A 60 2.010 -33.575 -6.556 1.00 33.33 H new ATOM 0 HB2 ALA A 60 0.295 -33.101 -6.532 1.00 33.33 H new ATOM 0 HB3 ALA A 60 0.969 -33.934 -7.953 1.00 33.33 H new ATOM 917 N GLN A 61 2.784 -31.733 -9.883 1.00 51.35 N ATOM 918 CA GLN A 61 3.951 -31.905 -10.749 1.00 31.01 C ATOM 919 C GLN A 61 4.353 -30.610 -11.475 1.00 42.21 C ATOM 920 O GLN A 61 5.520 -30.455 -11.840 1.00 61.11 O ATOM 921 CB GLN A 61 3.674 -33.008 -11.776 1.00 62.35 C ATOM 922 CG GLN A 61 4.868 -33.330 -12.669 1.00 12.53 C ATOM 923 CD GLN A 61 4.553 -34.378 -13.720 1.00 33.44 C ATOM 924 OE1 GLN A 61 3.417 -34.495 -14.174 1.00 35.13 O ATOM 925 NE2 GLN A 61 5.556 -35.142 -14.121 1.00 62.21 N ATOM 0 H GLN A 61 1.945 -31.410 -10.364 1.00 51.35 H new ATOM 0 HA GLN A 61 4.787 -32.184 -10.107 1.00 31.01 H new ATOM 0 HB2 GLN A 61 3.370 -33.913 -11.250 1.00 62.35 H new ATOM 0 HB3 GLN A 61 2.834 -32.706 -12.402 1.00 62.35 H new ATOM 0 HG2 GLN A 61 5.203 -32.417 -13.162 1.00 12.53 H new ATOM 0 HG3 GLN A 61 5.694 -33.680 -12.050 1.00 12.53 H new ATOM 0 HE21 GLN A 61 6.486 -35.015 -13.721 1.00 62.21 H new ATOM 0 HE22 GLN A 61 5.400 -35.858 -14.831 1.00 62.21 H new ATOM 934 N ILE A 62 3.409 -29.679 -11.673 1.00 4.23 N ATOM 935 CA ILE A 62 3.688 -28.461 -12.455 1.00 32.12 C ATOM 936 C ILE A 62 4.895 -27.709 -11.891 1.00 0.54 C ATOM 937 O ILE A 62 5.822 -27.361 -12.624 1.00 12.44 O ATOM 938 CB ILE A 62 2.459 -27.511 -12.498 1.00 60.44 C ATOM 939 CG1 ILE A 62 1.282 -28.184 -13.226 1.00 42.11 C ATOM 940 CG2 ILE A 62 2.814 -26.181 -13.167 1.00 4.10 C ATOM 941 CD1 ILE A 62 0.040 -27.322 -13.318 1.00 43.34 C ATOM 0 H ILE A 62 2.458 -29.741 -11.309 1.00 4.23 H new ATOM 0 HA ILE A 62 3.911 -28.784 -13.472 1.00 32.12 H new ATOM 0 HB ILE A 62 2.159 -27.302 -11.471 1.00 60.44 H new ATOM 0 HG12 ILE A 62 1.599 -28.456 -14.233 1.00 42.11 H new ATOM 0 HG13 ILE A 62 1.031 -29.111 -12.710 1.00 42.11 H new ATOM 0 HG21 ILE A 62 1.935 -25.536 -13.183 1.00 4.10 H new ATOM 0 HG22 ILE A 62 3.612 -25.693 -12.607 1.00 4.10 H new ATOM 0 HG23 ILE A 62 3.148 -26.365 -14.188 1.00 4.10 H new ATOM 0 HD11 ILE A 62 -0.743 -27.867 -13.844 1.00 43.34 H new ATOM 0 HD12 ILE A 62 -0.304 -27.071 -12.315 1.00 43.34 H new ATOM 0 HD13 ILE A 62 0.272 -26.406 -13.861 1.00 43.34 H new ATOM 953 N ASP A 63 4.872 -27.452 -10.589 1.00 4.21 N ATOM 954 CA ASP A 63 6.057 -26.969 -9.876 1.00 24.12 C ATOM 955 C ASP A 63 6.402 -27.918 -8.732 1.00 32.11 C ATOM 956 O ASP A 63 7.478 -27.827 -8.134 1.00 51.03 O ATOM 957 CB ASP A 63 5.862 -25.539 -9.354 1.00 63.41 C ATOM 958 CG ASP A 63 4.757 -25.432 -8.323 1.00 3.22 C ATOM 959 OD1 ASP A 63 3.584 -25.256 -8.722 1.00 1.22 O ATOM 960 OD2 ASP A 63 5.057 -25.515 -7.114 1.00 51.45 O ATOM 0 H ASP A 63 4.047 -27.569 -10.001 1.00 4.21 H new ATOM 0 HA ASP A 63 6.887 -26.946 -10.582 1.00 24.12 H new ATOM 0 HB2 ASP A 63 6.796 -25.187 -8.916 1.00 63.41 H new ATOM 0 HB3 ASP A 63 5.635 -24.880 -10.192 1.00 63.41 H new ATOM 965 N GLY A 64 5.468 -28.820 -8.424 1.00 4.34 N ATOM 966 CA GLY A 64 5.691 -29.818 -7.393 1.00 4.15 C ATOM 967 C GLY A 64 5.046 -29.459 -6.065 1.00 21.32 C ATOM 968 O GLY A 64 5.732 -29.389 -5.043 1.00 74.55 O ATOM 0 H GLY A 64 4.555 -28.875 -8.876 1.00 4.34 H new ATOM 0 HA2 GLY A 64 5.299 -30.777 -7.733 1.00 4.15 H new ATOM 0 HA3 GLY A 64 6.763 -29.946 -7.246 1.00 4.15 H new ATOM 972 N VAL A 65 3.730 -29.234 -6.071 1.00 53.23 N ATOM 973 CA VAL A 65 2.986 -28.938 -4.842 1.00 5.12 C ATOM 974 C VAL A 65 1.486 -29.104 -5.082 1.00 22.24 C ATOM 975 O VAL A 65 1.021 -29.003 -6.219 1.00 34.45 O ATOM 976 CB VAL A 65 3.261 -27.495 -4.333 1.00 20.52 C ATOM 977 CG1 VAL A 65 2.693 -26.454 -5.297 1.00 63.22 C ATOM 978 CG2 VAL A 65 2.701 -27.293 -2.924 1.00 11.54 C ATOM 0 H VAL A 65 3.156 -29.251 -6.914 1.00 53.23 H new ATOM 0 HA VAL A 65 3.325 -29.642 -4.082 1.00 5.12 H new ATOM 0 HB VAL A 65 4.342 -27.359 -4.289 1.00 20.52 H new ATOM 0 HG11 VAL A 65 2.900 -25.454 -4.916 1.00 63.22 H new ATOM 0 HG12 VAL A 65 3.158 -26.573 -6.276 1.00 63.22 H new ATOM 0 HG13 VAL A 65 1.616 -26.592 -5.388 1.00 63.22 H new ATOM 0 HG21 VAL A 65 2.907 -26.275 -2.593 1.00 11.54 H new ATOM 0 HG22 VAL A 65 1.624 -27.460 -2.933 1.00 11.54 H new ATOM 0 HG23 VAL A 65 3.172 -27.999 -2.241 1.00 11.54 H new ATOM 988 N VAL A 66 0.738 -29.380 -4.013 1.00 30.32 N ATOM 989 CA VAL A 66 -0.721 -29.421 -4.078 1.00 1.42 C ATOM 990 C VAL A 66 -1.327 -28.913 -2.763 1.00 32.13 C ATOM 991 O VAL A 66 -1.355 -29.614 -1.749 1.00 51.15 O ATOM 992 CB VAL A 66 -1.240 -30.850 -4.422 1.00 14.41 C ATOM 993 CG1 VAL A 66 -0.689 -31.898 -3.454 1.00 5.23 C ATOM 994 CG2 VAL A 66 -2.769 -30.885 -4.463 1.00 34.45 C ATOM 0 H VAL A 66 1.122 -29.579 -3.089 1.00 30.32 H new ATOM 0 HA VAL A 66 -1.042 -28.761 -4.884 1.00 1.42 H new ATOM 0 HB VAL A 66 -0.872 -31.101 -5.417 1.00 14.41 H new ATOM 0 HG11 VAL A 66 -1.073 -32.881 -3.725 1.00 5.23 H new ATOM 0 HG12 VAL A 66 0.400 -31.906 -3.507 1.00 5.23 H new ATOM 0 HG13 VAL A 66 -1.001 -31.655 -2.438 1.00 5.23 H new ATOM 0 HG21 VAL A 66 -3.103 -31.894 -4.705 1.00 34.45 H new ATOM 0 HG22 VAL A 66 -3.166 -30.595 -3.490 1.00 34.45 H new ATOM 0 HG23 VAL A 66 -3.129 -30.191 -5.223 1.00 34.45 H new ATOM 1004 N SER A 67 -1.747 -27.655 -2.782 1.00 53.53 N ATOM 1005 CA SER A 67 -2.390 -27.009 -1.644 1.00 63.30 C ATOM 1006 C SER A 67 -3.442 -26.022 -2.156 1.00 25.11 C ATOM 1007 O SER A 67 -3.592 -25.870 -3.363 1.00 45.11 O ATOM 1008 CB SER A 67 -1.341 -26.314 -0.771 1.00 44.10 C ATOM 1009 OG SER A 67 -0.395 -27.251 -0.278 1.00 1.41 O ATOM 0 H SER A 67 -1.650 -27.048 -3.596 1.00 53.53 H new ATOM 0 HA SER A 67 -2.889 -27.754 -1.024 1.00 63.30 H new ATOM 0 HB2 SER A 67 -0.830 -25.545 -1.351 1.00 44.10 H new ATOM 0 HB3 SER A 67 -1.831 -25.811 0.063 1.00 44.10 H new ATOM 0 HG SER A 67 0.267 -26.787 0.276 1.00 1.41 H new ATOM 1015 N LYS A 68 -4.161 -25.351 -1.257 1.00 41.35 N ATOM 1016 CA LYS A 68 -5.229 -24.424 -1.666 1.00 53.40 C ATOM 1017 C LYS A 68 -4.707 -23.364 -2.645 1.00 61.41 C ATOM 1018 O LYS A 68 -5.437 -22.895 -3.521 1.00 72.23 O ATOM 1019 CB LYS A 68 -5.870 -23.727 -0.451 1.00 10.32 C ATOM 1020 CG LYS A 68 -6.701 -24.643 0.449 1.00 71.13 C ATOM 1021 CD LYS A 68 -5.836 -25.592 1.273 1.00 22.42 C ATOM 1022 CE LYS A 68 -6.681 -26.520 2.137 1.00 22.41 C ATOM 1023 NZ LYS A 68 -7.554 -27.408 1.323 1.00 5.02 N ATOM 0 H LYS A 68 -4.030 -25.427 -0.248 1.00 41.35 H new ATOM 0 HA LYS A 68 -5.988 -25.024 -2.167 1.00 53.40 H new ATOM 0 HB2 LYS A 68 -5.081 -23.272 0.147 1.00 10.32 H new ATOM 0 HB3 LYS A 68 -6.506 -22.917 -0.808 1.00 10.32 H new ATOM 0 HG2 LYS A 68 -7.308 -24.035 1.120 1.00 71.13 H new ATOM 0 HG3 LYS A 68 -7.389 -25.224 -0.165 1.00 71.13 H new ATOM 0 HD2 LYS A 68 -5.210 -26.185 0.606 1.00 22.42 H new ATOM 0 HD3 LYS A 68 -5.165 -25.014 1.909 1.00 22.42 H new ATOM 0 HE2 LYS A 68 -6.026 -27.129 2.760 1.00 22.41 H new ATOM 0 HE3 LYS A 68 -7.298 -25.925 2.810 1.00 22.41 H new ATOM 0 HZ1 LYS A 68 -7.954 -28.152 1.929 1.00 5.02 H new ATOM 0 HZ2 LYS A 68 -8.326 -26.849 0.906 1.00 5.02 H new ATOM 0 HZ3 LYS A 68 -6.993 -27.845 0.564 1.00 5.02 H new ATOM 1037 N ASP A 69 -3.437 -23.005 -2.503 1.00 15.13 N ATOM 1038 CA ASP A 69 -2.815 -21.982 -3.347 1.00 73.13 C ATOM 1039 C ASP A 69 -2.705 -22.441 -4.804 1.00 2.11 C ATOM 1040 O ASP A 69 -2.483 -21.619 -5.699 1.00 71.50 O ATOM 1041 CB ASP A 69 -1.438 -21.573 -2.803 1.00 3.14 C ATOM 1042 CG ASP A 69 -0.453 -22.729 -2.748 1.00 33.44 C ATOM 1043 OD1 ASP A 69 -0.505 -23.504 -1.771 1.00 53.11 O ATOM 1044 OD2 ASP A 69 0.384 -22.857 -3.668 1.00 3.03 O ATOM 0 H ASP A 69 -2.810 -23.409 -1.807 1.00 15.13 H new ATOM 0 HA ASP A 69 -3.465 -21.107 -3.322 1.00 73.13 H new ATOM 0 HB2 ASP A 69 -1.026 -20.782 -3.430 1.00 3.14 H new ATOM 0 HB3 ASP A 69 -1.558 -21.157 -1.803 1.00 3.14 H new ATOM 1049 N GLU A 70 -2.847 -23.749 -5.036 1.00 14.54 N ATOM 1050 CA GLU A 70 -2.756 -24.315 -6.388 1.00 21.21 C ATOM 1051 C GLU A 70 -3.715 -23.592 -7.331 1.00 20.22 C ATOM 1052 O GLU A 70 -3.424 -23.422 -8.515 1.00 62.31 O ATOM 1053 CB GLU A 70 -3.068 -25.826 -6.384 1.00 43.43 C ATOM 1054 CG GLU A 70 -4.545 -26.162 -6.150 1.00 54.45 C ATOM 1055 CD GLU A 70 -4.818 -27.659 -6.091 1.00 72.43 C ATOM 1056 OE1 GLU A 70 -4.787 -28.318 -7.152 1.00 53.25 O ATOM 1057 OE2 GLU A 70 -5.085 -28.180 -4.980 1.00 33.23 O ATOM 0 H GLU A 70 -3.026 -24.438 -4.305 1.00 14.54 H new ATOM 0 HA GLU A 70 -1.733 -24.177 -6.738 1.00 21.21 H new ATOM 0 HB2 GLU A 70 -2.757 -26.252 -7.338 1.00 43.43 H new ATOM 0 HB3 GLU A 70 -2.470 -26.307 -5.610 1.00 43.43 H new ATOM 0 HG2 GLU A 70 -4.872 -25.703 -5.217 1.00 54.45 H new ATOM 0 HG3 GLU A 70 -5.142 -25.722 -6.949 1.00 54.45 H new ATOM 1064 N ILE A 71 -4.849 -23.146 -6.792 1.00 21.23 N ATOM 1065 CA ILE A 71 -5.831 -22.416 -7.580 1.00 21.42 C ATOM 1066 C ILE A 71 -5.195 -21.142 -8.135 1.00 5.33 C ATOM 1067 O ILE A 71 -5.251 -20.874 -9.337 1.00 63.22 O ATOM 1068 CB ILE A 71 -7.089 -22.048 -6.747 1.00 25.30 C ATOM 1069 CG1 ILE A 71 -7.742 -23.309 -6.143 1.00 51.32 C ATOM 1070 CG2 ILE A 71 -8.095 -21.289 -7.616 1.00 34.21 C ATOM 1071 CD1 ILE A 71 -8.895 -23.011 -5.205 1.00 41.44 C ATOM 0 H ILE A 71 -5.107 -23.279 -5.814 1.00 21.23 H new ATOM 0 HA ILE A 71 -6.151 -23.065 -8.395 1.00 21.42 H new ATOM 0 HB ILE A 71 -6.777 -21.404 -5.925 1.00 25.30 H new ATOM 0 HG12 ILE A 71 -8.100 -23.945 -6.953 1.00 51.32 H new ATOM 0 HG13 ILE A 71 -6.984 -23.876 -5.603 1.00 51.32 H new ATOM 0 HG21 ILE A 71 -8.973 -21.037 -7.021 1.00 34.21 H new ATOM 0 HG22 ILE A 71 -7.635 -20.374 -7.990 1.00 34.21 H new ATOM 0 HG23 ILE A 71 -8.395 -21.915 -8.457 1.00 34.21 H new ATOM 0 HD11 ILE A 71 -9.302 -23.946 -4.821 1.00 41.44 H new ATOM 0 HD12 ILE A 71 -8.540 -22.401 -4.374 1.00 41.44 H new ATOM 0 HD13 ILE A 71 -9.673 -22.471 -5.745 1.00 41.44 H new ATOM 1083 N GLU A 72 -4.555 -20.385 -7.243 1.00 15.22 N ATOM 1084 CA GLU A 72 -3.905 -19.127 -7.604 1.00 53.51 C ATOM 1085 C GLU A 72 -2.813 -19.365 -8.646 1.00 55.15 C ATOM 1086 O GLU A 72 -2.616 -18.554 -9.553 1.00 64.43 O ATOM 1087 CB GLU A 72 -3.304 -18.463 -6.357 1.00 52.51 C ATOM 1088 CG GLU A 72 -4.273 -18.383 -5.184 1.00 33.15 C ATOM 1089 CD GLU A 72 -3.802 -17.440 -4.090 1.00 43.24 C ATOM 1090 OE1 GLU A 72 -3.042 -17.882 -3.204 1.00 15.35 O ATOM 1091 OE2 GLU A 72 -4.188 -16.252 -4.112 1.00 52.10 O ATOM 0 H GLU A 72 -4.473 -20.626 -6.255 1.00 15.22 H new ATOM 0 HA GLU A 72 -4.656 -18.464 -8.033 1.00 53.51 H new ATOM 0 HB2 GLU A 72 -2.419 -19.020 -6.049 1.00 52.51 H new ATOM 0 HB3 GLU A 72 -2.974 -17.457 -6.614 1.00 52.51 H new ATOM 0 HG2 GLU A 72 -5.247 -18.054 -5.546 1.00 33.15 H new ATOM 0 HG3 GLU A 72 -4.409 -19.379 -4.764 1.00 33.15 H new ATOM 1098 N LYS A 73 -2.111 -20.486 -8.499 1.00 41.33 N ATOM 1099 CA LYS A 73 -1.059 -20.869 -9.435 1.00 45.24 C ATOM 1100 C LYS A 73 -1.638 -21.045 -10.836 1.00 24.45 C ATOM 1101 O LYS A 73 -1.216 -20.374 -11.779 1.00 4.23 O ATOM 1102 CB LYS A 73 -0.372 -22.163 -8.965 1.00 73.41 C ATOM 1103 CG LYS A 73 0.610 -22.758 -9.976 1.00 61.01 C ATOM 1104 CD LYS A 73 1.675 -21.752 -10.412 1.00 25.10 C ATOM 1105 CE LYS A 73 2.682 -22.379 -11.368 1.00 44.05 C ATOM 1106 NZ LYS A 73 3.486 -23.437 -10.704 1.00 4.13 N ATOM 0 H LYS A 73 -2.253 -21.148 -7.736 1.00 41.33 H new ATOM 0 HA LYS A 73 -0.312 -20.076 -9.468 1.00 45.24 H new ATOM 0 HB2 LYS A 73 0.160 -21.961 -8.035 1.00 73.41 H new ATOM 0 HB3 LYS A 73 -1.137 -22.906 -8.739 1.00 73.41 H new ATOM 0 HG2 LYS A 73 1.095 -23.630 -9.538 1.00 61.01 H new ATOM 0 HG3 LYS A 73 0.061 -23.105 -10.851 1.00 61.01 H new ATOM 0 HD2 LYS A 73 1.196 -20.900 -10.895 1.00 25.10 H new ATOM 0 HD3 LYS A 73 2.196 -21.369 -9.534 1.00 25.10 H new ATOM 0 HE2 LYS A 73 2.156 -22.804 -12.223 1.00 44.05 H new ATOM 0 HE3 LYS A 73 3.346 -21.606 -11.755 1.00 44.05 H new ATOM 0 HZ1 LYS A 73 4.050 -23.943 -11.416 1.00 4.13 H new ATOM 0 HZ2 LYS A 73 4.121 -23.003 -10.004 1.00 4.13 H new ATOM 0 HZ3 LYS A 73 2.851 -24.107 -10.226 1.00 4.13 H new ATOM 1120 N PHE A 74 -2.626 -21.932 -10.954 1.00 11.22 N ATOM 1121 CA PHE A 74 -3.262 -22.220 -12.240 1.00 22.20 C ATOM 1122 C PHE A 74 -3.826 -20.948 -12.862 1.00 73.02 C ATOM 1123 O PHE A 74 -3.780 -20.772 -14.078 1.00 45.14 O ATOM 1124 CB PHE A 74 -4.368 -23.269 -12.069 1.00 10.05 C ATOM 1125 CG PHE A 74 -3.853 -24.674 -11.869 1.00 14.54 C ATOM 1126 CD1 PHE A 74 -2.881 -24.948 -10.916 1.00 44.33 C ATOM 1127 CD2 PHE A 74 -4.348 -25.722 -12.630 1.00 44.31 C ATOM 1128 CE1 PHE A 74 -2.415 -26.234 -10.732 1.00 1.45 C ATOM 1129 CE2 PHE A 74 -3.883 -27.009 -12.448 1.00 73.32 C ATOM 1130 CZ PHE A 74 -2.919 -27.265 -11.499 1.00 62.40 C ATOM 0 H PHE A 74 -3.005 -22.465 -10.171 1.00 11.22 H new ATOM 0 HA PHE A 74 -2.504 -22.621 -12.912 1.00 22.20 H new ATOM 0 HB2 PHE A 74 -4.987 -22.994 -11.215 1.00 10.05 H new ATOM 0 HB3 PHE A 74 -5.012 -23.250 -12.948 1.00 10.05 H new ATOM 0 HD1 PHE A 74 -2.485 -24.145 -10.312 1.00 44.33 H new ATOM 0 HD2 PHE A 74 -5.107 -25.529 -13.374 1.00 44.31 H new ATOM 0 HE1 PHE A 74 -1.657 -26.433 -9.989 1.00 1.45 H new ATOM 0 HE2 PHE A 74 -4.275 -27.815 -13.050 1.00 73.32 H new ATOM 0 HZ PHE A 74 -2.557 -28.272 -11.355 1.00 62.40 H new ATOM 1140 N ILE A 75 -4.351 -20.067 -12.021 1.00 65.43 N ATOM 1141 CA ILE A 75 -4.842 -18.773 -12.474 1.00 31.44 C ATOM 1142 C ILE A 75 -3.697 -17.956 -13.079 1.00 22.43 C ATOM 1143 O ILE A 75 -3.803 -17.433 -14.196 1.00 22.03 O ATOM 1144 CB ILE A 75 -5.494 -17.993 -11.304 1.00 14.34 C ATOM 1145 CG1 ILE A 75 -6.752 -18.727 -10.811 1.00 51.04 C ATOM 1146 CG2 ILE A 75 -5.829 -16.563 -11.716 1.00 31.23 C ATOM 1147 CD1 ILE A 75 -7.349 -18.141 -9.548 1.00 30.54 C ATOM 0 H ILE A 75 -4.448 -20.226 -11.018 1.00 65.43 H new ATOM 0 HA ILE A 75 -5.600 -18.942 -13.239 1.00 31.44 H new ATOM 0 HB ILE A 75 -4.776 -17.943 -10.485 1.00 14.34 H new ATOM 0 HG12 ILE A 75 -7.504 -18.708 -11.600 1.00 51.04 H new ATOM 0 HG13 ILE A 75 -6.504 -19.773 -10.632 1.00 51.04 H new ATOM 0 HG21 ILE A 75 -6.285 -16.040 -10.876 1.00 31.23 H new ATOM 0 HG22 ILE A 75 -4.916 -16.047 -12.013 1.00 31.23 H new ATOM 0 HG23 ILE A 75 -6.525 -16.580 -12.554 1.00 31.23 H new ATOM 0 HD11 ILE A 75 -8.232 -18.713 -9.264 1.00 30.54 H new ATOM 0 HD12 ILE A 75 -6.614 -18.185 -8.744 1.00 30.54 H new ATOM 0 HD13 ILE A 75 -7.630 -17.103 -9.726 1.00 30.54 H new ATOM 1159 N ALA A 76 -2.590 -17.883 -12.348 1.00 52.44 N ATOM 1160 CA ALA A 76 -1.413 -17.148 -12.800 1.00 4.04 C ATOM 1161 C ALA A 76 -0.897 -17.705 -14.128 1.00 21.11 C ATOM 1162 O ALA A 76 -0.436 -16.949 -14.988 1.00 25.25 O ATOM 1163 CB ALA A 76 -0.321 -17.189 -11.739 1.00 5.44 C ATOM 0 H ALA A 76 -2.483 -18.326 -11.436 1.00 52.44 H new ATOM 0 HA ALA A 76 -1.701 -16.109 -12.960 1.00 4.04 H new ATOM 0 HB1 ALA A 76 0.550 -16.636 -12.092 1.00 5.44 H new ATOM 0 HB2 ALA A 76 -0.690 -16.736 -10.819 1.00 5.44 H new ATOM 0 HB3 ALA A 76 -0.040 -18.224 -11.546 1.00 5.44 H new ATOM 1169 N ASP A 77 -1.001 -19.026 -14.293 1.00 61.03 N ATOM 1170 CA ASP A 77 -0.574 -19.699 -15.524 1.00 42.01 C ATOM 1171 C ASP A 77 -1.383 -19.217 -16.729 1.00 61.43 C ATOM 1172 O ASP A 77 -0.923 -19.305 -17.868 1.00 2.14 O ATOM 1173 CB ASP A 77 -0.694 -21.230 -15.393 1.00 63.45 C ATOM 1174 CG ASP A 77 0.440 -21.858 -14.591 1.00 43.21 C ATOM 1175 OD1 ASP A 77 1.611 -21.741 -15.021 1.00 31.32 O ATOM 1176 OD2 ASP A 77 0.166 -22.484 -13.543 1.00 14.33 O ATOM 0 H ASP A 77 -1.380 -19.655 -13.585 1.00 61.03 H new ATOM 0 HA ASP A 77 0.474 -19.443 -15.683 1.00 42.01 H new ATOM 0 HB2 ASP A 77 -1.644 -21.473 -14.917 1.00 63.45 H new ATOM 0 HB3 ASP A 77 -0.713 -21.672 -16.389 1.00 63.45 H new ATOM 1181 N VAL A 78 -2.582 -18.685 -16.476 1.00 0.21 N ATOM 1182 CA VAL A 78 -3.444 -18.183 -17.550 1.00 54.41 C ATOM 1183 C VAL A 78 -3.114 -16.717 -17.849 1.00 22.23 C ATOM 1184 O VAL A 78 -3.941 -15.959 -18.359 1.00 42.11 O ATOM 1185 CB VAL A 78 -4.944 -18.334 -17.178 1.00 74.43 C ATOM 1186 CG1 VAL A 78 -5.854 -18.034 -18.370 1.00 55.44 C ATOM 1187 CG2 VAL A 78 -5.223 -19.734 -16.637 1.00 24.11 C ATOM 0 H VAL A 78 -2.977 -18.591 -15.540 1.00 0.21 H new ATOM 0 HA VAL A 78 -3.257 -18.778 -18.444 1.00 54.41 H new ATOM 0 HB VAL A 78 -5.164 -17.604 -16.400 1.00 74.43 H new ATOM 0 HG11 VAL A 78 -6.896 -18.150 -18.071 1.00 55.44 H new ATOM 0 HG12 VAL A 78 -5.685 -17.012 -18.708 1.00 55.44 H new ATOM 0 HG13 VAL A 78 -5.630 -18.726 -19.182 1.00 55.44 H new ATOM 0 HG21 VAL A 78 -6.279 -19.822 -16.382 1.00 24.11 H new ATOM 0 HG22 VAL A 78 -4.971 -20.474 -17.396 1.00 24.11 H new ATOM 0 HG23 VAL A 78 -4.619 -19.907 -15.746 1.00 24.11 H new ATOM 1197 N THR A 79 -1.881 -16.329 -17.522 1.00 30.41 N ATOM 1198 CA THR A 79 -1.381 -14.987 -17.811 1.00 54.12 C ATOM 1199 C THR A 79 -2.114 -13.938 -16.974 1.00 71.50 C ATOM 1200 O THR A 79 -2.043 -12.745 -17.249 1.00 33.50 O ATOM 1201 CB THR A 79 -1.505 -14.668 -19.327 1.00 72.30 C ATOM 1202 OG1 THR A 79 -1.053 -15.800 -20.093 1.00 53.21 O ATOM 1203 CG2 THR A 79 -0.688 -13.438 -19.725 1.00 22.22 C ATOM 0 H THR A 79 -1.206 -16.932 -17.053 1.00 30.41 H new ATOM 0 HA THR A 79 -0.325 -14.955 -17.541 1.00 54.12 H new ATOM 0 HB THR A 79 -2.554 -14.456 -19.534 1.00 72.30 H new ATOM 0 HG1 THR A 79 -1.132 -15.601 -21.049 1.00 53.21 H new ATOM 0 HG21 THR A 79 -0.805 -13.253 -20.793 1.00 22.22 H new ATOM 0 HG22 THR A 79 -1.040 -12.571 -19.166 1.00 22.22 H new ATOM 0 HG23 THR A 79 0.364 -13.612 -19.500 1.00 22.22 H new ATOM 1211 N LYS A 80 -2.801 -14.388 -15.925 1.00 61.35 N ATOM 1212 CA LYS A 80 -3.420 -13.469 -14.981 1.00 2.22 C ATOM 1213 C LYS A 80 -2.340 -12.807 -14.129 1.00 73.41 C ATOM 1214 O LYS A 80 -2.513 -11.675 -13.671 1.00 21.42 O ATOM 1215 CB LYS A 80 -4.450 -14.196 -14.097 1.00 2.02 C ATOM 1216 CG LYS A 80 -4.964 -13.376 -12.908 1.00 21.24 C ATOM 1217 CD LYS A 80 -5.516 -12.006 -13.313 1.00 33.52 C ATOM 1218 CE LYS A 80 -6.779 -12.105 -14.157 1.00 30.34 C ATOM 1219 NZ LYS A 80 -7.913 -12.664 -13.389 1.00 71.14 N ATOM 0 H LYS A 80 -2.940 -15.376 -15.711 1.00 61.35 H new ATOM 0 HA LYS A 80 -3.954 -12.698 -15.537 1.00 2.22 H new ATOM 0 HB2 LYS A 80 -5.299 -14.486 -14.715 1.00 2.02 H new ATOM 0 HB3 LYS A 80 -4.001 -15.115 -13.720 1.00 2.02 H new ATOM 0 HG2 LYS A 80 -5.746 -13.939 -12.398 1.00 21.24 H new ATOM 0 HG3 LYS A 80 -4.153 -13.237 -12.193 1.00 21.24 H new ATOM 0 HD2 LYS A 80 -5.729 -11.425 -12.415 1.00 33.52 H new ATOM 0 HD3 LYS A 80 -4.753 -11.463 -13.871 1.00 33.52 H new ATOM 0 HE2 LYS A 80 -7.045 -11.116 -14.529 1.00 30.34 H new ATOM 0 HE3 LYS A 80 -6.586 -12.732 -15.027 1.00 30.34 H new ATOM 0 HZ1 LYS A 80 -8.808 -12.313 -13.786 1.00 71.14 H new ATOM 0 HZ2 LYS A 80 -7.892 -13.702 -13.446 1.00 71.14 H new ATOM 0 HZ3 LYS A 80 -7.837 -12.370 -12.394 1.00 71.14 H new ATOM 1233 N ASP A 81 -1.221 -13.517 -13.948 1.00 15.43 N ATOM 1234 CA ASP A 81 -0.083 -13.017 -13.165 1.00 70.42 C ATOM 1235 C ASP A 81 -0.473 -12.787 -11.703 1.00 63.31 C ATOM 1236 O ASP A 81 -0.060 -13.535 -10.817 1.00 51.31 O ATOM 1237 CB ASP A 81 0.483 -11.723 -13.781 1.00 15.35 C ATOM 1238 CG ASP A 81 1.545 -11.981 -14.836 1.00 71.41 C ATOM 1239 OD1 ASP A 81 2.722 -12.179 -14.466 1.00 53.32 O ATOM 1240 OD2 ASP A 81 1.213 -11.982 -16.040 1.00 21.22 O ATOM 0 H ASP A 81 -1.078 -14.449 -14.337 1.00 15.43 H new ATOM 0 HA ASP A 81 0.695 -13.780 -13.191 1.00 70.42 H new ATOM 0 HB2 ASP A 81 -0.332 -11.153 -14.226 1.00 15.35 H new ATOM 0 HB3 ASP A 81 0.908 -11.106 -12.989 1.00 15.35 H new ATOM 1245 N GLU A 82 -1.249 -11.737 -11.467 1.00 51.11 N ATOM 1246 CA GLU A 82 -1.765 -11.406 -10.141 1.00 23.24 C ATOM 1247 C GLU A 82 -3.160 -12.015 -9.955 1.00 62.30 C ATOM 1248 O GLU A 82 -4.146 -11.480 -10.466 1.00 24.41 O ATOM 1249 CB GLU A 82 -1.839 -9.880 -9.995 1.00 2.34 C ATOM 1250 CG GLU A 82 -2.500 -9.390 -8.708 1.00 51.23 C ATOM 1251 CD GLU A 82 -2.963 -7.942 -8.812 1.00 42.24 C ATOM 1252 OE1 GLU A 82 -4.063 -7.705 -9.359 1.00 14.04 O ATOM 1253 OE2 GLU A 82 -2.228 -7.033 -8.371 1.00 21.23 O ATOM 0 H GLU A 82 -1.541 -11.085 -12.195 1.00 51.11 H new ATOM 0 HA GLU A 82 -1.099 -11.814 -9.380 1.00 23.24 H new ATOM 0 HB2 GLU A 82 -0.828 -9.475 -10.044 1.00 2.34 H new ATOM 0 HB3 GLU A 82 -2.387 -9.474 -10.845 1.00 2.34 H new ATOM 0 HG2 GLU A 82 -3.354 -10.026 -8.475 1.00 51.23 H new ATOM 0 HG3 GLU A 82 -1.796 -9.486 -7.881 1.00 51.23 H new ATOM 1260 N PRO A 83 -3.265 -13.157 -9.255 1.00 41.20 N ATOM 1261 CA PRO A 83 -4.553 -13.795 -8.989 1.00 1.43 C ATOM 1262 C PRO A 83 -5.274 -13.107 -7.827 1.00 63.44 C ATOM 1263 O PRO A 83 -4.762 -13.069 -6.705 1.00 23.54 O ATOM 1264 CB PRO A 83 -4.161 -15.235 -8.635 1.00 4.40 C ATOM 1265 CG PRO A 83 -2.792 -15.129 -8.044 1.00 51.24 C ATOM 1266 CD PRO A 83 -2.140 -13.911 -8.662 1.00 42.23 C ATOM 0 HA PRO A 83 -5.245 -13.740 -9.829 1.00 1.43 H new ATOM 0 HB2 PRO A 83 -4.864 -15.673 -7.926 1.00 4.40 H new ATOM 0 HB3 PRO A 83 -4.161 -15.873 -9.519 1.00 4.40 H new ATOM 0 HG2 PRO A 83 -2.846 -15.030 -6.960 1.00 51.24 H new ATOM 0 HG3 PRO A 83 -2.210 -16.027 -8.254 1.00 51.24 H new ATOM 0 HD2 PRO A 83 -1.614 -13.318 -7.914 1.00 42.23 H new ATOM 0 HD3 PRO A 83 -1.407 -14.192 -9.418 1.00 42.23 H new ATOM 1274 N THR A 84 -6.446 -12.538 -8.098 1.00 62.44 N ATOM 1275 CA THR A 84 -7.195 -11.816 -7.074 1.00 64.50 C ATOM 1276 C THR A 84 -8.236 -12.719 -6.412 1.00 62.30 C ATOM 1277 O THR A 84 -8.649 -13.746 -6.979 1.00 22.53 O ATOM 1278 CB THR A 84 -7.889 -10.551 -7.643 1.00 74.30 C ATOM 1279 OG1 THR A 84 -8.560 -9.839 -6.595 1.00 4.04 O ATOM 1280 CG2 THR A 84 -8.896 -10.902 -8.732 1.00 32.20 C ATOM 0 H THR A 84 -6.895 -12.563 -9.013 1.00 62.44 H new ATOM 0 HA THR A 84 -6.470 -11.498 -6.325 1.00 64.50 H new ATOM 0 HB THR A 84 -7.112 -9.924 -8.080 1.00 74.30 H new ATOM 0 HG1 THR A 84 -8.993 -9.042 -6.966 1.00 4.04 H new ATOM 0 HG21 THR A 84 -9.361 -9.990 -9.105 1.00 32.20 H new ATOM 0 HG22 THR A 84 -8.385 -11.410 -9.550 1.00 32.20 H new ATOM 0 HG23 THR A 84 -9.663 -11.558 -8.320 1.00 32.20 H new ATOM 1288 N ALA A 85 -8.664 -12.314 -5.215 1.00 11.33 N ATOM 1289 CA ALA A 85 -9.647 -13.060 -4.438 1.00 53.25 C ATOM 1290 C ALA A 85 -10.892 -13.336 -5.270 1.00 55.44 C ATOM 1291 O ALA A 85 -11.574 -14.337 -5.063 1.00 52.34 O ATOM 1292 CB ALA A 85 -10.008 -12.298 -3.165 1.00 13.24 C ATOM 0 H ALA A 85 -8.338 -11.461 -4.760 1.00 11.33 H new ATOM 0 HA ALA A 85 -9.209 -14.017 -4.155 1.00 53.25 H new ATOM 0 HB1 ALA A 85 -10.743 -12.868 -2.596 1.00 13.24 H new ATOM 0 HB2 ALA A 85 -9.112 -12.155 -2.560 1.00 13.24 H new ATOM 0 HB3 ALA A 85 -10.427 -11.327 -3.429 1.00 13.24 H new ATOM 1298 N GLN A 86 -11.176 -12.446 -6.223 1.00 34.21 N ATOM 1299 CA GLN A 86 -12.295 -12.636 -7.136 1.00 11.51 C ATOM 1300 C GLN A 86 -12.078 -13.902 -7.959 1.00 50.40 C ATOM 1301 O GLN A 86 -12.930 -14.785 -7.992 1.00 71.31 O ATOM 1302 CB GLN A 86 -12.450 -11.428 -8.069 1.00 50.03 C ATOM 1303 CG GLN A 86 -13.718 -11.474 -8.918 1.00 41.24 C ATOM 1304 CD GLN A 86 -13.747 -10.401 -9.992 1.00 21.50 C ATOM 1305 OE1 GLN A 86 -13.333 -10.628 -11.128 1.00 41.43 O ATOM 1306 NE2 GLN A 86 -14.223 -9.219 -9.637 1.00 55.22 N ATOM 0 H GLN A 86 -10.645 -11.589 -6.379 1.00 34.21 H new ATOM 0 HA GLN A 86 -13.208 -12.735 -6.549 1.00 11.51 H new ATOM 0 HB2 GLN A 86 -12.455 -10.516 -7.472 1.00 50.03 H new ATOM 0 HB3 GLN A 86 -11.583 -11.374 -8.727 1.00 50.03 H new ATOM 0 HG2 GLN A 86 -13.800 -12.454 -9.388 1.00 41.24 H new ATOM 0 HG3 GLN A 86 -14.587 -11.357 -8.271 1.00 41.24 H new ATOM 0 HE21 GLN A 86 -14.557 -9.069 -8.685 1.00 55.22 H new ATOM 0 HE22 GLN A 86 -14.256 -8.458 -10.315 1.00 55.22 H new ATOM 1315 N ASP A 87 -10.920 -13.986 -8.611 1.00 24.32 N ATOM 1316 CA ASP A 87 -10.556 -15.157 -9.408 1.00 32.24 C ATOM 1317 C ASP A 87 -10.627 -16.419 -8.569 1.00 42.21 C ATOM 1318 O ASP A 87 -11.290 -17.382 -8.944 1.00 5.42 O ATOM 1319 CB ASP A 87 -9.140 -15.030 -9.980 1.00 62.23 C ATOM 1320 CG ASP A 87 -8.990 -13.915 -10.995 1.00 31.03 C ATOM 1321 OD1 ASP A 87 -9.781 -13.874 -11.960 1.00 21.13 O ATOM 1322 OD2 ASP A 87 -8.069 -13.084 -10.841 1.00 14.52 O ATOM 0 H ASP A 87 -10.213 -13.251 -8.603 1.00 24.32 H new ATOM 0 HA ASP A 87 -11.269 -15.216 -10.230 1.00 32.24 H new ATOM 0 HB2 ASP A 87 -8.441 -14.860 -9.161 1.00 62.23 H new ATOM 0 HB3 ASP A 87 -8.860 -15.974 -10.447 1.00 62.23 H new ATOM 1327 N ILE A 88 -9.952 -16.402 -7.422 1.00 41.24 N ATOM 1328 CA ILE A 88 -9.954 -17.557 -6.526 1.00 12.41 C ATOM 1329 C ILE A 88 -11.382 -17.936 -6.138 1.00 62.53 C ATOM 1330 O ILE A 88 -11.738 -19.110 -6.127 1.00 0.14 O ATOM 1331 CB ILE A 88 -9.099 -17.313 -5.249 1.00 4.11 C ATOM 1332 CG1 ILE A 88 -7.596 -17.386 -5.584 1.00 4.15 C ATOM 1333 CG2 ILE A 88 -9.446 -18.317 -4.146 1.00 3.10 C ATOM 1334 CD1 ILE A 88 -7.086 -16.255 -6.451 1.00 42.04 C ATOM 0 H ILE A 88 -9.401 -15.609 -7.093 1.00 41.24 H new ATOM 0 HA ILE A 88 -9.500 -18.384 -7.072 1.00 12.41 H new ATOM 0 HB ILE A 88 -9.330 -16.314 -4.880 1.00 4.11 H new ATOM 0 HG12 ILE A 88 -7.030 -17.395 -4.653 1.00 4.15 H new ATOM 0 HG13 ILE A 88 -7.395 -18.331 -6.088 1.00 4.15 H new ATOM 0 HG21 ILE A 88 -8.831 -18.119 -3.268 1.00 3.10 H new ATOM 0 HG22 ILE A 88 -10.499 -18.218 -3.882 1.00 3.10 H new ATOM 0 HG23 ILE A 88 -9.255 -19.329 -4.502 1.00 3.10 H new ATOM 0 HD11 ILE A 88 -6.020 -16.390 -6.635 1.00 42.04 H new ATOM 0 HD12 ILE A 88 -7.621 -16.255 -7.401 1.00 42.04 H new ATOM 0 HD13 ILE A 88 -7.249 -15.305 -5.943 1.00 42.04 H new ATOM 1346 N SER A 89 -12.201 -16.933 -5.853 1.00 54.03 N ATOM 1347 CA SER A 89 -13.584 -17.159 -5.450 1.00 31.54 C ATOM 1348 C SER A 89 -14.365 -17.827 -6.584 1.00 63.41 C ATOM 1349 O SER A 89 -15.003 -18.862 -6.383 1.00 50.42 O ATOM 1350 CB SER A 89 -14.242 -15.832 -5.047 1.00 55.52 C ATOM 1351 OG SER A 89 -15.500 -16.042 -4.429 1.00 41.44 O ATOM 0 H SER A 89 -11.931 -15.950 -5.893 1.00 54.03 H new ATOM 0 HA SER A 89 -13.595 -17.825 -4.587 1.00 31.54 H new ATOM 0 HB2 SER A 89 -13.586 -15.292 -4.364 1.00 55.52 H new ATOM 0 HB3 SER A 89 -14.369 -15.205 -5.930 1.00 55.52 H new ATOM 0 HG SER A 89 -15.892 -15.178 -4.183 1.00 41.44 H new ATOM 1357 N ARG A 90 -14.273 -17.250 -7.782 1.00 23.34 N ATOM 1358 CA ARG A 90 -15.005 -17.753 -8.945 1.00 54.03 C ATOM 1359 C ARG A 90 -14.566 -19.181 -9.269 1.00 24.50 C ATOM 1360 O ARG A 90 -15.384 -20.104 -9.312 1.00 24.11 O ATOM 1361 CB ARG A 90 -14.783 -16.831 -10.161 1.00 2.20 C ATOM 1362 CG ARG A 90 -15.167 -15.375 -9.902 1.00 50.34 C ATOM 1363 CD ARG A 90 -15.033 -14.496 -11.145 1.00 62.12 C ATOM 1364 NE ARG A 90 -13.671 -14.468 -11.698 1.00 24.24 N ATOM 1365 CZ ARG A 90 -13.361 -13.916 -12.880 1.00 75.25 C ATOM 1366 NH1 ARG A 90 -14.316 -13.430 -13.659 1.00 2.51 N ATOM 1367 NH2 ARG A 90 -12.102 -13.854 -13.291 1.00 40.20 N ATOM 0 H ARG A 90 -13.696 -16.431 -7.973 1.00 23.34 H new ATOM 0 HA ARG A 90 -16.069 -17.762 -8.710 1.00 54.03 H new ATOM 0 HB2 ARG A 90 -13.734 -16.875 -10.453 1.00 2.20 H new ATOM 0 HB3 ARG A 90 -15.364 -17.207 -11.003 1.00 2.20 H new ATOM 0 HG2 ARG A 90 -16.195 -15.334 -9.543 1.00 50.34 H new ATOM 0 HG3 ARG A 90 -14.536 -14.973 -9.109 1.00 50.34 H new ATOM 0 HD2 ARG A 90 -15.720 -14.856 -11.911 1.00 62.12 H new ATOM 0 HD3 ARG A 90 -15.337 -13.479 -10.896 1.00 62.12 H new ATOM 0 HE ARG A 90 -12.921 -14.892 -11.152 1.00 24.24 H new ATOM 0 HH11 ARG A 90 -15.290 -13.475 -13.360 1.00 2.51 H new ATOM 0 HH12 ARG A 90 -14.077 -13.011 -14.558 1.00 2.51 H new ATOM 0 HH21 ARG A 90 -11.355 -14.229 -12.706 1.00 40.20 H new ATOM 0 HH22 ARG A 90 -11.880 -13.431 -14.192 1.00 40.20 H new ATOM 1381 N VAL A 91 -13.261 -19.347 -9.466 1.00 13.22 N ATOM 1382 CA VAL A 91 -12.672 -20.648 -9.774 1.00 73.33 C ATOM 1383 C VAL A 91 -13.072 -21.677 -8.715 1.00 11.43 C ATOM 1384 O VAL A 91 -13.603 -22.748 -9.041 1.00 41.13 O ATOM 1385 CB VAL A 91 -11.120 -20.552 -9.863 1.00 22.24 C ATOM 1386 CG1 VAL A 91 -10.488 -21.921 -10.110 1.00 73.11 C ATOM 1387 CG2 VAL A 91 -10.702 -19.566 -10.957 1.00 44.15 C ATOM 0 H VAL A 91 -12.583 -18.586 -9.417 1.00 13.22 H new ATOM 0 HA VAL A 91 -13.052 -20.968 -10.744 1.00 73.33 H new ATOM 0 HB VAL A 91 -10.757 -20.185 -8.903 1.00 22.24 H new ATOM 0 HG11 VAL A 91 -9.404 -21.817 -10.167 1.00 73.11 H new ATOM 0 HG12 VAL A 91 -10.746 -22.594 -9.292 1.00 73.11 H new ATOM 0 HG13 VAL A 91 -10.862 -22.331 -11.048 1.00 73.11 H new ATOM 0 HG21 VAL A 91 -9.614 -19.513 -11.003 1.00 44.15 H new ATOM 0 HG22 VAL A 91 -11.090 -19.903 -11.918 1.00 44.15 H new ATOM 0 HG23 VAL A 91 -11.104 -18.579 -10.730 1.00 44.15 H new ATOM 1397 N ALA A 92 -12.854 -21.326 -7.446 1.00 14.51 N ATOM 1398 CA ALA A 92 -13.165 -22.219 -6.334 1.00 51.41 C ATOM 1399 C ALA A 92 -14.644 -22.578 -6.313 1.00 45.24 C ATOM 1400 O ALA A 92 -15.004 -23.708 -5.995 1.00 41.04 O ATOM 1401 CB ALA A 92 -12.744 -21.608 -5.002 1.00 45.23 C ATOM 0 H ALA A 92 -12.462 -20.427 -7.165 1.00 14.51 H new ATOM 0 HA ALA A 92 -12.595 -23.136 -6.482 1.00 51.41 H new ATOM 0 HB1 ALA A 92 -12.988 -22.296 -4.193 1.00 45.23 H new ATOM 0 HB2 ALA A 92 -11.670 -21.424 -5.010 1.00 45.23 H new ATOM 0 HB3 ALA A 92 -13.273 -20.667 -4.850 1.00 45.23 H new ATOM 1407 N SER A 93 -15.492 -21.621 -6.671 1.00 15.05 N ATOM 1408 CA SER A 93 -16.924 -21.855 -6.727 1.00 62.23 C ATOM 1409 C SER A 93 -17.252 -22.871 -7.825 1.00 73.41 C ATOM 1410 O SER A 93 -18.078 -23.765 -7.628 1.00 13.21 O ATOM 1411 CB SER A 93 -17.663 -20.533 -6.965 1.00 70.15 C ATOM 1412 OG SER A 93 -17.431 -19.617 -5.905 1.00 11.51 O ATOM 0 H SER A 93 -15.209 -20.675 -6.927 1.00 15.05 H new ATOM 0 HA SER A 93 -17.256 -22.267 -5.774 1.00 62.23 H new ATOM 0 HB2 SER A 93 -17.334 -20.094 -7.907 1.00 70.15 H new ATOM 0 HB3 SER A 93 -18.732 -20.723 -7.058 1.00 70.15 H new ATOM 0 HG SER A 93 -16.472 -19.427 -5.841 1.00 11.51 H new ATOM 1418 N ARG A 94 -16.572 -22.752 -8.973 1.00 41.15 N ATOM 1419 CA ARG A 94 -16.802 -23.675 -10.086 1.00 3.43 C ATOM 1420 C ARG A 94 -16.449 -25.095 -9.669 1.00 32.51 C ATOM 1421 O ARG A 94 -17.264 -26.000 -9.774 1.00 40.31 O ATOM 1422 CB ARG A 94 -15.943 -23.323 -11.307 1.00 52.53 C ATOM 1423 CG ARG A 94 -15.968 -21.863 -11.714 1.00 61.23 C ATOM 1424 CD ARG A 94 -17.388 -21.336 -11.915 1.00 13.22 C ATOM 1425 NE ARG A 94 -17.397 -19.987 -12.491 1.00 3.54 N ATOM 1426 CZ ARG A 94 -17.911 -18.913 -11.891 1.00 23.02 C ATOM 1427 NH1 ARG A 94 -18.471 -19.009 -10.690 1.00 3.12 N ATOM 1428 NH2 ARG A 94 -17.880 -17.739 -12.501 1.00 21.02 N ATOM 0 H ARG A 94 -15.868 -22.036 -9.152 1.00 41.15 H new ATOM 0 HA ARG A 94 -17.856 -23.593 -10.351 1.00 3.43 H new ATOM 0 HB2 ARG A 94 -14.912 -23.608 -11.100 1.00 52.53 H new ATOM 0 HB3 ARG A 94 -16.277 -23.925 -12.152 1.00 52.53 H new ATOM 0 HG2 ARG A 94 -15.468 -21.268 -10.950 1.00 61.23 H new ATOM 0 HG3 ARG A 94 -15.403 -21.737 -12.638 1.00 61.23 H new ATOM 0 HD2 ARG A 94 -17.937 -22.013 -12.569 1.00 13.22 H new ATOM 0 HD3 ARG A 94 -17.910 -21.325 -10.958 1.00 13.22 H new ATOM 0 HE ARG A 94 -16.981 -19.862 -13.414 1.00 3.54 H new ATOM 0 HH11 ARG A 94 -18.511 -19.912 -10.217 1.00 3.12 H new ATOM 0 HH12 ARG A 94 -18.861 -18.180 -10.241 1.00 3.12 H new ATOM 0 HH21 ARG A 94 -17.463 -17.657 -13.428 1.00 21.02 H new ATOM 0 HH22 ARG A 94 -18.273 -16.916 -12.044 1.00 21.02 H new ATOM 1442 N LEU A 95 -15.220 -25.264 -9.182 1.00 55.01 N ATOM 1443 CA LEU A 95 -14.718 -26.586 -8.785 1.00 15.52 C ATOM 1444 C LEU A 95 -15.447 -27.121 -7.550 1.00 70.41 C ATOM 1445 O LEU A 95 -15.559 -28.331 -7.371 1.00 61.13 O ATOM 1446 CB LEU A 95 -13.193 -26.556 -8.571 1.00 62.31 C ATOM 1447 CG LEU A 95 -12.659 -25.503 -7.576 1.00 10.41 C ATOM 1448 CD1 LEU A 95 -12.297 -26.123 -6.224 1.00 12.14 C ATOM 1449 CD2 LEU A 95 -11.460 -24.772 -8.165 1.00 73.21 C ATOM 0 H LEU A 95 -14.551 -24.505 -9.052 1.00 55.01 H new ATOM 0 HA LEU A 95 -14.926 -27.276 -9.603 1.00 15.52 H new ATOM 0 HB2 LEU A 95 -12.877 -27.541 -8.228 1.00 62.31 H new ATOM 0 HB3 LEU A 95 -12.716 -26.386 -9.536 1.00 62.31 H new ATOM 0 HG LEU A 95 -13.461 -24.785 -7.401 1.00 10.41 H new ATOM 0 HD11 LEU A 95 -11.926 -25.346 -5.555 1.00 12.14 H new ATOM 0 HD12 LEU A 95 -13.182 -26.585 -5.787 1.00 12.14 H new ATOM 0 HD13 LEU A 95 -11.525 -26.879 -6.366 1.00 12.14 H new ATOM 0 HD21 LEU A 95 -11.097 -24.034 -7.450 1.00 73.21 H new ATOM 0 HD22 LEU A 95 -10.667 -25.488 -8.381 1.00 73.21 H new ATOM 0 HD23 LEU A 95 -11.756 -24.270 -9.086 1.00 73.21 H new ATOM 1461 N ALA A 96 -15.930 -26.221 -6.696 1.00 40.45 N ATOM 1462 CA ALA A 96 -16.733 -26.619 -5.539 1.00 52.43 C ATOM 1463 C ALA A 96 -17.977 -27.374 -6.000 1.00 51.03 C ATOM 1464 O ALA A 96 -18.263 -28.478 -5.529 1.00 52.32 O ATOM 1465 CB ALA A 96 -17.125 -25.399 -4.708 1.00 5.15 C ATOM 0 H ALA A 96 -15.781 -25.216 -6.781 1.00 40.45 H new ATOM 0 HA ALA A 96 -16.134 -27.279 -4.911 1.00 52.43 H new ATOM 0 HB1 ALA A 96 -17.721 -25.717 -3.853 1.00 5.15 H new ATOM 0 HB2 ALA A 96 -16.225 -24.895 -4.355 1.00 5.15 H new ATOM 0 HB3 ALA A 96 -17.708 -24.713 -5.322 1.00 5.15 H new ATOM 1471 N ALA A 97 -18.713 -26.763 -6.925 1.00 43.02 N ATOM 1472 CA ALA A 97 -19.892 -27.388 -7.519 1.00 4.04 C ATOM 1473 C ALA A 97 -19.491 -28.381 -8.613 1.00 60.22 C ATOM 1474 O ALA A 97 -20.284 -29.237 -9.017 1.00 2.12 O ATOM 1475 CB ALA A 97 -20.820 -26.318 -8.081 1.00 52.53 C ATOM 0 H ALA A 97 -18.512 -25.829 -7.282 1.00 43.02 H new ATOM 0 HA ALA A 97 -20.420 -27.941 -6.742 1.00 4.04 H new ATOM 0 HB1 ALA A 97 -21.697 -26.792 -8.522 1.00 52.53 H new ATOM 0 HB2 ALA A 97 -21.134 -25.650 -7.279 1.00 52.53 H new ATOM 0 HB3 ALA A 97 -20.294 -25.745 -8.845 1.00 52.53 H new ATOM 1481 N GLY A 98 -18.253 -28.247 -9.087 1.00 10.24 N ATOM 1482 CA GLY A 98 -17.750 -29.076 -10.174 1.00 71.13 C ATOM 1483 C GLY A 98 -16.888 -30.220 -9.694 1.00 75.14 C ATOM 1484 O GLY A 98 -16.241 -30.888 -10.500 1.00 24.30 O ATOM 0 H GLY A 98 -17.580 -27.568 -8.731 1.00 10.24 H new ATOM 0 HA2 GLY A 98 -18.592 -29.475 -10.739 1.00 71.13 H new ATOM 0 HA3 GLY A 98 -17.172 -28.456 -10.859 1.00 71.13 H new ATOM 1488 N GLY A 99 -16.840 -30.416 -8.381 1.00 44.44 N ATOM 1489 CA GLY A 99 -16.245 -31.620 -7.834 1.00 11.31 C ATOM 1490 C GLY A 99 -17.148 -32.796 -8.114 1.00 2.41 C ATOM 1491 O GLY A 99 -18.370 -32.634 -8.121 1.00 24.34 O ATOM 0 H GLY A 99 -17.202 -29.763 -7.686 1.00 44.44 H new ATOM 0 HA2 GLY A 99 -15.263 -31.787 -8.277 1.00 11.31 H new ATOM 0 HA3 GLY A 99 -16.095 -31.510 -6.760 1.00 11.31 H new ATOM 1495 N TRP A 100 -16.589 -33.981 -8.348 1.00 33.12 N ATOM 1496 CA TRP A 100 -17.408 -35.101 -8.803 1.00 54.53 C ATOM 1497 C TRP A 100 -17.597 -36.198 -7.749 1.00 63.43 C ATOM 1498 O TRP A 100 -16.879 -37.202 -7.745 1.00 14.14 O ATOM 1499 CB TRP A 100 -16.806 -35.715 -10.079 1.00 53.11 C ATOM 1500 CG TRP A 100 -16.921 -34.843 -11.298 1.00 53.11 C ATOM 1501 CD1 TRP A 100 -16.471 -33.563 -11.443 1.00 62.25 C ATOM 1502 CD2 TRP A 100 -17.510 -35.202 -12.555 1.00 74.21 C ATOM 1503 NE1 TRP A 100 -16.755 -33.102 -12.704 1.00 50.24 N ATOM 1504 CE2 TRP A 100 -17.392 -34.089 -13.406 1.00 71.24 C ATOM 1505 CE3 TRP A 100 -18.132 -36.358 -13.038 1.00 61.55 C ATOM 1506 CZ2 TRP A 100 -17.868 -34.096 -14.713 1.00 14.04 C ATOM 1507 CZ3 TRP A 100 -18.604 -36.365 -14.337 1.00 44.10 C ATOM 1508 CH2 TRP A 100 -18.470 -35.240 -15.161 1.00 25.43 C ATOM 0 H TRP A 100 -15.597 -34.188 -8.234 1.00 33.12 H new ATOM 0 HA TRP A 100 -18.396 -34.687 -9.005 1.00 54.53 H new ATOM 0 HB2 TRP A 100 -15.753 -35.934 -9.901 1.00 53.11 H new ATOM 0 HB3 TRP A 100 -17.300 -36.666 -10.279 1.00 53.11 H new ATOM 0 HD1 TRP A 100 -15.965 -32.995 -10.677 1.00 62.25 H new ATOM 0 HE1 TRP A 100 -16.528 -32.174 -13.060 1.00 50.24 H new ATOM 0 HE3 TRP A 100 -18.241 -37.228 -12.408 1.00 61.55 H new ATOM 0 HZ2 TRP A 100 -17.766 -33.230 -15.351 1.00 14.04 H new ATOM 0 HZ3 TRP A 100 -19.084 -37.252 -14.723 1.00 44.10 H new ATOM 0 HH2 TRP A 100 -18.850 -35.277 -16.171 1.00 25.43 H new ATOM 1519 N PRO A 101 -18.539 -35.993 -6.807 1.00 54.45 N ATOM 1520 CA PRO A 101 -19.319 -37.069 -6.225 1.00 61.44 C ATOM 1521 C PRO A 101 -20.688 -37.143 -6.923 1.00 74.42 C ATOM 1522 O PRO A 101 -21.383 -38.158 -6.879 1.00 34.13 O ATOM 1523 CB PRO A 101 -19.449 -36.641 -4.754 1.00 45.13 C ATOM 1524 CG PRO A 101 -19.269 -35.146 -4.738 1.00 52.13 C ATOM 1525 CD PRO A 101 -18.820 -34.719 -6.123 1.00 25.12 C ATOM 0 HA PRO A 101 -18.874 -38.059 -6.329 1.00 61.44 H new ATOM 0 HB2 PRO A 101 -20.422 -36.921 -4.351 1.00 45.13 H new ATOM 0 HB3 PRO A 101 -18.696 -37.131 -4.137 1.00 45.13 H new ATOM 0 HG2 PRO A 101 -20.203 -34.652 -4.470 1.00 52.13 H new ATOM 0 HG3 PRO A 101 -18.529 -34.858 -3.991 1.00 52.13 H new ATOM 0 HD2 PRO A 101 -19.595 -34.151 -6.638 1.00 25.12 H new ATOM 0 HD3 PRO A 101 -17.935 -34.084 -6.079 1.00 25.12 H new ATOM 1533 N LEU A 102 -21.041 -36.031 -7.582 1.00 10.31 N ATOM 1534 CA LEU A 102 -22.273 -35.880 -8.349 1.00 74.21 C ATOM 1535 C LEU A 102 -21.930 -35.165 -9.653 1.00 33.31 C ATOM 1536 O LEU A 102 -20.825 -34.639 -9.796 1.00 3.42 O ATOM 1537 CB LEU A 102 -23.334 -35.052 -7.593 1.00 54.21 C ATOM 1538 CG LEU A 102 -23.884 -35.649 -6.282 1.00 73.13 C ATOM 1539 CD1 LEU A 102 -22.918 -35.438 -5.119 1.00 1.32 C ATOM 1540 CD2 LEU A 102 -25.250 -35.052 -5.955 1.00 12.44 C ATOM 0 H LEU A 102 -20.459 -35.193 -7.593 1.00 10.31 H new ATOM 0 HA LEU A 102 -22.692 -36.870 -8.526 1.00 74.21 H new ATOM 0 HB2 LEU A 102 -22.904 -34.076 -7.367 1.00 54.21 H new ATOM 0 HB3 LEU A 102 -24.174 -34.882 -8.266 1.00 54.21 H new ATOM 0 HG LEU A 102 -23.995 -36.723 -6.430 1.00 73.13 H new ATOM 0 HD11 LEU A 102 -23.340 -35.872 -4.212 1.00 1.32 H new ATOM 0 HD12 LEU A 102 -21.967 -35.921 -5.344 1.00 1.32 H new ATOM 0 HD13 LEU A 102 -22.757 -34.370 -4.969 1.00 1.32 H new ATOM 0 HD21 LEU A 102 -25.623 -35.485 -5.027 1.00 12.44 H new ATOM 0 HD22 LEU A 102 -25.157 -33.972 -5.841 1.00 12.44 H new ATOM 0 HD23 LEU A 102 -25.947 -35.273 -6.764 1.00 12.44 H new ATOM 1552 N ALA A 103 -22.861 -35.150 -10.594 1.00 35.13 N ATOM 1553 CA ALA A 103 -22.672 -34.435 -11.855 1.00 1.22 C ATOM 1554 C ALA A 103 -23.964 -33.730 -12.264 1.00 44.52 C ATOM 1555 O ALA A 103 -24.955 -34.385 -12.604 1.00 71.31 O ATOM 1556 CB ALA A 103 -22.211 -35.394 -12.949 1.00 34.24 C ATOM 0 H ALA A 103 -23.760 -35.625 -10.512 1.00 35.13 H new ATOM 0 HA ALA A 103 -21.898 -33.681 -11.715 1.00 1.22 H new ATOM 0 HB1 ALA A 103 -22.075 -34.845 -13.881 1.00 34.24 H new ATOM 0 HB2 ALA A 103 -21.266 -35.852 -12.657 1.00 34.24 H new ATOM 0 HB3 ALA A 103 -22.962 -36.171 -13.092 1.00 34.24 H new ATOM 1562 N GLY A 104 -23.955 -32.397 -12.211 1.00 1.03 N ATOM 1563 CA GLY A 104 -25.138 -31.621 -12.558 1.00 34.40 C ATOM 1564 C GLY A 104 -24.814 -30.324 -13.279 1.00 2.44 C ATOM 1565 O GLY A 104 -25.519 -29.942 -14.217 1.00 60.53 O ATOM 0 H GLY A 104 -23.147 -31.840 -11.933 1.00 1.03 H new ATOM 0 HA2 GLY A 104 -25.789 -32.226 -13.188 1.00 34.40 H new ATOM 0 HA3 GLY A 104 -25.695 -31.394 -11.649 1.00 34.40 H new ATOM 1569 N VAL A 105 -23.750 -29.647 -12.842 1.00 75.25 N ATOM 1570 CA VAL A 105 -23.362 -28.362 -13.380 1.00 23.35 C ATOM 1571 C VAL A 105 -23.096 -28.413 -14.885 1.00 14.03 C ATOM 1572 O VAL A 105 -22.616 -29.423 -15.413 1.00 43.04 O ATOM 1573 CB VAL A 105 -22.100 -27.852 -12.653 1.00 43.11 C ATOM 1574 CG1 VAL A 105 -22.405 -27.528 -11.195 1.00 54.52 C ATOM 1575 CG2 VAL A 105 -20.953 -28.860 -12.758 1.00 71.45 C ATOM 0 H VAL A 105 -23.137 -29.985 -12.101 1.00 75.25 H new ATOM 0 HA VAL A 105 -24.196 -27.680 -13.217 1.00 23.35 H new ATOM 0 HB VAL A 105 -21.782 -26.933 -13.146 1.00 43.11 H new ATOM 0 HG11 VAL A 105 -21.500 -27.171 -10.705 1.00 54.52 H new ATOM 0 HG12 VAL A 105 -23.173 -26.756 -11.147 1.00 54.52 H new ATOM 0 HG13 VAL A 105 -22.761 -28.426 -10.690 1.00 54.52 H new ATOM 0 HG21 VAL A 105 -20.078 -28.472 -12.236 1.00 71.45 H new ATOM 0 HG22 VAL A 105 -21.256 -29.804 -12.306 1.00 71.45 H new ATOM 0 HG23 VAL A 105 -20.707 -29.023 -13.807 1.00 71.45 H new ATOM 1585 N ASP A 106 -23.420 -27.316 -15.568 1.00 34.34 N ATOM 1586 CA ASP A 106 -23.157 -27.181 -17.001 1.00 34.40 C ATOM 1587 C ASP A 106 -22.057 -26.144 -17.227 1.00 44.13 C ATOM 1588 O ASP A 106 -21.835 -25.272 -16.385 1.00 12.44 O ATOM 1589 CB ASP A 106 -24.431 -26.772 -17.767 1.00 3.44 C ATOM 1590 CG ASP A 106 -24.742 -25.285 -17.670 1.00 44.43 C ATOM 1591 OD1 ASP A 106 -25.451 -24.872 -16.724 1.00 25.55 O ATOM 1592 OD2 ASP A 106 -24.293 -24.529 -18.552 1.00 61.24 O ATOM 0 H ASP A 106 -23.869 -26.502 -15.148 1.00 34.34 H new ATOM 0 HA ASP A 106 -22.831 -28.149 -17.382 1.00 34.40 H new ATOM 0 HB2 ASP A 106 -24.319 -27.045 -18.816 1.00 3.44 H new ATOM 0 HB3 ASP A 106 -25.277 -27.339 -17.379 1.00 3.44 H new ATOM 1597 N SER A 107 -21.361 -26.256 -18.351 1.00 25.45 N ATOM 1598 CA SER A 107 -20.304 -25.314 -18.706 1.00 20.22 C ATOM 1599 C SER A 107 -20.716 -24.444 -19.897 1.00 62.13 C ATOM 1600 O SER A 107 -20.121 -23.388 -20.149 1.00 71.25 O ATOM 1601 CB SER A 107 -19.016 -26.085 -19.015 1.00 31.03 C ATOM 1602 OG SER A 107 -19.256 -27.141 -19.936 1.00 63.21 O ATOM 0 H SER A 107 -21.510 -26.995 -19.038 1.00 25.45 H new ATOM 0 HA SER A 107 -20.129 -24.648 -17.861 1.00 20.22 H new ATOM 0 HB2 SER A 107 -18.271 -25.403 -19.426 1.00 31.03 H new ATOM 0 HB3 SER A 107 -18.602 -26.491 -18.092 1.00 31.03 H new ATOM 0 HG SER A 107 -18.417 -27.615 -20.116 1.00 63.21 H new ATOM 1608 N THR A 108 -21.748 -24.888 -20.612 1.00 52.43 N ATOM 1609 CA THR A 108 -22.192 -24.231 -21.840 1.00 65.30 C ATOM 1610 C THR A 108 -22.696 -22.811 -21.566 1.00 75.14 C ATOM 1611 O THR A 108 -22.339 -21.865 -22.270 1.00 15.14 O ATOM 1612 CB THR A 108 -23.309 -25.051 -22.536 1.00 33.03 C ATOM 1613 OG1 THR A 108 -22.842 -26.383 -22.804 1.00 25.35 O ATOM 1614 CG2 THR A 108 -23.753 -24.399 -23.843 1.00 32.14 C ATOM 0 H THR A 108 -22.298 -25.709 -20.358 1.00 52.43 H new ATOM 0 HA THR A 108 -21.327 -24.172 -22.501 1.00 65.30 H new ATOM 0 HB THR A 108 -24.165 -25.084 -21.862 1.00 33.03 H new ATOM 0 HG1 THR A 108 -23.552 -26.897 -23.242 1.00 25.35 H new ATOM 0 HG21 THR A 108 -24.537 -25.002 -24.302 1.00 32.14 H new ATOM 0 HG22 THR A 108 -24.137 -23.399 -23.639 1.00 32.14 H new ATOM 0 HG23 THR A 108 -22.903 -24.330 -24.522 1.00 32.14 H new ATOM 1622 N ALA A 109 -23.490 -22.670 -20.513 1.00 54.00 N ATOM 1623 CA ALA A 109 -24.141 -21.401 -20.188 1.00 24.21 C ATOM 1624 C ALA A 109 -23.190 -20.438 -19.486 1.00 11.04 C ATOM 1625 O ALA A 109 -23.600 -19.375 -19.018 1.00 23.33 O ATOM 1626 CB ALA A 109 -25.374 -21.662 -19.328 1.00 14.02 C ATOM 0 H ALA A 109 -23.702 -23.425 -19.861 1.00 54.00 H new ATOM 0 HA ALA A 109 -24.444 -20.927 -21.122 1.00 24.21 H new ATOM 0 HB1 ALA A 109 -25.857 -20.715 -19.087 1.00 14.02 H new ATOM 0 HB2 ALA A 109 -26.072 -22.296 -19.875 1.00 14.02 H new ATOM 0 HB3 ALA A 109 -25.076 -22.162 -18.406 1.00 14.02 H new ATOM 1632 N LEU A 110 -21.920 -20.807 -19.429 1.00 1.22 N ATOM 1633 CA LEU A 110 -20.917 -20.004 -18.747 1.00 62.21 C ATOM 1634 C LEU A 110 -19.831 -19.531 -19.717 1.00 32.34 C ATOM 1635 O LEU A 110 -19.481 -18.350 -19.740 1.00 74.23 O ATOM 1636 CB LEU A 110 -20.278 -20.814 -17.612 1.00 35.40 C ATOM 1637 CG LEU A 110 -21.142 -21.032 -16.354 1.00 12.11 C ATOM 1638 CD1 LEU A 110 -22.265 -22.035 -16.616 1.00 12.33 C ATOM 1639 CD2 LEU A 110 -20.270 -21.475 -15.178 1.00 71.20 C ATOM 0 H LEU A 110 -21.558 -21.663 -19.850 1.00 1.22 H new ATOM 0 HA LEU A 110 -21.414 -19.126 -18.334 1.00 62.21 H new ATOM 0 HB2 LEU A 110 -19.996 -21.790 -18.006 1.00 35.40 H new ATOM 0 HB3 LEU A 110 -19.357 -20.314 -17.312 1.00 35.40 H new ATOM 0 HG LEU A 110 -21.609 -20.082 -16.096 1.00 12.11 H new ATOM 0 HD11 LEU A 110 -22.855 -22.166 -15.709 1.00 12.33 H new ATOM 0 HD12 LEU A 110 -22.906 -21.663 -17.415 1.00 12.33 H new ATOM 0 HD13 LEU A 110 -21.836 -22.993 -16.911 1.00 12.33 H new ATOM 0 HD21 LEU A 110 -20.895 -21.625 -14.298 1.00 71.20 H new ATOM 0 HD22 LEU A 110 -19.767 -22.409 -15.429 1.00 71.20 H new ATOM 0 HD23 LEU A 110 -19.525 -20.707 -14.968 1.00 71.20 H new ATOM 1651 N ASN A 111 -19.324 -20.458 -20.527 1.00 2.03 N ATOM 1652 CA ASN A 111 -18.138 -20.215 -21.354 1.00 51.20 C ATOM 1653 C ASN A 111 -18.357 -19.094 -22.373 1.00 3.43 C ATOM 1654 O ASN A 111 -18.761 -19.349 -23.512 1.00 20.31 O ATOM 1655 CB ASN A 111 -17.709 -21.506 -22.072 1.00 51.14 C ATOM 1656 CG ASN A 111 -16.354 -21.366 -22.750 1.00 45.04 C ATOM 1657 OD1 ASN A 111 -15.317 -21.625 -22.143 1.00 64.14 O ATOM 1658 ND2 ASN A 111 -16.353 -20.960 -24.010 1.00 71.21 N ATOM 0 H ASN A 111 -19.718 -21.393 -20.630 1.00 2.03 H new ATOM 0 HA ASN A 111 -17.342 -19.893 -20.682 1.00 51.20 H new ATOM 0 HB2 ASN A 111 -17.670 -22.324 -21.352 1.00 51.14 H new ATOM 0 HB3 ASN A 111 -18.460 -21.772 -22.816 1.00 51.14 H new ATOM 0 HD21 ASN A 111 -15.471 -20.853 -24.511 1.00 71.21 H new ATOM 0 HD22 ASN A 111 -17.234 -20.755 -24.480 1.00 71.21 H new ATOM 1665 N ALA A 112 -18.101 -17.859 -21.945 1.00 65.35 N ATOM 1666 CA ALA A 112 -18.196 -16.690 -22.811 1.00 3.51 C ATOM 1667 C ALA A 112 -17.619 -15.458 -22.107 1.00 55.23 C ATOM 1668 O ALA A 112 -16.397 -15.227 -22.205 1.00 20.44 O ATOM 1669 CB ALA A 112 -19.646 -16.450 -23.226 1.00 24.13 C ATOM 1670 OXT ALA A 112 -18.384 -14.729 -21.442 1.00 0.00 O ATOM 0 H ALA A 112 -17.822 -17.643 -20.988 1.00 65.35 H new ATOM 0 HA ALA A 112 -17.611 -16.874 -23.712 1.00 3.51 H new ATOM 0 HB1 ALA A 112 -19.699 -15.574 -23.872 1.00 24.13 H new ATOM 0 HB2 ALA A 112 -20.019 -17.321 -23.764 1.00 24.13 H new ATOM 0 HB3 ALA A 112 -20.256 -16.284 -22.338 1.00 24.13 H new TER 1676 ALA A 112