USER MOD reduce.3.24.130724 H: found=0, std=0, add=1152, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1150 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 43 SER OG : rot -105:sc= 1.39 USER MOD Set 1.2: A 46 THR OG1 : rot 180:sc= 0.864 USER MOD Set 2.1: A 31 HIS : no HD1:sc= -2.86 K(o=-5.7,f=-3.7!) USER MOD Set 2.2: A 33 GLN : amide:sc= -2.86 K(o=-5.7,f=-2.1) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -132:sc= -0.0201 (180deg=-0.299) USER MOD Single : A 3 THR OG1 : rot 180:sc= -0.0127 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 65:sc= 0.712 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 28 HIS : no HE2:sc= 0.0489 K(o=0.049,f=-2.5) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot -150:sc= 0 USER MOD Single : A 45 HIS : no HE2:sc= -0.155 K(o=-0.15,f=-1.1) USER MOD Single : A 57 THR OG1 : rot 28:sc= 0.421 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot -57:sc= 0.529 USER MOD Single : A 78 THR OG1 : rot 93:sc= 0.496 USER MOD Single : A 79 MET CE :methyl -163:sc= -0.305 (180deg=-0.838) USER MOD Single : A 87 THR OG1 : rot 137:sc= 0.0121 USER MOD Single : A 88 ASN : amide:sc= -0.295 X(o=-0.3,f=-0.12) USER MOD Single : A 89 HIS : no HD1:sc= 0.00886 K(o=0.0089,f=-4!) USER MOD Single : A 102 HIS : no HE2:sc= -0.0574 X(o=-0.057,f=-0.53) USER MOD Single : A 103 CYS SG : rot 94:sc= -2.35 USER MOD Single : A 104 THR OG1 : rot 180:sc= -0.124 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 MET CE :methyl 179:sc= 0 (180deg=-0.0065) USER MOD Single : A 113 CYS SG : rot 83:sc= -2.41! USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 135 ASN : amide:sc= -0.0376 K(o=-0.038,f=-0.76) USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD Single : A 146 HIS : no HE2:sc= 0.439 K(o=0.44,f=-1.5!) USER MOD Single : A 147 HIS : no HE2:sc= 0.0204 X(o=0.02,f=-0.2) USER MOD Single : A 148 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 149 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 150 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 151 HIS : no HD1:sc= 0 X(o=0,f=-0.00014) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -6.524 15.199 9.314 1.00 62.44 N ATOM 2 CA MET A 1 -5.382 14.385 9.808 1.00 35.30 C ATOM 3 C MET A 1 -4.450 13.987 8.640 1.00 52.43 C ATOM 4 O MET A 1 -4.908 13.804 7.508 1.00 61.10 O ATOM 5 CB MET A 1 -5.916 13.124 10.536 1.00 40.25 C ATOM 6 CG MET A 1 -6.814 13.418 11.748 1.00 31.25 C ATOM 7 SD MET A 1 -7.503 11.918 12.486 1.00 42.11 S ATOM 8 CE MET A 1 -8.514 12.607 13.801 1.00 72.14 C ATOM 0 H1 MET A 1 -6.635 16.042 9.913 1.00 62.44 H new ATOM 0 H2 MET A 1 -6.342 15.493 8.333 1.00 62.44 H new ATOM 0 H3 MET A 1 -7.395 14.632 9.349 1.00 62.44 H new ATOM 0 HA MET A 1 -4.801 14.981 10.512 1.00 35.30 H new ATOM 0 HB2 MET A 1 -6.476 12.519 9.823 1.00 40.25 H new ATOM 0 HB3 MET A 1 -5.068 12.524 10.866 1.00 40.25 H new ATOM 0 HG2 MET A 1 -6.237 13.956 12.500 1.00 31.25 H new ATOM 0 HG3 MET A 1 -7.628 14.074 11.441 1.00 31.25 H new ATOM 0 HE1 MET A 1 -9.003 11.799 14.345 1.00 72.14 H new ATOM 0 HE2 MET A 1 -7.884 13.176 14.485 1.00 72.14 H new ATOM 0 HE3 MET A 1 -9.270 13.265 13.372 1.00 72.14 H new ATOM 20 N ALA A 2 -3.140 13.860 8.933 1.00 14.45 N ATOM 21 CA ALA A 2 -2.110 13.482 7.931 1.00 62.42 C ATOM 22 C ALA A 2 -1.827 11.950 7.929 1.00 12.21 C ATOM 23 O ALA A 2 -0.886 11.485 7.273 1.00 21.11 O ATOM 24 CB ALA A 2 -0.828 14.298 8.183 1.00 10.35 C ATOM 0 H ALA A 2 -2.762 14.015 9.868 1.00 14.45 H new ATOM 0 HA ALA A 2 -2.491 13.719 6.937 1.00 62.42 H new ATOM 0 HB1 ALA A 2 -0.071 14.022 7.449 1.00 10.35 H new ATOM 0 HB2 ALA A 2 -1.050 15.361 8.093 1.00 10.35 H new ATOM 0 HB3 ALA A 2 -0.455 14.089 9.185 1.00 10.35 H new ATOM 30 N THR A 3 -2.659 11.173 8.662 1.00 12.44 N ATOM 31 CA THR A 3 -2.624 9.689 8.637 1.00 71.25 C ATOM 32 C THR A 3 -3.841 9.171 7.839 1.00 14.20 C ATOM 33 O THR A 3 -4.995 9.384 8.227 1.00 71.11 O ATOM 34 CB THR A 3 -2.612 9.049 10.072 1.00 72.54 C ATOM 35 OG1 THR A 3 -1.496 9.558 10.826 1.00 13.24 O ATOM 36 CG2 THR A 3 -2.524 7.503 10.020 1.00 50.51 C ATOM 0 H THR A 3 -3.371 11.554 9.285 1.00 12.44 H new ATOM 0 HA THR A 3 -1.692 9.391 8.157 1.00 71.25 H new ATOM 0 HB THR A 3 -3.551 9.319 10.554 1.00 72.54 H new ATOM 0 HG1 THR A 3 -1.495 9.157 11.720 1.00 13.24 H new ATOM 0 HG21 THR A 3 -2.519 7.105 11.035 1.00 50.51 H new ATOM 0 HG22 THR A 3 -3.384 7.108 9.479 1.00 50.51 H new ATOM 0 HG23 THR A 3 -1.607 7.208 9.509 1.00 50.51 H new ATOM 44 N LEU A 4 -3.550 8.505 6.721 1.00 70.43 N ATOM 45 CA LEU A 4 -4.546 8.022 5.743 1.00 32.31 C ATOM 46 C LEU A 4 -4.817 6.535 5.989 1.00 32.02 C ATOM 47 O LEU A 4 -3.884 5.774 6.216 1.00 23.54 O ATOM 48 CB LEU A 4 -4.012 8.236 4.292 1.00 44.24 C ATOM 49 CG LEU A 4 -4.143 9.679 3.696 1.00 75.12 C ATOM 50 CD1 LEU A 4 -3.560 10.774 4.613 1.00 40.32 C ATOM 51 CD2 LEU A 4 -3.489 9.750 2.304 1.00 5.15 C ATOM 0 H LEU A 4 -2.592 8.277 6.457 1.00 70.43 H new ATOM 0 HA LEU A 4 -5.474 8.582 5.861 1.00 32.31 H new ATOM 0 HB2 LEU A 4 -2.959 7.955 4.273 1.00 44.24 H new ATOM 0 HB3 LEU A 4 -4.538 7.547 3.631 1.00 44.24 H new ATOM 0 HG LEU A 4 -5.211 9.878 3.611 1.00 75.12 H new ATOM 0 HD11 LEU A 4 -3.684 11.748 4.140 1.00 40.32 H new ATOM 0 HD12 LEU A 4 -4.084 10.765 5.569 1.00 40.32 H new ATOM 0 HD13 LEU A 4 -2.500 10.583 4.779 1.00 40.32 H new ATOM 0 HD21 LEU A 4 -3.590 10.760 1.906 1.00 5.15 H new ATOM 0 HD22 LEU A 4 -2.432 9.496 2.385 1.00 5.15 H new ATOM 0 HD23 LEU A 4 -3.981 9.045 1.634 1.00 5.15 H new ATOM 63 N ARG A 5 -6.090 6.132 5.958 1.00 52.31 N ATOM 64 CA ARG A 5 -6.484 4.711 6.073 1.00 40.10 C ATOM 65 C ARG A 5 -7.536 4.347 5.004 1.00 32.45 C ATOM 66 O ARG A 5 -8.534 5.051 4.823 1.00 4.11 O ATOM 67 CB ARG A 5 -7.029 4.416 7.501 1.00 52.22 C ATOM 68 CG ARG A 5 -7.506 2.958 7.739 1.00 3.44 C ATOM 69 CD ARG A 5 -8.036 2.730 9.167 1.00 63.52 C ATOM 70 NE ARG A 5 -8.531 1.349 9.375 1.00 11.52 N ATOM 71 CZ ARG A 5 -8.941 0.859 10.528 1.00 52.22 C ATOM 72 NH1 ARG A 5 -8.958 1.587 11.601 1.00 64.14 N ATOM 73 NH2 ARG A 5 -9.346 -0.365 10.591 1.00 53.41 N ATOM 0 H ARG A 5 -6.878 6.771 5.853 1.00 52.31 H new ATOM 0 HA ARG A 5 -5.602 4.094 5.904 1.00 40.10 H new ATOM 0 HB2 ARG A 5 -6.249 4.649 8.225 1.00 52.22 H new ATOM 0 HB3 ARG A 5 -7.861 5.091 7.701 1.00 52.22 H new ATOM 0 HG2 ARG A 5 -8.290 2.715 7.022 1.00 3.44 H new ATOM 0 HG3 ARG A 5 -6.679 2.274 7.550 1.00 3.44 H new ATOM 0 HD2 ARG A 5 -7.242 2.940 9.884 1.00 63.52 H new ATOM 0 HD3 ARG A 5 -8.842 3.436 9.369 1.00 63.52 H new ATOM 0 HE ARG A 5 -8.556 0.730 8.564 1.00 11.52 H new ATOM 0 HH11 ARG A 5 -8.650 2.559 11.563 1.00 64.14 H new ATOM 0 HH12 ARG A 5 -9.279 1.188 12.483 1.00 64.14 H new ATOM 0 HH21 ARG A 5 -9.347 -0.946 9.752 1.00 53.41 H new ATOM 0 HH22 ARG A 5 -9.665 -0.752 11.479 1.00 53.41 H new ATOM 87 N ARG A 6 -7.279 3.245 4.291 1.00 50.32 N ATOM 88 CA ARG A 6 -8.240 2.599 3.373 1.00 5.21 C ATOM 89 C ARG A 6 -8.161 1.079 3.552 1.00 54.24 C ATOM 90 O ARG A 6 -7.131 0.552 3.963 1.00 22.42 O ATOM 91 CB ARG A 6 -7.988 3.013 1.885 1.00 72.23 C ATOM 92 CG ARG A 6 -8.743 4.287 1.443 1.00 53.43 C ATOM 93 CD ARG A 6 -10.275 4.120 1.562 1.00 71.24 C ATOM 94 NE ARG A 6 -11.020 5.330 1.178 1.00 15.41 N ATOM 95 CZ ARG A 6 -11.675 6.125 2.003 1.00 14.01 C ATOM 96 NH1 ARG A 6 -11.677 5.922 3.291 1.00 41.52 N ATOM 97 NH2 ARG A 6 -12.330 7.125 1.515 1.00 1.43 N ATOM 0 H ARG A 6 -6.381 2.763 4.333 1.00 50.32 H new ATOM 0 HA ARG A 6 -9.246 2.937 3.621 1.00 5.21 H new ATOM 0 HB2 ARG A 6 -6.919 3.169 1.740 1.00 72.23 H new ATOM 0 HB3 ARG A 6 -8.281 2.188 1.236 1.00 72.23 H new ATOM 0 HG2 ARG A 6 -8.421 5.130 2.054 1.00 53.43 H new ATOM 0 HG3 ARG A 6 -8.483 4.524 0.411 1.00 53.43 H new ATOM 0 HD2 ARG A 6 -10.594 3.289 0.932 1.00 71.24 H new ATOM 0 HD3 ARG A 6 -10.527 3.856 2.589 1.00 71.24 H new ATOM 0 HE ARG A 6 -11.031 5.575 0.188 1.00 15.41 H new ATOM 0 HH11 ARG A 6 -11.164 5.133 3.684 1.00 41.52 H new ATOM 0 HH12 ARG A 6 -12.192 6.552 3.906 1.00 41.52 H new ATOM 0 HH21 ARG A 6 -12.335 7.289 0.508 1.00 1.43 H new ATOM 0 HH22 ARG A 6 -12.843 7.751 2.136 1.00 1.43 H new ATOM 111 N SER A 7 -9.262 0.385 3.248 1.00 41.23 N ATOM 112 CA SER A 7 -9.365 -1.075 3.424 1.00 64.13 C ATOM 113 C SER A 7 -10.367 -1.692 2.432 1.00 55.30 C ATOM 114 O SER A 7 -11.253 -1.007 1.906 1.00 25.41 O ATOM 115 CB SER A 7 -9.768 -1.412 4.878 1.00 24.52 C ATOM 116 OG SER A 7 -10.994 -0.793 5.234 1.00 34.03 O ATOM 0 H SER A 7 -10.108 0.814 2.873 1.00 41.23 H new ATOM 0 HA SER A 7 -8.386 -1.507 3.219 1.00 64.13 H new ATOM 0 HB2 SER A 7 -9.858 -2.492 4.991 1.00 24.52 H new ATOM 0 HB3 SER A 7 -8.983 -1.085 5.560 1.00 24.52 H new ATOM 0 HG SER A 7 -11.222 -1.027 6.158 1.00 34.03 H new ATOM 122 N VAL A 8 -10.213 -3.001 2.200 1.00 11.21 N ATOM 123 CA VAL A 8 -11.051 -3.781 1.268 1.00 72.22 C ATOM 124 C VAL A 8 -11.148 -5.240 1.764 1.00 54.44 C ATOM 125 O VAL A 8 -10.236 -5.709 2.437 1.00 52.41 O ATOM 126 CB VAL A 8 -10.424 -3.748 -0.180 1.00 13.54 C ATOM 127 CG1 VAL A 8 -9.084 -4.538 -0.233 1.00 32.24 C ATOM 128 CG2 VAL A 8 -11.428 -4.242 -1.249 1.00 21.33 C ATOM 0 H VAL A 8 -9.494 -3.560 2.659 1.00 11.21 H new ATOM 0 HA VAL A 8 -12.049 -3.343 1.229 1.00 72.22 H new ATOM 0 HB VAL A 8 -10.197 -2.708 -0.416 1.00 13.54 H new ATOM 0 HG11 VAL A 8 -8.677 -4.497 -1.243 1.00 32.24 H new ATOM 0 HG12 VAL A 8 -8.372 -4.094 0.463 1.00 32.24 H new ATOM 0 HG13 VAL A 8 -9.263 -5.577 0.044 1.00 32.24 H new ATOM 0 HG21 VAL A 8 -10.960 -4.205 -2.233 1.00 21.33 H new ATOM 0 HG22 VAL A 8 -11.722 -5.268 -1.026 1.00 21.33 H new ATOM 0 HG23 VAL A 8 -12.310 -3.602 -1.243 1.00 21.33 H new ATOM 138 N GLU A 9 -12.236 -5.959 1.444 1.00 3.51 N ATOM 139 CA GLU A 9 -12.345 -7.408 1.741 1.00 52.12 C ATOM 140 C GLU A 9 -12.213 -8.236 0.446 1.00 13.53 C ATOM 141 O GLU A 9 -12.954 -8.039 -0.522 1.00 41.34 O ATOM 142 CB GLU A 9 -13.659 -7.732 2.496 1.00 21.14 C ATOM 143 CG GLU A 9 -13.695 -7.154 3.926 1.00 74.43 C ATOM 144 CD GLU A 9 -14.906 -7.630 4.741 1.00 14.42 C ATOM 145 OE1 GLU A 9 -14.862 -8.751 5.284 1.00 50.11 O ATOM 146 OE2 GLU A 9 -15.908 -6.892 4.825 1.00 64.25 O ATOM 0 H GLU A 9 -13.055 -5.567 0.980 1.00 3.51 H new ATOM 0 HA GLU A 9 -11.522 -7.684 2.401 1.00 52.12 H new ATOM 0 HB2 GLU A 9 -14.503 -7.337 1.930 1.00 21.14 H new ATOM 0 HB3 GLU A 9 -13.786 -8.814 2.545 1.00 21.14 H new ATOM 0 HG2 GLU A 9 -12.781 -7.436 4.448 1.00 74.43 H new ATOM 0 HG3 GLU A 9 -13.708 -6.065 3.871 1.00 74.43 H new ATOM 153 N VAL A 10 -11.238 -9.146 0.464 1.00 42.23 N ATOM 154 CA VAL A 10 -10.861 -10.013 -0.665 1.00 0.01 C ATOM 155 C VAL A 10 -11.532 -11.401 -0.526 1.00 51.03 C ATOM 156 O VAL A 10 -11.557 -11.961 0.570 1.00 44.05 O ATOM 157 CB VAL A 10 -9.299 -10.172 -0.678 1.00 55.52 C ATOM 158 CG1 VAL A 10 -8.817 -11.064 -1.837 1.00 33.54 C ATOM 159 CG2 VAL A 10 -8.608 -8.786 -0.716 1.00 35.22 C ATOM 0 H VAL A 10 -10.666 -9.309 1.292 1.00 42.23 H new ATOM 0 HA VAL A 10 -11.197 -9.562 -1.599 1.00 0.01 H new ATOM 0 HB VAL A 10 -9.015 -10.673 0.247 1.00 55.52 H new ATOM 0 HG11 VAL A 10 -7.730 -11.145 -1.806 1.00 33.54 H new ATOM 0 HG12 VAL A 10 -9.258 -12.056 -1.740 1.00 33.54 H new ATOM 0 HG13 VAL A 10 -9.121 -10.623 -2.786 1.00 33.54 H new ATOM 0 HG21 VAL A 10 -7.526 -8.919 -0.724 1.00 35.22 H new ATOM 0 HG22 VAL A 10 -8.915 -8.251 -1.615 1.00 35.22 H new ATOM 0 HG23 VAL A 10 -8.896 -8.212 0.164 1.00 35.22 H new ATOM 169 N ALA A 11 -12.080 -11.945 -1.635 1.00 12.45 N ATOM 170 CA ALA A 11 -12.638 -13.318 -1.669 1.00 24.13 C ATOM 171 C ALA A 11 -11.506 -14.384 -1.790 1.00 24.31 C ATOM 172 O ALA A 11 -11.381 -15.079 -2.808 1.00 50.21 O ATOM 173 CB ALA A 11 -13.671 -13.427 -2.814 1.00 10.22 C ATOM 0 H ALA A 11 -12.149 -11.451 -2.525 1.00 12.45 H new ATOM 0 HA ALA A 11 -13.151 -13.521 -0.729 1.00 24.13 H new ATOM 0 HB1 ALA A 11 -14.081 -14.437 -2.839 1.00 10.22 H new ATOM 0 HB2 ALA A 11 -14.477 -12.712 -2.647 1.00 10.22 H new ATOM 0 HB3 ALA A 11 -13.185 -13.209 -3.765 1.00 10.22 H new ATOM 179 N ALA A 12 -10.683 -14.483 -0.723 1.00 72.31 N ATOM 180 CA ALA A 12 -9.507 -15.383 -0.655 1.00 24.34 C ATOM 181 C ALA A 12 -8.925 -15.431 0.783 1.00 24.44 C ATOM 182 O ALA A 12 -9.155 -14.503 1.576 1.00 53.53 O ATOM 183 CB ALA A 12 -8.420 -14.917 -1.639 1.00 40.53 C ATOM 0 H ALA A 12 -10.817 -13.934 0.126 1.00 72.31 H new ATOM 0 HA ALA A 12 -9.836 -16.385 -0.930 1.00 24.34 H new ATOM 0 HB1 ALA A 12 -7.563 -15.587 -1.578 1.00 40.53 H new ATOM 0 HB2 ALA A 12 -8.818 -14.929 -2.654 1.00 40.53 H new ATOM 0 HB3 ALA A 12 -8.108 -13.904 -1.383 1.00 40.53 H new ATOM 189 N PRO A 13 -8.179 -16.525 1.145 1.00 53.11 N ATOM 190 CA PRO A 13 -7.377 -16.579 2.396 1.00 3.20 C ATOM 191 C PRO A 13 -6.212 -15.543 2.394 1.00 32.31 C ATOM 192 O PRO A 13 -5.560 -15.340 1.359 1.00 31.33 O ATOM 193 CB PRO A 13 -6.834 -18.037 2.427 1.00 53.53 C ATOM 194 CG PRO A 13 -7.681 -18.796 1.443 1.00 64.24 C ATOM 195 CD PRO A 13 -8.075 -17.800 0.387 1.00 73.42 C ATOM 0 HA PRO A 13 -7.971 -16.327 3.274 1.00 3.20 H new ATOM 0 HB2 PRO A 13 -5.781 -18.071 2.148 1.00 53.53 H new ATOM 0 HB3 PRO A 13 -6.913 -18.465 3.426 1.00 53.53 H new ATOM 0 HG2 PRO A 13 -7.126 -19.627 1.009 1.00 64.24 H new ATOM 0 HG3 PRO A 13 -8.560 -19.219 1.929 1.00 64.24 H new ATOM 0 HD2 PRO A 13 -7.330 -17.738 -0.406 1.00 73.42 H new ATOM 0 HD3 PRO A 13 -9.021 -18.066 -0.085 1.00 73.42 H new ATOM 203 N ALA A 14 -5.964 -14.917 3.571 1.00 34.11 N ATOM 204 CA ALA A 14 -4.949 -13.839 3.769 1.00 14.25 C ATOM 205 C ALA A 14 -3.532 -14.185 3.251 1.00 22.14 C ATOM 206 O ALA A 14 -2.792 -13.294 2.842 1.00 54.42 O ATOM 207 CB ALA A 14 -4.885 -13.462 5.265 1.00 14.12 C ATOM 0 H ALA A 14 -6.469 -15.147 4.427 1.00 34.11 H new ATOM 0 HA ALA A 14 -5.283 -12.995 3.165 1.00 14.25 H new ATOM 0 HB1 ALA A 14 -4.145 -12.675 5.411 1.00 14.12 H new ATOM 0 HB2 ALA A 14 -5.862 -13.106 5.593 1.00 14.12 H new ATOM 0 HB3 ALA A 14 -4.603 -14.338 5.849 1.00 14.12 H new ATOM 213 N ALA A 15 -3.173 -15.474 3.305 1.00 35.32 N ATOM 214 CA ALA A 15 -1.857 -15.976 2.845 1.00 55.10 C ATOM 215 C ALA A 15 -1.655 -15.785 1.321 1.00 41.05 C ATOM 216 O ALA A 15 -0.591 -15.347 0.880 1.00 64.24 O ATOM 217 CB ALA A 15 -1.696 -17.454 3.233 1.00 71.23 C ATOM 0 H ALA A 15 -3.783 -16.206 3.669 1.00 35.32 H new ATOM 0 HA ALA A 15 -1.086 -15.386 3.342 1.00 55.10 H new ATOM 0 HB1 ALA A 15 -0.726 -17.816 2.892 1.00 71.23 H new ATOM 0 HB2 ALA A 15 -1.760 -17.555 4.316 1.00 71.23 H new ATOM 0 HB3 ALA A 15 -2.487 -18.041 2.767 1.00 71.23 H new ATOM 223 N ASP A 16 -2.680 -16.153 0.529 1.00 2.21 N ATOM 224 CA ASP A 16 -2.679 -15.973 -0.949 1.00 3.14 C ATOM 225 C ASP A 16 -2.598 -14.489 -1.359 1.00 42.41 C ATOM 226 O ASP A 16 -1.933 -14.131 -2.342 1.00 55.41 O ATOM 227 CB ASP A 16 -3.940 -16.622 -1.548 1.00 50.13 C ATOM 228 CG ASP A 16 -4.005 -18.121 -1.229 1.00 10.21 C ATOM 229 OD1 ASP A 16 -4.549 -18.482 -0.167 1.00 2.32 O ATOM 230 OD2 ASP A 16 -3.488 -18.937 -2.021 1.00 15.02 O ATOM 0 H ASP A 16 -3.533 -16.583 0.887 1.00 2.21 H new ATOM 0 HA ASP A 16 -1.787 -16.461 -1.342 1.00 3.14 H new ATOM 0 HB2 ASP A 16 -4.828 -16.126 -1.155 1.00 50.13 H new ATOM 0 HB3 ASP A 16 -3.947 -16.478 -2.628 1.00 50.13 H new ATOM 235 N VAL A 17 -3.283 -13.637 -0.583 1.00 35.52 N ATOM 236 CA VAL A 17 -3.285 -12.174 -0.782 1.00 22.22 C ATOM 237 C VAL A 17 -1.907 -11.569 -0.406 1.00 72.12 C ATOM 238 O VAL A 17 -1.418 -10.635 -1.048 1.00 42.42 O ATOM 239 CB VAL A 17 -4.417 -11.504 0.082 1.00 41.50 C ATOM 240 CG1 VAL A 17 -4.540 -9.998 -0.240 1.00 55.31 C ATOM 241 CG2 VAL A 17 -5.777 -12.234 -0.101 1.00 61.03 C ATOM 0 H VAL A 17 -3.855 -13.941 0.205 1.00 35.52 H new ATOM 0 HA VAL A 17 -3.479 -11.975 -1.836 1.00 22.22 H new ATOM 0 HB VAL A 17 -4.135 -11.599 1.131 1.00 41.50 H new ATOM 0 HG11 VAL A 17 -5.329 -9.559 0.370 1.00 55.31 H new ATOM 0 HG12 VAL A 17 -3.594 -9.501 -0.023 1.00 55.31 H new ATOM 0 HG13 VAL A 17 -4.783 -9.870 -1.295 1.00 55.31 H new ATOM 0 HG21 VAL A 17 -6.537 -11.746 0.509 1.00 61.03 H new ATOM 0 HG22 VAL A 17 -6.073 -12.194 -1.149 1.00 61.03 H new ATOM 0 HG23 VAL A 17 -5.676 -13.274 0.208 1.00 61.03 H new ATOM 251 N TRP A 18 -1.294 -12.139 0.648 1.00 64.43 N ATOM 252 CA TRP A 18 0.045 -11.741 1.135 1.00 23.34 C ATOM 253 C TRP A 18 1.159 -12.180 0.150 1.00 54.23 C ATOM 254 O TRP A 18 2.214 -11.561 0.091 1.00 71.23 O ATOM 255 CB TRP A 18 0.297 -12.313 2.556 1.00 71.14 C ATOM 256 CG TRP A 18 1.638 -11.925 3.151 1.00 52.00 C ATOM 257 CD1 TRP A 18 2.704 -12.748 3.401 1.00 11.03 C ATOM 258 CD2 TRP A 18 2.061 -10.602 3.539 1.00 12.41 C ATOM 259 NE1 TRP A 18 3.740 -12.029 3.925 1.00 70.12 N ATOM 260 CE2 TRP A 18 3.374 -10.716 4.021 1.00 42.12 C ATOM 261 CE3 TRP A 18 1.455 -9.340 3.523 1.00 15.43 C ATOM 262 CZ2 TRP A 18 4.092 -9.621 4.497 1.00 55.45 C ATOM 263 CZ3 TRP A 18 2.171 -8.250 3.989 1.00 45.34 C ATOM 264 CH2 TRP A 18 3.479 -8.399 4.470 1.00 31.33 C ATOM 0 H TRP A 18 -1.714 -12.893 1.191 1.00 64.43 H new ATOM 0 HA TRP A 18 0.074 -10.653 1.193 1.00 23.34 H new ATOM 0 HB2 TRP A 18 -0.496 -11.970 3.220 1.00 71.14 H new ATOM 0 HB3 TRP A 18 0.230 -13.400 2.515 1.00 71.14 H new ATOM 0 HD1 TRP A 18 2.722 -13.811 3.211 1.00 11.03 H new ATOM 0 HE1 TRP A 18 4.644 -12.412 4.201 1.00 70.12 H new ATOM 0 HE3 TRP A 18 0.447 -9.219 3.154 1.00 15.43 H new ATOM 0 HZ2 TRP A 18 5.098 -9.733 4.874 1.00 55.45 H new ATOM 0 HZ3 TRP A 18 1.715 -7.271 3.982 1.00 45.34 H new ATOM 0 HH2 TRP A 18 4.014 -7.531 4.827 1.00 31.33 H new ATOM 275 N THR A 19 0.920 -13.268 -0.599 1.00 14.20 N ATOM 276 CA THR A 19 1.813 -13.697 -1.709 1.00 72.15 C ATOM 277 C THR A 19 1.848 -12.629 -2.843 1.00 4.51 C ATOM 278 O THR A 19 2.854 -12.467 -3.535 1.00 1.23 O ATOM 279 CB THR A 19 1.350 -15.087 -2.280 1.00 11.42 C ATOM 280 OG1 THR A 19 1.293 -16.051 -1.214 1.00 75.31 O ATOM 281 CG2 THR A 19 2.280 -15.632 -3.381 1.00 52.23 C ATOM 0 H THR A 19 0.113 -13.876 -0.462 1.00 14.20 H new ATOM 0 HA THR A 19 2.822 -13.801 -1.310 1.00 72.15 H new ATOM 0 HB THR A 19 0.368 -14.927 -2.726 1.00 11.42 H new ATOM 0 HG1 THR A 19 0.599 -15.790 -0.574 1.00 75.31 H new ATOM 0 HG21 THR A 19 1.904 -16.593 -3.732 1.00 52.23 H new ATOM 0 HG22 THR A 19 2.310 -14.928 -4.213 1.00 52.23 H new ATOM 0 HG23 THR A 19 3.285 -15.760 -2.978 1.00 52.23 H new ATOM 289 N LEU A 20 0.732 -11.894 -2.996 1.00 51.32 N ATOM 290 CA LEU A 20 0.570 -10.840 -4.020 1.00 43.02 C ATOM 291 C LEU A 20 1.248 -9.500 -3.594 1.00 40.34 C ATOM 292 O LEU A 20 2.031 -8.923 -4.364 1.00 34.40 O ATOM 293 CB LEU A 20 -0.952 -10.657 -4.293 1.00 64.33 C ATOM 294 CG LEU A 20 -1.380 -9.570 -5.330 1.00 42.22 C ATOM 295 CD1 LEU A 20 -0.730 -9.790 -6.709 1.00 23.35 C ATOM 296 CD2 LEU A 20 -2.918 -9.523 -5.454 1.00 51.22 C ATOM 0 H LEU A 20 -0.092 -12.014 -2.408 1.00 51.32 H new ATOM 0 HA LEU A 20 1.073 -11.145 -4.937 1.00 43.02 H new ATOM 0 HB2 LEU A 20 -1.350 -11.615 -4.628 1.00 64.33 H new ATOM 0 HB3 LEU A 20 -1.437 -10.425 -3.345 1.00 64.33 H new ATOM 0 HG LEU A 20 -1.023 -8.609 -4.959 1.00 42.22 H new ATOM 0 HD11 LEU A 20 -1.058 -9.009 -7.395 1.00 23.35 H new ATOM 0 HD12 LEU A 20 0.355 -9.753 -6.610 1.00 23.35 H new ATOM 0 HD13 LEU A 20 -1.026 -10.764 -7.099 1.00 23.35 H new ATOM 0 HD21 LEU A 20 -3.201 -8.761 -6.180 1.00 51.22 H new ATOM 0 HD22 LEU A 20 -3.286 -10.494 -5.785 1.00 51.22 H new ATOM 0 HD23 LEU A 20 -3.354 -9.281 -4.485 1.00 51.22 H new ATOM 308 N VAL A 21 0.937 -9.020 -2.366 1.00 31.21 N ATOM 309 CA VAL A 21 1.478 -7.727 -1.827 1.00 22.34 C ATOM 310 C VAL A 21 2.860 -7.873 -1.123 1.00 31.23 C ATOM 311 O VAL A 21 3.563 -6.876 -0.934 1.00 55.15 O ATOM 312 CB VAL A 21 0.473 -7.029 -0.829 1.00 23.22 C ATOM 313 CG1 VAL A 21 -0.825 -6.591 -1.543 1.00 23.44 C ATOM 314 CG2 VAL A 21 0.157 -7.934 0.391 1.00 44.23 C ATOM 0 H VAL A 21 0.313 -9.503 -1.720 1.00 31.21 H new ATOM 0 HA VAL A 21 1.612 -7.102 -2.710 1.00 22.34 H new ATOM 0 HB VAL A 21 0.966 -6.131 -0.456 1.00 23.22 H new ATOM 0 HG11 VAL A 21 -1.492 -6.115 -0.825 1.00 23.44 H new ATOM 0 HG12 VAL A 21 -0.583 -5.885 -2.337 1.00 23.44 H new ATOM 0 HG13 VAL A 21 -1.317 -7.464 -1.972 1.00 23.44 H new ATOM 0 HG21 VAL A 21 -0.538 -7.420 1.055 1.00 44.23 H new ATOM 0 HG22 VAL A 21 -0.292 -8.865 0.046 1.00 44.23 H new ATOM 0 HG23 VAL A 21 1.079 -8.154 0.930 1.00 44.23 H new ATOM 324 N GLY A 22 3.221 -9.112 -0.731 1.00 2.23 N ATOM 325 CA GLY A 22 4.491 -9.403 -0.024 1.00 71.43 C ATOM 326 C GLY A 22 5.730 -9.113 -0.868 1.00 65.12 C ATOM 327 O GLY A 22 6.783 -8.716 -0.345 1.00 3.34 O ATOM 0 H GLY A 22 2.645 -9.938 -0.893 1.00 2.23 H new ATOM 0 HA2 GLY A 22 4.535 -8.810 0.890 1.00 71.43 H new ATOM 0 HA3 GLY A 22 4.501 -10.451 0.276 1.00 71.43 H new ATOM 331 N ASP A 23 5.611 -9.360 -2.179 1.00 60.32 N ATOM 332 CA ASP A 23 6.563 -8.851 -3.171 1.00 22.35 C ATOM 333 C ASP A 23 6.182 -7.397 -3.506 1.00 60.43 C ATOM 334 O ASP A 23 5.259 -7.162 -4.296 1.00 25.43 O ATOM 335 CB ASP A 23 6.553 -9.719 -4.453 1.00 0.01 C ATOM 336 CG ASP A 23 7.045 -11.143 -4.210 1.00 3.21 C ATOM 337 OD1 ASP A 23 6.265 -11.976 -3.693 1.00 45.21 O ATOM 338 OD2 ASP A 23 8.222 -11.440 -4.508 1.00 3.12 O ATOM 0 H ASP A 23 4.855 -9.916 -2.579 1.00 60.32 H new ATOM 0 HA ASP A 23 7.571 -8.892 -2.759 1.00 22.35 H new ATOM 0 HB2 ASP A 23 5.540 -9.753 -4.854 1.00 0.01 H new ATOM 0 HB3 ASP A 23 7.180 -9.248 -5.210 1.00 0.01 H new ATOM 343 N PHE A 24 6.856 -6.415 -2.877 1.00 40.10 N ATOM 344 CA PHE A 24 6.555 -4.984 -3.112 1.00 1.04 C ATOM 345 C PHE A 24 7.113 -4.477 -4.483 1.00 31.13 C ATOM 346 O PHE A 24 6.836 -3.350 -4.912 1.00 1.42 O ATOM 347 CB PHE A 24 7.052 -4.133 -1.914 1.00 3.14 C ATOM 348 CG PHE A 24 6.428 -2.738 -1.849 1.00 45.34 C ATOM 349 CD1 PHE A 24 5.065 -2.555 -2.130 1.00 50.24 C ATOM 350 CD2 PHE A 24 7.180 -1.616 -1.528 1.00 54.30 C ATOM 351 CE1 PHE A 24 4.493 -1.304 -2.096 1.00 54.41 C ATOM 352 CE2 PHE A 24 6.600 -0.364 -1.494 1.00 14.34 C ATOM 353 CZ PHE A 24 5.260 -0.210 -1.782 1.00 11.32 C ATOM 0 H PHE A 24 7.607 -6.581 -2.207 1.00 40.10 H new ATOM 0 HA PHE A 24 5.473 -4.869 -3.179 1.00 1.04 H new ATOM 0 HB2 PHE A 24 6.832 -4.663 -0.987 1.00 3.14 H new ATOM 0 HB3 PHE A 24 8.136 -4.034 -1.975 1.00 3.14 H new ATOM 0 HD1 PHE A 24 4.455 -3.411 -2.377 1.00 50.24 H new ATOM 0 HD2 PHE A 24 8.231 -1.724 -1.302 1.00 54.30 H new ATOM 0 HE1 PHE A 24 3.443 -1.183 -2.316 1.00 54.41 H new ATOM 0 HE2 PHE A 24 7.198 0.499 -1.241 1.00 14.34 H new ATOM 0 HZ PHE A 24 4.813 0.773 -1.760 1.00 11.32 H new ATOM 363 N SER A 25 7.893 -5.335 -5.168 1.00 13.54 N ATOM 364 CA SER A 25 8.229 -5.156 -6.608 1.00 64.21 C ATOM 365 C SER A 25 6.990 -5.407 -7.490 1.00 21.35 C ATOM 366 O SER A 25 6.763 -4.722 -8.487 1.00 33.23 O ATOM 367 CB SER A 25 9.333 -6.145 -7.038 1.00 64.13 C ATOM 368 OG SER A 25 9.634 -6.037 -8.425 1.00 34.44 O ATOM 0 H SER A 25 8.309 -6.167 -4.750 1.00 13.54 H new ATOM 0 HA SER A 25 8.577 -4.131 -6.737 1.00 64.21 H new ATOM 0 HB2 SER A 25 10.235 -5.957 -6.455 1.00 64.13 H new ATOM 0 HB3 SER A 25 9.015 -7.163 -6.814 1.00 64.13 H new ATOM 0 HG SER A 25 10.338 -6.678 -8.658 1.00 34.44 H new ATOM 374 N ALA A 26 6.143 -6.344 -7.033 1.00 51.25 N ATOM 375 CA ALA A 26 5.046 -6.936 -7.831 1.00 44.14 C ATOM 376 C ALA A 26 3.755 -6.105 -7.729 1.00 44.11 C ATOM 377 O ALA A 26 2.663 -6.574 -8.082 1.00 23.33 O ATOM 378 CB ALA A 26 4.806 -8.371 -7.355 1.00 64.43 C ATOM 0 H ALA A 26 6.198 -6.720 -6.086 1.00 51.25 H new ATOM 0 HA ALA A 26 5.338 -6.939 -8.881 1.00 44.14 H new ATOM 0 HB1 ALA A 26 3.999 -8.817 -7.937 1.00 64.43 H new ATOM 0 HB2 ALA A 26 5.716 -8.956 -7.489 1.00 64.43 H new ATOM 0 HB3 ALA A 26 4.532 -8.363 -6.300 1.00 64.43 H new ATOM 384 N ILE A 27 3.904 -4.859 -7.257 1.00 22.05 N ATOM 385 CA ILE A 27 2.814 -3.892 -7.158 1.00 62.34 C ATOM 386 C ILE A 27 2.263 -3.499 -8.564 1.00 53.11 C ATOM 387 O ILE A 27 1.107 -3.108 -8.696 1.00 71.04 O ATOM 388 CB ILE A 27 3.278 -2.636 -6.322 1.00 61.30 C ATOM 389 CG1 ILE A 27 2.056 -1.726 -6.000 1.00 53.13 C ATOM 390 CG2 ILE A 27 4.404 -1.857 -7.048 1.00 11.12 C ATOM 391 CD1 ILE A 27 2.300 -0.596 -5.015 1.00 24.31 C ATOM 0 H ILE A 27 4.799 -4.495 -6.930 1.00 22.05 H new ATOM 0 HA ILE A 27 1.984 -4.358 -6.627 1.00 62.34 H new ATOM 0 HB ILE A 27 3.698 -2.984 -5.378 1.00 61.30 H new ATOM 0 HG12 ILE A 27 1.695 -1.294 -6.934 1.00 53.13 H new ATOM 0 HG13 ILE A 27 1.255 -2.354 -5.609 1.00 53.13 H new ATOM 0 HG21 ILE A 27 4.700 -0.999 -6.445 1.00 11.12 H new ATOM 0 HG22 ILE A 27 5.263 -2.511 -7.194 1.00 11.12 H new ATOM 0 HG23 ILE A 27 4.042 -1.512 -8.017 1.00 11.12 H new ATOM 0 HD11 ILE A 27 1.378 -0.033 -4.871 1.00 24.31 H new ATOM 0 HD12 ILE A 27 2.625 -1.009 -4.060 1.00 24.31 H new ATOM 0 HD13 ILE A 27 3.072 0.067 -5.406 1.00 24.31 H new ATOM 403 N HIS A 28 3.092 -3.679 -9.619 1.00 65.32 N ATOM 404 CA HIS A 28 2.672 -3.469 -11.032 1.00 64.54 C ATOM 405 C HIS A 28 1.664 -4.552 -11.538 1.00 61.11 C ATOM 406 O HIS A 28 1.121 -4.423 -12.639 1.00 25.52 O ATOM 407 CB HIS A 28 3.923 -3.398 -11.952 1.00 12.02 C ATOM 408 CG HIS A 28 4.783 -4.644 -11.968 1.00 35.52 C ATOM 409 ND1 HIS A 28 5.830 -4.857 -11.097 1.00 73.31 N ATOM 410 CD2 HIS A 28 4.748 -5.737 -12.763 1.00 14.20 C ATOM 411 CE1 HIS A 28 6.396 -6.017 -11.359 1.00 34.02 C ATOM 412 NE2 HIS A 28 5.760 -6.572 -12.362 1.00 44.13 N ATOM 0 H HIS A 28 4.064 -3.972 -9.520 1.00 65.32 H new ATOM 0 HA HIS A 28 2.139 -2.519 -11.072 1.00 64.54 H new ATOM 0 HB2 HIS A 28 3.594 -3.190 -12.970 1.00 12.02 H new ATOM 0 HB3 HIS A 28 4.538 -2.555 -11.637 1.00 12.02 H new ATOM 0 HD1 HIS A 28 6.122 -4.214 -10.361 1.00 73.31 H new ATOM 0 HD2 HIS A 28 4.051 -5.920 -13.567 1.00 14.20 H new ATOM 0 HE1 HIS A 28 7.241 -6.440 -10.836 1.00 34.02 H new ATOM 421 N ARG A 29 1.447 -5.624 -10.739 1.00 45.43 N ATOM 422 CA ARG A 29 0.470 -6.698 -11.067 1.00 74.20 C ATOM 423 C ARG A 29 -0.944 -6.378 -10.525 1.00 5.10 C ATOM 424 O ARG A 29 -1.948 -6.682 -11.182 1.00 24.23 O ATOM 425 CB ARG A 29 0.929 -8.066 -10.498 1.00 34.21 C ATOM 426 CG ARG A 29 2.305 -8.562 -10.991 1.00 43.55 C ATOM 427 CD ARG A 29 2.615 -9.991 -10.498 1.00 32.00 C ATOM 428 NE ARG A 29 2.533 -10.109 -9.026 1.00 15.15 N ATOM 429 CZ ARG A 29 2.729 -11.213 -8.326 1.00 51.24 C ATOM 430 NH1 ARG A 29 3.013 -12.345 -8.895 1.00 51.44 N ATOM 431 NH2 ARG A 29 2.645 -11.164 -7.035 1.00 42.11 N ATOM 0 H ARG A 29 1.937 -5.771 -9.857 1.00 45.43 H new ATOM 0 HA ARG A 29 0.425 -6.752 -12.155 1.00 74.20 H new ATOM 0 HB2 ARG A 29 0.955 -7.997 -9.410 1.00 34.21 H new ATOM 0 HB3 ARG A 29 0.180 -8.816 -10.752 1.00 34.21 H new ATOM 0 HG2 ARG A 29 2.329 -8.541 -12.081 1.00 43.55 H new ATOM 0 HG3 ARG A 29 3.082 -7.882 -10.642 1.00 43.55 H new ATOM 0 HD2 ARG A 29 1.915 -10.690 -10.956 1.00 32.00 H new ATOM 0 HD3 ARG A 29 3.614 -10.278 -10.828 1.00 32.00 H new ATOM 0 HE ARG A 29 2.305 -9.263 -8.504 1.00 15.15 H new ATOM 0 HH11 ARG A 29 3.091 -12.400 -9.911 1.00 51.44 H new ATOM 0 HH12 ARG A 29 3.159 -13.179 -8.326 1.00 51.44 H new ATOM 0 HH21 ARG A 29 2.430 -10.281 -6.571 1.00 42.11 H new ATOM 0 HH22 ARG A 29 2.794 -12.008 -6.482 1.00 42.11 H new ATOM 445 N TRP A 30 -1.025 -5.767 -9.319 1.00 52.04 N ATOM 446 CA TRP A 30 -2.321 -5.575 -8.614 1.00 14.45 C ATOM 447 C TRP A 30 -2.767 -4.100 -8.585 1.00 43.35 C ATOM 448 O TRP A 30 -3.966 -3.810 -8.722 1.00 24.15 O ATOM 449 CB TRP A 30 -2.301 -6.179 -7.182 1.00 1.01 C ATOM 450 CG TRP A 30 -1.347 -5.535 -6.205 1.00 25.35 C ATOM 451 CD1 TRP A 30 -0.024 -5.818 -6.038 1.00 75.54 C ATOM 452 CD2 TRP A 30 -1.662 -4.521 -5.235 1.00 52.11 C ATOM 453 NE1 TRP A 30 0.499 -5.031 -5.049 1.00 62.10 N ATOM 454 CE2 TRP A 30 -0.484 -4.234 -4.537 1.00 2.34 C ATOM 455 CE3 TRP A 30 -2.829 -3.832 -4.896 1.00 13.13 C ATOM 456 CZ2 TRP A 30 -0.427 -3.282 -3.521 1.00 12.34 C ATOM 457 CZ3 TRP A 30 -2.779 -2.891 -3.887 1.00 10.22 C ATOM 458 CH2 TRP A 30 -1.584 -2.626 -3.207 1.00 72.14 C ATOM 0 H TRP A 30 -0.217 -5.400 -8.815 1.00 52.04 H new ATOM 0 HA TRP A 30 -3.062 -6.123 -9.195 1.00 14.45 H new ATOM 0 HB2 TRP A 30 -3.308 -6.118 -6.769 1.00 1.01 H new ATOM 0 HB3 TRP A 30 -2.051 -7.237 -7.259 1.00 1.01 H new ATOM 0 HD1 TRP A 30 0.529 -6.554 -6.603 1.00 75.54 H new ATOM 0 HE1 TRP A 30 1.472 -5.038 -4.742 1.00 62.10 H new ATOM 0 HE3 TRP A 30 -3.755 -4.032 -5.415 1.00 13.13 H new ATOM 0 HZ2 TRP A 30 0.496 -3.071 -3.002 1.00 12.34 H new ATOM 0 HZ3 TRP A 30 -3.675 -2.351 -3.618 1.00 10.22 H new ATOM 0 HH2 TRP A 30 -1.577 -1.888 -2.418 1.00 72.14 H new ATOM 469 N HIS A 31 -1.810 -3.175 -8.391 1.00 3.11 N ATOM 470 CA HIS A 31 -2.086 -1.725 -8.397 1.00 65.42 C ATOM 471 C HIS A 31 -2.008 -1.206 -9.862 1.00 14.52 C ATOM 472 O HIS A 31 -0.929 -1.245 -10.468 1.00 55.43 O ATOM 473 CB HIS A 31 -1.097 -0.975 -7.483 1.00 4.14 C ATOM 474 CG HIS A 31 -1.466 0.464 -7.236 1.00 43.43 C ATOM 475 ND1 HIS A 31 -1.114 1.463 -8.114 1.00 72.24 N ATOM 476 CD2 HIS A 31 -2.168 1.007 -6.217 1.00 31.14 C ATOM 477 CE1 HIS A 31 -1.608 2.572 -7.608 1.00 70.23 C ATOM 478 NE2 HIS A 31 -2.251 2.345 -6.461 1.00 20.14 N ATOM 0 H HIS A 31 -0.831 -3.408 -8.227 1.00 3.11 H new ATOM 0 HA HIS A 31 -3.086 -1.540 -8.005 1.00 65.42 H new ATOM 0 HB2 HIS A 31 -1.037 -1.494 -6.526 1.00 4.14 H new ATOM 0 HB3 HIS A 31 -0.104 -1.014 -7.930 1.00 4.14 H new ATOM 0 HD2 HIS A 31 -2.584 0.481 -5.371 1.00 31.14 H new ATOM 0 HE1 HIS A 31 -1.506 3.546 -8.064 1.00 70.23 H new ATOM 0 HE2 HIS A 31 -2.716 3.041 -5.878 1.00 20.14 H new ATOM 486 N PRO A 32 -3.146 -0.701 -10.452 1.00 43.24 N ATOM 487 CA PRO A 32 -3.265 -0.476 -11.925 1.00 41.30 C ATOM 488 C PRO A 32 -2.397 0.691 -12.468 1.00 30.03 C ATOM 489 O PRO A 32 -2.108 0.756 -13.665 1.00 3.15 O ATOM 490 CB PRO A 32 -4.788 -0.179 -12.125 1.00 10.22 C ATOM 491 CG PRO A 32 -5.445 -0.471 -10.800 1.00 73.03 C ATOM 492 CD PRO A 32 -4.380 -0.275 -9.749 1.00 22.22 C ATOM 0 HA PRO A 32 -2.899 -1.340 -12.480 1.00 41.30 H new ATOM 0 HB2 PRO A 32 -4.948 0.858 -12.420 1.00 10.22 H new ATOM 0 HB3 PRO A 32 -5.207 -0.803 -12.914 1.00 10.22 H new ATOM 0 HG2 PRO A 32 -6.289 0.197 -10.628 1.00 73.03 H new ATOM 0 HG3 PRO A 32 -5.834 -1.489 -10.775 1.00 73.03 H new ATOM 0 HD2 PRO A 32 -4.321 0.763 -9.421 1.00 22.22 H new ATOM 0 HD3 PRO A 32 -4.570 -0.880 -8.862 1.00 22.22 H new ATOM 500 N GLN A 33 -1.985 1.596 -11.572 1.00 51.54 N ATOM 501 CA GLN A 33 -1.339 2.881 -11.943 1.00 2.02 C ATOM 502 C GLN A 33 0.206 2.851 -11.841 1.00 20.53 C ATOM 503 O GLN A 33 0.866 3.835 -12.202 1.00 75.34 O ATOM 504 CB GLN A 33 -1.934 3.989 -11.041 1.00 62.23 C ATOM 505 CG GLN A 33 -3.428 4.331 -11.342 1.00 1.13 C ATOM 506 CD GLN A 33 -4.248 4.716 -10.102 1.00 13.05 C ATOM 507 OE1 GLN A 33 -5.122 5.573 -10.154 1.00 30.33 O ATOM 508 NE2 GLN A 33 -4.041 4.008 -9.005 1.00 44.51 N ATOM 0 H GLN A 33 -2.086 1.467 -10.565 1.00 51.54 H new ATOM 0 HA GLN A 33 -1.548 3.078 -12.994 1.00 2.02 H new ATOM 0 HB2 GLN A 33 -1.847 3.679 -10.000 1.00 62.23 H new ATOM 0 HB3 GLN A 33 -1.337 4.894 -11.155 1.00 62.23 H new ATOM 0 HG2 GLN A 33 -3.464 5.153 -12.057 1.00 1.13 H new ATOM 0 HG3 GLN A 33 -3.896 3.471 -11.821 1.00 1.13 H new ATOM 0 HE21 GLN A 33 -3.307 3.300 -8.986 1.00 44.51 H new ATOM 0 HE22 GLN A 33 -4.615 4.170 -8.178 1.00 44.51 H new ATOM 517 N VAL A 34 0.778 1.740 -11.345 1.00 12.13 N ATOM 518 CA VAL A 34 2.248 1.579 -11.258 1.00 42.42 C ATOM 519 C VAL A 34 2.905 1.489 -12.662 1.00 65.25 C ATOM 520 O VAL A 34 2.519 0.656 -13.488 1.00 43.22 O ATOM 521 CB VAL A 34 2.621 0.314 -10.411 1.00 75.23 C ATOM 522 CG1 VAL A 34 4.156 0.119 -10.303 1.00 4.02 C ATOM 523 CG2 VAL A 34 1.976 0.397 -9.014 1.00 15.32 C ATOM 0 H VAL A 34 0.250 0.939 -10.998 1.00 12.13 H new ATOM 0 HA VAL A 34 2.637 2.468 -10.761 1.00 42.42 H new ATOM 0 HB VAL A 34 2.225 -0.560 -10.929 1.00 75.23 H new ATOM 0 HG11 VAL A 34 4.369 -0.769 -9.708 1.00 4.02 H new ATOM 0 HG12 VAL A 34 4.578 -0.003 -11.300 1.00 4.02 H new ATOM 0 HG13 VAL A 34 4.601 0.992 -9.825 1.00 4.02 H new ATOM 0 HG21 VAL A 34 2.243 -0.488 -8.437 1.00 15.32 H new ATOM 0 HG22 VAL A 34 2.336 1.288 -8.500 1.00 15.32 H new ATOM 0 HG23 VAL A 34 0.892 0.450 -9.116 1.00 15.32 H new ATOM 533 N SER A 35 3.932 2.332 -12.889 1.00 44.31 N ATOM 534 CA SER A 35 4.686 2.410 -14.174 1.00 45.23 C ATOM 535 C SER A 35 5.811 1.341 -14.281 1.00 25.52 C ATOM 536 O SER A 35 6.786 1.537 -15.017 1.00 52.00 O ATOM 537 CB SER A 35 5.298 3.825 -14.301 1.00 15.43 C ATOM 538 OG SER A 35 4.298 4.827 -14.275 1.00 74.22 O ATOM 0 H SER A 35 4.271 2.987 -12.185 1.00 44.31 H new ATOM 0 HA SER A 35 3.986 2.210 -14.985 1.00 45.23 H new ATOM 0 HB2 SER A 35 6.003 3.992 -13.487 1.00 15.43 H new ATOM 0 HB3 SER A 35 5.862 3.896 -15.231 1.00 15.43 H new ATOM 0 HG SER A 35 4.717 5.709 -14.355 1.00 74.22 H new ATOM 544 N ALA A 36 5.622 0.199 -13.578 1.00 33.21 N ATOM 545 CA ALA A 36 6.624 -0.894 -13.438 1.00 41.11 C ATOM 546 C ALA A 36 7.933 -0.403 -12.751 1.00 33.23 C ATOM 547 O ALA A 36 8.712 0.346 -13.350 1.00 40.23 O ATOM 548 CB ALA A 36 6.912 -1.590 -14.786 1.00 32.14 C ATOM 0 H ALA A 36 4.753 0.004 -13.081 1.00 33.21 H new ATOM 0 HA ALA A 36 6.181 -1.642 -12.780 1.00 41.11 H new ATOM 0 HB1 ALA A 36 7.648 -2.380 -14.638 1.00 32.14 H new ATOM 0 HB2 ALA A 36 5.990 -2.021 -15.177 1.00 32.14 H new ATOM 0 HB3 ALA A 36 7.301 -0.861 -15.496 1.00 32.14 H new ATOM 554 N PRO A 37 8.188 -0.804 -11.468 1.00 42.44 N ATOM 555 CA PRO A 37 9.346 -0.303 -10.700 1.00 5.43 C ATOM 556 C PRO A 37 10.667 -1.091 -10.937 1.00 30.33 C ATOM 557 O PRO A 37 10.651 -2.273 -11.296 1.00 70.32 O ATOM 558 CB PRO A 37 8.835 -0.444 -9.261 1.00 70.34 C ATOM 559 CG PRO A 37 8.000 -1.690 -9.272 1.00 12.12 C ATOM 560 CD PRO A 37 7.380 -1.762 -10.656 1.00 71.12 C ATOM 0 HA PRO A 37 9.635 0.708 -10.987 1.00 5.43 H new ATOM 0 HB2 PRO A 37 9.661 -0.527 -8.554 1.00 70.34 H new ATOM 0 HB3 PRO A 37 8.247 0.424 -8.963 1.00 70.34 H new ATOM 0 HG2 PRO A 37 8.610 -2.571 -9.071 1.00 12.12 H new ATOM 0 HG3 PRO A 37 7.231 -1.652 -8.501 1.00 12.12 H new ATOM 0 HD2 PRO A 37 7.431 -2.772 -11.064 1.00 71.12 H new ATOM 0 HD3 PRO A 37 6.328 -1.479 -10.636 1.00 71.12 H new ATOM 568 N THR A 38 11.809 -0.403 -10.727 1.00 20.44 N ATOM 569 CA THR A 38 13.164 -1.002 -10.849 1.00 40.11 C ATOM 570 C THR A 38 13.839 -1.067 -9.462 1.00 64.20 C ATOM 571 O THR A 38 13.992 -0.035 -8.800 1.00 3.53 O ATOM 572 CB THR A 38 14.062 -0.180 -11.827 1.00 34.33 C ATOM 573 OG1 THR A 38 13.393 -0.025 -13.087 1.00 24.44 O ATOM 574 CG2 THR A 38 15.433 -0.849 -12.064 1.00 62.02 C ATOM 0 H THR A 38 11.823 0.583 -10.468 1.00 20.44 H new ATOM 0 HA THR A 38 13.050 -2.009 -11.251 1.00 40.11 H new ATOM 0 HB THR A 38 14.237 0.792 -11.365 1.00 34.33 H new ATOM 0 HG1 THR A 38 14.057 0.037 -13.805 1.00 24.44 H new ATOM 0 HG21 THR A 38 16.021 -0.240 -12.751 1.00 62.02 H new ATOM 0 HG22 THR A 38 15.962 -0.940 -11.115 1.00 62.02 H new ATOM 0 HG23 THR A 38 15.285 -1.840 -12.494 1.00 62.02 H new ATOM 582 N LEU A 39 14.279 -2.269 -9.057 1.00 21.33 N ATOM 583 CA LEU A 39 14.715 -2.553 -7.668 1.00 72.03 C ATOM 584 C LEU A 39 16.226 -2.321 -7.469 1.00 63.24 C ATOM 585 O LEU A 39 17.047 -2.665 -8.325 1.00 5.20 O ATOM 586 CB LEU A 39 14.309 -4.008 -7.261 1.00 50.04 C ATOM 587 CG LEU A 39 12.865 -4.189 -6.693 1.00 31.22 C ATOM 588 CD1 LEU A 39 12.732 -3.533 -5.304 1.00 54.23 C ATOM 589 CD2 LEU A 39 11.797 -3.654 -7.674 1.00 70.42 C ATOM 0 H LEU A 39 14.345 -3.075 -9.678 1.00 21.33 H new ATOM 0 HA LEU A 39 14.204 -1.848 -7.012 1.00 72.03 H new ATOM 0 HB2 LEU A 39 14.416 -4.650 -8.135 1.00 50.04 H new ATOM 0 HB3 LEU A 39 15.018 -4.365 -6.514 1.00 50.04 H new ATOM 0 HG LEU A 39 12.688 -5.258 -6.576 1.00 31.22 H new ATOM 0 HD11 LEU A 39 11.717 -3.673 -4.931 1.00 54.23 H new ATOM 0 HD12 LEU A 39 13.439 -3.994 -4.615 1.00 54.23 H new ATOM 0 HD13 LEU A 39 12.945 -2.467 -5.383 1.00 54.23 H new ATOM 0 HD21 LEU A 39 10.805 -3.797 -7.245 1.00 70.42 H new ATOM 0 HD22 LEU A 39 11.966 -2.592 -7.852 1.00 70.42 H new ATOM 0 HD23 LEU A 39 11.866 -4.195 -8.617 1.00 70.42 H new ATOM 601 N ARG A 40 16.569 -1.712 -6.318 1.00 73.20 N ATOM 602 CA ARG A 40 17.954 -1.401 -5.923 1.00 72.20 C ATOM 603 C ARG A 40 18.288 -2.159 -4.616 1.00 15.43 C ATOM 604 O ARG A 40 17.621 -1.937 -3.599 1.00 22.22 O ATOM 605 CB ARG A 40 18.123 0.139 -5.702 1.00 71.43 C ATOM 606 CG ARG A 40 17.531 1.044 -6.808 1.00 33.24 C ATOM 607 CD ARG A 40 18.149 0.812 -8.196 1.00 64.12 C ATOM 608 NE ARG A 40 17.567 1.718 -9.204 1.00 0.32 N ATOM 609 CZ ARG A 40 17.674 1.581 -10.509 1.00 32.03 C ATOM 610 NH1 ARG A 40 18.342 0.603 -11.039 1.00 32.41 N ATOM 611 NH2 ARG A 40 17.105 2.440 -11.283 1.00 4.14 N ATOM 0 H ARG A 40 15.880 -1.418 -5.626 1.00 73.20 H new ATOM 0 HA ARG A 40 18.634 -1.714 -6.715 1.00 72.20 H new ATOM 0 HB2 ARG A 40 17.657 0.405 -4.753 1.00 71.43 H new ATOM 0 HB3 ARG A 40 19.186 0.359 -5.608 1.00 71.43 H new ATOM 0 HG2 ARG A 40 16.456 0.875 -6.866 1.00 33.24 H new ATOM 0 HG3 ARG A 40 17.674 2.087 -6.526 1.00 33.24 H new ATOM 0 HD2 ARG A 40 19.227 0.966 -8.146 1.00 64.12 H new ATOM 0 HD3 ARG A 40 17.988 -0.223 -8.499 1.00 64.12 H new ATOM 0 HE ARG A 40 17.037 2.519 -8.861 1.00 0.32 H new ATOM 0 HH11 ARG A 40 18.801 -0.084 -10.441 1.00 32.41 H new ATOM 0 HH12 ARG A 40 18.408 0.521 -12.054 1.00 32.41 H new ATOM 0 HH21 ARG A 40 16.578 3.216 -10.883 1.00 4.14 H new ATOM 0 HH22 ARG A 40 17.182 2.343 -12.296 1.00 4.14 H new ATOM 625 N GLY A 41 19.356 -2.988 -4.640 1.00 55.35 N ATOM 626 CA GLY A 41 19.751 -3.877 -3.520 1.00 61.44 C ATOM 627 C GLY A 41 18.634 -4.706 -2.842 1.00 51.24 C ATOM 628 O GLY A 41 17.453 -4.623 -3.209 1.00 14.12 O ATOM 0 H GLY A 41 19.976 -3.061 -5.447 1.00 55.35 H new ATOM 0 HA2 GLY A 41 20.507 -4.569 -3.890 1.00 61.44 H new ATOM 0 HA3 GLY A 41 20.227 -3.264 -2.755 1.00 61.44 H new ATOM 632 N ALA A 42 19.045 -5.549 -1.871 1.00 2.32 N ATOM 633 CA ALA A 42 18.139 -6.411 -1.072 1.00 21.02 C ATOM 634 C ALA A 42 17.208 -7.314 -1.958 1.00 33.53 C ATOM 635 O ALA A 42 17.712 -8.087 -2.788 1.00 4.52 O ATOM 636 CB ALA A 42 17.372 -5.543 -0.049 1.00 20.14 C ATOM 0 H ALA A 42 20.027 -5.654 -1.614 1.00 2.32 H new ATOM 0 HA ALA A 42 18.743 -7.128 -0.516 1.00 21.02 H new ATOM 0 HB1 ALA A 42 16.706 -6.176 0.538 1.00 20.14 H new ATOM 0 HB2 ALA A 42 18.082 -5.049 0.614 1.00 20.14 H new ATOM 0 HB3 ALA A 42 16.786 -4.791 -0.577 1.00 20.14 H new ATOM 642 N SER A 43 15.865 -7.204 -1.799 1.00 32.54 N ATOM 643 CA SER A 43 14.868 -7.999 -2.575 1.00 61.14 C ATOM 644 C SER A 43 13.436 -7.419 -2.337 1.00 33.03 C ATOM 645 O SER A 43 13.245 -6.665 -1.377 1.00 31.33 O ATOM 646 CB SER A 43 14.913 -9.515 -2.173 1.00 44.30 C ATOM 647 OG SER A 43 14.060 -9.817 -1.073 1.00 42.42 O ATOM 0 H SER A 43 15.438 -6.563 -1.130 1.00 32.54 H new ATOM 0 HA SER A 43 15.118 -7.928 -3.633 1.00 61.14 H new ATOM 0 HB2 SER A 43 14.623 -10.123 -3.030 1.00 44.30 H new ATOM 0 HB3 SER A 43 15.937 -9.789 -1.920 1.00 44.30 H new ATOM 0 HG SER A 43 14.600 -9.945 -0.266 1.00 42.42 H new ATOM 653 N PRO A 44 12.396 -7.762 -3.188 1.00 63.23 N ATOM 654 CA PRO A 44 10.986 -7.272 -2.999 1.00 11.32 C ATOM 655 C PRO A 44 10.392 -7.553 -1.592 1.00 74.31 C ATOM 656 O PRO A 44 9.464 -6.863 -1.157 1.00 32.40 O ATOM 657 CB PRO A 44 10.194 -8.037 -4.100 1.00 50.40 C ATOM 658 CG PRO A 44 11.094 -9.155 -4.534 1.00 12.34 C ATOM 659 CD PRO A 44 12.492 -8.606 -4.406 1.00 34.44 C ATOM 0 HA PRO A 44 10.936 -6.186 -3.079 1.00 11.32 H new ATOM 0 HB2 PRO A 44 9.251 -8.420 -3.711 1.00 50.40 H new ATOM 0 HB3 PRO A 44 9.951 -7.381 -4.936 1.00 50.40 H new ATOM 0 HG2 PRO A 44 10.958 -10.037 -3.908 1.00 12.34 H new ATOM 0 HG3 PRO A 44 10.881 -9.457 -5.560 1.00 12.34 H new ATOM 0 HD2 PRO A 44 13.231 -9.399 -4.293 1.00 34.44 H new ATOM 0 HD3 PRO A 44 12.781 -8.024 -5.281 1.00 34.44 H new ATOM 667 N HIS A 45 10.929 -8.577 -0.908 1.00 63.43 N ATOM 668 CA HIS A 45 10.555 -8.905 0.478 1.00 40.44 C ATOM 669 C HIS A 45 11.520 -8.238 1.481 1.00 44.51 C ATOM 670 O HIS A 45 11.083 -7.657 2.477 1.00 74.43 O ATOM 671 CB HIS A 45 10.556 -10.437 0.685 1.00 55.40 C ATOM 672 CG HIS A 45 9.515 -11.170 -0.111 1.00 41.15 C ATOM 673 ND1 HIS A 45 8.260 -11.461 0.382 1.00 33.24 N ATOM 674 CD2 HIS A 45 9.548 -11.685 -1.359 1.00 42.32 C ATOM 675 CE1 HIS A 45 7.573 -12.118 -0.526 1.00 72.21 C ATOM 676 NE2 HIS A 45 8.332 -12.269 -1.581 1.00 71.33 N ATOM 0 H HIS A 45 11.634 -9.201 -1.300 1.00 63.43 H new ATOM 0 HA HIS A 45 9.551 -8.521 0.658 1.00 40.44 H new ATOM 0 HB2 HIS A 45 11.539 -10.827 0.421 1.00 55.40 H new ATOM 0 HB3 HIS A 45 10.403 -10.649 1.743 1.00 55.40 H new ATOM 0 HD1 HIS A 45 7.918 -11.206 1.308 1.00 33.24 H new ATOM 0 HD2 HIS A 45 10.377 -11.643 -2.050 1.00 42.32 H new ATOM 0 HE1 HIS A 45 6.558 -12.472 -0.420 1.00 72.21 H new ATOM 685 N THR A 46 12.833 -8.325 1.192 1.00 21.35 N ATOM 686 CA THR A 46 13.910 -7.941 2.136 1.00 55.53 C ATOM 687 C THR A 46 13.948 -6.409 2.411 1.00 61.01 C ATOM 688 O THR A 46 14.137 -5.621 1.477 1.00 14.44 O ATOM 689 CB THR A 46 15.313 -8.413 1.616 1.00 33.33 C ATOM 690 OG1 THR A 46 15.316 -9.837 1.432 1.00 50.02 O ATOM 691 CG2 THR A 46 16.465 -8.042 2.560 1.00 10.21 C ATOM 0 H THR A 46 13.181 -8.664 0.295 1.00 21.35 H new ATOM 0 HA THR A 46 13.682 -8.444 3.075 1.00 55.53 H new ATOM 0 HB THR A 46 15.476 -7.894 0.671 1.00 33.33 H new ATOM 0 HG1 THR A 46 16.195 -10.123 1.106 1.00 50.02 H new ATOM 0 HG21 THR A 46 17.407 -8.397 2.142 1.00 10.21 H new ATOM 0 HG22 THR A 46 16.505 -6.959 2.677 1.00 10.21 H new ATOM 0 HG23 THR A 46 16.302 -8.506 3.533 1.00 10.21 H new ATOM 699 N PRO A 47 13.753 -5.977 3.709 1.00 31.53 N ATOM 700 CA PRO A 47 13.859 -4.549 4.124 1.00 23.23 C ATOM 701 C PRO A 47 15.210 -3.893 3.718 1.00 24.32 C ATOM 702 O PRO A 47 16.279 -4.278 4.209 1.00 42.44 O ATOM 703 CB PRO A 47 13.684 -4.603 5.673 1.00 23.23 C ATOM 704 CG PRO A 47 13.875 -6.044 6.049 1.00 23.21 C ATOM 705 CD PRO A 47 13.382 -6.836 4.865 1.00 42.34 C ATOM 0 HA PRO A 47 13.113 -3.927 3.630 1.00 23.23 H new ATOM 0 HB2 PRO A 47 14.415 -3.967 6.173 1.00 23.23 H new ATOM 0 HB3 PRO A 47 12.697 -4.248 5.969 1.00 23.23 H new ATOM 0 HG2 PRO A 47 14.923 -6.260 6.257 1.00 23.21 H new ATOM 0 HG3 PRO A 47 13.313 -6.293 6.949 1.00 23.21 H new ATOM 0 HD2 PRO A 47 13.857 -7.815 4.809 1.00 42.34 H new ATOM 0 HD3 PRO A 47 12.306 -7.006 4.913 1.00 42.34 H new ATOM 713 N GLY A 48 15.134 -2.911 2.800 1.00 55.45 N ATOM 714 CA GLY A 48 16.315 -2.224 2.257 1.00 75.54 C ATOM 715 C GLY A 48 16.186 -1.926 0.762 1.00 3.44 C ATOM 716 O GLY A 48 16.796 -0.978 0.257 1.00 1.33 O ATOM 0 H GLY A 48 14.251 -2.574 2.416 1.00 55.45 H new ATOM 0 HA2 GLY A 48 16.468 -1.290 2.798 1.00 75.54 H new ATOM 0 HA3 GLY A 48 17.199 -2.839 2.426 1.00 75.54 H new ATOM 720 N ALA A 49 15.379 -2.738 0.053 1.00 45.52 N ATOM 721 CA ALA A 49 15.173 -2.602 -1.406 1.00 64.52 C ATOM 722 C ALA A 49 14.465 -1.283 -1.786 1.00 31.20 C ATOM 723 O ALA A 49 13.492 -0.881 -1.137 1.00 14.03 O ATOM 724 CB ALA A 49 14.378 -3.799 -1.929 1.00 4.22 C ATOM 0 H ALA A 49 14.852 -3.505 0.471 1.00 45.52 H new ATOM 0 HA ALA A 49 16.158 -2.578 -1.873 1.00 64.52 H new ATOM 0 HB1 ALA A 49 14.228 -3.695 -3.004 1.00 4.22 H new ATOM 0 HB2 ALA A 49 14.928 -4.718 -1.726 1.00 4.22 H new ATOM 0 HB3 ALA A 49 13.410 -3.839 -1.430 1.00 4.22 H new ATOM 730 N GLU A 50 14.945 -0.624 -2.854 1.00 64.23 N ATOM 731 CA GLU A 50 14.359 0.641 -3.354 1.00 40.32 C ATOM 732 C GLU A 50 13.833 0.466 -4.782 1.00 43.30 C ATOM 733 O GLU A 50 14.602 0.155 -5.683 1.00 3.33 O ATOM 734 CB GLU A 50 15.392 1.797 -3.301 1.00 3.23 C ATOM 735 CG GLU A 50 15.887 2.124 -1.891 1.00 51.13 C ATOM 736 CD GLU A 50 16.849 3.319 -1.852 1.00 72.12 C ATOM 737 OE1 GLU A 50 17.976 3.189 -2.374 1.00 43.41 O ATOM 738 OE2 GLU A 50 16.495 4.375 -1.274 1.00 50.32 O ATOM 0 H GLU A 50 15.746 -0.947 -3.396 1.00 64.23 H new ATOM 0 HA GLU A 50 13.524 0.900 -2.703 1.00 40.32 H new ATOM 0 HB2 GLU A 50 16.247 1.535 -3.924 1.00 3.23 H new ATOM 0 HB3 GLU A 50 14.944 2.691 -3.734 1.00 3.23 H new ATOM 0 HG2 GLU A 50 15.030 2.334 -1.251 1.00 51.13 H new ATOM 0 HG3 GLU A 50 16.387 1.249 -1.476 1.00 51.13 H new ATOM 745 N ARG A 51 12.521 0.663 -4.993 1.00 52.45 N ATOM 746 CA ARG A 51 11.912 0.471 -6.323 1.00 72.31 C ATOM 747 C ARG A 51 11.556 1.828 -6.967 1.00 40.43 C ATOM 748 O ARG A 51 11.011 2.722 -6.311 1.00 72.42 O ATOM 749 CB ARG A 51 10.692 -0.484 -6.246 1.00 3.32 C ATOM 750 CG ARG A 51 9.371 0.085 -5.643 1.00 23.04 C ATOM 751 CD ARG A 51 8.899 -0.655 -4.378 1.00 60.32 C ATOM 752 NE ARG A 51 9.421 -0.035 -3.148 1.00 24.33 N ATOM 753 CZ ARG A 51 10.430 -0.467 -2.421 1.00 54.30 C ATOM 754 NH1 ARG A 51 11.145 -1.489 -2.782 1.00 25.32 N ATOM 755 NH2 ARG A 51 10.719 0.153 -1.331 1.00 23.25 N ATOM 0 H ARG A 51 11.865 0.953 -4.268 1.00 52.45 H new ATOM 0 HA ARG A 51 12.646 -0.007 -6.972 1.00 72.31 H new ATOM 0 HB2 ARG A 51 10.477 -0.837 -7.254 1.00 3.32 H new ATOM 0 HB3 ARG A 51 10.983 -1.355 -5.658 1.00 3.32 H new ATOM 0 HG2 ARG A 51 9.515 1.139 -5.404 1.00 23.04 H new ATOM 0 HG3 ARG A 51 8.586 0.034 -6.397 1.00 23.04 H new ATOM 0 HD2 ARG A 51 7.809 -0.661 -4.347 1.00 60.32 H new ATOM 0 HD3 ARG A 51 9.222 -1.695 -4.425 1.00 60.32 H new ATOM 0 HE ARG A 51 8.954 0.813 -2.828 1.00 24.33 H new ATOM 0 HH11 ARG A 51 10.931 -1.980 -3.650 1.00 25.32 H new ATOM 0 HH12 ARG A 51 11.921 -1.801 -2.198 1.00 25.32 H new ATOM 0 HH21 ARG A 51 10.170 0.963 -1.044 1.00 23.25 H new ATOM 0 HH22 ARG A 51 11.497 -0.166 -0.754 1.00 23.25 H new ATOM 769 N VAL A 52 11.907 1.976 -8.257 1.00 44.33 N ATOM 770 CA VAL A 52 11.770 3.245 -9.001 1.00 50.12 C ATOM 771 C VAL A 52 10.739 3.094 -10.153 1.00 1.55 C ATOM 772 O VAL A 52 11.038 2.474 -11.183 1.00 41.30 O ATOM 773 CB VAL A 52 13.162 3.725 -9.565 1.00 53.34 C ATOM 774 CG1 VAL A 52 13.063 5.150 -10.152 1.00 74.20 C ATOM 775 CG2 VAL A 52 14.280 3.640 -8.491 1.00 73.32 C ATOM 0 H VAL A 52 12.295 1.217 -8.817 1.00 44.33 H new ATOM 0 HA VAL A 52 11.407 4.004 -8.308 1.00 50.12 H new ATOM 0 HB VAL A 52 13.436 3.045 -10.372 1.00 53.34 H new ATOM 0 HG11 VAL A 52 14.038 5.455 -10.533 1.00 74.20 H new ATOM 0 HG12 VAL A 52 12.336 5.159 -10.964 1.00 74.20 H new ATOM 0 HG13 VAL A 52 12.745 5.843 -9.373 1.00 74.20 H new ATOM 0 HG21 VAL A 52 15.223 3.979 -8.920 1.00 73.32 H new ATOM 0 HG22 VAL A 52 14.018 4.273 -7.643 1.00 73.32 H new ATOM 0 HG23 VAL A 52 14.385 2.608 -8.156 1.00 73.32 H new ATOM 785 N PHE A 53 9.522 3.636 -9.941 1.00 4.22 N ATOM 786 CA PHE A 53 8.386 3.559 -10.901 1.00 21.32 C ATOM 787 C PHE A 53 8.725 4.253 -12.245 1.00 61.42 C ATOM 788 O PHE A 53 8.647 5.482 -12.348 1.00 43.25 O ATOM 789 CB PHE A 53 7.105 4.204 -10.284 1.00 62.10 C ATOM 790 CG PHE A 53 6.454 3.457 -9.106 1.00 70.41 C ATOM 791 CD1 PHE A 53 7.201 2.698 -8.203 1.00 73.04 C ATOM 792 CD2 PHE A 53 5.072 3.533 -8.901 1.00 74.24 C ATOM 793 CE1 PHE A 53 6.592 2.044 -7.149 1.00 42.22 C ATOM 794 CE2 PHE A 53 4.470 2.875 -7.845 1.00 64.54 C ATOM 795 CZ PHE A 53 5.228 2.129 -6.971 1.00 14.44 C ATOM 0 H PHE A 53 9.291 4.147 -9.089 1.00 4.22 H new ATOM 0 HA PHE A 53 8.200 2.504 -11.101 1.00 21.32 H new ATOM 0 HB2 PHE A 53 7.358 5.211 -9.951 1.00 62.10 H new ATOM 0 HB3 PHE A 53 6.361 4.307 -11.074 1.00 62.10 H new ATOM 0 HD1 PHE A 53 8.271 2.621 -8.330 1.00 73.04 H new ATOM 0 HD2 PHE A 53 4.466 4.115 -9.579 1.00 74.24 H new ATOM 0 HE1 PHE A 53 7.188 1.463 -6.461 1.00 42.22 H new ATOM 0 HE2 PHE A 53 3.401 2.946 -7.705 1.00 64.54 H new ATOM 0 HZ PHE A 53 4.756 1.612 -6.149 1.00 14.44 H new ATOM 805 N GLY A 54 9.093 3.450 -13.260 1.00 3.53 N ATOM 806 CA GLY A 54 9.496 3.980 -14.572 1.00 14.03 C ATOM 807 C GLY A 54 10.896 4.602 -14.559 1.00 1.14 C ATOM 808 O GLY A 54 11.068 5.757 -14.954 1.00 53.43 O ATOM 0 H GLY A 54 9.119 2.432 -13.195 1.00 3.53 H new ATOM 0 HA2 GLY A 54 9.468 3.176 -15.307 1.00 14.03 H new ATOM 0 HA3 GLY A 54 8.773 4.730 -14.893 1.00 14.03 H new ATOM 812 N ALA A 55 11.902 3.833 -14.091 1.00 44.22 N ATOM 813 CA ALA A 55 13.306 4.311 -14.004 1.00 42.30 C ATOM 814 C ALA A 55 13.910 4.584 -15.410 1.00 10.02 C ATOM 815 O ALA A 55 14.468 3.682 -16.053 1.00 54.50 O ATOM 816 CB ALA A 55 14.166 3.307 -13.217 1.00 13.15 C ATOM 0 H ALA A 55 11.771 2.875 -13.766 1.00 44.22 H new ATOM 0 HA ALA A 55 13.303 5.260 -13.468 1.00 42.30 H new ATOM 0 HB1 ALA A 55 15.192 3.671 -13.162 1.00 13.15 H new ATOM 0 HB2 ALA A 55 13.766 3.196 -12.209 1.00 13.15 H new ATOM 0 HB3 ALA A 55 14.151 2.341 -13.721 1.00 13.15 H new ATOM 822 N GLY A 56 13.753 5.832 -15.882 1.00 21.05 N ATOM 823 CA GLY A 56 14.193 6.244 -17.224 1.00 0.53 C ATOM 824 C GLY A 56 13.255 7.279 -17.849 1.00 1.10 C ATOM 825 O GLY A 56 12.995 7.255 -19.061 1.00 44.42 O ATOM 0 H GLY A 56 13.318 6.582 -15.344 1.00 21.05 H new ATOM 0 HA2 GLY A 56 15.199 6.659 -17.163 1.00 0.53 H new ATOM 0 HA3 GLY A 56 14.248 5.369 -17.871 1.00 0.53 H new ATOM 829 N THR A 57 12.757 8.208 -17.007 1.00 14.32 N ATOM 830 CA THR A 57 11.823 9.289 -17.415 1.00 14.32 C ATOM 831 C THR A 57 12.219 10.628 -16.728 1.00 70.40 C ATOM 832 O THR A 57 13.360 10.781 -16.280 1.00 41.34 O ATOM 833 CB THR A 57 10.336 8.880 -17.100 1.00 61.14 C ATOM 834 OG1 THR A 57 9.414 9.830 -17.667 1.00 40.00 O ATOM 835 CG2 THR A 57 10.058 8.749 -15.595 1.00 41.53 C ATOM 0 H THR A 57 12.991 8.233 -16.015 1.00 14.32 H new ATOM 0 HA THR A 57 11.895 9.438 -18.492 1.00 14.32 H new ATOM 0 HB THR A 57 10.191 7.900 -17.554 1.00 61.14 H new ATOM 0 HG1 THR A 57 9.818 10.246 -18.457 1.00 40.00 H new ATOM 0 HG21 THR A 57 9.017 8.465 -15.441 1.00 41.53 H new ATOM 0 HG22 THR A 57 10.709 7.985 -15.170 1.00 41.53 H new ATOM 0 HG23 THR A 57 10.250 9.704 -15.105 1.00 41.53 H new ATOM 843 N GLU A 58 11.303 11.612 -16.689 1.00 3.24 N ATOM 844 CA GLU A 58 11.558 12.940 -16.078 1.00 42.22 C ATOM 845 C GLU A 58 10.721 13.165 -14.787 1.00 24.33 C ATOM 846 O GLU A 58 10.623 14.301 -14.296 1.00 74.51 O ATOM 847 CB GLU A 58 11.255 14.022 -17.151 1.00 1.42 C ATOM 848 CG GLU A 58 9.790 14.069 -17.638 1.00 54.21 C ATOM 849 CD GLU A 58 9.575 15.017 -18.838 1.00 31.25 C ATOM 850 OE1 GLU A 58 9.472 16.247 -18.632 1.00 32.52 O ATOM 851 OE2 GLU A 58 9.518 14.536 -19.993 1.00 75.40 O ATOM 0 H GLU A 58 10.365 11.515 -17.078 1.00 3.24 H new ATOM 0 HA GLU A 58 12.600 13.002 -15.765 1.00 42.22 H new ATOM 0 HB2 GLU A 58 11.518 14.999 -16.744 1.00 1.42 H new ATOM 0 HB3 GLU A 58 11.902 13.850 -18.011 1.00 1.42 H new ATOM 0 HG2 GLU A 58 9.475 13.064 -17.917 1.00 54.21 H new ATOM 0 HG3 GLU A 58 9.151 14.386 -16.814 1.00 54.21 H new ATOM 858 N GLU A 59 10.158 12.068 -14.218 1.00 32.23 N ATOM 859 CA GLU A 59 9.189 12.148 -13.081 1.00 72.33 C ATOM 860 C GLU A 59 8.901 10.764 -12.416 1.00 14.00 C ATOM 861 O GLU A 59 7.762 10.474 -12.011 1.00 12.41 O ATOM 862 CB GLU A 59 7.863 12.805 -13.576 1.00 72.24 C ATOM 863 CG GLU A 59 7.177 12.084 -14.758 1.00 40.23 C ATOM 864 CD GLU A 59 5.844 12.737 -15.152 1.00 62.44 C ATOM 865 OE1 GLU A 59 5.865 13.809 -15.788 1.00 32.34 O ATOM 866 OE2 GLU A 59 4.771 12.194 -14.806 1.00 32.03 O ATOM 0 H GLU A 59 10.355 11.115 -14.524 1.00 32.23 H new ATOM 0 HA GLU A 59 9.648 12.764 -12.307 1.00 72.33 H new ATOM 0 HB2 GLU A 59 7.163 12.848 -12.741 1.00 72.24 H new ATOM 0 HB3 GLU A 59 8.073 13.833 -13.870 1.00 72.24 H new ATOM 0 HG2 GLU A 59 7.847 12.085 -15.618 1.00 40.23 H new ATOM 0 HG3 GLU A 59 7.002 11.042 -14.492 1.00 40.23 H new ATOM 873 N GLU A 60 9.945 9.945 -12.248 1.00 5.51 N ATOM 874 CA GLU A 60 9.834 8.600 -11.617 1.00 32.13 C ATOM 875 C GLU A 60 9.726 8.686 -10.064 1.00 21.05 C ATOM 876 O GLU A 60 10.162 9.660 -9.450 1.00 24.45 O ATOM 877 CB GLU A 60 11.019 7.674 -12.038 1.00 3.31 C ATOM 878 CG GLU A 60 12.445 8.280 -11.913 1.00 71.44 C ATOM 879 CD GLU A 60 12.938 8.974 -13.202 1.00 10.35 C ATOM 880 OE1 GLU A 60 12.694 10.192 -13.377 1.00 54.00 O ATOM 881 OE2 GLU A 60 13.553 8.292 -14.053 1.00 65.12 O ATOM 0 H GLU A 60 10.893 10.183 -12.540 1.00 5.51 H new ATOM 0 HA GLU A 60 8.908 8.158 -11.984 1.00 32.13 H new ATOM 0 HB2 GLU A 60 10.978 6.769 -11.432 1.00 3.31 H new ATOM 0 HB3 GLU A 60 10.865 7.372 -13.074 1.00 3.31 H new ATOM 0 HG2 GLU A 60 12.454 9.001 -11.096 1.00 71.44 H new ATOM 0 HG3 GLU A 60 13.145 7.488 -11.646 1.00 71.44 H new ATOM 888 N LEU A 61 9.144 7.636 -9.449 1.00 3.24 N ATOM 889 CA LEU A 61 8.895 7.571 -7.982 1.00 25.22 C ATOM 890 C LEU A 61 9.860 6.564 -7.309 1.00 22.31 C ATOM 891 O LEU A 61 9.846 5.383 -7.643 1.00 22.51 O ATOM 892 CB LEU A 61 7.420 7.155 -7.713 1.00 23.31 C ATOM 893 CG LEU A 61 7.030 6.909 -6.215 1.00 4.10 C ATOM 894 CD1 LEU A 61 7.210 8.180 -5.358 1.00 50.10 C ATOM 895 CD2 LEU A 61 5.595 6.344 -6.096 1.00 15.34 C ATOM 0 H LEU A 61 8.831 6.805 -9.950 1.00 3.24 H new ATOM 0 HA LEU A 61 9.073 8.558 -7.556 1.00 25.22 H new ATOM 0 HB2 LEU A 61 6.767 7.931 -8.113 1.00 23.31 H new ATOM 0 HB3 LEU A 61 7.214 6.244 -8.274 1.00 23.31 H new ATOM 0 HG LEU A 61 7.716 6.159 -5.820 1.00 4.10 H new ATOM 0 HD11 LEU A 61 6.929 7.966 -4.327 1.00 50.10 H new ATOM 0 HD12 LEU A 61 8.252 8.497 -5.392 1.00 50.10 H new ATOM 0 HD13 LEU A 61 6.576 8.976 -5.749 1.00 50.10 H new ATOM 0 HD21 LEU A 61 5.353 6.184 -5.045 1.00 15.34 H new ATOM 0 HD22 LEU A 61 4.888 7.053 -6.527 1.00 15.34 H new ATOM 0 HD23 LEU A 61 5.531 5.397 -6.632 1.00 15.34 H new ATOM 907 N VAL A 62 10.674 7.032 -6.345 1.00 44.34 N ATOM 908 CA VAL A 62 11.636 6.168 -5.613 1.00 32.03 C ATOM 909 C VAL A 62 11.135 5.913 -4.170 1.00 54.43 C ATOM 910 O VAL A 62 10.906 6.864 -3.411 1.00 74.44 O ATOM 911 CB VAL A 62 13.075 6.806 -5.573 1.00 2.45 C ATOM 912 CG1 VAL A 62 14.122 5.828 -4.967 1.00 42.25 C ATOM 913 CG2 VAL A 62 13.504 7.292 -6.981 1.00 50.25 C ATOM 0 H VAL A 62 10.689 8.008 -6.049 1.00 44.34 H new ATOM 0 HA VAL A 62 11.702 5.221 -6.148 1.00 32.03 H new ATOM 0 HB VAL A 62 13.032 7.675 -4.916 1.00 2.45 H new ATOM 0 HG11 VAL A 62 15.102 6.305 -4.957 1.00 42.25 H new ATOM 0 HG12 VAL A 62 13.833 5.571 -3.948 1.00 42.25 H new ATOM 0 HG13 VAL A 62 14.166 4.922 -5.571 1.00 42.25 H new ATOM 0 HG21 VAL A 62 14.501 7.729 -6.927 1.00 50.25 H new ATOM 0 HG22 VAL A 62 13.515 6.447 -7.670 1.00 50.25 H new ATOM 0 HG23 VAL A 62 12.798 8.042 -7.338 1.00 50.25 H new ATOM 923 N GLU A 63 10.952 4.626 -3.808 1.00 71.01 N ATOM 924 CA GLU A 63 10.515 4.203 -2.452 1.00 1.11 C ATOM 925 C GLU A 63 11.593 3.323 -1.778 1.00 24.25 C ATOM 926 O GLU A 63 12.142 2.453 -2.426 1.00 45.32 O ATOM 927 CB GLU A 63 9.201 3.392 -2.536 1.00 30.55 C ATOM 928 CG GLU A 63 8.042 4.087 -3.272 1.00 3.42 C ATOM 929 CD GLU A 63 6.764 3.228 -3.307 1.00 13.34 C ATOM 930 OE1 GLU A 63 6.835 2.091 -3.830 1.00 14.13 O ATOM 931 OE2 GLU A 63 5.707 3.674 -2.805 1.00 51.24 O ATOM 0 H GLU A 63 11.102 3.845 -4.447 1.00 71.01 H new ATOM 0 HA GLU A 63 10.357 5.105 -1.860 1.00 1.11 H new ATOM 0 HB2 GLU A 63 9.410 2.445 -3.034 1.00 30.55 H new ATOM 0 HB3 GLU A 63 8.875 3.154 -1.523 1.00 30.55 H new ATOM 0 HG2 GLU A 63 7.824 5.037 -2.784 1.00 3.42 H new ATOM 0 HG3 GLU A 63 8.350 4.316 -4.292 1.00 3.42 H new ATOM 938 N ARG A 64 11.841 3.525 -0.468 1.00 11.22 N ATOM 939 CA ARG A 64 12.761 2.679 0.346 1.00 45.52 C ATOM 940 C ARG A 64 11.937 1.730 1.245 1.00 63.12 C ATOM 941 O ARG A 64 11.007 2.163 1.923 1.00 30.11 O ATOM 942 CB ARG A 64 13.704 3.585 1.207 1.00 10.25 C ATOM 943 CG ARG A 64 14.488 2.873 2.354 1.00 24.51 C ATOM 944 CD ARG A 64 15.609 1.925 1.876 1.00 64.55 C ATOM 945 NE ARG A 64 16.771 2.651 1.330 1.00 33.42 N ATOM 946 CZ ARG A 64 18.009 2.186 1.236 1.00 62.23 C ATOM 947 NH1 ARG A 64 18.312 0.982 1.605 1.00 12.04 N ATOM 948 NH2 ARG A 64 18.930 2.939 0.738 1.00 71.44 N ATOM 0 H ARG A 64 11.411 4.281 0.065 1.00 11.22 H new ATOM 0 HA ARG A 64 13.381 2.077 -0.318 1.00 45.52 H new ATOM 0 HB2 ARG A 64 14.426 4.058 0.541 1.00 10.25 H new ATOM 0 HB3 ARG A 64 13.105 4.383 1.646 1.00 10.25 H new ATOM 0 HG2 ARG A 64 14.925 3.632 3.003 1.00 24.51 H new ATOM 0 HG3 ARG A 64 13.783 2.304 2.959 1.00 24.51 H new ATOM 0 HD2 ARG A 64 15.933 1.302 2.710 1.00 64.55 H new ATOM 0 HD3 ARG A 64 15.213 1.255 1.113 1.00 64.55 H new ATOM 0 HE ARG A 64 16.607 3.600 0.993 1.00 33.42 H new ATOM 0 HH11 ARG A 64 17.590 0.366 1.979 1.00 12.04 H new ATOM 0 HH12 ARG A 64 19.273 0.650 1.522 1.00 12.04 H new ATOM 0 HH21 ARG A 64 18.702 3.882 0.421 1.00 71.44 H new ATOM 0 HH22 ARG A 64 19.886 2.592 0.661 1.00 71.44 H new ATOM 962 N LEU A 65 12.281 0.429 1.230 1.00 34.30 N ATOM 963 CA LEU A 65 11.594 -0.595 2.043 1.00 52.25 C ATOM 964 C LEU A 65 12.197 -0.637 3.469 1.00 21.14 C ATOM 965 O LEU A 65 13.398 -0.864 3.631 1.00 14.42 O ATOM 966 CB LEU A 65 11.701 -1.977 1.340 1.00 63.12 C ATOM 967 CG LEU A 65 10.825 -3.127 1.926 1.00 42.43 C ATOM 968 CD1 LEU A 65 9.345 -2.705 2.004 1.00 63.04 C ATOM 969 CD2 LEU A 65 10.986 -4.424 1.096 1.00 10.33 C ATOM 0 H LEU A 65 13.039 0.058 0.657 1.00 34.30 H new ATOM 0 HA LEU A 65 10.538 -0.340 2.137 1.00 52.25 H new ATOM 0 HB2 LEU A 65 11.436 -1.847 0.291 1.00 63.12 H new ATOM 0 HB3 LEU A 65 12.743 -2.294 1.368 1.00 63.12 H new ATOM 0 HG LEU A 65 11.172 -3.331 2.939 1.00 42.43 H new ATOM 0 HD11 LEU A 65 8.754 -3.523 2.416 1.00 63.04 H new ATOM 0 HD12 LEU A 65 9.250 -1.830 2.647 1.00 63.04 H new ATOM 0 HD13 LEU A 65 8.983 -2.463 1.005 1.00 63.04 H new ATOM 0 HD21 LEU A 65 10.365 -5.210 1.525 1.00 10.33 H new ATOM 0 HD22 LEU A 65 10.677 -4.238 0.067 1.00 10.33 H new ATOM 0 HD23 LEU A 65 12.030 -4.738 1.110 1.00 10.33 H new ATOM 981 N VAL A 66 11.354 -0.397 4.488 1.00 32.21 N ATOM 982 CA VAL A 66 11.800 -0.250 5.898 1.00 65.13 C ATOM 983 C VAL A 66 11.785 -1.596 6.662 1.00 65.02 C ATOM 984 O VAL A 66 12.743 -1.931 7.377 1.00 55.12 O ATOM 985 CB VAL A 66 10.901 0.795 6.660 1.00 25.54 C ATOM 986 CG1 VAL A 66 11.331 0.967 8.141 1.00 10.22 C ATOM 987 CG2 VAL A 66 10.897 2.158 5.925 1.00 30.20 C ATOM 0 H VAL A 66 10.346 -0.299 4.366 1.00 32.21 H new ATOM 0 HA VAL A 66 12.829 0.107 5.865 1.00 65.13 H new ATOM 0 HB VAL A 66 9.885 0.401 6.665 1.00 25.54 H new ATOM 0 HG11 VAL A 66 10.683 1.697 8.626 1.00 10.22 H new ATOM 0 HG12 VAL A 66 11.250 0.010 8.657 1.00 10.22 H new ATOM 0 HG13 VAL A 66 12.363 1.315 8.182 1.00 10.22 H new ATOM 0 HG21 VAL A 66 10.270 2.863 6.470 1.00 30.20 H new ATOM 0 HG22 VAL A 66 11.915 2.545 5.870 1.00 30.20 H new ATOM 0 HG23 VAL A 66 10.504 2.027 4.917 1.00 30.20 H new ATOM 997 N GLU A 67 10.689 -2.354 6.509 1.00 53.41 N ATOM 998 CA GLU A 67 10.444 -3.592 7.284 1.00 31.30 C ATOM 999 C GLU A 67 9.410 -4.494 6.569 1.00 13.51 C ATOM 1000 O GLU A 67 8.624 -4.021 5.743 1.00 5.11 O ATOM 1001 CB GLU A 67 9.955 -3.212 8.716 1.00 44.34 C ATOM 1002 CG GLU A 67 9.780 -4.384 9.705 1.00 72.24 C ATOM 1003 CD GLU A 67 9.310 -3.928 11.095 1.00 65.22 C ATOM 1004 OE1 GLU A 67 10.138 -3.383 11.855 1.00 64.14 O ATOM 1005 OE2 GLU A 67 8.116 -4.097 11.429 1.00 64.31 O ATOM 0 H GLU A 67 9.945 -2.132 5.847 1.00 53.41 H new ATOM 0 HA GLU A 67 11.373 -4.157 7.361 1.00 31.30 H new ATOM 0 HB2 GLU A 67 10.664 -2.504 9.145 1.00 44.34 H new ATOM 0 HB3 GLU A 67 9.001 -2.693 8.627 1.00 44.34 H new ATOM 0 HG2 GLU A 67 9.059 -5.092 9.297 1.00 72.24 H new ATOM 0 HG3 GLU A 67 10.727 -4.915 9.803 1.00 72.24 H new ATOM 1012 N ARG A 68 9.436 -5.798 6.881 1.00 21.02 N ATOM 1013 CA ARG A 68 8.408 -6.757 6.434 1.00 51.11 C ATOM 1014 C ARG A 68 8.222 -7.862 7.494 1.00 65.04 C ATOM 1015 O ARG A 68 9.202 -8.452 7.963 1.00 25.30 O ATOM 1016 CB ARG A 68 8.795 -7.408 5.079 1.00 23.35 C ATOM 1017 CG ARG A 68 7.702 -8.335 4.472 1.00 0.30 C ATOM 1018 CD ARG A 68 8.271 -9.430 3.542 1.00 61.54 C ATOM 1019 NE ARG A 68 8.892 -10.558 4.283 1.00 32.33 N ATOM 1020 CZ ARG A 68 10.180 -10.707 4.564 1.00 64.41 C ATOM 1021 NH1 ARG A 68 11.060 -9.806 4.271 1.00 71.33 N ATOM 1022 NH2 ARG A 68 10.575 -11.784 5.149 1.00 51.32 N ATOM 0 H ARG A 68 10.169 -6.220 7.450 1.00 21.02 H new ATOM 0 HA ARG A 68 7.475 -6.208 6.301 1.00 51.11 H new ATOM 0 HB2 ARG A 68 9.022 -6.618 4.363 1.00 23.35 H new ATOM 0 HB3 ARG A 68 9.709 -7.986 5.216 1.00 23.35 H new ATOM 0 HG2 ARG A 68 7.148 -8.809 5.282 1.00 0.30 H new ATOM 0 HG3 ARG A 68 6.991 -7.727 3.912 1.00 0.30 H new ATOM 0 HD2 ARG A 68 7.470 -9.815 2.911 1.00 61.54 H new ATOM 0 HD3 ARG A 68 9.014 -8.986 2.879 1.00 61.54 H new ATOM 0 HE ARG A 68 8.264 -11.293 4.609 1.00 32.33 H new ATOM 0 HH11 ARG A 68 10.773 -8.944 3.808 1.00 71.33 H new ATOM 0 HH12 ARG A 68 12.042 -9.957 4.503 1.00 71.33 H new ATOM 0 HH21 ARG A 68 9.900 -12.510 5.391 1.00 51.32 H new ATOM 0 HH22 ARG A 68 11.562 -11.911 5.371 1.00 51.32 H new ATOM 1036 N ASP A 69 6.958 -8.141 7.842 1.00 40.41 N ATOM 1037 CA ASP A 69 6.585 -9.234 8.751 1.00 3.43 C ATOM 1038 C ASP A 69 5.569 -10.167 8.060 1.00 2.31 C ATOM 1039 O ASP A 69 4.457 -9.758 7.730 1.00 23.54 O ATOM 1040 CB ASP A 69 6.019 -8.683 10.080 1.00 13.02 C ATOM 1041 CG ASP A 69 5.581 -9.808 11.039 1.00 10.11 C ATOM 1042 OD1 ASP A 69 6.377 -10.744 11.277 1.00 41.11 O ATOM 1043 OD2 ASP A 69 4.438 -9.784 11.518 1.00 63.15 O ATOM 0 H ASP A 69 6.159 -7.610 7.497 1.00 40.41 H new ATOM 0 HA ASP A 69 7.480 -9.809 8.991 1.00 3.43 H new ATOM 0 HB2 ASP A 69 6.775 -8.067 10.567 1.00 13.02 H new ATOM 0 HB3 ASP A 69 5.168 -8.036 9.869 1.00 13.02 H new ATOM 1048 N GLU A 70 5.965 -11.431 7.844 1.00 40.22 N ATOM 1049 CA GLU A 70 5.116 -12.446 7.172 1.00 23.13 C ATOM 1050 C GLU A 70 4.428 -13.399 8.175 1.00 24.33 C ATOM 1051 O GLU A 70 3.870 -14.427 7.780 1.00 50.53 O ATOM 1052 CB GLU A 70 5.960 -13.221 6.121 1.00 12.10 C ATOM 1053 CG GLU A 70 7.266 -13.848 6.642 1.00 3.10 C ATOM 1054 CD GLU A 70 8.122 -14.463 5.516 1.00 20.14 C ATOM 1055 OE1 GLU A 70 8.520 -13.712 4.598 1.00 42.10 O ATOM 1056 OE2 GLU A 70 8.410 -15.680 5.545 1.00 11.32 O ATOM 0 H GLU A 70 6.879 -11.785 8.127 1.00 40.22 H new ATOM 0 HA GLU A 70 4.308 -11.926 6.658 1.00 23.13 H new ATOM 0 HB2 GLU A 70 5.342 -14.013 5.699 1.00 12.10 H new ATOM 0 HB3 GLU A 70 6.206 -12.540 5.306 1.00 12.10 H new ATOM 0 HG2 GLU A 70 7.848 -13.086 7.161 1.00 3.10 H new ATOM 0 HG3 GLU A 70 7.027 -14.620 7.374 1.00 3.10 H new ATOM 1063 N SER A 71 4.444 -13.038 9.471 1.00 11.42 N ATOM 1064 CA SER A 71 3.699 -13.776 10.525 1.00 24.45 C ATOM 1065 C SER A 71 2.317 -13.124 10.756 1.00 1.25 C ATOM 1066 O SER A 71 1.287 -13.806 10.806 1.00 31.41 O ATOM 1067 CB SER A 71 4.510 -13.803 11.843 1.00 65.11 C ATOM 1068 OG SER A 71 3.856 -14.576 12.844 1.00 33.34 O ATOM 0 H SER A 71 4.966 -12.235 9.822 1.00 11.42 H new ATOM 0 HA SER A 71 3.550 -14.803 10.192 1.00 24.45 H new ATOM 0 HB2 SER A 71 5.501 -14.216 11.653 1.00 65.11 H new ATOM 0 HB3 SER A 71 4.653 -12.785 12.204 1.00 65.11 H new ATOM 0 HG SER A 71 4.395 -14.574 13.663 1.00 33.34 H new ATOM 1074 N ALA A 72 2.315 -11.783 10.875 1.00 33.11 N ATOM 1075 CA ALA A 72 1.084 -10.977 11.107 1.00 2.41 C ATOM 1076 C ALA A 72 0.692 -10.149 9.855 1.00 1.43 C ATOM 1077 O ALA A 72 -0.233 -9.326 9.926 1.00 52.03 O ATOM 1078 CB ALA A 72 1.265 -10.062 12.337 1.00 31.40 C ATOM 0 H ALA A 72 3.163 -11.220 10.814 1.00 33.11 H new ATOM 0 HA ALA A 72 0.266 -11.670 11.303 1.00 2.41 H new ATOM 0 HB1 ALA A 72 0.357 -9.479 12.494 1.00 31.40 H new ATOM 0 HB2 ALA A 72 1.461 -10.672 13.219 1.00 31.40 H new ATOM 0 HB3 ALA A 72 2.104 -9.387 12.168 1.00 31.40 H new ATOM 1084 N ARG A 73 1.387 -10.408 8.717 1.00 55.24 N ATOM 1085 CA ARG A 73 1.096 -9.778 7.400 1.00 41.44 C ATOM 1086 C ARG A 73 1.147 -8.228 7.469 1.00 63.13 C ATOM 1087 O ARG A 73 0.126 -7.556 7.342 1.00 22.21 O ATOM 1088 CB ARG A 73 -0.267 -10.287 6.834 1.00 62.24 C ATOM 1089 CG ARG A 73 -0.287 -11.780 6.384 1.00 12.53 C ATOM 1090 CD ARG A 73 -1.531 -12.565 6.871 1.00 72.12 C ATOM 1091 NE ARG A 73 -1.386 -13.054 8.265 1.00 41.34 N ATOM 1092 CZ ARG A 73 -1.848 -12.466 9.356 1.00 24.01 C ATOM 1093 NH1 ARG A 73 -2.440 -11.314 9.308 1.00 4.03 N ATOM 1094 NH2 ARG A 73 -1.672 -13.030 10.505 1.00 51.52 N ATOM 0 H ARG A 73 2.169 -11.063 8.686 1.00 55.24 H new ATOM 0 HA ARG A 73 1.882 -10.082 6.709 1.00 41.44 H new ATOM 0 HB2 ARG A 73 -1.034 -10.144 7.595 1.00 62.24 H new ATOM 0 HB3 ARG A 73 -0.543 -9.665 5.983 1.00 62.24 H new ATOM 0 HG2 ARG A 73 -0.246 -11.822 5.296 1.00 12.53 H new ATOM 0 HG3 ARG A 73 0.611 -12.274 6.756 1.00 12.53 H new ATOM 0 HD2 ARG A 73 -2.410 -11.924 6.804 1.00 72.12 H new ATOM 0 HD3 ARG A 73 -1.704 -13.413 6.208 1.00 72.12 H new ATOM 0 HE ARG A 73 -0.880 -13.930 8.394 1.00 41.34 H new ATOM 0 HH11 ARG A 73 -2.559 -10.839 8.413 1.00 4.03 H new ATOM 0 HH12 ARG A 73 -2.787 -10.883 10.165 1.00 4.03 H new ATOM 0 HH21 ARG A 73 -1.180 -13.922 10.566 1.00 51.52 H new ATOM 0 HH22 ARG A 73 -2.025 -12.584 11.352 1.00 51.52 H new ATOM 1108 N ARG A 74 2.354 -7.686 7.694 1.00 34.11 N ATOM 1109 CA ARG A 74 2.588 -6.235 7.857 1.00 44.33 C ATOM 1110 C ARG A 74 3.840 -5.771 7.060 1.00 25.43 C ATOM 1111 O ARG A 74 4.971 -6.098 7.413 1.00 64.53 O ATOM 1112 CB ARG A 74 2.725 -5.928 9.372 1.00 5.13 C ATOM 1113 CG ARG A 74 3.011 -4.454 9.727 1.00 22.40 C ATOM 1114 CD ARG A 74 2.961 -4.204 11.241 1.00 14.33 C ATOM 1115 NE ARG A 74 1.597 -4.408 11.773 1.00 51.34 N ATOM 1116 CZ ARG A 74 1.286 -4.646 13.028 1.00 64.33 C ATOM 1117 NH1 ARG A 74 2.192 -4.720 13.946 1.00 0.34 N ATOM 1118 NH2 ARG A 74 0.046 -4.810 13.356 1.00 0.45 N ATOM 0 H ARG A 74 3.205 -8.244 7.769 1.00 34.11 H new ATOM 0 HA ARG A 74 1.744 -5.678 7.451 1.00 44.33 H new ATOM 0 HB2 ARG A 74 1.805 -6.232 9.871 1.00 5.13 H new ATOM 0 HB3 ARG A 74 3.527 -6.544 9.779 1.00 5.13 H new ATOM 0 HG2 ARG A 74 3.993 -4.174 9.346 1.00 22.40 H new ATOM 0 HG3 ARG A 74 2.282 -3.814 9.230 1.00 22.40 H new ATOM 0 HD2 ARG A 74 3.655 -4.876 11.746 1.00 14.33 H new ATOM 0 HD3 ARG A 74 3.289 -3.187 11.455 1.00 14.33 H new ATOM 0 HE ARG A 74 0.827 -4.360 11.106 1.00 51.34 H new ATOM 0 HH11 ARG A 74 3.175 -4.593 13.704 1.00 0.34 H new ATOM 0 HH12 ARG A 74 1.925 -4.906 14.913 1.00 0.34 H new ATOM 0 HH21 ARG A 74 -0.682 -4.754 12.643 1.00 0.45 H new ATOM 0 HH22 ARG A 74 -0.204 -4.995 14.327 1.00 0.45 H new ATOM 1132 N LEU A 75 3.608 -4.996 5.987 1.00 54.43 N ATOM 1133 CA LEU A 75 4.653 -4.511 5.052 1.00 54.35 C ATOM 1134 C LEU A 75 4.915 -2.996 5.255 1.00 41.20 C ATOM 1135 O LEU A 75 4.096 -2.178 4.870 1.00 25.32 O ATOM 1136 CB LEU A 75 4.183 -4.782 3.590 1.00 2.03 C ATOM 1137 CG LEU A 75 5.102 -4.232 2.457 1.00 61.45 C ATOM 1138 CD1 LEU A 75 6.516 -4.828 2.558 1.00 30.33 C ATOM 1139 CD2 LEU A 75 4.476 -4.475 1.068 1.00 65.04 C ATOM 0 H LEU A 75 2.672 -4.679 5.735 1.00 54.43 H new ATOM 0 HA LEU A 75 5.585 -5.041 5.249 1.00 54.35 H new ATOM 0 HB2 LEU A 75 4.083 -5.859 3.457 1.00 2.03 H new ATOM 0 HB3 LEU A 75 3.190 -4.351 3.464 1.00 2.03 H new ATOM 0 HG LEU A 75 5.193 -3.154 2.587 1.00 61.45 H new ATOM 0 HD11 LEU A 75 7.137 -4.428 1.757 1.00 30.33 H new ATOM 0 HD12 LEU A 75 6.953 -4.566 3.521 1.00 30.33 H new ATOM 0 HD13 LEU A 75 6.461 -5.913 2.468 1.00 30.33 H new ATOM 0 HD21 LEU A 75 5.138 -4.081 0.297 1.00 65.04 H new ATOM 0 HD22 LEU A 75 4.335 -5.545 0.914 1.00 65.04 H new ATOM 0 HD23 LEU A 75 3.512 -3.970 1.010 1.00 65.04 H new ATOM 1151 N VAL A 76 6.077 -2.634 5.822 1.00 74.31 N ATOM 1152 CA VAL A 76 6.420 -1.223 6.161 1.00 44.30 C ATOM 1153 C VAL A 76 7.432 -0.634 5.141 1.00 24.10 C ATOM 1154 O VAL A 76 8.466 -1.239 4.863 1.00 74.24 O ATOM 1155 CB VAL A 76 7.023 -1.123 7.613 1.00 22.11 C ATOM 1156 CG1 VAL A 76 7.263 0.353 8.044 1.00 21.02 C ATOM 1157 CG2 VAL A 76 6.127 -1.868 8.636 1.00 74.14 C ATOM 0 H VAL A 76 6.810 -3.301 6.062 1.00 74.31 H new ATOM 0 HA VAL A 76 5.497 -0.645 6.118 1.00 44.30 H new ATOM 0 HB VAL A 76 7.997 -1.612 7.595 1.00 22.11 H new ATOM 0 HG11 VAL A 76 7.679 0.375 9.051 1.00 21.02 H new ATOM 0 HG12 VAL A 76 7.961 0.825 7.353 1.00 21.02 H new ATOM 0 HG13 VAL A 76 6.317 0.894 8.031 1.00 21.02 H new ATOM 0 HG21 VAL A 76 6.564 -1.785 9.631 1.00 74.14 H new ATOM 0 HG22 VAL A 76 5.131 -1.424 8.639 1.00 74.14 H new ATOM 0 HG23 VAL A 76 6.055 -2.920 8.358 1.00 74.14 H new ATOM 1167 N TYR A 77 7.135 0.561 4.605 1.00 50.44 N ATOM 1168 CA TYR A 77 8.011 1.262 3.637 1.00 50.24 C ATOM 1169 C TYR A 77 7.897 2.806 3.777 1.00 73.35 C ATOM 1170 O TYR A 77 7.179 3.319 4.643 1.00 24.25 O ATOM 1171 CB TYR A 77 7.700 0.811 2.182 1.00 63.54 C ATOM 1172 CG TYR A 77 6.315 1.224 1.641 1.00 1.30 C ATOM 1173 CD1 TYR A 77 5.172 0.460 1.901 1.00 71.42 C ATOM 1174 CD2 TYR A 77 6.162 2.380 0.856 1.00 55.14 C ATOM 1175 CE1 TYR A 77 3.934 0.828 1.397 1.00 73.03 C ATOM 1176 CE2 TYR A 77 4.934 2.745 0.351 1.00 13.22 C ATOM 1177 CZ TYR A 77 3.823 1.972 0.623 1.00 51.12 C ATOM 1178 OH TYR A 77 2.599 2.337 0.111 1.00 51.54 O ATOM 0 H TYR A 77 6.281 1.073 4.827 1.00 50.44 H new ATOM 0 HA TYR A 77 9.041 0.988 3.866 1.00 50.24 H new ATOM 0 HB2 TYR A 77 8.465 1.219 1.522 1.00 63.54 H new ATOM 0 HB3 TYR A 77 7.782 -0.275 2.131 1.00 63.54 H new ATOM 0 HD1 TYR A 77 5.256 -0.432 2.505 1.00 71.42 H new ATOM 0 HD2 TYR A 77 7.025 2.994 0.645 1.00 55.14 H new ATOM 0 HE1 TYR A 77 3.062 0.227 1.606 1.00 73.03 H new ATOM 0 HE2 TYR A 77 4.840 3.633 -0.256 1.00 13.22 H new ATOM 0 HH TYR A 77 2.237 1.602 -0.426 1.00 51.54 H new ATOM 1188 N THR A 78 8.643 3.524 2.919 1.00 40.21 N ATOM 1189 CA THR A 78 8.661 5.007 2.864 1.00 60.00 C ATOM 1190 C THR A 78 8.954 5.497 1.431 1.00 21.31 C ATOM 1191 O THR A 78 9.440 4.733 0.598 1.00 45.03 O ATOM 1192 CB THR A 78 9.732 5.609 3.837 1.00 42.12 C ATOM 1193 OG1 THR A 78 9.778 7.043 3.728 1.00 74.45 O ATOM 1194 CG2 THR A 78 11.140 5.041 3.587 1.00 71.15 C ATOM 0 H THR A 78 9.261 3.090 2.233 1.00 40.21 H new ATOM 0 HA THR A 78 7.674 5.348 3.175 1.00 60.00 H new ATOM 0 HB THR A 78 9.423 5.324 4.843 1.00 42.12 H new ATOM 0 HG1 THR A 78 9.184 7.441 4.398 1.00 74.45 H new ATOM 0 HG21 THR A 78 11.844 5.491 4.287 1.00 71.15 H new ATOM 0 HG22 THR A 78 11.127 3.960 3.730 1.00 71.15 H new ATOM 0 HG23 THR A 78 11.448 5.269 2.567 1.00 71.15 H new ATOM 1202 N MET A 79 8.645 6.776 1.159 1.00 12.41 N ATOM 1203 CA MET A 79 8.975 7.457 -0.115 1.00 1.34 C ATOM 1204 C MET A 79 10.060 8.555 0.135 1.00 10.11 C ATOM 1205 O MET A 79 9.718 9.673 0.542 1.00 11.53 O ATOM 1206 CB MET A 79 7.668 8.068 -0.707 1.00 45.31 C ATOM 1207 CG MET A 79 6.580 7.029 -1.066 1.00 21.25 C ATOM 1208 SD MET A 79 4.905 7.726 -1.082 1.00 63.52 S ATOM 1209 CE MET A 79 5.020 9.001 -2.332 1.00 20.51 C ATOM 0 H MET A 79 8.154 7.377 1.821 1.00 12.41 H new ATOM 0 HA MET A 79 9.386 6.746 -0.832 1.00 1.34 H new ATOM 0 HB2 MET A 79 7.254 8.775 0.012 1.00 45.31 H new ATOM 0 HB3 MET A 79 7.920 8.635 -1.603 1.00 45.31 H new ATOM 0 HG2 MET A 79 6.800 6.606 -2.046 1.00 21.25 H new ATOM 0 HG3 MET A 79 6.619 6.209 -0.349 1.00 21.25 H new ATOM 0 HE1 MET A 79 4.180 9.688 -2.230 1.00 20.51 H new ATOM 0 HE2 MET A 79 5.954 9.549 -2.208 1.00 20.51 H new ATOM 0 HE3 MET A 79 4.996 8.544 -3.321 1.00 20.51 H new ATOM 1219 N PRO A 80 11.396 8.232 -0.031 1.00 10.12 N ATOM 1220 CA PRO A 80 12.506 9.225 0.099 1.00 2.11 C ATOM 1221 C PRO A 80 12.497 10.284 -1.031 1.00 51.13 C ATOM 1222 O PRO A 80 13.075 11.367 -0.888 1.00 32.43 O ATOM 1223 CB PRO A 80 13.789 8.347 0.047 1.00 12.21 C ATOM 1224 CG PRO A 80 13.374 7.130 -0.721 1.00 62.44 C ATOM 1225 CD PRO A 80 11.936 6.879 -0.319 1.00 50.04 C ATOM 0 HA PRO A 80 12.424 9.812 1.014 1.00 2.11 H new ATOM 0 HB2 PRO A 80 14.608 8.869 -0.447 1.00 12.21 H new ATOM 0 HB3 PRO A 80 14.134 8.087 1.048 1.00 12.21 H new ATOM 0 HG2 PRO A 80 13.460 7.294 -1.795 1.00 62.44 H new ATOM 0 HG3 PRO A 80 14.006 6.276 -0.477 1.00 62.44 H new ATOM 0 HD2 PRO A 80 11.379 6.390 -1.118 1.00 50.04 H new ATOM 0 HD3 PRO A 80 11.874 6.231 0.555 1.00 50.04 H new ATOM 1233 N ASP A 81 11.839 9.951 -2.154 1.00 13.53 N ATOM 1234 CA ASP A 81 11.597 10.886 -3.270 1.00 71.43 C ATOM 1235 C ASP A 81 10.075 10.975 -3.566 1.00 22.22 C ATOM 1236 O ASP A 81 9.581 10.329 -4.499 1.00 55.13 O ATOM 1237 CB ASP A 81 12.396 10.435 -4.518 1.00 61.45 C ATOM 1238 CG ASP A 81 13.918 10.511 -4.317 1.00 13.51 C ATOM 1239 OD1 ASP A 81 14.524 9.524 -3.846 1.00 71.22 O ATOM 1240 OD2 ASP A 81 14.513 11.570 -4.617 1.00 62.34 O ATOM 0 H ASP A 81 11.457 9.019 -2.316 1.00 13.53 H new ATOM 0 HA ASP A 81 11.942 11.883 -2.994 1.00 71.43 H new ATOM 0 HB2 ASP A 81 12.119 9.411 -4.769 1.00 61.45 H new ATOM 0 HB3 ASP A 81 12.116 11.059 -5.367 1.00 61.45 H new ATOM 1245 N PRO A 82 9.291 11.739 -2.732 1.00 75.20 N ATOM 1246 CA PRO A 82 7.833 11.890 -2.917 1.00 71.33 C ATOM 1247 C PRO A 82 7.449 13.078 -3.857 1.00 64.43 C ATOM 1248 O PRO A 82 8.108 14.121 -3.841 1.00 73.40 O ATOM 1249 CB PRO A 82 7.355 12.129 -1.466 1.00 2.33 C ATOM 1250 CG PRO A 82 8.469 12.905 -0.818 1.00 2.51 C ATOM 1251 CD PRO A 82 9.756 12.496 -1.530 1.00 12.32 C ATOM 0 HA PRO A 82 7.376 11.030 -3.406 1.00 71.33 H new ATOM 0 HB2 PRO A 82 6.419 12.687 -1.445 1.00 2.33 H new ATOM 0 HB3 PRO A 82 7.176 11.187 -0.948 1.00 2.33 H new ATOM 0 HG2 PRO A 82 8.299 13.978 -0.910 1.00 2.51 H new ATOM 0 HG3 PRO A 82 8.528 12.682 0.247 1.00 2.51 H new ATOM 0 HD2 PRO A 82 10.348 13.367 -1.813 1.00 12.32 H new ATOM 0 HD3 PRO A 82 10.385 11.878 -0.890 1.00 12.32 H new ATOM 1259 N PRO A 83 6.373 12.933 -4.702 1.00 14.13 N ATOM 1260 CA PRO A 83 5.845 14.049 -5.540 1.00 74.33 C ATOM 1261 C PRO A 83 4.988 15.073 -4.730 1.00 1.33 C ATOM 1262 O PRO A 83 4.456 16.030 -5.299 1.00 15.41 O ATOM 1263 CB PRO A 83 4.980 13.309 -6.618 1.00 72.54 C ATOM 1264 CG PRO A 83 5.255 11.842 -6.420 1.00 43.23 C ATOM 1265 CD PRO A 83 5.621 11.687 -4.965 1.00 53.00 C ATOM 0 HA PRO A 83 6.647 14.655 -5.962 1.00 74.33 H new ATOM 0 HB2 PRO A 83 3.920 13.530 -6.490 1.00 72.54 H new ATOM 0 HB3 PRO A 83 5.252 13.627 -7.625 1.00 72.54 H new ATOM 0 HG2 PRO A 83 4.379 11.243 -6.669 1.00 43.23 H new ATOM 0 HG3 PRO A 83 6.066 11.505 -7.066 1.00 43.23 H new ATOM 0 HD2 PRO A 83 4.740 11.601 -4.330 1.00 53.00 H new ATOM 0 HD3 PRO A 83 6.229 10.799 -4.790 1.00 53.00 H new ATOM 1273 N PHE A 84 4.857 14.853 -3.403 1.00 60.14 N ATOM 1274 CA PHE A 84 3.969 15.651 -2.516 1.00 20.24 C ATOM 1275 C PHE A 84 4.784 16.347 -1.390 1.00 24.13 C ATOM 1276 O PHE A 84 5.799 15.792 -0.942 1.00 34.32 O ATOM 1277 CB PHE A 84 2.876 14.720 -1.919 1.00 22.33 C ATOM 1278 CG PHE A 84 2.060 13.987 -2.988 1.00 22.45 C ATOM 1279 CD1 PHE A 84 1.066 14.652 -3.709 1.00 41.53 C ATOM 1280 CD2 PHE A 84 2.303 12.644 -3.293 1.00 55.53 C ATOM 1281 CE1 PHE A 84 0.343 14.001 -4.695 1.00 33.43 C ATOM 1282 CE2 PHE A 84 1.576 11.993 -4.277 1.00 61.11 C ATOM 1283 CZ PHE A 84 0.598 12.673 -4.977 1.00 11.34 C ATOM 0 H PHE A 84 5.363 14.116 -2.912 1.00 60.14 H new ATOM 0 HA PHE A 84 3.491 16.437 -3.101 1.00 20.24 H new ATOM 0 HB2 PHE A 84 3.349 13.987 -1.266 1.00 22.33 H new ATOM 0 HB3 PHE A 84 2.203 15.312 -1.299 1.00 22.33 H new ATOM 0 HD1 PHE A 84 0.858 15.690 -3.495 1.00 41.53 H new ATOM 0 HD2 PHE A 84 3.069 12.106 -2.754 1.00 55.53 H new ATOM 0 HE1 PHE A 84 -0.421 14.532 -5.244 1.00 33.43 H new ATOM 0 HE2 PHE A 84 1.774 10.954 -4.497 1.00 61.11 H new ATOM 0 HZ PHE A 84 0.033 12.166 -5.745 1.00 11.34 H new ATOM 1293 N PRO A 85 4.361 17.579 -0.920 1.00 51.13 N ATOM 1294 CA PRO A 85 5.089 18.328 0.138 1.00 33.14 C ATOM 1295 C PRO A 85 4.913 17.700 1.552 1.00 41.22 C ATOM 1296 O PRO A 85 4.066 18.122 2.352 1.00 62.14 O ATOM 1297 CB PRO A 85 4.492 19.756 0.038 1.00 64.05 C ATOM 1298 CG PRO A 85 3.099 19.549 -0.481 1.00 22.24 C ATOM 1299 CD PRO A 85 3.163 18.336 -1.394 1.00 33.11 C ATOM 0 HA PRO A 85 6.169 18.313 -0.006 1.00 33.14 H new ATOM 0 HB2 PRO A 85 4.484 20.251 1.009 1.00 64.05 H new ATOM 0 HB3 PRO A 85 5.076 20.384 -0.635 1.00 64.05 H new ATOM 0 HG2 PRO A 85 2.399 19.383 0.338 1.00 22.24 H new ATOM 0 HG3 PRO A 85 2.751 20.428 -1.025 1.00 22.24 H new ATOM 0 HD2 PRO A 85 2.257 17.734 -1.320 1.00 33.11 H new ATOM 0 HD3 PRO A 85 3.266 18.630 -2.439 1.00 33.11 H new ATOM 1307 N ILE A 86 5.709 16.643 1.820 1.00 5.20 N ATOM 1308 CA ILE A 86 5.673 15.871 3.084 1.00 25.00 C ATOM 1309 C ILE A 86 7.116 15.647 3.621 1.00 63.10 C ATOM 1310 O ILE A 86 8.016 15.274 2.858 1.00 2.32 O ATOM 1311 CB ILE A 86 4.923 14.488 2.880 1.00 71.11 C ATOM 1312 CG1 ILE A 86 5.628 13.595 1.801 1.00 52.41 C ATOM 1313 CG2 ILE A 86 3.437 14.719 2.505 1.00 23.15 C ATOM 1314 CD1 ILE A 86 4.928 12.281 1.483 1.00 64.23 C ATOM 0 H ILE A 86 6.403 16.296 1.158 1.00 5.20 H new ATOM 0 HA ILE A 86 5.116 16.446 3.824 1.00 25.00 H new ATOM 0 HB ILE A 86 4.966 13.954 3.829 1.00 71.11 H new ATOM 0 HG12 ILE A 86 5.719 14.171 0.880 1.00 52.41 H new ATOM 0 HG13 ILE A 86 6.640 13.375 2.141 1.00 52.41 H new ATOM 0 HG21 ILE A 86 2.942 13.757 2.370 1.00 23.15 H new ATOM 0 HG22 ILE A 86 2.942 15.273 3.303 1.00 23.15 H new ATOM 0 HG23 ILE A 86 3.380 15.290 1.578 1.00 23.15 H new ATOM 0 HD11 ILE A 86 5.496 11.740 0.726 1.00 64.23 H new ATOM 0 HD12 ILE A 86 4.861 11.676 2.387 1.00 64.23 H new ATOM 0 HD13 ILE A 86 3.925 12.485 1.107 1.00 64.23 H new ATOM 1326 N THR A 87 7.339 15.893 4.929 1.00 22.13 N ATOM 1327 CA THR A 87 8.685 15.787 5.550 1.00 52.23 C ATOM 1328 C THR A 87 9.103 14.303 5.738 1.00 62.41 C ATOM 1329 O THR A 87 9.890 13.775 4.948 1.00 61.05 O ATOM 1330 CB THR A 87 8.750 16.553 6.918 1.00 3.23 C ATOM 1331 OG1 THR A 87 8.281 17.904 6.758 1.00 42.24 O ATOM 1332 CG2 THR A 87 10.169 16.575 7.525 1.00 62.43 C ATOM 0 H THR A 87 6.604 16.168 5.581 1.00 22.13 H new ATOM 0 HA THR A 87 9.392 16.258 4.867 1.00 52.23 H new ATOM 0 HB THR A 87 8.104 16.009 7.608 1.00 3.23 H new ATOM 0 HG1 THR A 87 7.693 18.137 7.507 1.00 42.24 H new ATOM 0 HG21 THR A 87 10.152 17.118 8.470 1.00 62.43 H new ATOM 0 HG22 THR A 87 10.506 15.553 7.700 1.00 62.43 H new ATOM 0 HG23 THR A 87 10.852 17.069 6.835 1.00 62.43 H new ATOM 1340 N ASN A 88 8.570 13.626 6.774 1.00 42.15 N ATOM 1341 CA ASN A 88 8.840 12.188 7.011 1.00 10.32 C ATOM 1342 C ASN A 88 7.605 11.339 6.629 1.00 20.20 C ATOM 1343 O ASN A 88 6.565 11.400 7.286 1.00 24.33 O ATOM 1344 CB ASN A 88 9.283 11.937 8.483 1.00 52.04 C ATOM 1345 CG ASN A 88 8.384 12.612 9.523 1.00 20.14 C ATOM 1346 OD1 ASN A 88 8.639 13.737 9.936 1.00 22.32 O ATOM 1347 ND2 ASN A 88 7.320 11.949 9.933 1.00 43.34 N ATOM 0 H ASN A 88 7.949 14.050 7.463 1.00 42.15 H new ATOM 0 HA ASN A 88 9.667 11.879 6.372 1.00 10.32 H new ATOM 0 HB2 ASN A 88 9.297 10.863 8.670 1.00 52.04 H new ATOM 0 HB3 ASN A 88 10.304 12.296 8.611 1.00 52.04 H new ATOM 0 HD21 ASN A 88 6.685 12.372 10.610 1.00 43.34 H new ATOM 0 HD22 ASN A 88 7.132 11.014 9.573 1.00 43.34 H new ATOM 1354 N HIS A 89 7.719 10.593 5.518 1.00 41.32 N ATOM 1355 CA HIS A 89 6.668 9.660 5.053 1.00 41.43 C ATOM 1356 C HIS A 89 6.838 8.252 5.691 1.00 51.22 C ATOM 1357 O HIS A 89 7.956 7.782 5.886 1.00 11.11 O ATOM 1358 CB HIS A 89 6.705 9.557 3.507 1.00 12.12 C ATOM 1359 CG HIS A 89 5.674 8.618 2.939 1.00 23.51 C ATOM 1360 ND1 HIS A 89 6.010 7.348 2.533 1.00 41.43 N ATOM 1361 CD2 HIS A 89 4.337 8.789 2.788 1.00 2.24 C ATOM 1362 CE1 HIS A 89 4.884 6.781 2.150 1.00 22.11 C ATOM 1363 NE2 HIS A 89 3.847 7.616 2.290 1.00 34.34 N ATOM 0 H HIS A 89 8.540 10.616 4.914 1.00 41.32 H new ATOM 0 HA HIS A 89 5.700 10.052 5.366 1.00 41.43 H new ATOM 0 HB2 HIS A 89 6.554 10.549 3.082 1.00 12.12 H new ATOM 0 HB3 HIS A 89 7.696 9.225 3.197 1.00 12.12 H new ATOM 0 HD2 HIS A 89 3.770 9.679 3.017 1.00 2.24 H new ATOM 0 HE1 HIS A 89 4.807 5.772 1.772 1.00 22.11 H new ATOM 0 HE2 HIS A 89 2.873 7.414 2.066 1.00 34.34 H new ATOM 1371 N ARG A 90 5.708 7.595 6.018 1.00 74.30 N ATOM 1372 CA ARG A 90 5.689 6.201 6.516 1.00 64.55 C ATOM 1373 C ARG A 90 4.372 5.515 6.077 1.00 40.12 C ATOM 1374 O ARG A 90 3.302 5.928 6.502 1.00 35.35 O ATOM 1375 CB ARG A 90 5.809 6.194 8.072 1.00 53.10 C ATOM 1376 CG ARG A 90 6.232 4.838 8.694 1.00 35.05 C ATOM 1377 CD ARG A 90 7.704 4.483 8.376 1.00 23.30 C ATOM 1378 NE ARG A 90 8.630 5.534 8.861 1.00 10.43 N ATOM 1379 CZ ARG A 90 9.593 6.104 8.164 1.00 51.01 C ATOM 1380 NH1 ARG A 90 9.911 5.691 6.987 1.00 3.02 N ATOM 1381 NH2 ARG A 90 10.256 7.086 8.673 1.00 43.53 N ATOM 0 H ARG A 90 4.781 8.014 5.945 1.00 74.30 H new ATOM 0 HA ARG A 90 6.533 5.653 6.098 1.00 64.55 H new ATOM 0 HB2 ARG A 90 6.533 6.953 8.368 1.00 53.10 H new ATOM 0 HB3 ARG A 90 4.848 6.487 8.496 1.00 53.10 H new ATOM 0 HG2 ARG A 90 6.095 4.877 9.775 1.00 35.05 H new ATOM 0 HG3 ARG A 90 5.580 4.049 8.319 1.00 35.05 H new ATOM 0 HD2 ARG A 90 7.958 3.530 8.839 1.00 23.30 H new ATOM 0 HD3 ARG A 90 7.825 4.357 7.300 1.00 23.30 H new ATOM 0 HE ARG A 90 8.511 5.846 9.825 1.00 10.43 H new ATOM 0 HH11 ARG A 90 9.413 4.904 6.571 1.00 3.02 H new ATOM 0 HH12 ARG A 90 10.661 6.151 6.470 1.00 3.02 H new ATOM 0 HH21 ARG A 90 10.035 7.419 9.611 1.00 43.53 H new ATOM 0 HH22 ARG A 90 11.002 7.530 8.137 1.00 43.53 H new ATOM 1395 N ALA A 91 4.444 4.491 5.208 1.00 2.40 N ATOM 1396 CA ALA A 91 3.239 3.751 4.738 1.00 24.54 C ATOM 1397 C ALA A 91 3.379 2.230 4.943 1.00 33.45 C ATOM 1398 O ALA A 91 4.466 1.677 4.818 1.00 35.42 O ATOM 1399 CB ALA A 91 2.948 4.082 3.268 1.00 12.53 C ATOM 0 H ALA A 91 5.320 4.150 4.812 1.00 2.40 H new ATOM 0 HA ALA A 91 2.394 4.078 5.344 1.00 24.54 H new ATOM 0 HB1 ALA A 91 2.065 3.534 2.939 1.00 12.53 H new ATOM 0 HB2 ALA A 91 2.770 5.152 3.164 1.00 12.53 H new ATOM 0 HB3 ALA A 91 3.802 3.795 2.655 1.00 12.53 H new ATOM 1405 N VAL A 92 2.255 1.563 5.275 1.00 13.53 N ATOM 1406 CA VAL A 92 2.211 0.119 5.616 1.00 53.21 C ATOM 1407 C VAL A 92 0.997 -0.587 4.934 1.00 32.12 C ATOM 1408 O VAL A 92 -0.092 -0.016 4.847 1.00 50.12 O ATOM 1409 CB VAL A 92 2.117 -0.094 7.190 1.00 3.03 C ATOM 1410 CG1 VAL A 92 2.131 -1.591 7.579 1.00 3.21 C ATOM 1411 CG2 VAL A 92 3.239 0.665 7.950 1.00 40.25 C ATOM 0 H VAL A 92 1.341 2.013 5.315 1.00 13.53 H new ATOM 0 HA VAL A 92 3.136 -0.324 5.246 1.00 53.21 H new ATOM 0 HB VAL A 92 1.157 0.325 7.492 1.00 3.03 H new ATOM 0 HG11 VAL A 92 2.065 -1.686 8.663 1.00 3.21 H new ATOM 0 HG12 VAL A 92 1.281 -2.095 7.118 1.00 3.21 H new ATOM 0 HG13 VAL A 92 3.057 -2.049 7.230 1.00 3.21 H new ATOM 0 HG21 VAL A 92 3.135 0.491 9.021 1.00 40.25 H new ATOM 0 HG22 VAL A 92 4.212 0.305 7.616 1.00 40.25 H new ATOM 0 HG23 VAL A 92 3.158 1.733 7.747 1.00 40.25 H new ATOM 1421 N LEU A 93 1.210 -1.832 4.459 1.00 0.42 N ATOM 1422 CA LEU A 93 0.123 -2.774 4.070 1.00 32.42 C ATOM 1423 C LEU A 93 -0.121 -3.743 5.245 1.00 1.10 C ATOM 1424 O LEU A 93 0.836 -4.175 5.880 1.00 53.32 O ATOM 1425 CB LEU A 93 0.495 -3.598 2.783 1.00 11.42 C ATOM 1426 CG LEU A 93 -0.015 -3.051 1.411 1.00 63.54 C ATOM 1427 CD1 LEU A 93 -1.550 -2.913 1.398 1.00 12.33 C ATOM 1428 CD2 LEU A 93 0.669 -1.730 1.031 1.00 43.21 C ATOM 0 H LEU A 93 2.144 -2.221 4.331 1.00 0.42 H new ATOM 0 HA LEU A 93 -0.773 -2.197 3.843 1.00 32.42 H new ATOM 0 HB2 LEU A 93 1.581 -3.674 2.733 1.00 11.42 H new ATOM 0 HB3 LEU A 93 0.110 -4.610 2.907 1.00 11.42 H new ATOM 0 HG LEU A 93 0.259 -3.783 0.651 1.00 63.54 H new ATOM 0 HD11 LEU A 93 -1.873 -2.530 0.430 1.00 12.33 H new ATOM 0 HD12 LEU A 93 -2.004 -3.888 1.572 1.00 12.33 H new ATOM 0 HD13 LEU A 93 -1.860 -2.223 2.183 1.00 12.33 H new ATOM 0 HD21 LEU A 93 0.286 -1.385 0.071 1.00 43.21 H new ATOM 0 HD22 LEU A 93 0.462 -0.980 1.795 1.00 43.21 H new ATOM 0 HD23 LEU A 93 1.745 -1.886 0.957 1.00 43.21 H new ATOM 1440 N GLU A 94 -1.381 -4.086 5.539 1.00 43.50 N ATOM 1441 CA GLU A 94 -1.680 -5.104 6.563 1.00 1.32 C ATOM 1442 C GLU A 94 -2.886 -5.960 6.143 1.00 60.43 C ATOM 1443 O GLU A 94 -4.019 -5.488 6.146 1.00 30.43 O ATOM 1444 CB GLU A 94 -1.925 -4.419 7.938 1.00 53.34 C ATOM 1445 CG GLU A 94 -2.016 -5.397 9.128 1.00 4.15 C ATOM 1446 CD GLU A 94 -2.202 -4.694 10.487 1.00 53.11 C ATOM 1447 OE1 GLU A 94 -1.293 -3.944 10.900 1.00 2.05 O ATOM 1448 OE2 GLU A 94 -3.244 -4.893 11.150 1.00 30.02 O ATOM 0 H GLU A 94 -2.203 -3.682 5.091 1.00 43.50 H new ATOM 0 HA GLU A 94 -0.822 -5.770 6.660 1.00 1.32 H new ATOM 0 HB2 GLU A 94 -1.119 -3.710 8.126 1.00 53.34 H new ATOM 0 HB3 GLU A 94 -2.849 -3.844 7.884 1.00 53.34 H new ATOM 0 HG2 GLU A 94 -2.849 -6.080 8.964 1.00 4.15 H new ATOM 0 HG3 GLU A 94 -1.110 -6.002 9.161 1.00 4.15 H new ATOM 1455 N VAL A 95 -2.638 -7.242 5.809 1.00 35.23 N ATOM 1456 CA VAL A 95 -3.705 -8.173 5.402 1.00 15.44 C ATOM 1457 C VAL A 95 -4.180 -8.960 6.641 1.00 41.23 C ATOM 1458 O VAL A 95 -3.467 -9.821 7.154 1.00 32.53 O ATOM 1459 CB VAL A 95 -3.231 -9.166 4.275 1.00 64.31 C ATOM 1460 CG1 VAL A 95 -4.407 -10.034 3.758 1.00 65.54 C ATOM 1461 CG2 VAL A 95 -2.546 -8.410 3.110 1.00 25.43 C ATOM 0 H VAL A 95 -1.706 -7.655 5.814 1.00 35.23 H new ATOM 0 HA VAL A 95 -4.527 -7.590 4.985 1.00 15.44 H new ATOM 0 HB VAL A 95 -2.493 -9.834 4.718 1.00 64.31 H new ATOM 0 HG11 VAL A 95 -4.047 -10.709 2.981 1.00 65.54 H new ATOM 0 HG12 VAL A 95 -4.819 -10.616 4.582 1.00 65.54 H new ATOM 0 HG13 VAL A 95 -5.183 -9.388 3.347 1.00 65.54 H new ATOM 0 HG21 VAL A 95 -2.231 -9.124 2.349 1.00 25.43 H new ATOM 0 HG22 VAL A 95 -3.249 -7.701 2.673 1.00 25.43 H new ATOM 0 HG23 VAL A 95 -1.676 -7.873 3.487 1.00 25.43 H new ATOM 1471 N VAL A 96 -5.393 -8.660 7.109 1.00 32.42 N ATOM 1472 CA VAL A 96 -5.951 -9.223 8.351 1.00 11.54 C ATOM 1473 C VAL A 96 -6.971 -10.348 8.012 1.00 24.00 C ATOM 1474 O VAL A 96 -7.963 -10.076 7.325 1.00 42.42 O ATOM 1475 CB VAL A 96 -6.659 -8.096 9.202 1.00 23.12 C ATOM 1476 CG1 VAL A 96 -7.019 -8.600 10.621 1.00 21.01 C ATOM 1477 CG2 VAL A 96 -5.797 -6.804 9.270 1.00 42.25 C ATOM 0 H VAL A 96 -6.025 -8.014 6.636 1.00 32.42 H new ATOM 0 HA VAL A 96 -5.135 -9.642 8.939 1.00 11.54 H new ATOM 0 HB VAL A 96 -7.589 -7.845 8.693 1.00 23.12 H new ATOM 0 HG11 VAL A 96 -7.504 -7.799 11.179 1.00 21.01 H new ATOM 0 HG12 VAL A 96 -7.696 -9.451 10.544 1.00 21.01 H new ATOM 0 HG13 VAL A 96 -6.110 -8.905 11.140 1.00 21.01 H new ATOM 0 HG21 VAL A 96 -6.316 -6.051 9.863 1.00 42.25 H new ATOM 0 HG22 VAL A 96 -4.836 -7.031 9.732 1.00 42.25 H new ATOM 0 HG23 VAL A 96 -5.633 -6.422 8.262 1.00 42.25 H new ATOM 1487 N PRO A 97 -6.753 -11.630 8.472 1.00 20.34 N ATOM 1488 CA PRO A 97 -7.692 -12.745 8.196 1.00 14.44 C ATOM 1489 C PRO A 97 -8.995 -12.640 9.039 1.00 65.04 C ATOM 1490 O PRO A 97 -9.118 -13.246 10.112 1.00 11.03 O ATOM 1491 CB PRO A 97 -6.857 -14.007 8.538 1.00 53.12 C ATOM 1492 CG PRO A 97 -5.877 -13.545 9.580 1.00 2.53 C ATOM 1493 CD PRO A 97 -5.593 -12.082 9.280 1.00 31.40 C ATOM 0 HA PRO A 97 -8.054 -12.751 7.168 1.00 14.44 H new ATOM 0 HB2 PRO A 97 -7.490 -14.810 8.917 1.00 53.12 H new ATOM 0 HB3 PRO A 97 -6.345 -14.394 7.657 1.00 53.12 H new ATOM 0 HG2 PRO A 97 -6.290 -13.663 10.582 1.00 2.53 H new ATOM 0 HG3 PRO A 97 -4.961 -14.135 9.541 1.00 2.53 H new ATOM 0 HD2 PRO A 97 -5.499 -11.501 10.197 1.00 31.40 H new ATOM 0 HD3 PRO A 97 -4.659 -11.965 8.731 1.00 31.40 H new ATOM 1501 N ARG A 98 -9.948 -11.825 8.538 1.00 14.11 N ATOM 1502 CA ARG A 98 -11.263 -11.594 9.188 1.00 24.00 C ATOM 1503 C ARG A 98 -12.124 -12.886 9.131 1.00 33.21 C ATOM 1504 O ARG A 98 -12.905 -13.173 10.040 1.00 13.10 O ATOM 1505 CB ARG A 98 -11.972 -10.382 8.486 1.00 51.41 C ATOM 1506 CG ARG A 98 -13.158 -9.728 9.266 1.00 63.40 C ATOM 1507 CD ARG A 98 -14.505 -10.470 9.127 1.00 43.33 C ATOM 1508 NE ARG A 98 -14.962 -10.510 7.727 1.00 22.23 N ATOM 1509 CZ ARG A 98 -15.903 -11.295 7.251 1.00 25.13 C ATOM 1510 NH1 ARG A 98 -16.496 -12.166 7.999 1.00 25.10 N ATOM 1511 NH2 ARG A 98 -16.234 -11.199 6.008 1.00 22.00 N ATOM 0 H ARG A 98 -9.830 -11.305 7.668 1.00 14.11 H new ATOM 0 HA ARG A 98 -11.126 -11.348 10.241 1.00 24.00 H new ATOM 0 HB2 ARG A 98 -11.224 -9.613 8.293 1.00 51.41 H new ATOM 0 HB3 ARG A 98 -12.343 -10.717 7.517 1.00 51.41 H new ATOM 0 HG2 ARG A 98 -12.895 -9.674 10.322 1.00 63.40 H new ATOM 0 HG3 ARG A 98 -13.285 -8.703 8.916 1.00 63.40 H new ATOM 0 HD2 ARG A 98 -14.401 -11.487 9.505 1.00 43.33 H new ATOM 0 HD3 ARG A 98 -15.258 -9.976 9.742 1.00 43.33 H new ATOM 0 HE ARG A 98 -14.509 -9.874 7.071 1.00 22.23 H new ATOM 0 HH11 ARG A 98 -16.237 -12.255 8.981 1.00 25.10 H new ATOM 0 HH12 ARG A 98 -17.223 -12.764 7.607 1.00 25.10 H new ATOM 0 HH21 ARG A 98 -15.767 -10.520 5.407 1.00 22.00 H new ATOM 0 HH22 ARG A 98 -16.963 -11.802 5.626 1.00 22.00 H new ATOM 1525 N ASP A 99 -11.932 -13.651 8.053 1.00 45.32 N ATOM 1526 CA ASP A 99 -12.651 -14.902 7.764 1.00 12.42 C ATOM 1527 C ASP A 99 -11.712 -15.873 6.990 1.00 5.25 C ATOM 1528 O ASP A 99 -10.664 -15.456 6.474 1.00 31.35 O ATOM 1529 CB ASP A 99 -13.942 -14.561 6.967 1.00 63.22 C ATOM 1530 CG ASP A 99 -14.696 -15.778 6.427 1.00 35.13 C ATOM 1531 OD1 ASP A 99 -15.302 -16.523 7.218 1.00 74.45 O ATOM 1532 OD2 ASP A 99 -14.655 -16.018 5.202 1.00 3.22 O ATOM 0 H ASP A 99 -11.251 -13.412 7.332 1.00 45.32 H new ATOM 0 HA ASP A 99 -12.947 -15.406 8.684 1.00 12.42 H new ATOM 0 HB2 ASP A 99 -14.612 -13.992 7.612 1.00 63.22 H new ATOM 0 HB3 ASP A 99 -13.677 -13.914 6.131 1.00 63.22 H new ATOM 1537 N ASP A 100 -12.108 -17.157 6.922 1.00 63.45 N ATOM 1538 CA ASP A 100 -11.336 -18.234 6.261 1.00 13.30 C ATOM 1539 C ASP A 100 -11.080 -17.926 4.760 1.00 73.53 C ATOM 1540 O ASP A 100 -9.955 -18.074 4.272 1.00 34.04 O ATOM 1541 CB ASP A 100 -12.096 -19.577 6.404 1.00 54.15 C ATOM 1542 CG ASP A 100 -12.525 -19.862 7.854 1.00 44.11 C ATOM 1543 OD1 ASP A 100 -13.609 -19.386 8.265 1.00 24.41 O ATOM 1544 OD2 ASP A 100 -11.769 -20.530 8.595 1.00 4.33 O ATOM 0 H ASP A 100 -12.984 -17.484 7.329 1.00 63.45 H new ATOM 0 HA ASP A 100 -10.365 -18.302 6.751 1.00 13.30 H new ATOM 0 HB2 ASP A 100 -12.978 -19.561 5.764 1.00 54.15 H new ATOM 0 HB3 ASP A 100 -11.461 -20.389 6.050 1.00 54.15 H new ATOM 1549 N ARG A 101 -12.146 -17.506 4.050 1.00 33.11 N ATOM 1550 CA ARG A 101 -12.087 -17.142 2.607 1.00 31.13 C ATOM 1551 C ARG A 101 -12.344 -15.632 2.373 1.00 55.10 C ATOM 1552 O ARG A 101 -12.527 -15.224 1.228 1.00 11.41 O ATOM 1553 CB ARG A 101 -13.104 -17.996 1.770 1.00 73.51 C ATOM 1554 CG ARG A 101 -12.615 -19.416 1.377 1.00 43.23 C ATOM 1555 CD ARG A 101 -12.623 -20.429 2.542 1.00 61.41 C ATOM 1556 NE ARG A 101 -11.964 -21.703 2.176 1.00 73.54 N ATOM 1557 CZ ARG A 101 -12.555 -22.876 2.058 1.00 4.53 C ATOM 1558 NH1 ARG A 101 -13.841 -23.010 2.191 1.00 33.33 N ATOM 1559 NH2 ARG A 101 -11.842 -23.916 1.782 1.00 73.11 N ATOM 0 H ARG A 101 -13.077 -17.407 4.455 1.00 33.11 H new ATOM 0 HA ARG A 101 -11.074 -17.363 2.269 1.00 31.13 H new ATOM 0 HB2 ARG A 101 -14.027 -18.093 2.341 1.00 73.51 H new ATOM 0 HB3 ARG A 101 -13.349 -17.449 0.859 1.00 73.51 H new ATOM 0 HG2 ARG A 101 -13.246 -19.797 0.574 1.00 43.23 H new ATOM 0 HG3 ARG A 101 -11.603 -19.343 0.980 1.00 43.23 H new ATOM 0 HD2 ARG A 101 -12.117 -19.994 3.404 1.00 61.41 H new ATOM 0 HD3 ARG A 101 -13.652 -20.627 2.843 1.00 61.41 H new ATOM 0 HE ARG A 101 -10.960 -21.671 1.999 1.00 73.54 H new ATOM 0 HH11 ARG A 101 -14.421 -22.195 2.392 1.00 33.33 H new ATOM 0 HH12 ARG A 101 -14.271 -23.930 2.094 1.00 33.33 H new ATOM 0 HH21 ARG A 101 -10.834 -23.825 1.658 1.00 73.11 H new ATOM 0 HH22 ARG A 101 -12.287 -24.829 1.688 1.00 73.11 H new ATOM 1573 N HIS A 102 -12.361 -14.800 3.434 1.00 3.53 N ATOM 1574 CA HIS A 102 -12.563 -13.326 3.299 1.00 42.41 C ATOM 1575 C HIS A 102 -11.595 -12.569 4.228 1.00 53.24 C ATOM 1576 O HIS A 102 -11.661 -12.716 5.443 1.00 4.44 O ATOM 1577 CB HIS A 102 -14.034 -12.927 3.600 1.00 60.31 C ATOM 1578 CG HIS A 102 -15.054 -13.617 2.728 1.00 42.22 C ATOM 1579 ND1 HIS A 102 -16.051 -14.423 3.227 1.00 52.54 N ATOM 1580 CD2 HIS A 102 -15.231 -13.610 1.380 1.00 53.40 C ATOM 1581 CE1 HIS A 102 -16.794 -14.878 2.241 1.00 43.21 C ATOM 1582 NE2 HIS A 102 -16.319 -14.397 1.113 1.00 54.43 N ATOM 0 H HIS A 102 -12.238 -15.114 4.397 1.00 3.53 H new ATOM 0 HA HIS A 102 -12.350 -13.049 2.267 1.00 42.41 H new ATOM 0 HB2 HIS A 102 -14.253 -13.152 4.644 1.00 60.31 H new ATOM 0 HB3 HIS A 102 -14.138 -11.849 3.478 1.00 60.31 H new ATOM 0 HD1 HIS A 102 -16.193 -14.636 4.214 1.00 52.54 H new ATOM 0 HD2 HIS A 102 -14.627 -13.083 0.656 1.00 53.40 H new ATOM 0 HE1 HIS A 102 -17.647 -15.533 2.341 1.00 43.21 H new ATOM 1591 N CYS A 103 -10.706 -11.739 3.657 1.00 33.04 N ATOM 1592 CA CYS A 103 -9.598 -11.102 4.413 1.00 3.22 C ATOM 1593 C CYS A 103 -9.453 -9.616 4.046 1.00 24.12 C ATOM 1594 O CYS A 103 -9.453 -9.258 2.865 1.00 53.34 O ATOM 1595 CB CYS A 103 -8.291 -11.865 4.144 1.00 11.44 C ATOM 1596 SG CYS A 103 -8.386 -13.608 4.620 1.00 60.32 S ATOM 0 H CYS A 103 -10.728 -11.488 2.669 1.00 33.04 H new ATOM 0 HA CYS A 103 -9.827 -11.149 5.478 1.00 3.22 H new ATOM 0 HB2 CYS A 103 -8.047 -11.795 3.084 1.00 11.44 H new ATOM 0 HB3 CYS A 103 -7.478 -11.388 4.691 1.00 11.44 H new ATOM 0 HG CYS A 103 -8.718 -14.323 3.586 1.00 60.32 H new ATOM 1602 N THR A 104 -9.314 -8.760 5.072 1.00 11.03 N ATOM 1603 CA THR A 104 -9.320 -7.295 4.906 1.00 64.23 C ATOM 1604 C THR A 104 -7.890 -6.729 4.723 1.00 70.34 C ATOM 1605 O THR A 104 -7.079 -6.784 5.646 1.00 54.04 O ATOM 1606 CB THR A 104 -10.004 -6.582 6.122 1.00 71.42 C ATOM 1607 OG1 THR A 104 -11.292 -7.171 6.378 1.00 24.24 O ATOM 1608 CG2 THR A 104 -10.173 -5.068 5.871 1.00 43.15 C ATOM 0 H THR A 104 -9.194 -9.062 6.039 1.00 11.03 H new ATOM 0 HA THR A 104 -9.895 -7.092 4.003 1.00 64.23 H new ATOM 0 HB THR A 104 -9.357 -6.715 6.989 1.00 71.42 H new ATOM 0 HG1 THR A 104 -11.712 -6.721 7.140 1.00 24.24 H new ATOM 0 HG21 THR A 104 -10.651 -4.607 6.735 1.00 43.15 H new ATOM 0 HG22 THR A 104 -9.195 -4.614 5.712 1.00 43.15 H new ATOM 0 HG23 THR A 104 -10.793 -4.913 4.988 1.00 43.15 H new ATOM 1616 N VAL A 105 -7.597 -6.161 3.536 1.00 4.33 N ATOM 1617 CA VAL A 105 -6.291 -5.535 3.237 1.00 3.04 C ATOM 1618 C VAL A 105 -6.353 -4.031 3.565 1.00 5.34 C ATOM 1619 O VAL A 105 -7.025 -3.260 2.872 1.00 25.50 O ATOM 1620 CB VAL A 105 -5.881 -5.731 1.732 1.00 65.21 C ATOM 1621 CG1 VAL A 105 -4.438 -5.220 1.461 1.00 55.43 C ATOM 1622 CG2 VAL A 105 -6.040 -7.205 1.315 1.00 34.24 C ATOM 0 H VAL A 105 -8.256 -6.123 2.759 1.00 4.33 H new ATOM 0 HA VAL A 105 -5.537 -6.023 3.854 1.00 3.04 H new ATOM 0 HB VAL A 105 -6.554 -5.130 1.121 1.00 65.21 H new ATOM 0 HG11 VAL A 105 -4.190 -5.372 0.411 1.00 55.43 H new ATOM 0 HG12 VAL A 105 -4.378 -4.158 1.698 1.00 55.43 H new ATOM 0 HG13 VAL A 105 -3.734 -5.772 2.084 1.00 55.43 H new ATOM 0 HG21 VAL A 105 -5.752 -7.321 0.270 1.00 34.24 H new ATOM 0 HG22 VAL A 105 -5.402 -7.831 1.939 1.00 34.24 H new ATOM 0 HG23 VAL A 105 -7.079 -7.508 1.440 1.00 34.24 H new ATOM 1632 N VAL A 106 -5.653 -3.632 4.630 1.00 74.32 N ATOM 1633 CA VAL A 106 -5.650 -2.252 5.139 1.00 70.21 C ATOM 1634 C VAL A 106 -4.363 -1.532 4.680 1.00 41.00 C ATOM 1635 O VAL A 106 -3.258 -1.892 5.102 1.00 74.41 O ATOM 1636 CB VAL A 106 -5.749 -2.222 6.715 1.00 54.30 C ATOM 1637 CG1 VAL A 106 -5.846 -0.766 7.257 1.00 20.32 C ATOM 1638 CG2 VAL A 106 -6.932 -3.089 7.219 1.00 61.45 C ATOM 0 H VAL A 106 -5.064 -4.264 5.172 1.00 74.32 H new ATOM 0 HA VAL A 106 -6.523 -1.738 4.736 1.00 70.21 H new ATOM 0 HB VAL A 106 -4.828 -2.654 7.107 1.00 54.30 H new ATOM 0 HG11 VAL A 106 -5.913 -0.786 8.345 1.00 20.32 H new ATOM 0 HG12 VAL A 106 -4.959 -0.207 6.958 1.00 20.32 H new ATOM 0 HG13 VAL A 106 -6.734 -0.284 6.848 1.00 20.32 H new ATOM 0 HG21 VAL A 106 -6.975 -3.049 8.307 1.00 61.45 H new ATOM 0 HG22 VAL A 106 -7.865 -2.707 6.805 1.00 61.45 H new ATOM 0 HG23 VAL A 106 -6.789 -4.121 6.899 1.00 61.45 H new ATOM 1648 N TRP A 107 -4.512 -0.524 3.811 1.00 51.14 N ATOM 1649 CA TRP A 107 -3.391 0.305 3.333 1.00 51.41 C ATOM 1650 C TRP A 107 -3.420 1.665 4.078 1.00 65.31 C ATOM 1651 O TRP A 107 -4.401 2.410 4.000 1.00 23.34 O ATOM 1652 CB TRP A 107 -3.492 0.502 1.794 1.00 12.15 C ATOM 1653 CG TRP A 107 -2.216 0.960 1.109 1.00 32.24 C ATOM 1654 CD1 TRP A 107 -1.068 1.451 1.689 1.00 71.10 C ATOM 1655 CD2 TRP A 107 -1.975 0.964 -0.302 1.00 70.21 C ATOM 1656 NE1 TRP A 107 -0.145 1.741 0.726 1.00 1.30 N ATOM 1657 CE2 TRP A 107 -0.672 1.453 -0.504 1.00 13.43 C ATOM 1658 CE3 TRP A 107 -2.737 0.592 -1.411 1.00 34.30 C ATOM 1659 CZ2 TRP A 107 -0.114 1.587 -1.772 1.00 50.43 C ATOM 1660 CZ3 TRP A 107 -2.187 0.732 -2.669 1.00 12.43 C ATOM 1661 CH2 TRP A 107 -0.884 1.220 -2.843 1.00 70.34 C ATOM 0 H TRP A 107 -5.414 -0.257 3.417 1.00 51.14 H new ATOM 0 HA TRP A 107 -2.443 -0.191 3.541 1.00 51.41 H new ATOM 0 HB2 TRP A 107 -3.807 -0.440 1.345 1.00 12.15 H new ATOM 0 HB3 TRP A 107 -4.276 1.231 1.589 1.00 12.15 H new ATOM 0 HD1 TRP A 107 -0.919 1.587 2.750 1.00 71.10 H new ATOM 0 HE1 TRP A 107 0.789 2.113 0.896 1.00 1.30 H new ATOM 0 HE3 TRP A 107 -3.737 0.203 -1.287 1.00 34.30 H new ATOM 0 HZ2 TRP A 107 0.888 1.966 -1.906 1.00 50.43 H new ATOM 0 HZ3 TRP A 107 -2.771 0.461 -3.536 1.00 12.43 H new ATOM 0 HH2 TRP A 107 -0.480 1.308 -3.841 1.00 70.34 H new ATOM 1672 N THR A 108 -2.332 1.968 4.798 1.00 0.01 N ATOM 1673 CA THR A 108 -2.216 3.165 5.659 1.00 50.44 C ATOM 1674 C THR A 108 -0.989 4.012 5.244 1.00 2.31 C ATOM 1675 O THR A 108 0.039 3.450 4.883 1.00 35.13 O ATOM 1676 CB THR A 108 -2.092 2.732 7.167 1.00 53.44 C ATOM 1677 OG1 THR A 108 -3.222 1.915 7.536 1.00 54.41 O ATOM 1678 CG2 THR A 108 -2.005 3.933 8.130 1.00 63.04 C ATOM 0 H THR A 108 -1.495 1.386 4.803 1.00 0.01 H new ATOM 0 HA THR A 108 -3.113 3.772 5.537 1.00 50.44 H new ATOM 0 HB THR A 108 -1.163 2.170 7.257 1.00 53.44 H new ATOM 0 HG1 THR A 108 -3.139 1.647 8.475 1.00 54.41 H new ATOM 0 HG21 THR A 108 -1.921 3.572 9.155 1.00 63.04 H new ATOM 0 HG22 THR A 108 -1.129 4.534 7.884 1.00 63.04 H new ATOM 0 HG23 THR A 108 -2.903 4.543 8.033 1.00 63.04 H new ATOM 1686 N ALA A 109 -1.104 5.358 5.273 1.00 2.14 N ATOM 1687 CA ALA A 109 0.033 6.269 4.997 1.00 32.13 C ATOM 1688 C ALA A 109 -0.008 7.515 5.904 1.00 72.05 C ATOM 1689 O ALA A 109 -0.843 8.402 5.734 1.00 41.15 O ATOM 1690 CB ALA A 109 0.059 6.688 3.520 1.00 72.35 C ATOM 0 H ALA A 109 -1.977 5.841 5.486 1.00 2.14 H new ATOM 0 HA ALA A 109 0.948 5.719 5.218 1.00 32.13 H new ATOM 0 HB1 ALA A 109 0.903 7.356 3.346 1.00 72.35 H new ATOM 0 HB2 ALA A 109 0.161 5.803 2.892 1.00 72.35 H new ATOM 0 HB3 ALA A 109 -0.869 7.203 3.272 1.00 72.35 H new ATOM 1696 N MET A 110 0.946 7.578 6.835 1.00 2.35 N ATOM 1697 CA MET A 110 1.118 8.694 7.779 1.00 62.42 C ATOM 1698 C MET A 110 2.389 9.478 7.408 1.00 14.42 C ATOM 1699 O MET A 110 3.480 8.915 7.303 1.00 1.22 O ATOM 1700 CB MET A 110 1.169 8.206 9.261 1.00 14.53 C ATOM 1701 CG MET A 110 1.957 6.915 9.508 1.00 21.20 C ATOM 1702 SD MET A 110 1.132 5.475 8.790 1.00 41.41 S ATOM 1703 CE MET A 110 2.202 4.138 9.304 1.00 61.44 C ATOM 0 H MET A 110 1.638 6.840 6.960 1.00 2.35 H new ATOM 0 HA MET A 110 0.251 9.350 7.701 1.00 62.42 H new ATOM 0 HB2 MET A 110 1.604 8.998 9.870 1.00 14.53 H new ATOM 0 HB3 MET A 110 0.147 8.059 9.611 1.00 14.53 H new ATOM 0 HG2 MET A 110 2.955 7.012 9.082 1.00 21.20 H new ATOM 0 HG3 MET A 110 2.082 6.765 10.580 1.00 21.20 H new ATOM 0 HE1 MET A 110 1.800 3.191 8.944 1.00 61.44 H new ATOM 0 HE2 MET A 110 3.199 4.290 8.890 1.00 61.44 H new ATOM 0 HE3 MET A 110 2.260 4.117 10.392 1.00 61.44 H new ATOM 1713 N PHE A 111 2.228 10.789 7.219 1.00 14.35 N ATOM 1714 CA PHE A 111 3.309 11.692 6.777 1.00 20.51 C ATOM 1715 C PHE A 111 3.247 13.024 7.541 1.00 72.43 C ATOM 1716 O PHE A 111 2.189 13.418 8.033 1.00 34.42 O ATOM 1717 CB PHE A 111 3.262 11.891 5.228 1.00 53.31 C ATOM 1718 CG PHE A 111 1.866 12.074 4.623 1.00 52.43 C ATOM 1719 CD1 PHE A 111 1.096 13.202 4.902 1.00 44.12 C ATOM 1720 CD2 PHE A 111 1.327 11.112 3.761 1.00 61.12 C ATOM 1721 CE1 PHE A 111 -0.157 13.363 4.348 1.00 22.23 C ATOM 1722 CE2 PHE A 111 0.074 11.277 3.207 1.00 14.21 C ATOM 1723 CZ PHE A 111 -0.666 12.403 3.500 1.00 15.34 C ATOM 0 H PHE A 111 1.338 11.265 7.368 1.00 14.35 H new ATOM 0 HA PHE A 111 4.270 11.234 7.010 1.00 20.51 H new ATOM 0 HB2 PHE A 111 3.865 12.763 4.974 1.00 53.31 H new ATOM 0 HB3 PHE A 111 3.733 11.029 4.755 1.00 53.31 H new ATOM 0 HD1 PHE A 111 1.487 13.962 5.562 1.00 44.12 H new ATOM 0 HD2 PHE A 111 1.900 10.227 3.526 1.00 61.12 H new ATOM 0 HE1 PHE A 111 -0.740 14.242 4.579 1.00 22.23 H new ATOM 0 HE2 PHE A 111 -0.327 10.524 2.544 1.00 14.21 H new ATOM 0 HZ PHE A 111 -1.646 12.533 3.064 1.00 15.34 H new ATOM 1733 N ASP A 112 4.396 13.704 7.661 1.00 64.53 N ATOM 1734 CA ASP A 112 4.472 15.008 8.331 1.00 33.24 C ATOM 1735 C ASP A 112 4.157 16.141 7.326 1.00 33.20 C ATOM 1736 O ASP A 112 5.054 16.708 6.694 1.00 20.21 O ATOM 1737 CB ASP A 112 5.857 15.183 8.991 1.00 4.22 C ATOM 1738 CG ASP A 112 5.951 16.451 9.847 1.00 34.00 C ATOM 1739 OD1 ASP A 112 5.307 16.494 10.915 1.00 11.30 O ATOM 1740 OD2 ASP A 112 6.662 17.403 9.467 1.00 13.14 O ATOM 0 H ASP A 112 5.289 13.369 7.300 1.00 64.53 H new ATOM 0 HA ASP A 112 3.724 15.058 9.122 1.00 33.24 H new ATOM 0 HB2 ASP A 112 6.071 14.314 9.613 1.00 4.22 H new ATOM 0 HB3 ASP A 112 6.622 15.216 8.216 1.00 4.22 H new ATOM 1745 N CYS A 113 2.856 16.401 7.134 1.00 10.25 N ATOM 1746 CA CYS A 113 2.362 17.470 6.225 1.00 44.20 C ATOM 1747 C CYS A 113 1.411 18.445 6.952 1.00 64.03 C ATOM 1748 O CYS A 113 0.795 18.092 7.965 1.00 53.22 O ATOM 1749 CB CYS A 113 1.640 16.836 5.020 1.00 30.11 C ATOM 1750 SG CYS A 113 1.035 18.020 3.794 1.00 43.21 S ATOM 0 H CYS A 113 2.110 15.883 7.599 1.00 10.25 H new ATOM 0 HA CYS A 113 3.224 18.041 5.881 1.00 44.20 H new ATOM 0 HB2 CYS A 113 2.322 16.142 4.529 1.00 30.11 H new ATOM 0 HB3 CYS A 113 0.797 16.250 5.386 1.00 30.11 H new ATOM 0 HG CYS A 113 2.000 18.336 2.982 1.00 43.21 H new ATOM 1756 N SER A 114 1.307 19.675 6.408 1.00 4.50 N ATOM 1757 CA SER A 114 0.390 20.723 6.922 1.00 32.43 C ATOM 1758 C SER A 114 -1.096 20.305 6.743 1.00 24.33 C ATOM 1759 O SER A 114 -1.450 19.838 5.665 1.00 15.31 O ATOM 1760 CB SER A 114 0.646 22.063 6.190 1.00 4.45 C ATOM 1761 OG SER A 114 1.995 22.483 6.342 1.00 64.13 O ATOM 0 H SER A 114 1.854 19.973 5.601 1.00 4.50 H new ATOM 0 HA SER A 114 0.587 20.848 7.987 1.00 32.43 H new ATOM 0 HB2 SER A 114 0.414 21.952 5.131 1.00 4.45 H new ATOM 0 HB3 SER A 114 -0.022 22.829 6.584 1.00 4.45 H new ATOM 0 HG SER A 114 2.129 23.331 5.869 1.00 64.13 H new ATOM 1767 N PRO A 115 -1.973 20.448 7.800 1.00 35.13 N ATOM 1768 CA PRO A 115 -3.431 20.076 7.736 1.00 13.11 C ATOM 1769 C PRO A 115 -4.194 20.568 6.467 1.00 44.24 C ATOM 1770 O PRO A 115 -5.039 19.839 5.917 1.00 31.40 O ATOM 1771 CB PRO A 115 -4.003 20.733 9.016 1.00 34.21 C ATOM 1772 CG PRO A 115 -2.866 20.688 9.990 1.00 4.34 C ATOM 1773 CD PRO A 115 -1.612 20.936 9.171 1.00 71.01 C ATOM 0 HA PRO A 115 -3.551 18.994 7.675 1.00 13.11 H new ATOM 0 HB2 PRO A 115 -4.326 21.757 8.828 1.00 34.21 H new ATOM 0 HB3 PRO A 115 -4.870 20.188 9.390 1.00 34.21 H new ATOM 0 HG2 PRO A 115 -2.984 21.446 10.764 1.00 4.34 H new ATOM 0 HG3 PRO A 115 -2.820 19.722 10.493 1.00 4.34 H new ATOM 0 HD2 PRO A 115 -1.344 21.992 9.161 1.00 71.01 H new ATOM 0 HD3 PRO A 115 -0.757 20.394 9.576 1.00 71.01 H new ATOM 1781 N GLU A 116 -3.884 21.802 6.011 1.00 45.35 N ATOM 1782 CA GLU A 116 -4.504 22.406 4.804 1.00 71.33 C ATOM 1783 C GLU A 116 -4.130 21.637 3.507 1.00 61.44 C ATOM 1784 O GLU A 116 -4.916 21.575 2.552 1.00 31.34 O ATOM 1785 CB GLU A 116 -4.098 23.901 4.669 1.00 53.42 C ATOM 1786 CG GLU A 116 -4.852 24.667 3.561 1.00 13.44 C ATOM 1787 CD GLU A 116 -4.371 26.116 3.381 1.00 13.11 C ATOM 1788 OE1 GLU A 116 -4.685 26.968 4.238 1.00 24.21 O ATOM 1789 OE2 GLU A 116 -3.681 26.414 2.381 1.00 63.32 O ATOM 0 H GLU A 116 -3.200 22.407 6.465 1.00 45.35 H new ATOM 0 HA GLU A 116 -5.584 22.336 4.932 1.00 71.33 H new ATOM 0 HB2 GLU A 116 -4.272 24.400 5.622 1.00 53.42 H new ATOM 0 HB3 GLU A 116 -3.028 23.958 4.470 1.00 53.42 H new ATOM 0 HG2 GLU A 116 -4.735 24.134 2.618 1.00 13.44 H new ATOM 0 HG3 GLU A 116 -5.917 24.672 3.794 1.00 13.44 H new ATOM 1796 N THR A 117 -2.920 21.069 3.469 1.00 21.33 N ATOM 1797 CA THR A 117 -2.463 20.229 2.339 1.00 13.34 C ATOM 1798 C THR A 117 -2.880 18.750 2.549 1.00 70.13 C ATOM 1799 O THR A 117 -3.131 18.031 1.589 1.00 13.52 O ATOM 1800 CB THR A 117 -0.910 20.334 2.155 1.00 3.42 C ATOM 1801 OG1 THR A 117 -0.525 21.719 2.061 1.00 31.14 O ATOM 1802 CG2 THR A 117 -0.413 19.587 0.897 1.00 73.34 C ATOM 0 H THR A 117 -2.228 21.173 4.212 1.00 21.33 H new ATOM 0 HA THR A 117 -2.942 20.599 1.433 1.00 13.34 H new ATOM 0 HB THR A 117 -0.451 19.865 3.025 1.00 3.42 H new ATOM 0 HG1 THR A 117 0.446 21.782 1.948 1.00 31.14 H new ATOM 0 HG21 THR A 117 0.669 19.691 0.816 1.00 73.34 H new ATOM 0 HG22 THR A 117 -0.671 18.531 0.975 1.00 73.34 H new ATOM 0 HG23 THR A 117 -0.886 20.012 0.011 1.00 73.34 H new ATOM 1810 N ALA A 118 -2.995 18.325 3.823 1.00 20.34 N ATOM 1811 CA ALA A 118 -3.340 16.927 4.189 1.00 15.24 C ATOM 1812 C ALA A 118 -4.801 16.569 3.800 1.00 52.51 C ATOM 1813 O ALA A 118 -5.098 15.417 3.491 1.00 35.20 O ATOM 1814 CB ALA A 118 -3.092 16.705 5.691 1.00 61.11 C ATOM 0 H ALA A 118 -2.853 18.935 4.628 1.00 20.34 H new ATOM 0 HA ALA A 118 -2.693 16.257 3.622 1.00 15.24 H new ATOM 0 HB1 ALA A 118 -3.347 15.678 5.954 1.00 61.11 H new ATOM 0 HB2 ALA A 118 -2.041 16.888 5.917 1.00 61.11 H new ATOM 0 HB3 ALA A 118 -3.712 17.392 6.268 1.00 61.11 H new ATOM 1820 N ARG A 119 -5.706 17.577 3.834 1.00 32.25 N ATOM 1821 CA ARG A 119 -7.120 17.432 3.367 1.00 61.10 C ATOM 1822 C ARG A 119 -7.204 17.205 1.834 1.00 74.31 C ATOM 1823 O ARG A 119 -8.155 16.590 1.332 1.00 3.11 O ATOM 1824 CB ARG A 119 -7.962 18.665 3.792 1.00 41.14 C ATOM 1825 CG ARG A 119 -7.504 20.003 3.173 1.00 74.05 C ATOM 1826 CD ARG A 119 -8.159 21.238 3.821 1.00 5.22 C ATOM 1827 NE ARG A 119 -9.623 21.271 3.650 1.00 50.25 N ATOM 1828 CZ ARG A 119 -10.498 21.560 4.596 1.00 71.44 C ATOM 1829 NH1 ARG A 119 -10.133 21.702 5.837 1.00 1.12 N ATOM 1830 NH2 ARG A 119 -11.749 21.669 4.289 1.00 74.14 N ATOM 0 H ARG A 119 -5.486 18.510 4.182 1.00 32.25 H new ATOM 0 HA ARG A 119 -7.535 16.545 3.846 1.00 61.10 H new ATOM 0 HB2 ARG A 119 -9.002 18.490 3.517 1.00 41.14 H new ATOM 0 HB3 ARG A 119 -7.930 18.753 4.878 1.00 41.14 H new ATOM 0 HG2 ARG A 119 -6.421 20.085 3.266 1.00 74.05 H new ATOM 0 HG3 ARG A 119 -7.733 19.998 2.107 1.00 74.05 H new ATOM 0 HD2 ARG A 119 -7.923 21.251 4.885 1.00 5.22 H new ATOM 0 HD3 ARG A 119 -7.728 22.140 3.388 1.00 5.22 H new ATOM 0 HE ARG A 119 -9.991 21.052 2.724 1.00 50.25 H new ATOM 0 HH11 ARG A 119 -9.153 21.590 6.096 1.00 1.12 H new ATOM 0 HH12 ARG A 119 -10.827 21.925 6.550 1.00 1.12 H new ATOM 0 HH21 ARG A 119 -12.051 21.532 3.324 1.00 74.14 H new ATOM 0 HH22 ARG A 119 -12.434 21.892 5.011 1.00 74.14 H new ATOM 1844 N GLU A 120 -6.206 17.728 1.104 1.00 61.12 N ATOM 1845 CA GLU A 120 -6.020 17.459 -0.336 1.00 72.01 C ATOM 1846 C GLU A 120 -5.526 16.004 -0.545 1.00 44.44 C ATOM 1847 O GLU A 120 -6.059 15.259 -1.373 1.00 72.14 O ATOM 1848 CB GLU A 120 -4.999 18.473 -0.927 1.00 5.31 C ATOM 1849 CG GLU A 120 -4.670 18.298 -2.424 1.00 52.53 C ATOM 1850 CD GLU A 120 -5.830 18.675 -3.360 1.00 52.42 C ATOM 1851 OE1 GLU A 120 -6.042 19.882 -3.593 1.00 71.42 O ATOM 1852 OE2 GLU A 120 -6.536 17.776 -3.864 1.00 5.24 O ATOM 0 H GLU A 120 -5.501 18.352 1.495 1.00 61.12 H new ATOM 0 HA GLU A 120 -6.973 17.576 -0.853 1.00 72.01 H new ATOM 0 HB2 GLU A 120 -5.386 19.480 -0.775 1.00 5.31 H new ATOM 0 HB3 GLU A 120 -4.071 18.399 -0.359 1.00 5.31 H new ATOM 0 HG2 GLU A 120 -3.802 18.910 -2.670 1.00 52.53 H new ATOM 0 HG3 GLU A 120 -4.390 17.260 -2.607 1.00 52.53 H new ATOM 1859 N LEU A 121 -4.536 15.605 0.276 1.00 1.13 N ATOM 1860 CA LEU A 121 -3.812 14.322 0.123 1.00 34.43 C ATOM 1861 C LEU A 121 -4.649 13.098 0.564 1.00 4.43 C ATOM 1862 O LEU A 121 -4.493 12.018 0.001 1.00 23.43 O ATOM 1863 CB LEU A 121 -2.468 14.377 0.899 1.00 30.21 C ATOM 1864 CG LEU A 121 -1.479 15.513 0.469 1.00 65.33 C ATOM 1865 CD1 LEU A 121 -0.156 15.443 1.259 1.00 3.11 C ATOM 1866 CD2 LEU A 121 -1.227 15.500 -1.055 1.00 1.22 C ATOM 0 H LEU A 121 -4.213 16.162 1.067 1.00 1.13 H new ATOM 0 HA LEU A 121 -3.615 14.190 -0.941 1.00 34.43 H new ATOM 0 HB2 LEU A 121 -2.687 14.495 1.960 1.00 30.21 H new ATOM 0 HB3 LEU A 121 -1.963 13.418 0.782 1.00 30.21 H new ATOM 0 HG LEU A 121 -1.954 16.463 0.713 1.00 65.33 H new ATOM 0 HD11 LEU A 121 0.505 16.246 0.934 1.00 3.11 H new ATOM 0 HD12 LEU A 121 -0.362 15.551 2.324 1.00 3.11 H new ATOM 0 HD13 LEU A 121 0.325 14.482 1.078 1.00 3.11 H new ATOM 0 HD21 LEU A 121 -0.536 16.302 -1.316 1.00 1.22 H new ATOM 0 HD22 LEU A 121 -0.797 14.541 -1.344 1.00 1.22 H new ATOM 0 HD23 LEU A 121 -2.170 15.648 -1.581 1.00 1.22 H new ATOM 1878 N GLU A 122 -5.540 13.263 1.560 1.00 22.11 N ATOM 1879 CA GLU A 122 -6.447 12.166 2.002 1.00 43.01 C ATOM 1880 C GLU A 122 -7.428 11.755 0.871 1.00 52.42 C ATOM 1881 O GLU A 122 -7.796 10.583 0.748 1.00 61.41 O ATOM 1882 CB GLU A 122 -7.215 12.557 3.297 1.00 23.54 C ATOM 1883 CG GLU A 122 -8.098 13.804 3.159 1.00 60.05 C ATOM 1884 CD GLU A 122 -8.973 14.082 4.395 1.00 64.42 C ATOM 1885 OE1 GLU A 122 -10.087 13.520 4.477 1.00 73.04 O ATOM 1886 OE2 GLU A 122 -8.557 14.858 5.281 1.00 52.41 O ATOM 0 H GLU A 122 -5.657 14.135 2.076 1.00 22.11 H new ATOM 0 HA GLU A 122 -5.827 11.300 2.233 1.00 43.01 H new ATOM 0 HB2 GLU A 122 -7.839 11.717 3.602 1.00 23.54 H new ATOM 0 HB3 GLU A 122 -6.493 12.725 4.096 1.00 23.54 H new ATOM 0 HG2 GLU A 122 -7.462 14.670 2.972 1.00 60.05 H new ATOM 0 HG3 GLU A 122 -8.742 13.688 2.287 1.00 60.05 H new ATOM 1893 N SER A 123 -7.853 12.744 0.060 1.00 65.42 N ATOM 1894 CA SER A 123 -8.646 12.499 -1.170 1.00 64.14 C ATOM 1895 C SER A 123 -7.799 11.835 -2.289 1.00 11.31 C ATOM 1896 O SER A 123 -8.110 10.726 -2.731 1.00 62.34 O ATOM 1897 CB SER A 123 -9.255 13.828 -1.686 1.00 2.22 C ATOM 1898 OG SER A 123 -9.981 13.634 -2.894 1.00 31.24 O ATOM 0 H SER A 123 -7.660 13.730 0.234 1.00 65.42 H new ATOM 0 HA SER A 123 -9.446 11.807 -0.908 1.00 64.14 H new ATOM 0 HB2 SER A 123 -9.916 14.246 -0.926 1.00 2.22 H new ATOM 0 HB3 SER A 123 -8.459 14.554 -1.851 1.00 2.22 H new ATOM 0 HG SER A 123 -10.354 14.490 -3.193 1.00 31.24 H new ATOM 1904 N VAL A 124 -6.722 12.528 -2.714 1.00 13.42 N ATOM 1905 CA VAL A 124 -5.895 12.117 -3.883 1.00 3.22 C ATOM 1906 C VAL A 124 -5.122 10.797 -3.626 1.00 54.33 C ATOM 1907 O VAL A 124 -5.266 9.828 -4.371 1.00 40.53 O ATOM 1908 CB VAL A 124 -4.880 13.266 -4.273 1.00 12.40 C ATOM 1909 CG1 VAL A 124 -3.945 12.845 -5.442 1.00 3.55 C ATOM 1910 CG2 VAL A 124 -5.635 14.576 -4.617 1.00 72.31 C ATOM 0 H VAL A 124 -6.397 13.384 -2.264 1.00 13.42 H new ATOM 0 HA VAL A 124 -6.582 11.939 -4.710 1.00 3.22 H new ATOM 0 HB VAL A 124 -4.249 13.448 -3.403 1.00 12.40 H new ATOM 0 HG11 VAL A 124 -3.265 13.664 -5.677 1.00 3.55 H new ATOM 0 HG12 VAL A 124 -3.369 11.967 -5.149 1.00 3.55 H new ATOM 0 HG13 VAL A 124 -4.545 12.609 -6.321 1.00 3.55 H new ATOM 0 HG21 VAL A 124 -4.916 15.351 -4.882 1.00 72.31 H new ATOM 0 HG22 VAL A 124 -6.305 14.400 -5.458 1.00 72.31 H new ATOM 0 HG23 VAL A 124 -6.215 14.899 -3.753 1.00 72.31 H new ATOM 1920 N ILE A 125 -4.332 10.774 -2.548 1.00 40.24 N ATOM 1921 CA ILE A 125 -3.498 9.607 -2.174 1.00 44.21 C ATOM 1922 C ILE A 125 -4.370 8.493 -1.533 1.00 22.21 C ATOM 1923 O ILE A 125 -4.273 7.323 -1.913 1.00 30.22 O ATOM 1924 CB ILE A 125 -2.343 10.038 -1.186 1.00 4.14 C ATOM 1925 CG1 ILE A 125 -1.467 11.173 -1.808 1.00 23.31 C ATOM 1926 CG2 ILE A 125 -1.471 8.833 -0.748 1.00 23.02 C ATOM 1927 CD1 ILE A 125 -0.364 11.701 -0.894 1.00 53.51 C ATOM 0 H ILE A 125 -4.246 11.560 -1.904 1.00 40.24 H new ATOM 0 HA ILE A 125 -3.044 9.211 -3.082 1.00 44.21 H new ATOM 0 HB ILE A 125 -2.818 10.431 -0.287 1.00 4.14 H new ATOM 0 HG12 ILE A 125 -1.012 10.801 -2.726 1.00 23.31 H new ATOM 0 HG13 ILE A 125 -2.116 12.003 -2.088 1.00 23.31 H new ATOM 0 HG21 ILE A 125 -0.690 9.177 -0.070 1.00 23.02 H new ATOM 0 HG22 ILE A 125 -2.095 8.098 -0.240 1.00 23.02 H new ATOM 0 HG23 ILE A 125 -1.014 8.377 -1.626 1.00 23.02 H new ATOM 0 HD11 ILE A 125 0.191 12.485 -1.409 1.00 53.51 H new ATOM 0 HD12 ILE A 125 -0.808 12.108 0.014 1.00 53.51 H new ATOM 0 HD13 ILE A 125 0.313 10.888 -0.634 1.00 53.51 H new ATOM 1939 N GLY A 126 -5.225 8.888 -0.567 1.00 74.00 N ATOM 1940 CA GLY A 126 -6.077 7.943 0.175 1.00 24.50 C ATOM 1941 C GLY A 126 -7.075 7.160 -0.691 1.00 74.30 C ATOM 1942 O GLY A 126 -6.965 5.945 -0.828 1.00 43.33 O ATOM 0 H GLY A 126 -5.342 9.861 -0.284 1.00 74.00 H new ATOM 0 HA2 GLY A 126 -5.437 7.233 0.699 1.00 24.50 H new ATOM 0 HA3 GLY A 126 -6.631 8.494 0.935 1.00 24.50 H new ATOM 1946 N ASP A 127 -8.056 7.852 -1.285 1.00 51.43 N ATOM 1947 CA ASP A 127 -9.118 7.182 -2.077 1.00 63.13 C ATOM 1948 C ASP A 127 -8.710 7.041 -3.572 1.00 3.22 C ATOM 1949 O ASP A 127 -8.910 5.985 -4.185 1.00 12.42 O ATOM 1950 CB ASP A 127 -10.461 7.949 -1.920 1.00 12.43 C ATOM 1951 CG ASP A 127 -11.682 7.084 -2.291 1.00 31.13 C ATOM 1952 OD1 ASP A 127 -12.075 7.049 -3.478 1.00 13.41 O ATOM 1953 OD2 ASP A 127 -12.246 6.413 -1.390 1.00 12.13 O ATOM 0 H ASP A 127 -8.144 8.867 -1.238 1.00 51.43 H new ATOM 0 HA ASP A 127 -9.252 6.172 -1.691 1.00 63.13 H new ATOM 0 HB2 ASP A 127 -10.562 8.291 -0.890 1.00 12.43 H new ATOM 0 HB3 ASP A 127 -10.444 8.838 -2.551 1.00 12.43 H new ATOM 1958 N GLY A 128 -8.093 8.100 -4.121 1.00 42.25 N ATOM 1959 CA GLY A 128 -7.754 8.172 -5.554 1.00 0.35 C ATOM 1960 C GLY A 128 -6.589 7.266 -6.000 1.00 55.32 C ATOM 1961 O GLY A 128 -6.464 6.958 -7.190 1.00 60.04 O ATOM 0 H GLY A 128 -7.816 8.925 -3.590 1.00 42.25 H new ATOM 0 HA2 GLY A 128 -8.639 7.910 -6.134 1.00 0.35 H new ATOM 0 HA3 GLY A 128 -7.505 9.204 -5.801 1.00 0.35 H new ATOM 1965 N VAL A 129 -5.709 6.867 -5.058 1.00 72.35 N ATOM 1966 CA VAL A 129 -4.572 5.951 -5.350 1.00 61.41 C ATOM 1967 C VAL A 129 -4.756 4.581 -4.648 1.00 5.42 C ATOM 1968 O VAL A 129 -4.727 3.530 -5.312 1.00 1.00 O ATOM 1969 CB VAL A 129 -3.188 6.597 -4.937 1.00 21.40 C ATOM 1970 CG1 VAL A 129 -1.997 5.620 -5.136 1.00 21.25 C ATOM 1971 CG2 VAL A 129 -2.938 7.923 -5.705 1.00 41.43 C ATOM 0 H VAL A 129 -5.760 7.163 -4.083 1.00 72.35 H new ATOM 0 HA VAL A 129 -4.563 5.785 -6.427 1.00 61.41 H new ATOM 0 HB VAL A 129 -3.252 6.818 -3.872 1.00 21.40 H new ATOM 0 HG11 VAL A 129 -1.070 6.111 -4.838 1.00 21.25 H new ATOM 0 HG12 VAL A 129 -2.150 4.731 -4.524 1.00 21.25 H new ATOM 0 HG13 VAL A 129 -1.934 5.332 -6.185 1.00 21.25 H new ATOM 0 HG21 VAL A 129 -1.980 8.344 -5.401 1.00 41.43 H new ATOM 0 HG22 VAL A 129 -2.924 7.726 -6.777 1.00 41.43 H new ATOM 0 HG23 VAL A 129 -3.735 8.631 -5.477 1.00 41.43 H new ATOM 1981 N PHE A 130 -4.948 4.599 -3.309 1.00 23.15 N ATOM 1982 CA PHE A 130 -4.998 3.353 -2.492 1.00 43.32 C ATOM 1983 C PHE A 130 -6.269 2.536 -2.757 1.00 74.34 C ATOM 1984 O PHE A 130 -6.181 1.370 -3.134 1.00 35.32 O ATOM 1985 CB PHE A 130 -4.895 3.649 -0.968 1.00 52.14 C ATOM 1986 CG PHE A 130 -3.609 4.306 -0.481 1.00 1.41 C ATOM 1987 CD1 PHE A 130 -2.512 4.507 -1.324 1.00 43.23 C ATOM 1988 CD2 PHE A 130 -3.498 4.711 0.846 1.00 41.22 C ATOM 1989 CE1 PHE A 130 -1.356 5.088 -0.853 1.00 50.33 C ATOM 1990 CE2 PHE A 130 -2.340 5.288 1.315 1.00 15.01 C ATOM 1991 CZ PHE A 130 -1.271 5.478 0.465 1.00 22.14 C ATOM 0 H PHE A 130 -5.071 5.455 -2.769 1.00 23.15 H new ATOM 0 HA PHE A 130 -4.132 2.767 -2.799 1.00 43.32 H new ATOM 0 HB2 PHE A 130 -5.731 4.291 -0.689 1.00 52.14 H new ATOM 0 HB3 PHE A 130 -5.021 2.709 -0.430 1.00 52.14 H new ATOM 0 HD1 PHE A 130 -2.572 4.202 -2.358 1.00 43.23 H new ATOM 0 HD2 PHE A 130 -4.332 4.570 1.517 1.00 41.22 H new ATOM 0 HE1 PHE A 130 -0.517 5.238 -1.516 1.00 50.33 H new ATOM 0 HE2 PHE A 130 -2.268 5.592 2.349 1.00 15.01 H new ATOM 0 HZ PHE A 130 -0.364 5.934 0.834 1.00 22.14 H new ATOM 2001 N ALA A 131 -7.448 3.171 -2.572 1.00 62.40 N ATOM 2002 CA ALA A 131 -8.758 2.491 -2.740 1.00 71.41 C ATOM 2003 C ALA A 131 -8.916 1.905 -4.167 1.00 23.25 C ATOM 2004 O ALA A 131 -9.517 0.858 -4.347 1.00 71.13 O ATOM 2005 CB ALA A 131 -9.912 3.444 -2.405 1.00 63.21 C ATOM 0 H ALA A 131 -7.522 4.153 -2.306 1.00 62.40 H new ATOM 0 HA ALA A 131 -8.791 1.657 -2.039 1.00 71.41 H new ATOM 0 HB1 ALA A 131 -10.862 2.925 -2.535 1.00 63.21 H new ATOM 0 HB2 ALA A 131 -9.819 3.778 -1.372 1.00 63.21 H new ATOM 0 HB3 ALA A 131 -9.876 4.307 -3.070 1.00 63.21 H new ATOM 2011 N VAL A 132 -8.317 2.590 -5.154 1.00 51.22 N ATOM 2012 CA VAL A 132 -8.218 2.111 -6.550 1.00 52.33 C ATOM 2013 C VAL A 132 -7.469 0.744 -6.655 1.00 23.35 C ATOM 2014 O VAL A 132 -7.979 -0.205 -7.269 1.00 52.33 O ATOM 2015 CB VAL A 132 -7.504 3.219 -7.422 1.00 11.52 C ATOM 2016 CG1 VAL A 132 -6.964 2.671 -8.757 1.00 4.20 C ATOM 2017 CG2 VAL A 132 -8.452 4.424 -7.661 1.00 1.33 C ATOM 0 H VAL A 132 -7.882 3.501 -5.008 1.00 51.22 H new ATOM 0 HA VAL A 132 -9.225 1.936 -6.928 1.00 52.33 H new ATOM 0 HB VAL A 132 -6.639 3.559 -6.853 1.00 11.52 H new ATOM 0 HG11 VAL A 132 -6.484 3.476 -9.313 1.00 4.20 H new ATOM 0 HG12 VAL A 132 -6.237 1.883 -8.560 1.00 4.20 H new ATOM 0 HG13 VAL A 132 -7.788 2.265 -9.344 1.00 4.20 H new ATOM 0 HG21 VAL A 132 -7.941 5.175 -8.263 1.00 1.33 H new ATOM 0 HG22 VAL A 132 -9.346 4.085 -8.185 1.00 1.33 H new ATOM 0 HG23 VAL A 132 -8.736 4.859 -6.703 1.00 1.33 H new ATOM 2027 N GLY A 133 -6.270 0.664 -6.044 1.00 12.11 N ATOM 2028 CA GLY A 133 -5.456 -0.565 -6.058 1.00 64.31 C ATOM 2029 C GLY A 133 -6.053 -1.709 -5.223 1.00 33.15 C ATOM 2030 O GLY A 133 -5.950 -2.884 -5.592 1.00 44.11 O ATOM 0 H GLY A 133 -5.845 1.438 -5.534 1.00 12.11 H new ATOM 0 HA2 GLY A 133 -5.339 -0.901 -7.088 1.00 64.31 H new ATOM 0 HA3 GLY A 133 -4.459 -0.335 -5.683 1.00 64.31 H new ATOM 2034 N LEU A 134 -6.700 -1.344 -4.104 1.00 42.51 N ATOM 2035 CA LEU A 134 -7.348 -2.294 -3.172 1.00 31.45 C ATOM 2036 C LEU A 134 -8.612 -2.929 -3.796 1.00 1.43 C ATOM 2037 O LEU A 134 -8.845 -4.137 -3.660 1.00 42.33 O ATOM 2038 CB LEU A 134 -7.702 -1.565 -1.851 1.00 2.23 C ATOM 2039 CG LEU A 134 -6.496 -1.065 -0.995 1.00 63.32 C ATOM 2040 CD1 LEU A 134 -6.984 -0.354 0.281 1.00 3.24 C ATOM 2041 CD2 LEU A 134 -5.523 -2.221 -0.661 1.00 11.13 C ATOM 0 H LEU A 134 -6.791 -0.370 -3.814 1.00 42.51 H new ATOM 0 HA LEU A 134 -6.647 -3.102 -2.964 1.00 31.45 H new ATOM 0 HB2 LEU A 134 -8.331 -0.708 -2.091 1.00 2.23 H new ATOM 0 HB3 LEU A 134 -8.301 -2.238 -1.238 1.00 2.23 H new ATOM 0 HG LEU A 134 -5.943 -0.338 -1.590 1.00 63.32 H new ATOM 0 HD11 LEU A 134 -6.125 -0.015 0.860 1.00 3.24 H new ATOM 0 HD12 LEU A 134 -7.598 0.504 0.007 1.00 3.24 H new ATOM 0 HD13 LEU A 134 -7.575 -1.047 0.880 1.00 3.24 H new ATOM 0 HD21 LEU A 134 -4.695 -1.839 -0.064 1.00 11.13 H new ATOM 0 HD22 LEU A 134 -6.051 -2.990 -0.098 1.00 11.13 H new ATOM 0 HD23 LEU A 134 -5.136 -2.650 -1.586 1.00 11.13 H new ATOM 2053 N ASN A 135 -9.416 -2.100 -4.496 1.00 1.32 N ATOM 2054 CA ASN A 135 -10.618 -2.574 -5.216 1.00 64.11 C ATOM 2055 C ASN A 135 -10.208 -3.465 -6.400 1.00 23.24 C ATOM 2056 O ASN A 135 -10.829 -4.498 -6.635 1.00 62.25 O ATOM 2057 CB ASN A 135 -11.508 -1.398 -5.704 1.00 61.42 C ATOM 2058 CG ASN A 135 -12.170 -0.624 -4.562 1.00 22.42 C ATOM 2059 OD1 ASN A 135 -12.477 -1.177 -3.511 1.00 3.22 O ATOM 2060 ND2 ASN A 135 -12.405 0.658 -4.762 1.00 63.31 N ATOM 0 H ASN A 135 -9.254 -1.096 -4.578 1.00 1.32 H new ATOM 0 HA ASN A 135 -11.213 -3.159 -4.514 1.00 64.11 H new ATOM 0 HB2 ASN A 135 -10.900 -0.712 -6.294 1.00 61.42 H new ATOM 0 HB3 ASN A 135 -12.282 -1.788 -6.366 1.00 61.42 H new ATOM 0 HD21 ASN A 135 -12.852 1.214 -4.033 1.00 63.31 H new ATOM 0 HD22 ASN A 135 -12.140 1.093 -5.645 1.00 63.31 H new ATOM 2067 N ALA A 136 -9.134 -3.062 -7.114 1.00 22.40 N ATOM 2068 CA ALA A 136 -8.530 -3.855 -8.216 1.00 40.31 C ATOM 2069 C ALA A 136 -8.113 -5.261 -7.744 1.00 50.42 C ATOM 2070 O ALA A 136 -8.295 -6.259 -8.456 1.00 45.34 O ATOM 2071 CB ALA A 136 -7.323 -3.107 -8.802 1.00 22.44 C ATOM 0 H ALA A 136 -8.658 -2.176 -6.945 1.00 22.40 H new ATOM 0 HA ALA A 136 -9.286 -3.981 -8.991 1.00 40.31 H new ATOM 0 HB1 ALA A 136 -6.887 -3.696 -9.609 1.00 22.44 H new ATOM 0 HB2 ALA A 136 -7.647 -2.142 -9.191 1.00 22.44 H new ATOM 0 HB3 ALA A 136 -6.577 -2.952 -8.022 1.00 22.44 H new ATOM 2077 N LEU A 137 -7.544 -5.316 -6.528 1.00 45.20 N ATOM 2078 CA LEU A 137 -7.128 -6.574 -5.883 1.00 34.32 C ATOM 2079 C LEU A 137 -8.374 -7.458 -5.582 1.00 53.43 C ATOM 2080 O LEU A 137 -8.348 -8.673 -5.772 1.00 71.31 O ATOM 2081 CB LEU A 137 -6.292 -6.238 -4.602 1.00 34.43 C ATOM 2082 CG LEU A 137 -5.351 -7.366 -4.050 1.00 72.21 C ATOM 2083 CD1 LEU A 137 -4.226 -6.793 -3.159 1.00 73.24 C ATOM 2084 CD2 LEU A 137 -6.123 -8.463 -3.290 1.00 62.51 C ATOM 0 H LEU A 137 -7.359 -4.487 -5.963 1.00 45.20 H new ATOM 0 HA LEU A 137 -6.491 -7.155 -6.549 1.00 34.32 H new ATOM 0 HB2 LEU A 137 -5.681 -5.362 -4.817 1.00 34.43 H new ATOM 0 HB3 LEU A 137 -6.985 -5.957 -3.809 1.00 34.43 H new ATOM 0 HG LEU A 137 -4.896 -7.828 -4.926 1.00 72.21 H new ATOM 0 HD11 LEU A 137 -3.598 -7.607 -2.798 1.00 73.24 H new ATOM 0 HD12 LEU A 137 -3.620 -6.098 -3.740 1.00 73.24 H new ATOM 0 HD13 LEU A 137 -4.665 -6.270 -2.310 1.00 73.24 H new ATOM 0 HD21 LEU A 137 -5.423 -9.217 -2.930 1.00 62.51 H new ATOM 0 HD22 LEU A 137 -6.646 -8.019 -2.443 1.00 62.51 H new ATOM 0 HD23 LEU A 137 -6.846 -8.929 -3.959 1.00 62.51 H new ATOM 2096 N ALA A 138 -9.471 -6.818 -5.157 1.00 23.33 N ATOM 2097 CA ALA A 138 -10.753 -7.507 -4.883 1.00 12.15 C ATOM 2098 C ALA A 138 -11.458 -7.986 -6.189 1.00 54.21 C ATOM 2099 O ALA A 138 -12.183 -8.979 -6.169 1.00 42.42 O ATOM 2100 CB ALA A 138 -11.671 -6.581 -4.075 1.00 70.14 C ATOM 0 H ALA A 138 -9.502 -5.812 -4.992 1.00 23.33 H new ATOM 0 HA ALA A 138 -10.536 -8.402 -4.300 1.00 12.15 H new ATOM 0 HB1 ALA A 138 -12.614 -7.089 -3.874 1.00 70.14 H new ATOM 0 HB2 ALA A 138 -11.189 -6.324 -3.132 1.00 70.14 H new ATOM 0 HB3 ALA A 138 -11.863 -5.672 -4.644 1.00 70.14 H new ATOM 2106 N GLU A 139 -11.226 -7.270 -7.316 1.00 23.25 N ATOM 2107 CA GLU A 139 -11.830 -7.586 -8.646 1.00 53.52 C ATOM 2108 C GLU A 139 -11.291 -8.918 -9.230 1.00 1.21 C ATOM 2109 O GLU A 139 -12.064 -9.750 -9.720 1.00 74.22 O ATOM 2110 CB GLU A 139 -11.547 -6.429 -9.646 1.00 11.01 C ATOM 2111 CG GLU A 139 -12.260 -5.087 -9.331 1.00 4.10 C ATOM 2112 CD GLU A 139 -11.595 -3.846 -9.966 1.00 4.41 C ATOM 2113 OE1 GLU A 139 -10.762 -4.003 -10.888 1.00 71.55 O ATOM 2114 OE2 GLU A 139 -11.889 -2.709 -9.530 1.00 22.54 O ATOM 0 H GLU A 139 -10.614 -6.454 -7.335 1.00 23.25 H new ATOM 0 HA GLU A 139 -12.904 -7.697 -8.497 1.00 53.52 H new ATOM 0 HB2 GLU A 139 -10.472 -6.252 -9.675 1.00 11.01 H new ATOM 0 HB3 GLU A 139 -11.844 -6.753 -10.644 1.00 11.01 H new ATOM 0 HG2 GLU A 139 -13.292 -5.148 -9.677 1.00 4.10 H new ATOM 0 HG3 GLU A 139 -12.294 -4.953 -8.250 1.00 4.10 H new ATOM 2121 N ARG A 140 -9.957 -9.107 -9.167 1.00 40.41 N ATOM 2122 CA ARG A 140 -9.281 -10.327 -9.697 1.00 62.21 C ATOM 2123 C ARG A 140 -9.561 -11.585 -8.831 1.00 42.13 C ATOM 2124 O ARG A 140 -9.498 -12.714 -9.330 1.00 63.44 O ATOM 2125 CB ARG A 140 -7.756 -10.082 -9.857 1.00 30.10 C ATOM 2126 CG ARG A 140 -7.030 -9.587 -8.588 1.00 71.42 C ATOM 2127 CD ARG A 140 -5.541 -9.273 -8.837 1.00 23.40 C ATOM 2128 NE ARG A 140 -5.355 -8.384 -10.008 1.00 75.22 N ATOM 2129 CZ ARG A 140 -5.283 -7.064 -9.980 1.00 74.21 C ATOM 2130 NH1 ARG A 140 -5.423 -6.400 -8.875 1.00 42.45 N ATOM 2131 NH2 ARG A 140 -5.096 -6.409 -11.083 1.00 21.31 N ATOM 0 H ARG A 140 -9.316 -8.430 -8.753 1.00 40.41 H new ATOM 0 HA ARG A 140 -9.705 -10.528 -10.681 1.00 62.21 H new ATOM 0 HB2 ARG A 140 -7.288 -11.010 -10.184 1.00 30.10 H new ATOM 0 HB3 ARG A 140 -7.604 -9.351 -10.651 1.00 30.10 H new ATOM 0 HG2 ARG A 140 -7.528 -8.692 -8.215 1.00 71.42 H new ATOM 0 HG3 ARG A 140 -7.112 -10.345 -7.809 1.00 71.42 H new ATOM 0 HD2 ARG A 140 -5.116 -8.801 -7.951 1.00 23.40 H new ATOM 0 HD3 ARG A 140 -4.995 -10.203 -8.996 1.00 23.40 H new ATOM 0 HE ARG A 140 -5.275 -8.832 -10.921 1.00 75.22 H new ATOM 0 HH11 ARG A 140 -5.593 -6.896 -8.000 1.00 42.45 H new ATOM 0 HH12 ARG A 140 -5.363 -5.382 -8.881 1.00 42.45 H new ATOM 0 HH21 ARG A 140 -5.005 -6.912 -11.966 1.00 21.31 H new ATOM 0 HH22 ARG A 140 -5.040 -5.391 -11.068 1.00 21.31 H new ATOM 2145 N TYR A 141 -9.867 -11.384 -7.536 1.00 11.42 N ATOM 2146 CA TYR A 141 -10.350 -12.470 -6.640 1.00 3.43 C ATOM 2147 C TYR A 141 -11.901 -12.509 -6.599 1.00 62.22 C ATOM 2148 O TYR A 141 -12.489 -13.419 -6.010 1.00 1.25 O ATOM 2149 CB TYR A 141 -9.789 -12.283 -5.214 1.00 72.43 C ATOM 2150 CG TYR A 141 -8.288 -12.587 -5.058 1.00 1.02 C ATOM 2151 CD1 TYR A 141 -7.834 -13.892 -4.844 1.00 20.32 C ATOM 2152 CD2 TYR A 141 -7.334 -11.571 -5.062 1.00 62.30 C ATOM 2153 CE1 TYR A 141 -6.496 -14.167 -4.640 1.00 23.30 C ATOM 2154 CE2 TYR A 141 -5.998 -11.839 -4.868 1.00 1.03 C ATOM 2155 CZ TYR A 141 -5.581 -13.133 -4.653 1.00 25.10 C ATOM 2156 OH TYR A 141 -4.243 -13.394 -4.449 1.00 52.41 O ATOM 0 H TYR A 141 -9.790 -10.476 -7.077 1.00 11.42 H new ATOM 0 HA TYR A 141 -9.992 -13.419 -7.040 1.00 3.43 H new ATOM 0 HB2 TYR A 141 -9.970 -11.255 -4.901 1.00 72.43 H new ATOM 0 HB3 TYR A 141 -10.347 -12.926 -4.534 1.00 72.43 H new ATOM 0 HD1 TYR A 141 -8.546 -14.704 -4.838 1.00 20.32 H new ATOM 0 HD2 TYR A 141 -7.650 -10.551 -5.221 1.00 62.30 H new ATOM 0 HE1 TYR A 141 -6.168 -15.182 -4.472 1.00 23.30 H new ATOM 0 HE2 TYR A 141 -5.277 -11.035 -4.884 1.00 1.03 H new ATOM 0 HH TYR A 141 -3.736 -12.556 -4.490 1.00 52.41 H new ATOM 2166 N GLY A 142 -12.552 -11.526 -7.256 1.00 65.12 N ATOM 2167 CA GLY A 142 -14.024 -11.480 -7.375 1.00 41.13 C ATOM 2168 C GLY A 142 -14.597 -12.506 -8.364 1.00 25.51 C ATOM 2169 O GLY A 142 -15.791 -12.505 -8.631 1.00 1.25 O ATOM 0 H GLY A 142 -12.077 -10.749 -7.715 1.00 65.12 H new ATOM 0 HA2 GLY A 142 -14.464 -11.651 -6.393 1.00 41.13 H new ATOM 0 HA3 GLY A 142 -14.323 -10.480 -7.689 1.00 41.13 H new ATOM 2173 N ARG A 143 -13.719 -13.375 -8.900 1.00 23.22 N ATOM 2174 CA ARG A 143 -14.068 -14.523 -9.778 1.00 74.40 C ATOM 2175 C ARG A 143 -15.173 -15.456 -9.183 1.00 62.11 C ATOM 2176 O ARG A 143 -15.868 -16.154 -9.929 1.00 14.42 O ATOM 2177 CB ARG A 143 -12.764 -15.328 -10.048 1.00 13.31 C ATOM 2178 CG ARG A 143 -12.057 -15.836 -8.760 1.00 4.22 C ATOM 2179 CD ARG A 143 -10.641 -16.383 -9.004 1.00 21.43 C ATOM 2180 NE ARG A 143 -10.619 -17.574 -9.872 1.00 62.43 N ATOM 2181 CZ ARG A 143 -9.527 -18.147 -10.343 1.00 51.04 C ATOM 2182 NH1 ARG A 143 -8.344 -17.667 -10.093 1.00 62.25 N ATOM 2183 NH2 ARG A 143 -9.634 -19.205 -11.076 1.00 35.33 N ATOM 0 H ARG A 143 -12.716 -13.301 -8.733 1.00 23.22 H new ATOM 0 HA ARG A 143 -14.492 -14.127 -10.701 1.00 74.40 H new ATOM 0 HB2 ARG A 143 -13.001 -16.183 -10.681 1.00 13.31 H new ATOM 0 HB3 ARG A 143 -12.071 -14.700 -10.607 1.00 13.31 H new ATOM 0 HG2 ARG A 143 -12.002 -15.019 -8.041 1.00 4.22 H new ATOM 0 HG3 ARG A 143 -12.666 -16.619 -8.307 1.00 4.22 H new ATOM 0 HD2 ARG A 143 -10.030 -15.602 -9.455 1.00 21.43 H new ATOM 0 HD3 ARG A 143 -10.185 -16.631 -8.046 1.00 21.43 H new ATOM 0 HE ARG A 143 -11.516 -17.987 -10.128 1.00 62.43 H new ATOM 0 HH11 ARG A 143 -8.244 -16.829 -9.521 1.00 62.25 H new ATOM 0 HH12 ARG A 143 -7.516 -18.129 -10.469 1.00 62.25 H new ATOM 0 HH21 ARG A 143 -10.555 -19.589 -11.285 1.00 35.33 H new ATOM 0 HH22 ARG A 143 -8.797 -19.656 -11.445 1.00 35.33 H new ATOM 2197 N LEU A 144 -15.317 -15.458 -7.835 1.00 53.02 N ATOM 2198 CA LEU A 144 -16.359 -16.241 -7.117 1.00 32.55 C ATOM 2199 C LEU A 144 -17.802 -15.817 -7.513 1.00 33.33 C ATOM 2200 O LEU A 144 -18.732 -16.632 -7.466 1.00 71.42 O ATOM 2201 CB LEU A 144 -16.168 -16.121 -5.570 1.00 45.13 C ATOM 2202 CG LEU A 144 -15.005 -16.954 -4.928 1.00 42.12 C ATOM 2203 CD1 LEU A 144 -15.169 -18.465 -5.206 1.00 21.24 C ATOM 2204 CD2 LEU A 144 -13.607 -16.444 -5.355 1.00 24.15 C ATOM 0 H LEU A 144 -14.715 -14.918 -7.213 1.00 53.02 H new ATOM 0 HA LEU A 144 -16.234 -17.281 -7.417 1.00 32.55 H new ATOM 0 HB2 LEU A 144 -16.005 -15.070 -5.330 1.00 45.13 H new ATOM 0 HB3 LEU A 144 -17.101 -16.416 -5.090 1.00 45.13 H new ATOM 0 HG LEU A 144 -15.074 -16.808 -3.850 1.00 42.12 H new ATOM 0 HD11 LEU A 144 -14.345 -19.011 -4.746 1.00 21.24 H new ATOM 0 HD12 LEU A 144 -16.113 -18.812 -4.786 1.00 21.24 H new ATOM 0 HD13 LEU A 144 -15.164 -18.640 -6.282 1.00 21.24 H new ATOM 0 HD21 LEU A 144 -12.837 -17.055 -4.883 1.00 24.15 H new ATOM 0 HD22 LEU A 144 -13.510 -16.512 -6.439 1.00 24.15 H new ATOM 0 HD23 LEU A 144 -13.488 -15.406 -5.044 1.00 24.15 H new ATOM 2216 N GLU A 145 -17.966 -14.546 -7.913 1.00 63.35 N ATOM 2217 CA GLU A 145 -19.276 -13.972 -8.295 1.00 54.54 C ATOM 2218 C GLU A 145 -19.140 -13.046 -9.537 1.00 3.40 C ATOM 2219 O GLU A 145 -19.694 -13.342 -10.599 1.00 12.35 O ATOM 2220 CB GLU A 145 -19.900 -13.217 -7.075 1.00 21.23 C ATOM 2221 CG GLU A 145 -18.919 -12.286 -6.312 1.00 52.13 C ATOM 2222 CD GLU A 145 -19.559 -11.543 -5.132 1.00 64.34 C ATOM 2223 OE1 GLU A 145 -19.816 -12.183 -4.092 1.00 12.33 O ATOM 2224 OE2 GLU A 145 -19.812 -10.322 -5.243 1.00 53.02 O ATOM 0 H GLU A 145 -17.195 -13.882 -7.982 1.00 63.35 H new ATOM 0 HA GLU A 145 -19.949 -14.782 -8.576 1.00 54.54 H new ATOM 0 HB2 GLU A 145 -20.743 -12.622 -7.427 1.00 21.23 H new ATOM 0 HB3 GLU A 145 -20.298 -13.952 -6.376 1.00 21.23 H new ATOM 0 HG2 GLU A 145 -18.082 -12.879 -5.944 1.00 52.13 H new ATOM 0 HG3 GLU A 145 -18.510 -11.556 -7.010 1.00 52.13 H new ATOM 2231 N HIS A 146 -18.357 -11.959 -9.385 1.00 60.12 N ATOM 2232 CA HIS A 146 -18.179 -10.883 -10.386 1.00 70.45 C ATOM 2233 C HIS A 146 -19.537 -10.350 -10.922 1.00 32.42 C ATOM 2234 O HIS A 146 -19.941 -10.659 -12.055 1.00 32.12 O ATOM 2235 CB HIS A 146 -17.208 -11.315 -11.544 1.00 55.15 C ATOM 2236 CG HIS A 146 -16.141 -10.293 -11.866 1.00 23.45 C ATOM 2237 ND1 HIS A 146 -16.313 -9.270 -12.776 1.00 52.02 N ATOM 2238 CD2 HIS A 146 -14.888 -10.137 -11.374 1.00 63.52 C ATOM 2239 CE1 HIS A 146 -15.221 -8.533 -12.827 1.00 15.31 C ATOM 2240 NE2 HIS A 146 -14.340 -9.037 -11.987 1.00 33.24 N ATOM 0 H HIS A 146 -17.814 -11.799 -8.537 1.00 60.12 H new ATOM 0 HA HIS A 146 -17.702 -10.048 -9.872 1.00 70.45 H new ATOM 0 HB2 HIS A 146 -16.726 -12.253 -11.269 1.00 55.15 H new ATOM 0 HB3 HIS A 146 -17.794 -11.509 -12.442 1.00 55.15 H new ATOM 0 HD1 HIS A 146 -17.157 -9.109 -13.326 1.00 52.02 H new ATOM 0 HD2 HIS A 146 -14.409 -10.763 -10.636 1.00 63.52 H new ATOM 0 HE1 HIS A 146 -15.074 -7.664 -13.451 1.00 15.31 H new ATOM 2249 N HIS A 147 -20.258 -9.609 -10.056 1.00 41.44 N ATOM 2250 CA HIS A 147 -21.508 -8.917 -10.427 1.00 52.42 C ATOM 2251 C HIS A 147 -21.203 -7.800 -11.446 1.00 20.51 C ATOM 2252 O HIS A 147 -20.667 -6.751 -11.069 1.00 40.52 O ATOM 2253 CB HIS A 147 -22.215 -8.346 -9.166 1.00 5.43 C ATOM 2254 CG HIS A 147 -22.725 -9.400 -8.208 1.00 45.34 C ATOM 2255 ND1 HIS A 147 -22.151 -9.662 -6.979 1.00 64.02 N ATOM 2256 CD2 HIS A 147 -23.794 -10.235 -8.294 1.00 32.41 C ATOM 2257 CE1 HIS A 147 -22.837 -10.600 -6.359 1.00 11.31 C ATOM 2258 NE2 HIS A 147 -23.833 -10.962 -7.131 1.00 30.21 N ATOM 0 H HIS A 147 -19.990 -9.474 -9.081 1.00 41.44 H new ATOM 0 HA HIS A 147 -22.187 -9.634 -10.890 1.00 52.42 H new ATOM 0 HB2 HIS A 147 -21.518 -7.696 -8.636 1.00 5.43 H new ATOM 0 HB3 HIS A 147 -23.052 -7.724 -9.483 1.00 5.43 H new ATOM 0 HD1 HIS A 147 -21.321 -9.199 -6.608 1.00 64.02 H new ATOM 0 HD2 HIS A 147 -24.483 -10.312 -9.122 1.00 32.41 H new ATOM 0 HE1 HIS A 147 -22.617 -11.002 -5.381 1.00 11.31 H new ATOM 2267 N HIS A 148 -21.515 -8.073 -12.734 1.00 1.33 N ATOM 2268 CA HIS A 148 -21.090 -7.250 -13.898 1.00 35.21 C ATOM 2269 C HIS A 148 -19.533 -7.230 -14.052 1.00 20.14 C ATOM 2270 O HIS A 148 -18.820 -7.930 -13.322 1.00 3.41 O ATOM 2271 CB HIS A 148 -21.676 -5.812 -13.818 1.00 23.33 C ATOM 2272 CG HIS A 148 -23.184 -5.758 -13.763 1.00 40.32 C ATOM 2273 ND1 HIS A 148 -23.974 -5.660 -14.886 1.00 73.21 N ATOM 2274 CD2 HIS A 148 -24.043 -5.789 -12.713 1.00 75.33 C ATOM 2275 CE1 HIS A 148 -25.244 -5.633 -14.535 1.00 25.13 C ATOM 2276 NE2 HIS A 148 -25.313 -5.709 -13.223 1.00 54.34 N ATOM 0 H HIS A 148 -22.077 -8.881 -13.001 1.00 1.33 H new ATOM 0 HA HIS A 148 -21.495 -7.719 -14.795 1.00 35.21 H new ATOM 0 HB2 HIS A 148 -21.274 -5.317 -12.934 1.00 23.33 H new ATOM 0 HB3 HIS A 148 -21.335 -5.245 -14.684 1.00 23.33 H new ATOM 0 HD2 HIS A 148 -23.776 -5.863 -11.669 1.00 75.33 H new ATOM 0 HE1 HIS A 148 -26.085 -5.561 -15.209 1.00 25.13 H new ATOM 0 HE2 HIS A 148 -26.173 -5.708 -12.674 1.00 54.34 H new ATOM 2285 N HIS A 149 -19.012 -6.476 -15.041 1.00 61.32 N ATOM 2286 CA HIS A 149 -17.549 -6.291 -15.208 1.00 60.05 C ATOM 2287 C HIS A 149 -17.025 -5.207 -14.224 1.00 2.52 C ATOM 2288 O HIS A 149 -16.528 -5.551 -13.142 1.00 73.11 O ATOM 2289 CB HIS A 149 -17.187 -5.947 -16.687 1.00 12.01 C ATOM 2290 CG HIS A 149 -17.195 -7.131 -17.621 1.00 22.53 C ATOM 2291 ND1 HIS A 149 -18.001 -7.225 -18.736 1.00 71.25 N ATOM 2292 CD2 HIS A 149 -16.459 -8.266 -17.605 1.00 64.32 C ATOM 2293 CE1 HIS A 149 -17.757 -8.358 -19.361 1.00 74.34 C ATOM 2294 NE2 HIS A 149 -16.828 -9.008 -18.696 1.00 72.30 N ATOM 0 H HIS A 149 -19.576 -5.986 -15.735 1.00 61.32 H new ATOM 0 HA HIS A 149 -17.054 -7.232 -14.968 1.00 60.05 H new ATOM 0 HB2 HIS A 149 -17.892 -5.203 -17.057 1.00 12.01 H new ATOM 0 HB3 HIS A 149 -16.198 -5.489 -16.709 1.00 12.01 H new ATOM 0 HD2 HIS A 149 -15.717 -8.537 -16.868 1.00 64.32 H new ATOM 0 HE1 HIS A 149 -18.239 -8.696 -20.267 1.00 74.34 H new ATOM 0 HE2 HIS A 149 -16.444 -9.918 -18.951 1.00 72.30 H new ATOM 2303 N HIS A 150 -17.188 -3.912 -14.601 1.00 72.45 N ATOM 2304 CA HIS A 150 -16.777 -2.738 -13.781 1.00 13.24 C ATOM 2305 C HIS A 150 -15.300 -2.866 -13.281 1.00 25.01 C ATOM 2306 O HIS A 150 -15.042 -2.986 -12.077 1.00 34.15 O ATOM 2307 CB HIS A 150 -17.784 -2.530 -12.609 1.00 61.32 C ATOM 2308 CG HIS A 150 -17.690 -1.190 -11.923 1.00 22.31 C ATOM 2309 ND1 HIS A 150 -17.118 -1.015 -10.680 1.00 10.22 N ATOM 2310 CD2 HIS A 150 -18.111 0.040 -12.309 1.00 0.02 C ATOM 2311 CE1 HIS A 150 -17.189 0.253 -10.335 1.00 14.32 C ATOM 2312 NE2 HIS A 150 -17.784 0.915 -11.303 1.00 14.40 N ATOM 0 H HIS A 150 -17.612 -3.649 -15.491 1.00 72.45 H new ATOM 0 HA HIS A 150 -16.804 -1.848 -14.410 1.00 13.24 H new ATOM 0 HB2 HIS A 150 -18.797 -2.656 -12.992 1.00 61.32 H new ATOM 0 HB3 HIS A 150 -17.624 -3.313 -11.868 1.00 61.32 H new ATOM 0 HD2 HIS A 150 -18.610 0.285 -13.235 1.00 0.02 H new ATOM 0 HE1 HIS A 150 -16.821 0.678 -9.413 1.00 14.32 H new ATOM 0 HE2 HIS A 150 -17.972 1.917 -11.306 1.00 14.40 H new ATOM 2321 N HIS A 151 -14.359 -2.861 -14.253 1.00 13.34 N ATOM 2322 CA HIS A 151 -12.910 -3.158 -14.039 1.00 5.45 C ATOM 2323 C HIS A 151 -12.674 -4.582 -13.471 1.00 14.45 C ATOM 2324 O HIS A 151 -13.413 -5.531 -13.743 1.00 12.40 O ATOM 2325 CB HIS A 151 -12.226 -2.103 -13.124 1.00 72.41 C ATOM 2326 CG HIS A 151 -12.322 -0.684 -13.598 1.00 0.33 C ATOM 2327 ND1 HIS A 151 -12.002 -0.291 -14.878 1.00 71.45 N ATOM 2328 CD2 HIS A 151 -12.711 0.442 -12.951 1.00 62.45 C ATOM 2329 CE1 HIS A 151 -12.192 1.006 -15.001 1.00 1.44 C ATOM 2330 NE2 HIS A 151 -12.620 1.473 -13.848 1.00 75.20 N ATOM 0 H HIS A 151 -14.581 -2.648 -15.226 1.00 13.34 H new ATOM 0 HA HIS A 151 -12.451 -3.108 -15.026 1.00 5.45 H new ATOM 0 HB2 HIS A 151 -12.669 -2.167 -12.130 1.00 72.41 H new ATOM 0 HB3 HIS A 151 -11.173 -2.364 -13.021 1.00 72.41 H new ATOM 0 HD2 HIS A 151 -13.032 0.513 -11.922 1.00 62.45 H new ATOM 0 HE1 HIS A 151 -12.025 1.587 -15.896 1.00 1.44 H new ATOM 0 HE2 HIS A 151 -12.848 2.448 -13.653 1.00 75.20 H new TER 2339 HIS A 151