USER MOD reduce.3.24.130724 H: found=0, std=0, add=1141, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1137 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 50 THR OG1 : rot 176:sc= 0 USER MOD Set 1.2: A 101 THR OG1 : rot 180:sc= 0 USER MOD Set 1.3: A 103 GLN : amide:sc= -0.939 K(o=-0.94,f=0.061) USER MOD Set 2.1: A 34 THR OG1 : rot 48:sc= 0.0264 USER MOD Set 2.2: A 49 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 HIS : no HD1:sc= -0.28 X(o=-0.28,f=0) USER MOD Single : A 4 THR OG1 : rot 180:sc=-0.00816 USER MOD Single : A 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 8 HIS : no HD1:sc= -0.0224 X(o=-0.022,f=0) USER MOD Single : A 9 THR OG1 : rot 180:sc= -0.244 USER MOD Single : A 13 GLN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 29 THR OG1 : rot 180:sc= -0.127 USER MOD Single : A 31 GLN : amide:sc= -1.41 K(o=-1.4,f=-0.4) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 160:sc= 0 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot -143:sc= 1.17 USER MOD Single : A 53 ASN : amide:sc= -1.62 K(o=-1.6,f=-5.7!) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot 57:sc= 0.0549 USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot -78:sc= 0.454 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 75 MET CE :methyl 168:sc= -0.287 (180deg=-0.643) USER MOD Single : A 76 THR OG1 : rot 67:sc= 1.23 USER MOD Single : A 77 THR OG1 : rot 43:sc= 0.751 USER MOD Single : A 78 THR OG1 : rot -167:sc= 0.327 USER MOD Single : A 79 HIS : no HE2:sc= 0.104 K(o=0.1,f=-1.1) USER MOD Single : A 80 SER OG : rot 110:sc= 1.01 USER MOD Single : A 83 MET CE :methyl -164:sc= 0 (180deg=-0.0189) USER MOD Single : A 86 MET CE :methyl -177:sc= 0 (180deg=-0.0211) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 HIS : no HE2:sc= 0.574 K(o=0.57,f=-2.7!) USER MOD Single : A 110 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 112 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ -141:sc= 0.797 (180deg=-0.0582) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 ASN : amide:sc= -0.626 K(o=-0.63,f=0) USER MOD Single : A 127 THR OG1 : rot 180:sc= -0.0615 USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 THR OG1 : rot -37:sc= 0.233 USER MOD Single : A 135 THR OG1 : rot 180:sc= 0.00868 USER MOD Single : A 137 ASN : amide:sc= -0.155 K(o=-0.15,f=-1.1!) USER MOD Single : A 141 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 144 LYS NZ :NH3+ 146:sc= 1.87 (180deg=0.628) USER MOD Single : A 145 ASN : amide:sc= 0 X(o=0,f=0.08) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -40.367 86.410 16.386 1.00 83.99 N ATOM 2 CA MET A 1 -39.861 87.761 16.735 1.00 84.55 C ATOM 3 C MET A 1 -38.430 87.944 16.216 1.00 83.40 C ATOM 4 O MET A 1 -38.274 88.095 15.008 1.00 82.97 O ATOM 5 CB MET A 1 -40.005 88.068 18.237 1.00 85.55 C ATOM 6 CG MET A 1 -41.449 88.324 18.677 1.00 86.91 C ATOM 7 SD MET A 1 -41.580 88.864 20.406 1.00 88.24 S ATOM 8 CE MET A 1 -43.378 89.048 20.519 1.00 89.72 C ATOM 0 H1 MET A 1 -41.337 86.300 16.744 1.00 83.99 H new ATOM 0 H2 MET A 1 -40.364 86.294 15.352 1.00 83.99 H new ATOM 0 H3 MET A 1 -39.755 85.688 16.817 1.00 83.99 H new ATOM 0 HA MET A 1 -40.485 88.500 16.233 1.00 84.55 H new ATOM 0 HB2 MET A 1 -39.603 87.232 18.810 1.00 85.55 H new ATOM 0 HB3 MET A 1 -39.400 88.942 18.480 1.00 85.55 H new ATOM 0 HG2 MET A 1 -41.891 89.083 18.031 1.00 86.91 H new ATOM 0 HG3 MET A 1 -42.031 87.412 18.542 1.00 86.91 H new ATOM 0 HE1 MET A 1 -43.648 89.377 21.522 1.00 89.72 H new ATOM 0 HE2 MET A 1 -43.715 89.787 19.792 1.00 89.72 H new ATOM 0 HE3 MET A 1 -43.856 88.091 20.311 1.00 89.72 H new ATOM 20 N GLY A 2 -37.383 87.928 17.052 1.00 82.93 N ATOM 21 CA GLY A 2 -35.996 88.139 16.611 1.00 81.95 C ATOM 22 C GLY A 2 -35.080 87.041 17.114 1.00 80.91 C ATOM 23 O GLY A 2 -34.565 87.146 18.219 1.00 81.23 O ATOM 0 H GLY A 2 -37.473 87.768 18.055 1.00 82.93 H new ATOM 0 HA2 GLY A 2 -35.961 88.173 15.522 1.00 81.95 H new ATOM 0 HA3 GLY A 2 -35.641 89.104 16.972 1.00 81.95 H new ATOM 27 N HIS A 3 -34.858 86.008 16.300 1.00 79.69 N ATOM 28 CA HIS A 3 -34.036 84.818 16.584 1.00 78.52 C ATOM 29 C HIS A 3 -33.982 83.895 15.347 1.00 77.20 C ATOM 30 O HIS A 3 -34.613 84.190 14.327 1.00 77.21 O ATOM 31 CB HIS A 3 -34.523 84.080 17.866 1.00 78.84 C ATOM 32 CG HIS A 3 -35.968 83.620 17.911 1.00 79.38 C ATOM 33 ND1 HIS A 3 -36.686 83.333 19.057 1.00 79.99 N ATOM 34 CD2 HIS A 3 -36.803 83.356 16.852 1.00 79.41 C ATOM 35 CE1 HIS A 3 -37.907 82.909 18.693 1.00 80.38 C ATOM 36 NE2 HIS A 3 -38.031 82.921 17.356 1.00 80.05 N ATOM 0 H HIS A 3 -35.269 85.972 15.367 1.00 79.69 H new ATOM 0 HA HIS A 3 -33.016 85.141 16.792 1.00 78.52 H new ATOM 0 HB2 HIS A 3 -33.888 83.206 18.011 1.00 78.84 H new ATOM 0 HB3 HIS A 3 -34.355 84.740 18.717 1.00 78.84 H new ATOM 0 HD2 HIS A 3 -36.552 83.466 15.807 1.00 79.41 H new ATOM 0 HE1 HIS A 3 -38.681 82.601 19.380 1.00 80.38 H new ATOM 0 HE2 HIS A 3 -38.857 82.664 16.816 1.00 80.05 H new ATOM 44 N THR A 4 -33.268 82.767 15.466 1.00 76.13 N ATOM 45 CA THR A 4 -33.238 81.626 14.542 1.00 74.83 C ATOM 46 C THR A 4 -32.545 80.453 15.244 1.00 73.90 C ATOM 47 O THR A 4 -31.995 80.618 16.337 1.00 74.33 O ATOM 48 CB THR A 4 -32.600 82.009 13.195 1.00 74.34 C ATOM 49 OG1 THR A 4 -32.830 80.971 12.278 1.00 73.59 O ATOM 50 CG2 THR A 4 -31.099 82.284 13.269 1.00 73.82 C ATOM 0 H THR A 4 -32.654 82.618 16.266 1.00 76.13 H new ATOM 0 HA THR A 4 -34.251 81.314 14.288 1.00 74.83 H new ATOM 0 HB THR A 4 -33.067 82.943 12.882 1.00 74.34 H new ATOM 0 HG1 THR A 4 -32.430 81.203 11.414 1.00 73.59 H new ATOM 0 HG21 THR A 4 -30.728 82.547 12.278 1.00 73.82 H new ATOM 0 HG22 THR A 4 -30.914 83.109 13.957 1.00 73.82 H new ATOM 0 HG23 THR A 4 -30.583 81.392 13.625 1.00 73.82 H new ATOM 58 N MET A 5 -32.557 79.284 14.609 1.00 72.67 N ATOM 59 CA MET A 5 -31.934 78.046 15.091 1.00 71.65 C ATOM 60 C MET A 5 -31.533 77.157 13.897 1.00 70.25 C ATOM 61 O MET A 5 -32.356 76.974 12.994 1.00 70.10 O ATOM 62 CB MET A 5 -32.924 77.313 16.012 1.00 72.02 C ATOM 63 CG MET A 5 -32.261 76.223 16.862 1.00 71.16 C ATOM 64 SD MET A 5 -31.116 76.875 18.104 1.00 71.53 S ATOM 65 CE MET A 5 -30.827 75.365 19.054 1.00 71.07 C ATOM 0 H MET A 5 -33.019 79.164 13.707 1.00 72.67 H new ATOM 0 HA MET A 5 -31.031 78.280 15.654 1.00 71.65 H new ATOM 0 HB2 MET A 5 -33.403 78.038 16.670 1.00 72.02 H new ATOM 0 HB3 MET A 5 -33.711 76.864 15.406 1.00 72.02 H new ATOM 0 HG2 MET A 5 -33.036 75.642 17.362 1.00 71.16 H new ATOM 0 HG3 MET A 5 -31.723 75.539 16.206 1.00 71.16 H new ATOM 0 HE1 MET A 5 -30.137 75.576 19.871 1.00 71.07 H new ATOM 0 HE2 MET A 5 -31.772 75.004 19.460 1.00 71.07 H new ATOM 0 HE3 MET A 5 -30.397 74.603 18.404 1.00 71.07 H new ATOM 75 N PRO A 6 -30.303 76.610 13.848 1.00 69.26 N ATOM 76 CA PRO A 6 -29.870 75.733 12.765 1.00 67.92 C ATOM 77 C PRO A 6 -30.434 74.315 12.930 1.00 67.20 C ATOM 78 O PRO A 6 -30.620 73.840 14.051 1.00 67.63 O ATOM 79 CB PRO A 6 -28.340 75.741 12.826 1.00 67.34 C ATOM 80 CG PRO A 6 -28.054 75.952 14.312 1.00 68.07 C ATOM 81 CD PRO A 6 -29.200 76.853 14.771 1.00 69.43 C ATOM 0 HA PRO A 6 -30.234 76.078 11.798 1.00 67.92 H new ATOM 0 HB2 PRO A 6 -27.917 74.804 12.463 1.00 67.34 H new ATOM 0 HB3 PRO A 6 -27.916 76.539 12.217 1.00 67.34 H new ATOM 0 HG2 PRO A 6 -28.043 75.008 14.857 1.00 68.07 H new ATOM 0 HG3 PRO A 6 -27.084 76.423 14.471 1.00 68.07 H new ATOM 0 HD2 PRO A 6 -29.491 76.621 15.795 1.00 69.43 H new ATOM 0 HD3 PRO A 6 -28.902 77.901 14.754 1.00 69.43 H new ATOM 89 N ALA A 7 -30.658 73.637 11.800 1.00 66.13 N ATOM 90 CA ALA A 7 -30.936 72.203 11.751 1.00 65.15 C ATOM 91 C ALA A 7 -29.640 71.381 11.636 1.00 63.60 C ATOM 92 O ALA A 7 -28.548 71.916 11.427 1.00 63.20 O ATOM 93 CB ALA A 7 -31.912 71.932 10.596 1.00 65.14 C ATOM 0 H ALA A 7 -30.651 74.079 10.881 1.00 66.13 H new ATOM 0 HA ALA A 7 -31.403 71.885 12.683 1.00 65.15 H new ATOM 0 HB1 ALA A 7 -32.130 70.865 10.546 1.00 65.14 H new ATOM 0 HB2 ALA A 7 -32.837 72.483 10.764 1.00 65.14 H new ATOM 0 HB3 ALA A 7 -31.463 72.255 9.657 1.00 65.14 H new ATOM 99 N HIS A 8 -29.768 70.061 11.742 1.00 62.74 N ATOM 100 CA HIS A 8 -28.675 69.110 11.597 1.00 61.24 C ATOM 101 C HIS A 8 -29.224 67.739 11.168 1.00 60.55 C ATOM 102 O HIS A 8 -30.440 67.522 11.169 1.00 61.28 O ATOM 103 CB HIS A 8 -27.848 69.062 12.905 1.00 61.06 C ATOM 104 CG HIS A 8 -28.608 68.913 14.212 1.00 61.29 C ATOM 105 ND1 HIS A 8 -28.233 69.472 15.414 1.00 61.72 N ATOM 106 CD2 HIS A 8 -29.758 68.202 14.454 1.00 61.21 C ATOM 107 CE1 HIS A 8 -29.136 69.128 16.344 1.00 61.88 C ATOM 108 NE2 HIS A 8 -30.091 68.354 15.808 1.00 61.58 N ATOM 0 H HIS A 8 -30.663 69.612 11.937 1.00 62.74 H new ATOM 0 HA HIS A 8 -27.995 69.430 10.808 1.00 61.24 H new ATOM 0 HB2 HIS A 8 -27.146 68.232 12.828 1.00 61.06 H new ATOM 0 HB3 HIS A 8 -27.257 69.976 12.962 1.00 61.06 H new ATOM 0 HD2 HIS A 8 -30.311 67.625 13.727 1.00 61.21 H new ATOM 0 HE1 HIS A 8 -29.099 69.432 17.380 1.00 61.88 H new ATOM 0 HE2 HIS A 8 -30.898 67.956 16.289 1.00 61.58 H new ATOM 116 N THR A 9 -28.329 66.811 10.815 1.00 59.20 N ATOM 117 CA THR A 9 -28.636 65.420 10.467 1.00 58.37 C ATOM 118 C THR A 9 -27.392 64.559 10.718 1.00 57.02 C ATOM 119 O THR A 9 -26.288 65.098 10.587 1.00 56.66 O ATOM 120 CB THR A 9 -29.128 65.327 9.014 1.00 58.28 C ATOM 121 OG1 THR A 9 -29.752 64.081 8.889 1.00 57.91 O ATOM 122 CG2 THR A 9 -28.039 65.443 7.945 1.00 57.43 C ATOM 0 H THR A 9 -27.331 67.016 10.762 1.00 59.20 H new ATOM 0 HA THR A 9 -29.444 65.043 11.095 1.00 58.37 H new ATOM 0 HB THR A 9 -29.788 66.176 8.837 1.00 58.28 H new ATOM 0 HG1 THR A 9 -30.087 63.973 7.974 1.00 57.91 H new ATOM 0 HG21 THR A 9 -28.490 65.365 6.956 1.00 57.43 H new ATOM 0 HG22 THR A 9 -27.537 66.406 8.040 1.00 57.43 H new ATOM 0 HG23 THR A 9 -27.313 64.641 8.077 1.00 57.43 H new ATOM 130 N PRO A 10 -27.521 63.268 11.092 1.00 56.32 N ATOM 131 CA PRO A 10 -26.383 62.367 11.246 1.00 54.99 C ATOM 132 C PRO A 10 -25.952 61.738 9.905 1.00 53.90 C ATOM 133 O PRO A 10 -26.730 61.735 8.942 1.00 54.19 O ATOM 134 CB PRO A 10 -26.865 61.297 12.234 1.00 54.89 C ATOM 135 CG PRO A 10 -28.349 61.171 11.903 1.00 55.74 C ATOM 136 CD PRO A 10 -28.740 62.609 11.561 1.00 56.87 C ATOM 0 HA PRO A 10 -25.500 62.896 11.605 1.00 54.99 H new ATOM 0 HB2 PRO A 10 -26.339 60.353 12.095 1.00 54.89 H new ATOM 0 HB3 PRO A 10 -26.706 61.602 13.268 1.00 54.89 H new ATOM 0 HG2 PRO A 10 -28.521 60.495 11.066 1.00 55.74 H new ATOM 0 HG3 PRO A 10 -28.921 60.786 12.747 1.00 55.74 H new ATOM 0 HD2 PRO A 10 -29.513 62.629 10.792 1.00 56.87 H new ATOM 0 HD3 PRO A 10 -29.146 63.119 12.434 1.00 56.87 H new ATOM 144 N PRO A 11 -24.740 61.145 9.844 1.00 52.69 N ATOM 145 CA PRO A 11 -24.334 60.213 8.793 1.00 51.55 C ATOM 146 C PRO A 11 -24.996 58.835 9.005 1.00 50.91 C ATOM 147 O PRO A 11 -25.809 58.655 9.911 1.00 51.32 O ATOM 148 CB PRO A 11 -22.805 60.158 8.904 1.00 50.67 C ATOM 149 CG PRO A 11 -22.575 60.289 10.409 1.00 50.96 C ATOM 150 CD PRO A 11 -23.679 61.255 10.842 1.00 52.40 C ATOM 0 HA PRO A 11 -24.645 60.526 7.796 1.00 51.55 H new ATOM 0 HB2 PRO A 11 -22.404 59.223 8.512 1.00 50.67 H new ATOM 0 HB3 PRO A 11 -22.329 60.967 8.349 1.00 50.67 H new ATOM 0 HG2 PRO A 11 -22.658 59.327 10.915 1.00 50.96 H new ATOM 0 HG3 PRO A 11 -21.583 60.682 10.633 1.00 50.96 H new ATOM 0 HD2 PRO A 11 -24.051 60.999 11.834 1.00 52.40 H new ATOM 0 HD3 PRO A 11 -23.302 62.276 10.897 1.00 52.40 H new ATOM 158 N ALA A 12 -24.641 57.844 8.180 1.00 49.93 N ATOM 159 CA ALA A 12 -25.184 56.484 8.253 1.00 49.27 C ATOM 160 C ALA A 12 -24.103 55.425 7.979 1.00 47.86 C ATOM 161 O ALA A 12 -23.131 55.692 7.274 1.00 47.60 O ATOM 162 CB ALA A 12 -26.356 56.374 7.264 1.00 49.83 C ATOM 0 H ALA A 12 -23.958 57.966 7.432 1.00 49.93 H new ATOM 0 HA ALA A 12 -25.545 56.290 9.263 1.00 49.27 H new ATOM 0 HB1 ALA A 12 -26.773 55.368 7.305 1.00 49.83 H new ATOM 0 HB2 ALA A 12 -27.127 57.097 7.531 1.00 49.83 H new ATOM 0 HB3 ALA A 12 -26.000 56.579 6.254 1.00 49.83 H new ATOM 168 N GLN A 13 -24.294 54.212 8.511 1.00 47.01 N ATOM 169 CA GLN A 13 -23.361 53.086 8.382 1.00 45.63 C ATOM 170 C GLN A 13 -24.106 51.744 8.482 1.00 44.84 C ATOM 171 O GLN A 13 -25.130 51.667 9.165 1.00 45.41 O ATOM 172 CB GLN A 13 -22.264 53.188 9.461 1.00 45.51 C ATOM 173 CG GLN A 13 -22.770 52.884 10.887 1.00 46.10 C ATOM 174 CD GLN A 13 -21.709 53.095 11.964 1.00 46.16 C ATOM 175 OE1 GLN A 13 -20.773 53.854 11.805 1.00 45.94 O ATOM 176 NE2 GLN A 13 -21.839 52.450 13.097 1.00 46.57 N ATOM 0 H GLN A 13 -25.123 53.980 9.057 1.00 47.01 H new ATOM 0 HA GLN A 13 -22.890 53.131 7.400 1.00 45.63 H new ATOM 0 HB2 GLN A 13 -21.459 52.496 9.215 1.00 45.51 H new ATOM 0 HB3 GLN A 13 -21.839 54.192 9.441 1.00 45.51 H new ATOM 0 HG2 GLN A 13 -23.628 53.520 11.103 1.00 46.10 H new ATOM 0 HG3 GLN A 13 -23.119 51.852 10.929 1.00 46.10 H new ATOM 0 HE21 GLN A 13 -22.623 51.812 13.234 1.00 46.57 H new ATOM 0 HE22 GLN A 13 -21.156 52.586 13.842 1.00 46.57 H new ATOM 185 N THR A 14 -23.560 50.686 7.860 1.00 43.57 N ATOM 186 CA THR A 14 -24.086 49.307 7.830 1.00 42.63 C ATOM 187 C THR A 14 -23.060 48.384 7.168 1.00 41.00 C ATOM 188 O THR A 14 -22.179 48.863 6.454 1.00 40.73 O ATOM 189 CB THR A 14 -25.469 49.259 7.157 1.00 43.18 C ATOM 190 OG1 THR A 14 -26.020 47.970 7.318 1.00 43.12 O ATOM 191 CG2 THR A 14 -25.429 49.584 5.660 1.00 42.87 C ATOM 0 H THR A 14 -22.690 50.773 7.334 1.00 43.57 H new ATOM 0 HA THR A 14 -24.239 48.948 8.848 1.00 42.63 H new ATOM 0 HB THR A 14 -26.078 50.022 7.642 1.00 43.18 H new ATOM 0 HG1 THR A 14 -26.902 47.936 6.892 1.00 43.12 H new ATOM 0 HG21 THR A 14 -26.437 49.532 5.249 1.00 42.87 H new ATOM 0 HG22 THR A 14 -25.030 50.588 5.516 1.00 42.87 H new ATOM 0 HG23 THR A 14 -24.791 48.863 5.148 1.00 42.87 H new ATOM 199 N ALA A 15 -23.143 47.072 7.404 1.00 40.00 N ATOM 200 CA ALA A 15 -22.192 46.087 6.873 1.00 38.42 C ATOM 201 C ALA A 15 -22.894 45.029 5.991 1.00 37.46 C ATOM 202 O ALA A 15 -23.813 44.372 6.496 1.00 37.78 O ATOM 203 CB ALA A 15 -21.466 45.437 8.060 1.00 38.26 C ATOM 0 H ALA A 15 -23.880 46.658 7.975 1.00 40.00 H new ATOM 0 HA ALA A 15 -21.471 46.588 6.227 1.00 38.42 H new ATOM 0 HB1 ALA A 15 -20.753 44.700 7.691 1.00 38.26 H new ATOM 0 HB2 ALA A 15 -20.936 46.203 8.626 1.00 38.26 H new ATOM 0 HB3 ALA A 15 -22.193 44.946 8.707 1.00 38.26 H new ATOM 209 N PRO A 16 -22.491 44.838 4.715 1.00 36.41 N ATOM 210 CA PRO A 16 -22.978 43.757 3.858 1.00 35.39 C ATOM 211 C PRO A 16 -22.219 42.450 4.135 1.00 33.97 C ATOM 212 O PRO A 16 -21.220 42.445 4.857 1.00 33.89 O ATOM 213 CB PRO A 16 -22.736 44.259 2.431 1.00 35.05 C ATOM 214 CG PRO A 16 -21.436 45.049 2.573 1.00 35.06 C ATOM 215 CD PRO A 16 -21.550 45.669 3.967 1.00 36.25 C ATOM 0 HA PRO A 16 -24.029 43.527 4.034 1.00 35.39 H new ATOM 0 HB2 PRO A 16 -22.635 43.436 1.723 1.00 35.05 H new ATOM 0 HB3 PRO A 16 -23.555 44.886 2.077 1.00 35.05 H new ATOM 0 HG2 PRO A 16 -20.562 44.403 2.491 1.00 35.06 H new ATOM 0 HG3 PRO A 16 -21.343 45.812 1.800 1.00 35.06 H new ATOM 0 HD2 PRO A 16 -20.578 45.695 4.461 1.00 36.25 H new ATOM 0 HD3 PRO A 16 -21.905 46.698 3.906 1.00 36.25 H new ATOM 223 N ALA A 17 -22.666 41.338 3.535 1.00 32.93 N ATOM 224 CA ALA A 17 -22.067 40.013 3.724 1.00 31.55 C ATOM 225 C ALA A 17 -22.436 39.013 2.608 1.00 30.36 C ATOM 226 O ALA A 17 -23.312 39.270 1.780 1.00 30.78 O ATOM 227 CB ALA A 17 -22.452 39.488 5.120 1.00 31.99 C ATOM 0 H ALA A 17 -23.463 41.335 2.898 1.00 32.93 H new ATOM 0 HA ALA A 17 -20.984 40.116 3.659 1.00 31.55 H new ATOM 0 HB1 ALA A 17 -22.012 38.502 5.272 1.00 31.99 H new ATOM 0 HB2 ALA A 17 -22.080 40.173 5.882 1.00 31.99 H new ATOM 0 HB3 ALA A 17 -23.537 39.416 5.195 1.00 31.99 H new ATOM 233 N ALA A 18 -21.774 37.850 2.636 1.00 28.97 N ATOM 234 CA ALA A 18 -21.964 36.673 1.775 1.00 27.67 C ATOM 235 C ALA A 18 -21.433 35.425 2.522 1.00 26.35 C ATOM 236 O ALA A 18 -21.458 35.423 3.755 1.00 26.89 O ATOM 237 CB ALA A 18 -21.277 36.940 0.425 1.00 27.26 C ATOM 0 H ALA A 18 -21.031 37.694 3.317 1.00 28.97 H new ATOM 0 HA ALA A 18 -23.015 36.481 1.557 1.00 27.67 H new ATOM 0 HB1 ALA A 18 -21.408 36.076 -0.227 1.00 27.26 H new ATOM 0 HB2 ALA A 18 -21.722 37.818 -0.042 1.00 27.26 H new ATOM 0 HB3 ALA A 18 -20.213 37.115 0.586 1.00 27.26 H new ATOM 243 N GLN A 19 -20.910 34.393 1.847 1.00 24.76 N ATOM 244 CA GLN A 19 -20.259 33.234 2.487 1.00 23.45 C ATOM 245 C GLN A 19 -19.215 32.605 1.539 1.00 21.52 C ATOM 246 O GLN A 19 -19.325 32.745 0.323 1.00 21.38 O ATOM 247 CB GLN A 19 -21.336 32.217 2.936 1.00 24.11 C ATOM 248 CG GLN A 19 -20.791 31.044 3.778 1.00 23.94 C ATOM 249 CD GLN A 19 -21.892 30.198 4.416 1.00 24.88 C ATOM 250 OE1 GLN A 19 -22.154 29.070 4.013 1.00 24.93 O ATOM 251 NE2 GLN A 19 -22.556 30.705 5.442 1.00 25.80 N ATOM 0 H GLN A 19 -20.925 34.335 0.829 1.00 24.76 H new ATOM 0 HA GLN A 19 -19.719 33.561 3.375 1.00 23.45 H new ATOM 0 HB2 GLN A 19 -22.096 32.742 3.515 1.00 24.11 H new ATOM 0 HB3 GLN A 19 -21.830 31.815 2.052 1.00 24.11 H new ATOM 0 HG2 GLN A 19 -20.173 30.407 3.145 1.00 23.94 H new ATOM 0 HG3 GLN A 19 -20.144 31.438 4.562 1.00 23.94 H new ATOM 0 HE21 GLN A 19 -22.338 31.643 5.777 1.00 25.80 H new ATOM 0 HE22 GLN A 19 -23.286 30.157 5.898 1.00 25.80 H new ATOM 260 N LYS A 20 -18.222 31.887 2.088 1.00 20.18 N ATOM 261 CA LYS A 20 -17.266 31.050 1.334 1.00 18.34 C ATOM 262 C LYS A 20 -16.788 29.818 2.144 1.00 17.50 C ATOM 263 O LYS A 20 -16.753 29.885 3.376 1.00 18.35 O ATOM 264 CB LYS A 20 -16.075 31.896 0.827 1.00 17.71 C ATOM 265 CG LYS A 20 -15.123 32.396 1.932 1.00 17.92 C ATOM 266 CD LYS A 20 -13.938 33.177 1.342 1.00 17.92 C ATOM 267 CE LYS A 20 -12.981 33.607 2.463 1.00 18.34 C ATOM 268 NZ LYS A 20 -11.847 34.409 1.948 1.00 18.49 N ATOM 0 H LYS A 20 -18.055 31.870 3.094 1.00 20.18 H new ATOM 0 HA LYS A 20 -17.797 30.658 0.467 1.00 18.34 H new ATOM 0 HB2 LYS A 20 -15.502 31.302 0.114 1.00 17.71 H new ATOM 0 HB3 LYS A 20 -16.464 32.758 0.284 1.00 17.71 H new ATOM 0 HG2 LYS A 20 -15.671 33.034 2.625 1.00 17.92 H new ATOM 0 HG3 LYS A 20 -14.751 31.547 2.506 1.00 17.92 H new ATOM 0 HD2 LYS A 20 -13.408 32.558 0.618 1.00 17.92 H new ATOM 0 HD3 LYS A 20 -14.301 34.054 0.806 1.00 17.92 H new ATOM 0 HE2 LYS A 20 -13.529 34.189 3.204 1.00 18.34 H new ATOM 0 HE3 LYS A 20 -12.598 32.722 2.972 1.00 18.34 H new ATOM 0 HZ1 LYS A 20 -11.226 34.678 2.737 1.00 18.49 H new ATOM 0 HZ2 LYS A 20 -11.308 33.846 1.260 1.00 18.49 H new ATOM 0 HZ3 LYS A 20 -12.210 35.267 1.485 1.00 18.49 H new ATOM 282 N ALA A 21 -16.442 28.735 1.428 1.00 16.06 N ATOM 283 CA ALA A 21 -15.934 27.400 1.821 1.00 15.17 C ATOM 284 C ALA A 21 -16.910 26.296 1.351 1.00 14.33 C ATOM 285 O ALA A 21 -17.531 26.451 0.299 1.00 13.80 O ATOM 286 CB ALA A 21 -15.519 27.295 3.303 1.00 15.91 C ATOM 0 H ALA A 21 -16.523 28.779 0.412 1.00 16.06 H new ATOM 0 HA ALA A 21 -14.991 27.240 1.297 1.00 15.17 H new ATOM 0 HB1 ALA A 21 -15.159 26.287 3.509 1.00 15.91 H new ATOM 0 HB2 ALA A 21 -14.726 28.013 3.511 1.00 15.91 H new ATOM 0 HB3 ALA A 21 -16.379 27.510 3.938 1.00 15.91 H new ATOM 292 N GLY A 22 -17.050 25.193 2.101 1.00 14.47 N ATOM 293 CA GLY A 22 -17.903 24.039 1.771 1.00 13.86 C ATOM 294 C GLY A 22 -17.246 22.685 2.065 1.00 13.12 C ATOM 295 O GLY A 22 -16.164 22.630 2.648 1.00 13.37 O ATOM 0 H GLY A 22 -16.556 25.075 2.985 1.00 14.47 H new ATOM 0 HA2 GLY A 22 -18.833 24.112 2.335 1.00 13.86 H new ATOM 0 HA3 GLY A 22 -18.167 24.083 0.714 1.00 13.86 H new ATOM 299 N ALA A 23 -17.923 21.603 1.656 1.00 12.52 N ATOM 300 CA ALA A 23 -17.538 20.193 1.832 1.00 11.95 C ATOM 301 C ALA A 23 -18.269 19.304 0.804 1.00 11.18 C ATOM 302 O ALA A 23 -19.241 19.755 0.195 1.00 11.59 O ATOM 303 CB ALA A 23 -17.876 19.771 3.272 1.00 13.22 C ATOM 0 H ALA A 23 -18.811 21.693 1.162 1.00 12.52 H new ATOM 0 HA ALA A 23 -16.468 20.073 1.663 1.00 11.95 H new ATOM 0 HB1 ALA A 23 -17.597 18.728 3.420 1.00 13.22 H new ATOM 0 HB2 ALA A 23 -17.325 20.397 3.974 1.00 13.22 H new ATOM 0 HB3 ALA A 23 -18.946 19.888 3.444 1.00 13.22 H new ATOM 309 N GLN A 24 -17.848 18.047 0.618 1.00 10.44 N ATOM 310 CA GLN A 24 -18.484 17.108 -0.325 1.00 9.92 C ATOM 311 C GLN A 24 -18.087 15.650 -0.004 1.00 9.47 C ATOM 312 O GLN A 24 -17.203 15.425 0.824 1.00 9.81 O ATOM 313 CB GLN A 24 -18.102 17.517 -1.770 1.00 9.27 C ATOM 314 CG GLN A 24 -19.085 17.028 -2.853 1.00 10.00 C ATOM 315 CD GLN A 24 -18.837 17.625 -4.238 1.00 10.19 C ATOM 316 OE1 GLN A 24 -17.825 18.243 -4.539 1.00 9.82 O ATOM 317 NE2 GLN A 24 -19.766 17.477 -5.178 1.00 11.19 N ATOM 0 H GLN A 24 -17.054 17.647 1.118 1.00 10.44 H new ATOM 0 HA GLN A 24 -19.568 17.158 -0.226 1.00 9.92 H new ATOM 0 HB2 GLN A 24 -18.036 18.604 -1.821 1.00 9.27 H new ATOM 0 HB3 GLN A 24 -17.110 17.126 -1.995 1.00 9.27 H new ATOM 0 HG2 GLN A 24 -19.023 15.942 -2.921 1.00 10.00 H new ATOM 0 HG3 GLN A 24 -20.101 17.270 -2.542 1.00 10.00 H new ATOM 0 HE21 GLN A 24 -20.625 16.969 -4.970 1.00 11.19 H new ATOM 0 HE22 GLN A 24 -19.619 17.872 -6.107 1.00 11.19 H new ATOM 326 N ALA A 25 -18.718 14.661 -0.658 1.00 8.98 N ATOM 327 CA ALA A 25 -18.342 13.242 -0.584 1.00 8.58 C ATOM 328 C ALA A 25 -18.736 12.467 -1.861 1.00 7.75 C ATOM 329 O ALA A 25 -19.837 12.650 -2.388 1.00 8.21 O ATOM 330 CB ALA A 25 -18.989 12.615 0.660 1.00 10.15 C ATOM 0 H ALA A 25 -19.520 14.830 -1.265 1.00 8.98 H new ATOM 0 HA ALA A 25 -17.257 13.177 -0.506 1.00 8.58 H new ATOM 0 HB1 ALA A 25 -18.714 11.562 0.721 1.00 10.15 H new ATOM 0 HB2 ALA A 25 -18.639 13.134 1.553 1.00 10.15 H new ATOM 0 HB3 ALA A 25 -20.073 12.704 0.590 1.00 10.15 H new ATOM 336 N LEU A 26 -17.840 11.595 -2.346 1.00 6.80 N ATOM 337 CA LEU A 26 -18.072 10.689 -3.481 1.00 6.15 C ATOM 338 C LEU A 26 -17.912 9.223 -3.026 1.00 5.87 C ATOM 339 O LEU A 26 -17.032 8.943 -2.197 1.00 5.71 O ATOM 340 CB LEU A 26 -17.084 10.992 -4.634 1.00 5.51 C ATOM 341 CG LEU A 26 -17.396 12.176 -5.578 1.00 6.19 C ATOM 342 CD1 LEU A 26 -18.762 12.034 -6.264 1.00 7.39 C ATOM 343 CD2 LEU A 26 -17.286 13.550 -4.900 1.00 6.96 C ATOM 0 H LEU A 26 -16.906 11.498 -1.948 1.00 6.80 H new ATOM 0 HA LEU A 26 -19.088 10.845 -3.844 1.00 6.15 H new ATOM 0 HB2 LEU A 26 -16.103 11.169 -4.193 1.00 5.51 H new ATOM 0 HB3 LEU A 26 -17.001 10.093 -5.245 1.00 5.51 H new ATOM 0 HG LEU A 26 -16.619 12.130 -6.341 1.00 6.19 H new ATOM 0 HD11 LEU A 26 -18.933 12.891 -6.916 1.00 7.39 H new ATOM 0 HD12 LEU A 26 -18.779 11.119 -6.856 1.00 7.39 H new ATOM 0 HD13 LEU A 26 -19.546 11.991 -5.508 1.00 7.39 H new ATOM 0 HD21 LEU A 26 -17.518 14.332 -5.623 1.00 6.96 H new ATOM 0 HD22 LEU A 26 -17.989 13.603 -4.069 1.00 6.96 H new ATOM 0 HD23 LEU A 26 -16.272 13.691 -4.526 1.00 6.96 H new ATOM 355 N PRO A 27 -18.694 8.273 -3.581 1.00 6.16 N ATOM 356 CA PRO A 27 -18.551 6.851 -3.301 1.00 6.16 C ATOM 357 C PRO A 27 -17.351 6.287 -4.082 1.00 4.83 C ATOM 358 O PRO A 27 -17.509 5.649 -5.117 1.00 4.65 O ATOM 359 CB PRO A 27 -19.899 6.235 -3.697 1.00 7.31 C ATOM 360 CG PRO A 27 -20.351 7.110 -4.864 1.00 7.40 C ATOM 361 CD PRO A 27 -19.823 8.494 -4.478 1.00 6.96 C ATOM 0 HA PRO A 27 -18.336 6.624 -2.257 1.00 6.16 H new ATOM 0 HB2 PRO A 27 -19.794 5.191 -3.993 1.00 7.31 H new ATOM 0 HB3 PRO A 27 -20.612 6.262 -2.873 1.00 7.31 H new ATOM 0 HG2 PRO A 27 -19.933 6.768 -5.811 1.00 7.40 H new ATOM 0 HG3 PRO A 27 -21.435 7.108 -4.974 1.00 7.40 H new ATOM 0 HD2 PRO A 27 -19.512 9.051 -5.362 1.00 6.96 H new ATOM 0 HD3 PRO A 27 -20.599 9.082 -3.987 1.00 6.96 H new ATOM 369 N VAL A 28 -16.140 6.570 -3.595 1.00 4.20 N ATOM 370 CA VAL A 28 -14.870 6.194 -4.241 1.00 3.02 C ATOM 371 C VAL A 28 -13.790 5.935 -3.196 1.00 2.91 C ATOM 372 O VAL A 28 -13.789 6.559 -2.132 1.00 3.70 O ATOM 373 CB VAL A 28 -14.424 7.272 -5.256 1.00 2.85 C ATOM 374 CG1 VAL A 28 -14.049 8.616 -4.604 1.00 3.96 C ATOM 375 CG2 VAL A 28 -13.261 6.777 -6.124 1.00 2.75 C ATOM 0 H VAL A 28 -16.007 7.078 -2.721 1.00 4.20 H new ATOM 0 HA VAL A 28 -15.030 5.268 -4.794 1.00 3.02 H new ATOM 0 HB VAL A 28 -15.296 7.452 -5.884 1.00 2.85 H new ATOM 0 HG11 VAL A 28 -13.746 9.323 -5.376 1.00 3.96 H new ATOM 0 HG12 VAL A 28 -14.910 9.012 -4.066 1.00 3.96 H new ATOM 0 HG13 VAL A 28 -13.225 8.465 -3.907 1.00 3.96 H new ATOM 0 HG21 VAL A 28 -12.973 7.559 -6.826 1.00 2.75 H new ATOM 0 HG22 VAL A 28 -12.412 6.530 -5.487 1.00 2.75 H new ATOM 0 HG23 VAL A 28 -13.571 5.890 -6.676 1.00 2.75 H new ATOM 385 N THR A 29 -12.885 4.987 -3.465 1.00 2.46 N ATOM 386 CA THR A 29 -11.792 4.597 -2.561 1.00 2.78 C ATOM 387 C THR A 29 -10.693 3.913 -3.373 1.00 2.68 C ATOM 388 O THR A 29 -10.948 3.485 -4.487 1.00 2.84 O ATOM 389 CB THR A 29 -12.277 3.670 -1.424 1.00 3.35 C ATOM 390 OG1 THR A 29 -13.663 3.745 -1.183 1.00 3.67 O ATOM 391 CG2 THR A 29 -11.583 4.014 -0.105 1.00 4.25 C ATOM 0 H THR A 29 -12.891 4.457 -4.336 1.00 2.46 H new ATOM 0 HA THR A 29 -11.403 5.499 -2.088 1.00 2.78 H new ATOM 0 HB THR A 29 -12.029 2.665 -1.765 1.00 3.35 H new ATOM 0 HG1 THR A 29 -13.902 3.134 -0.455 1.00 3.67 H new ATOM 0 HG21 THR A 29 -11.942 3.347 0.679 1.00 4.25 H new ATOM 0 HG22 THR A 29 -10.506 3.894 -0.219 1.00 4.25 H new ATOM 0 HG23 THR A 29 -11.807 5.046 0.165 1.00 4.25 H new ATOM 399 N VAL A 30 -9.494 3.791 -2.812 1.00 3.20 N ATOM 400 CA VAL A 30 -8.269 3.263 -3.437 1.00 3.87 C ATOM 401 C VAL A 30 -7.421 2.712 -2.282 1.00 3.70 C ATOM 402 O VAL A 30 -7.294 3.448 -1.307 1.00 3.93 O ATOM 403 CB VAL A 30 -7.485 4.374 -4.194 1.00 5.13 C ATOM 404 CG1 VAL A 30 -6.295 3.780 -4.949 1.00 7.00 C ATOM 405 CG2 VAL A 30 -8.337 5.170 -5.199 1.00 5.88 C ATOM 0 H VAL A 30 -9.333 4.075 -1.846 1.00 3.20 H new ATOM 0 HA VAL A 30 -8.510 2.499 -4.176 1.00 3.87 H new ATOM 0 HB VAL A 30 -7.156 5.063 -3.416 1.00 5.13 H new ATOM 0 HG11 VAL A 30 -5.762 4.575 -5.471 1.00 7.00 H new ATOM 0 HG12 VAL A 30 -5.622 3.294 -4.243 1.00 7.00 H new ATOM 0 HG13 VAL A 30 -6.652 3.047 -5.672 1.00 7.00 H new ATOM 0 HG21 VAL A 30 -7.717 5.924 -5.684 1.00 5.88 H new ATOM 0 HG22 VAL A 30 -8.740 4.492 -5.952 1.00 5.88 H new ATOM 0 HG23 VAL A 30 -9.158 5.658 -4.674 1.00 5.88 H new ATOM 415 N GLN A 31 -6.906 1.464 -2.350 1.00 3.77 N ATOM 416 CA GLN A 31 -6.160 0.752 -1.281 1.00 3.78 C ATOM 417 C GLN A 31 -5.805 1.551 -0.010 1.00 3.67 C ATOM 418 O GLN A 31 -4.716 2.107 0.122 1.00 4.48 O ATOM 419 CB GLN A 31 -4.950 0.011 -1.877 1.00 4.15 C ATOM 420 CG GLN A 31 -3.835 0.887 -2.494 1.00 4.25 C ATOM 421 CD GLN A 31 -2.826 0.115 -3.343 1.00 4.80 C ATOM 422 OE1 GLN A 31 -1.666 0.493 -3.457 1.00 5.66 O ATOM 423 NE2 GLN A 31 -3.185 -0.995 -3.959 1.00 4.68 N ATOM 0 H GLN A 31 -7.002 0.896 -3.192 1.00 3.77 H new ATOM 0 HA GLN A 31 -6.877 0.032 -0.886 1.00 3.78 H new ATOM 0 HB2 GLN A 31 -4.506 -0.602 -1.093 1.00 4.15 H new ATOM 0 HB3 GLN A 31 -5.313 -0.670 -2.647 1.00 4.15 H new ATOM 0 HG2 GLN A 31 -4.295 1.659 -3.110 1.00 4.25 H new ATOM 0 HG3 GLN A 31 -3.302 1.396 -1.691 1.00 4.25 H new ATOM 0 HE21 GLN A 31 -4.144 -1.334 -3.882 1.00 4.68 H new ATOM 0 HE22 GLN A 31 -2.504 -1.514 -4.512 1.00 4.68 H new ATOM 432 N GLY A 32 -6.737 1.602 0.949 1.00 3.23 N ATOM 433 CA GLY A 32 -6.614 2.434 2.151 1.00 3.04 C ATOM 434 C GLY A 32 -5.734 1.759 3.194 1.00 3.09 C ATOM 435 O GLY A 32 -6.242 1.360 4.235 1.00 4.10 O ATOM 0 H GLY A 32 -7.603 1.064 0.912 1.00 3.23 H new ATOM 0 HA2 GLY A 32 -6.191 3.403 1.885 1.00 3.04 H new ATOM 0 HA3 GLY A 32 -7.602 2.622 2.570 1.00 3.04 H new ATOM 439 N ALA A 33 -4.459 1.554 2.855 1.00 2.54 N ATOM 440 CA ALA A 33 -3.536 0.595 3.466 1.00 2.84 C ATOM 441 C ALA A 33 -3.635 0.495 4.995 1.00 2.41 C ATOM 442 O ALA A 33 -3.323 1.443 5.719 1.00 2.27 O ATOM 443 CB ALA A 33 -2.113 0.904 2.975 1.00 3.65 C ATOM 0 H ALA A 33 -4.018 2.084 2.103 1.00 2.54 H new ATOM 0 HA ALA A 33 -3.828 -0.403 3.139 1.00 2.84 H new ATOM 0 HB1 ALA A 33 -1.413 0.198 3.421 1.00 3.65 H new ATOM 0 HB2 ALA A 33 -2.075 0.815 1.889 1.00 3.65 H new ATOM 0 HB3 ALA A 33 -1.840 1.918 3.266 1.00 3.65 H new ATOM 449 N THR A 34 -4.067 -0.690 5.444 1.00 2.36 N ATOM 450 CA THR A 34 -4.262 -1.100 6.829 1.00 2.19 C ATOM 451 C THR A 34 -3.024 -1.845 7.316 1.00 2.14 C ATOM 452 O THR A 34 -2.808 -3.026 7.028 1.00 2.66 O ATOM 453 CB THR A 34 -5.547 -1.916 6.987 1.00 2.23 C ATOM 454 OG1 THR A 34 -5.652 -2.876 5.969 1.00 3.74 O ATOM 455 CG2 THR A 34 -6.781 -1.014 6.913 1.00 2.01 C ATOM 0 H THR A 34 -4.306 -1.440 4.795 1.00 2.36 H new ATOM 0 HA THR A 34 -4.388 -0.218 7.457 1.00 2.19 H new ATOM 0 HB THR A 34 -5.501 -2.403 7.961 1.00 2.23 H new ATOM 0 HG1 THR A 34 -4.803 -3.359 5.886 1.00 3.74 H new ATOM 0 HG21 THR A 34 -7.681 -1.618 7.028 1.00 2.01 H new ATOM 0 HG22 THR A 34 -6.738 -0.272 7.710 1.00 2.01 H new ATOM 0 HG23 THR A 34 -6.805 -0.508 5.948 1.00 2.01 H new ATOM 463 N VAL A 35 -2.195 -1.119 8.057 1.00 1.54 N ATOM 464 CA VAL A 35 -0.905 -1.618 8.560 1.00 1.28 C ATOM 465 C VAL A 35 -1.130 -2.573 9.735 1.00 1.32 C ATOM 466 O VAL A 35 -2.092 -2.439 10.496 1.00 1.40 O ATOM 467 CB VAL A 35 0.058 -0.481 8.979 1.00 1.02 C ATOM 468 CG1 VAL A 35 1.503 -0.972 9.181 1.00 1.03 C ATOM 469 CG2 VAL A 35 0.084 0.666 7.948 1.00 1.21 C ATOM 0 H VAL A 35 -2.394 -0.157 8.332 1.00 1.54 H new ATOM 0 HA VAL A 35 -0.430 -2.150 7.736 1.00 1.28 H new ATOM 0 HB VAL A 35 -0.334 -0.117 9.929 1.00 1.02 H new ATOM 0 HG11 VAL A 35 2.135 -0.133 9.474 1.00 1.03 H new ATOM 0 HG12 VAL A 35 1.523 -1.732 9.962 1.00 1.03 H new ATOM 0 HG13 VAL A 35 1.876 -1.399 8.250 1.00 1.03 H new ATOM 0 HG21 VAL A 35 0.773 1.441 8.283 1.00 1.21 H new ATOM 0 HG22 VAL A 35 0.413 0.281 6.983 1.00 1.21 H new ATOM 0 HG23 VAL A 35 -0.916 1.088 7.848 1.00 1.21 H new ATOM 479 N ALA A 36 -0.223 -3.545 9.877 1.00 1.37 N ATOM 480 CA ALA A 36 -0.095 -4.450 11.014 1.00 1.61 C ATOM 481 C ALA A 36 0.173 -3.689 12.317 1.00 1.33 C ATOM 482 O ALA A 36 1.315 -3.400 12.666 1.00 1.88 O ATOM 483 CB ALA A 36 1.000 -5.480 10.708 1.00 2.09 C ATOM 0 H ALA A 36 0.478 -3.728 9.159 1.00 1.37 H new ATOM 0 HA ALA A 36 -1.038 -4.975 11.166 1.00 1.61 H new ATOM 0 HB1 ALA A 36 1.104 -6.162 11.552 1.00 2.09 H new ATOM 0 HB2 ALA A 36 0.729 -6.045 9.816 1.00 2.09 H new ATOM 0 HB3 ALA A 36 1.946 -4.966 10.538 1.00 2.09 H new ATOM 489 N ALA A 37 -0.918 -3.385 13.022 1.00 0.95 N ATOM 490 CA ALA A 37 -0.949 -2.976 14.427 1.00 0.97 C ATOM 491 C ALA A 37 -0.001 -3.828 15.289 1.00 1.15 C ATOM 492 O ALA A 37 -0.002 -5.052 15.159 1.00 1.32 O ATOM 493 CB ALA A 37 -2.390 -3.130 14.943 1.00 1.27 C ATOM 0 H ALA A 37 -1.850 -3.419 12.608 1.00 0.95 H new ATOM 0 HA ALA A 37 -0.617 -1.940 14.498 1.00 0.97 H new ATOM 0 HB1 ALA A 37 -2.436 -2.830 15.990 1.00 1.27 H new ATOM 0 HB2 ALA A 37 -3.056 -2.499 14.355 1.00 1.27 H new ATOM 0 HB3 ALA A 37 -2.701 -4.171 14.850 1.00 1.27 H new ATOM 499 N VAL A 38 0.760 -3.184 16.175 1.00 1.43 N ATOM 500 CA VAL A 38 1.868 -3.814 16.912 1.00 1.73 C ATOM 501 C VAL A 38 2.254 -2.975 18.163 1.00 2.02 C ATOM 502 O VAL A 38 2.043 -1.755 18.150 1.00 2.10 O ATOM 503 CB VAL A 38 3.055 -4.033 15.915 1.00 1.77 C ATOM 504 CG1 VAL A 38 4.348 -3.271 16.248 1.00 3.33 C ATOM 505 CG2 VAL A 38 3.379 -5.521 15.709 1.00 2.07 C ATOM 0 H VAL A 38 0.627 -2.200 16.407 1.00 1.43 H new ATOM 0 HA VAL A 38 1.570 -4.787 17.303 1.00 1.73 H new ATOM 0 HB VAL A 38 2.676 -3.604 14.987 1.00 1.77 H new ATOM 0 HG11 VAL A 38 5.105 -3.493 15.496 1.00 3.33 H new ATOM 0 HG12 VAL A 38 4.147 -2.200 16.256 1.00 3.33 H new ATOM 0 HG13 VAL A 38 4.710 -3.580 17.229 1.00 3.33 H new ATOM 0 HG21 VAL A 38 4.209 -5.619 15.009 1.00 2.07 H new ATOM 0 HG22 VAL A 38 3.654 -5.969 16.664 1.00 2.07 H new ATOM 0 HG23 VAL A 38 2.504 -6.032 15.308 1.00 2.07 H new ATOM 515 N PRO A 39 2.813 -3.578 19.238 1.00 2.31 N ATOM 516 CA PRO A 39 3.174 -2.875 20.473 1.00 2.65 C ATOM 517 C PRO A 39 4.487 -2.081 20.361 1.00 2.92 C ATOM 518 O PRO A 39 5.351 -2.444 19.561 1.00 2.86 O ATOM 519 CB PRO A 39 3.329 -3.958 21.547 1.00 2.92 C ATOM 520 CG PRO A 39 3.695 -5.208 20.755 1.00 2.90 C ATOM 521 CD PRO A 39 3.005 -5.010 19.406 1.00 2.45 C ATOM 0 HA PRO A 39 2.401 -2.144 20.707 1.00 2.65 H new ATOM 0 HB2 PRO A 39 4.106 -3.699 22.267 1.00 2.92 H new ATOM 0 HB3 PRO A 39 2.406 -4.097 22.110 1.00 2.92 H new ATOM 0 HG2 PRO A 39 4.775 -5.305 20.640 1.00 2.90 H new ATOM 0 HG3 PRO A 39 3.345 -6.112 21.253 1.00 2.90 H new ATOM 0 HD2 PRO A 39 3.613 -5.416 18.598 1.00 2.45 H new ATOM 0 HD3 PRO A 39 2.049 -5.534 19.380 1.00 2.45 H new ATOM 529 N PRO A 40 4.690 -1.046 21.206 1.00 3.29 N ATOM 530 CA PRO A 40 5.949 -0.314 21.290 1.00 3.55 C ATOM 531 C PRO A 40 7.080 -1.219 21.777 1.00 3.83 C ATOM 532 O PRO A 40 6.856 -2.113 22.588 1.00 4.38 O ATOM 533 CB PRO A 40 5.700 0.852 22.250 1.00 3.93 C ATOM 534 CG PRO A 40 4.600 0.315 23.161 1.00 3.97 C ATOM 535 CD PRO A 40 3.767 -0.559 22.224 1.00 3.48 C ATOM 0 HA PRO A 40 6.263 0.052 20.312 1.00 3.55 H new ATOM 0 HB2 PRO A 40 6.598 1.112 22.811 1.00 3.93 H new ATOM 0 HB3 PRO A 40 5.383 1.751 21.721 1.00 3.93 H new ATOM 0 HG2 PRO A 40 5.010 -0.261 23.991 1.00 3.97 H new ATOM 0 HG3 PRO A 40 4.007 1.120 23.594 1.00 3.97 H new ATOM 0 HD2 PRO A 40 3.310 -1.387 22.766 1.00 3.48 H new ATOM 0 HD3 PRO A 40 2.956 0.013 21.774 1.00 3.48 H new ATOM 543 N SER A 41 8.279 -0.966 21.239 1.00 4.11 N ATOM 544 CA SER A 41 9.520 -1.765 21.331 1.00 4.39 C ATOM 545 C SER A 41 9.666 -2.671 20.089 1.00 4.06 C ATOM 546 O SER A 41 10.785 -2.982 19.690 1.00 4.38 O ATOM 547 CB SER A 41 9.636 -2.547 22.663 1.00 4.89 C ATOM 548 OG SER A 41 10.961 -2.930 23.003 1.00 5.34 O ATOM 0 H SER A 41 8.425 -0.126 20.679 1.00 4.11 H new ATOM 0 HA SER A 41 10.362 -1.072 21.339 1.00 4.39 H new ATOM 0 HB2 SER A 41 9.230 -1.934 23.467 1.00 4.89 H new ATOM 0 HB3 SER A 41 9.016 -3.442 22.601 1.00 4.89 H new ATOM 0 HG SER A 41 10.953 -3.416 23.854 1.00 5.34 H new ATOM 554 N ILE A 42 8.561 -3.019 19.408 1.00 3.55 N ATOM 555 CA ILE A 42 8.568 -3.794 18.148 1.00 3.26 C ATOM 556 C ILE A 42 8.504 -2.849 16.924 1.00 2.85 C ATOM 557 O ILE A 42 8.099 -1.691 17.050 1.00 3.08 O ATOM 558 CB ILE A 42 7.455 -4.875 18.200 1.00 3.22 C ATOM 559 CG1 ILE A 42 7.566 -5.787 19.449 1.00 3.80 C ATOM 560 CG2 ILE A 42 7.409 -5.748 16.931 1.00 3.03 C ATOM 561 CD1 ILE A 42 8.924 -6.477 19.649 1.00 4.35 C ATOM 0 H ILE A 42 7.623 -2.768 19.719 1.00 3.55 H new ATOM 0 HA ILE A 42 9.508 -4.334 18.032 1.00 3.26 H new ATOM 0 HB ILE A 42 6.524 -4.312 18.263 1.00 3.22 H new ATOM 0 HG12 ILE A 42 7.349 -5.189 20.334 1.00 3.80 H new ATOM 0 HG13 ILE A 42 6.795 -6.554 19.386 1.00 3.80 H new ATOM 0 HG21 ILE A 42 6.612 -6.485 17.025 1.00 3.03 H new ATOM 0 HG22 ILE A 42 7.219 -5.118 16.062 1.00 3.03 H new ATOM 0 HG23 ILE A 42 8.363 -6.260 16.807 1.00 3.03 H new ATOM 0 HD11 ILE A 42 8.892 -7.089 20.550 1.00 4.35 H new ATOM 0 HD12 ILE A 42 9.141 -7.109 18.788 1.00 4.35 H new ATOM 0 HD13 ILE A 42 9.704 -5.722 19.751 1.00 4.35 H new ATOM 573 N ARG A 43 8.968 -3.308 15.748 1.00 2.45 N ATOM 574 CA ARG A 43 9.361 -2.404 14.648 1.00 2.25 C ATOM 575 C ARG A 43 9.459 -3.019 13.234 1.00 1.81 C ATOM 576 O ARG A 43 10.063 -2.412 12.352 1.00 1.83 O ATOM 577 CB ARG A 43 10.647 -1.657 15.061 1.00 2.85 C ATOM 578 CG ARG A 43 11.875 -2.569 15.219 1.00 2.82 C ATOM 579 CD ARG A 43 12.960 -1.840 16.017 1.00 3.65 C ATOM 580 NE ARG A 43 14.215 -2.609 16.056 1.00 3.96 N ATOM 581 CZ ARG A 43 15.346 -2.167 16.596 1.00 4.65 C ATOM 582 NH1 ARG A 43 15.391 -1.057 17.299 1.00 5.16 N ATOM 583 NH2 ARG A 43 16.468 -2.842 16.475 1.00 5.28 N ATOM 0 H ARG A 43 9.081 -4.299 15.533 1.00 2.45 H new ATOM 0 HA ARG A 43 8.530 -1.711 14.520 1.00 2.25 H new ATOM 0 HB2 ARG A 43 10.867 -0.894 14.315 1.00 2.85 H new ATOM 0 HB3 ARG A 43 10.468 -1.139 16.003 1.00 2.85 H new ATOM 0 HG2 ARG A 43 11.593 -3.490 15.728 1.00 2.82 H new ATOM 0 HG3 ARG A 43 12.259 -2.851 14.239 1.00 2.82 H new ATOM 0 HD2 ARG A 43 13.145 -0.863 15.571 1.00 3.65 H new ATOM 0 HD3 ARG A 43 12.608 -1.665 17.034 1.00 3.65 H new ATOM 0 HE ARG A 43 14.216 -3.541 15.642 1.00 3.96 H new ATOM 0 HH11 ARG A 43 14.542 -0.509 17.442 1.00 5.16 H new ATOM 0 HH12 ARG A 43 16.274 -0.743 17.701 1.00 5.16 H new ATOM 0 HH21 ARG A 43 16.481 -3.722 15.959 1.00 5.28 H new ATOM 0 HH22 ARG A 43 17.326 -2.486 16.897 1.00 5.28 H new ATOM 597 N ASP A 44 8.871 -4.196 12.992 1.00 1.54 N ATOM 598 CA ASP A 44 8.649 -4.762 11.645 1.00 1.42 C ATOM 599 C ASP A 44 7.141 -4.979 11.422 1.00 1.15 C ATOM 600 O ASP A 44 6.519 -5.732 12.183 1.00 1.09 O ATOM 601 CB ASP A 44 9.365 -6.122 11.505 1.00 1.71 C ATOM 602 CG ASP A 44 10.842 -6.029 11.112 1.00 1.77 C ATOM 603 OD1 ASP A 44 11.129 -5.244 10.173 1.00 2.44 O ATOM 604 OD2 ASP A 44 11.636 -6.810 11.692 1.00 2.33 O ATOM 0 H ASP A 44 8.527 -4.799 13.739 1.00 1.54 H new ATOM 0 HA ASP A 44 9.047 -4.065 10.908 1.00 1.42 H new ATOM 0 HB2 ASP A 44 9.288 -6.657 12.451 1.00 1.71 H new ATOM 0 HB3 ASP A 44 8.841 -6.718 10.758 1.00 1.71 H new ATOM 609 N THR A 45 6.563 -4.344 10.392 1.00 1.09 N ATOM 610 CA THR A 45 5.110 -4.346 10.124 1.00 1.00 C ATOM 611 C THR A 45 4.810 -4.523 8.639 1.00 0.87 C ATOM 612 O THR A 45 5.548 -4.040 7.782 1.00 1.01 O ATOM 613 CB THR A 45 4.438 -3.071 10.644 1.00 1.05 C ATOM 614 OG1 THR A 45 5.063 -1.974 10.041 1.00 2.60 O ATOM 615 CG2 THR A 45 4.521 -2.916 12.160 1.00 1.81 C ATOM 0 H THR A 45 7.096 -3.805 9.709 1.00 1.09 H new ATOM 0 HA THR A 45 4.696 -5.199 10.662 1.00 1.00 H new ATOM 0 HB THR A 45 3.379 -3.131 10.393 1.00 1.05 H new ATOM 0 HG1 THR A 45 4.474 -1.193 10.093 1.00 2.60 H new ATOM 0 HG21 THR A 45 4.025 -1.992 12.459 1.00 1.81 H new ATOM 0 HG22 THR A 45 4.030 -3.763 12.640 1.00 1.81 H new ATOM 0 HG23 THR A 45 5.567 -2.882 12.466 1.00 1.81 H new ATOM 623 N ALA A 46 3.684 -5.164 8.319 1.00 1.05 N ATOM 624 CA ALA A 46 3.197 -5.427 6.957 1.00 1.24 C ATOM 625 C ALA A 46 1.869 -4.697 6.707 1.00 1.27 C ATOM 626 O ALA A 46 1.036 -4.625 7.612 1.00 1.42 O ATOM 627 CB ALA A 46 3.008 -6.945 6.807 1.00 1.62 C ATOM 0 H ALA A 46 3.056 -5.532 9.033 1.00 1.05 H new ATOM 0 HA ALA A 46 3.918 -5.061 6.226 1.00 1.24 H new ATOM 0 HB1 ALA A 46 2.646 -7.169 5.803 1.00 1.62 H new ATOM 0 HB2 ALA A 46 3.961 -7.448 6.970 1.00 1.62 H new ATOM 0 HB3 ALA A 46 2.282 -7.296 7.541 1.00 1.62 H new ATOM 633 N ALA A 47 1.647 -4.162 5.502 1.00 1.27 N ATOM 634 CA ALA A 47 0.466 -3.352 5.191 1.00 1.30 C ATOM 635 C ALA A 47 -0.342 -3.914 4.010 1.00 1.38 C ATOM 636 O ALA A 47 0.174 -4.086 2.902 1.00 1.16 O ATOM 637 CB ALA A 47 0.928 -1.913 4.959 1.00 1.27 C ATOM 0 H ALA A 47 2.283 -4.279 4.713 1.00 1.27 H new ATOM 0 HA ALA A 47 -0.226 -3.379 6.032 1.00 1.30 H new ATOM 0 HB1 ALA A 47 0.067 -1.288 4.725 1.00 1.27 H new ATOM 0 HB2 ALA A 47 1.415 -1.538 5.859 1.00 1.27 H new ATOM 0 HB3 ALA A 47 1.632 -1.887 4.127 1.00 1.27 H new ATOM 643 N TYR A 48 -1.622 -4.204 4.267 1.00 1.92 N ATOM 644 CA TYR A 48 -2.555 -4.774 3.285 1.00 1.99 C ATOM 645 C TYR A 48 -3.656 -3.771 2.883 1.00 2.05 C ATOM 646 O TYR A 48 -3.850 -2.759 3.551 1.00 2.07 O ATOM 647 CB TYR A 48 -3.240 -6.032 3.858 1.00 2.45 C ATOM 648 CG TYR A 48 -2.436 -7.291 4.154 1.00 3.01 C ATOM 649 CD1 TYR A 48 -1.036 -7.385 4.001 1.00 3.93 C ATOM 650 CD2 TYR A 48 -3.151 -8.413 4.620 1.00 3.80 C ATOM 651 CE1 TYR A 48 -0.355 -8.557 4.390 1.00 4.88 C ATOM 652 CE2 TYR A 48 -2.479 -9.589 4.997 1.00 4.56 C ATOM 653 CZ TYR A 48 -1.072 -9.651 4.919 1.00 4.88 C ATOM 654 OH TYR A 48 -0.409 -10.746 5.380 1.00 5.88 O ATOM 0 H TYR A 48 -2.048 -4.047 5.180 1.00 1.92 H new ATOM 0 HA TYR A 48 -1.964 -5.026 2.404 1.00 1.99 H new ATOM 0 HB2 TYR A 48 -3.726 -5.737 4.788 1.00 2.45 H new ATOM 0 HB3 TYR A 48 -4.029 -6.313 3.161 1.00 2.45 H new ATOM 0 HD1 TYR A 48 -0.484 -6.556 3.584 1.00 3.93 H new ATOM 0 HD2 TYR A 48 -4.228 -8.369 4.688 1.00 3.80 H new ATOM 0 HE1 TYR A 48 0.718 -8.617 4.283 1.00 4.88 H new ATOM 0 HE2 TYR A 48 -3.039 -10.444 5.346 1.00 4.56 H new ATOM 0 HH TYR A 48 -1.055 -11.405 5.710 1.00 5.88 H new ATOM 664 N MET A 49 -4.414 -4.104 1.831 1.00 2.27 N ATOM 665 CA MET A 49 -5.770 -3.626 1.498 1.00 2.98 C ATOM 666 C MET A 49 -6.239 -4.127 0.128 1.00 2.79 C ATOM 667 O MET A 49 -5.444 -4.624 -0.670 1.00 2.33 O ATOM 668 CB MET A 49 -5.941 -2.087 1.594 1.00 3.36 C ATOM 669 CG MET A 49 -6.872 -1.735 2.760 1.00 4.98 C ATOM 670 SD MET A 49 -8.562 -2.357 2.559 1.00 7.60 S ATOM 671 CE MET A 49 -9.208 -1.969 4.201 1.00 8.91 C ATOM 0 H MET A 49 -4.073 -4.766 1.134 1.00 2.27 H new ATOM 0 HA MET A 49 -6.408 -4.059 2.268 1.00 2.98 H new ATOM 0 HB2 MET A 49 -4.970 -1.613 1.737 1.00 3.36 H new ATOM 0 HB3 MET A 49 -6.350 -1.699 0.661 1.00 3.36 H new ATOM 0 HG2 MET A 49 -6.453 -2.139 3.682 1.00 4.98 H new ATOM 0 HG3 MET A 49 -6.905 -0.651 2.873 1.00 4.98 H new ATOM 0 HE1 MET A 49 -10.250 -2.284 4.266 1.00 8.91 H new ATOM 0 HE2 MET A 49 -8.623 -2.494 4.956 1.00 8.91 H new ATOM 0 HE3 MET A 49 -9.142 -0.895 4.373 1.00 8.91 H new ATOM 681 N THR A 50 -7.522 -3.902 -0.172 1.00 3.21 N ATOM 682 CA THR A 50 -8.027 -3.669 -1.530 1.00 2.56 C ATOM 683 C THR A 50 -9.315 -2.881 -1.449 1.00 3.36 C ATOM 684 O THR A 50 -10.265 -3.275 -0.785 1.00 4.70 O ATOM 685 CB THR A 50 -8.165 -4.936 -2.366 1.00 3.14 C ATOM 686 OG1 THR A 50 -8.697 -4.588 -3.620 1.00 3.49 O ATOM 687 CG2 THR A 50 -9.015 -6.057 -1.768 1.00 3.65 C ATOM 0 H THR A 50 -8.255 -3.876 0.537 1.00 3.21 H new ATOM 0 HA THR A 50 -7.281 -3.084 -2.067 1.00 2.56 H new ATOM 0 HB THR A 50 -7.158 -5.348 -2.423 1.00 3.14 H new ATOM 0 HG1 THR A 50 -8.727 -5.382 -4.194 1.00 3.49 H new ATOM 0 HG21 THR A 50 -9.037 -6.903 -2.455 1.00 3.65 H new ATOM 0 HG22 THR A 50 -8.585 -6.373 -0.818 1.00 3.65 H new ATOM 0 HG23 THR A 50 -10.030 -5.696 -1.604 1.00 3.65 H new ATOM 695 N LEU A 51 -9.284 -1.719 -2.088 1.00 2.91 N ATOM 696 CA LEU A 51 -10.317 -0.688 -2.133 1.00 3.56 C ATOM 697 C LEU A 51 -10.151 0.018 -3.476 1.00 2.33 C ATOM 698 O LEU A 51 -9.017 0.148 -3.950 1.00 2.95 O ATOM 699 CB LEU A 51 -10.114 0.295 -0.966 1.00 5.51 C ATOM 700 CG LEU A 51 -10.729 -0.155 0.379 1.00 7.71 C ATOM 701 CD1 LEU A 51 -10.201 0.717 1.526 1.00 8.82 C ATOM 702 CD2 LEU A 51 -12.265 -0.093 0.343 1.00 8.57 C ATOM 0 H LEU A 51 -8.467 -1.449 -2.635 1.00 2.91 H new ATOM 0 HA LEU A 51 -11.319 -1.106 -2.037 1.00 3.56 H new ATOM 0 HB2 LEU A 51 -9.045 0.453 -0.825 1.00 5.51 H new ATOM 0 HB3 LEU A 51 -10.545 1.258 -1.242 1.00 5.51 H new ATOM 0 HG LEU A 51 -10.433 -1.191 0.547 1.00 7.71 H new ATOM 0 HD11 LEU A 51 -10.643 0.388 2.466 1.00 8.82 H new ATOM 0 HD12 LEU A 51 -9.116 0.625 1.583 1.00 8.82 H new ATOM 0 HD13 LEU A 51 -10.468 1.758 1.344 1.00 8.82 H new ATOM 0 HD21 LEU A 51 -12.665 -0.416 1.304 1.00 8.57 H new ATOM 0 HD22 LEU A 51 -12.583 0.930 0.143 1.00 8.57 H new ATOM 0 HD23 LEU A 51 -12.637 -0.749 -0.444 1.00 8.57 H new ATOM 714 N THR A 52 -11.262 0.427 -4.099 1.00 1.80 N ATOM 715 CA THR A 52 -11.330 0.680 -5.543 1.00 1.90 C ATOM 716 C THR A 52 -12.657 1.314 -5.940 1.00 1.68 C ATOM 717 O THR A 52 -13.639 1.222 -5.201 1.00 2.53 O ATOM 718 CB THR A 52 -11.047 -0.635 -6.280 1.00 3.54 C ATOM 719 OG1 THR A 52 -10.876 -0.394 -7.650 1.00 4.70 O ATOM 720 CG2 THR A 52 -12.155 -1.683 -6.103 1.00 4.54 C ATOM 0 H THR A 52 -12.144 0.593 -3.613 1.00 1.80 H new ATOM 0 HA THR A 52 -10.571 1.407 -5.831 1.00 1.90 H new ATOM 0 HB THR A 52 -10.136 -1.038 -5.837 1.00 3.54 H new ATOM 0 HG1 THR A 52 -11.269 -1.131 -8.163 1.00 4.70 H new ATOM 0 HG21 THR A 52 -11.891 -2.588 -6.650 1.00 4.54 H new ATOM 0 HG22 THR A 52 -12.267 -1.919 -5.045 1.00 4.54 H new ATOM 0 HG23 THR A 52 -13.095 -1.288 -6.488 1.00 4.54 H new ATOM 728 N ASN A 53 -12.697 1.913 -7.131 1.00 1.72 N ATOM 729 CA ASN A 53 -13.897 2.510 -7.706 1.00 1.81 C ATOM 730 C ASN A 53 -14.835 1.453 -8.307 1.00 1.92 C ATOM 731 O ASN A 53 -14.452 0.555 -9.055 1.00 2.24 O ATOM 732 CB ASN A 53 -13.606 3.589 -8.773 1.00 2.38 C ATOM 733 CG ASN A 53 -12.163 4.055 -8.890 1.00 3.08 C ATOM 734 OD1 ASN A 53 -11.749 5.036 -8.298 1.00 4.40 O ATOM 735 ND2 ASN A 53 -11.360 3.373 -9.673 1.00 2.97 N ATOM 0 H ASN A 53 -11.878 1.997 -7.733 1.00 1.72 H new ATOM 0 HA ASN A 53 -14.387 2.999 -6.864 1.00 1.81 H new ATOM 0 HB2 ASN A 53 -13.920 3.203 -9.743 1.00 2.38 H new ATOM 0 HB3 ASN A 53 -14.229 4.458 -8.559 1.00 2.38 H new ATOM 0 HD21 ASN A 53 -10.389 3.664 -9.786 1.00 2.97 H new ATOM 0 HD22 ASN A 53 -11.707 2.552 -10.168 1.00 2.97 H new ATOM 742 N LYS A 54 -16.125 1.654 -8.053 1.00 2.37 N ATOM 743 CA LYS A 54 -17.235 0.860 -8.592 1.00 2.87 C ATOM 744 C LYS A 54 -18.168 1.772 -9.426 1.00 2.80 C ATOM 745 O LYS A 54 -19.376 1.810 -9.220 1.00 3.47 O ATOM 746 CB LYS A 54 -17.875 0.120 -7.396 1.00 3.87 C ATOM 747 CG LYS A 54 -18.664 -1.142 -7.783 1.00 4.56 C ATOM 748 CD LYS A 54 -19.050 -2.000 -6.560 1.00 5.61 C ATOM 749 CE LYS A 54 -17.851 -2.750 -5.943 1.00 6.62 C ATOM 750 NZ LYS A 54 -18.241 -3.576 -4.768 1.00 7.44 N ATOM 0 H LYS A 54 -16.443 2.405 -7.441 1.00 2.37 H new ATOM 0 HA LYS A 54 -16.928 0.092 -9.303 1.00 2.87 H new ATOM 0 HB2 LYS A 54 -17.090 -0.158 -6.693 1.00 3.87 H new ATOM 0 HB3 LYS A 54 -18.542 0.806 -6.874 1.00 3.87 H new ATOM 0 HG2 LYS A 54 -19.568 -0.851 -8.318 1.00 4.56 H new ATOM 0 HG3 LYS A 54 -18.067 -1.743 -8.470 1.00 4.56 H new ATOM 0 HD2 LYS A 54 -19.499 -1.359 -5.801 1.00 5.61 H new ATOM 0 HD3 LYS A 54 -19.810 -2.723 -6.856 1.00 5.61 H new ATOM 0 HE2 LYS A 54 -17.399 -3.391 -6.700 1.00 6.62 H new ATOM 0 HE3 LYS A 54 -17.092 -2.029 -5.641 1.00 6.62 H new ATOM 0 HZ1 LYS A 54 -17.402 -4.059 -4.390 1.00 7.44 H new ATOM 0 HZ2 LYS A 54 -18.649 -2.963 -4.033 1.00 7.44 H new ATOM 0 HZ3 LYS A 54 -18.946 -4.283 -5.059 1.00 7.44 H new ATOM 764 N SER A 55 -17.563 2.561 -10.325 1.00 2.21 N ATOM 765 CA SER A 55 -18.116 3.653 -11.168 1.00 2.30 C ATOM 766 C SER A 55 -16.990 4.262 -12.033 1.00 2.16 C ATOM 767 O SER A 55 -15.817 4.054 -11.717 1.00 2.66 O ATOM 768 CB SER A 55 -18.781 4.764 -10.330 1.00 3.08 C ATOM 769 OG SER A 55 -20.179 4.598 -10.293 1.00 3.47 O ATOM 0 H SER A 55 -16.566 2.444 -10.506 1.00 2.21 H new ATOM 0 HA SER A 55 -18.887 3.216 -11.802 1.00 2.30 H new ATOM 0 HB2 SER A 55 -18.382 4.748 -9.316 1.00 3.08 H new ATOM 0 HB3 SER A 55 -18.538 5.739 -10.753 1.00 3.08 H new ATOM 0 HG SER A 55 -20.394 3.708 -9.944 1.00 3.47 H new ATOM 775 N ASP A 56 -17.328 5.015 -13.088 1.00 2.23 N ATOM 776 CA ASP A 56 -16.446 5.426 -14.194 1.00 2.39 C ATOM 777 C ASP A 56 -15.503 6.595 -13.833 1.00 2.75 C ATOM 778 O ASP A 56 -15.677 7.738 -14.262 1.00 3.58 O ATOM 779 CB ASP A 56 -17.284 5.741 -15.450 1.00 2.72 C ATOM 780 CG ASP A 56 -17.947 4.521 -16.099 1.00 3.09 C ATOM 781 OD1 ASP A 56 -17.224 3.539 -16.428 1.00 3.52 O ATOM 782 OD2 ASP A 56 -19.175 4.554 -16.313 1.00 4.01 O ATOM 0 H ASP A 56 -18.276 5.375 -13.201 1.00 2.23 H new ATOM 0 HA ASP A 56 -15.789 4.582 -14.404 1.00 2.39 H new ATOM 0 HB2 ASP A 56 -18.059 6.459 -15.183 1.00 2.72 H new ATOM 0 HB3 ASP A 56 -16.642 6.224 -16.187 1.00 2.72 H new ATOM 787 N GLN A 57 -14.460 6.280 -13.062 1.00 2.21 N ATOM 788 CA GLN A 57 -13.409 7.220 -12.632 1.00 2.43 C ATOM 789 C GLN A 57 -12.019 6.532 -12.515 1.00 2.23 C ATOM 790 O GLN A 57 -11.866 5.646 -11.677 1.00 2.11 O ATOM 791 CB GLN A 57 -13.863 7.881 -11.311 1.00 2.73 C ATOM 792 CG GLN A 57 -13.963 6.919 -10.110 1.00 3.33 C ATOM 793 CD GLN A 57 -15.134 7.225 -9.189 1.00 4.50 C ATOM 794 OE1 GLN A 57 -15.180 8.248 -8.523 1.00 5.38 O ATOM 795 NE2 GLN A 57 -16.130 6.366 -9.139 1.00 5.19 N ATOM 0 H GLN A 57 -14.314 5.335 -12.706 1.00 2.21 H new ATOM 0 HA GLN A 57 -13.275 7.993 -13.389 1.00 2.43 H new ATOM 0 HB2 GLN A 57 -13.165 8.680 -11.062 1.00 2.73 H new ATOM 0 HB3 GLN A 57 -14.836 8.346 -11.469 1.00 2.73 H new ATOM 0 HG2 GLN A 57 -14.057 5.898 -10.479 1.00 3.33 H new ATOM 0 HG3 GLN A 57 -13.037 6.967 -9.537 1.00 3.33 H new ATOM 0 HE21 GLN A 57 -16.094 5.511 -9.694 1.00 5.19 H new ATOM 0 HE22 GLN A 57 -16.937 6.555 -8.545 1.00 5.19 H new ATOM 804 N PRO A 58 -11.004 6.876 -13.339 1.00 2.38 N ATOM 805 CA PRO A 58 -9.651 6.303 -13.258 1.00 2.30 C ATOM 806 C PRO A 58 -8.642 7.208 -12.511 1.00 2.33 C ATOM 807 O PRO A 58 -8.944 8.362 -12.207 1.00 3.20 O ATOM 808 CB PRO A 58 -9.249 6.118 -14.723 1.00 2.53 C ATOM 809 CG PRO A 58 -9.862 7.349 -15.386 1.00 2.82 C ATOM 810 CD PRO A 58 -11.159 7.580 -14.606 1.00 2.71 C ATOM 0 HA PRO A 58 -9.646 5.377 -12.683 1.00 2.30 H new ATOM 0 HB2 PRO A 58 -8.167 6.086 -14.847 1.00 2.53 H new ATOM 0 HB3 PRO A 58 -9.645 5.192 -15.140 1.00 2.53 H new ATOM 0 HG2 PRO A 58 -9.198 8.211 -15.320 1.00 2.82 H new ATOM 0 HG3 PRO A 58 -10.058 7.177 -16.444 1.00 2.82 H new ATOM 0 HD2 PRO A 58 -11.330 8.644 -14.442 1.00 2.71 H new ATOM 0 HD3 PRO A 58 -12.018 7.201 -15.159 1.00 2.71 H new ATOM 818 N ILE A 59 -7.420 6.700 -12.266 1.00 1.72 N ATOM 819 CA ILE A 59 -6.253 7.464 -11.762 1.00 1.76 C ATOM 820 C ILE A 59 -4.928 6.772 -12.135 1.00 1.71 C ATOM 821 O ILE A 59 -4.946 5.638 -12.603 1.00 2.14 O ATOM 822 CB ILE A 59 -6.400 7.778 -10.245 1.00 2.19 C ATOM 823 CG1 ILE A 59 -6.006 9.232 -9.899 1.00 3.55 C ATOM 824 CG2 ILE A 59 -5.575 6.852 -9.332 1.00 2.40 C ATOM 825 CD1 ILE A 59 -6.934 10.305 -10.489 1.00 3.84 C ATOM 0 H ILE A 59 -7.206 5.714 -12.417 1.00 1.72 H new ATOM 0 HA ILE A 59 -6.226 8.433 -12.261 1.00 1.76 H new ATOM 0 HB ILE A 59 -7.461 7.613 -10.055 1.00 2.19 H new ATOM 0 HG12 ILE A 59 -5.989 9.342 -8.815 1.00 3.55 H new ATOM 0 HG13 ILE A 59 -4.991 9.413 -10.253 1.00 3.55 H new ATOM 0 HG21 ILE A 59 -5.731 7.135 -8.291 1.00 2.40 H new ATOM 0 HG22 ILE A 59 -5.892 5.820 -9.479 1.00 2.40 H new ATOM 0 HG23 ILE A 59 -4.517 6.946 -9.579 1.00 2.40 H new ATOM 0 HD11 ILE A 59 -6.581 11.293 -10.195 1.00 3.84 H new ATOM 0 HD12 ILE A 59 -6.934 10.229 -11.576 1.00 3.84 H new ATOM 0 HD13 ILE A 59 -7.947 10.155 -10.115 1.00 3.84 H new ATOM 837 N LYS A 60 -3.761 7.417 -11.954 1.00 1.66 N ATOM 838 CA LYS A 60 -2.489 6.974 -12.565 1.00 1.91 C ATOM 839 C LYS A 60 -1.211 7.304 -11.753 1.00 1.77 C ATOM 840 O LYS A 60 -0.311 8.022 -12.196 1.00 2.32 O ATOM 841 CB LYS A 60 -2.444 7.422 -14.047 1.00 2.60 C ATOM 842 CG LYS A 60 -2.769 8.908 -14.304 1.00 3.37 C ATOM 843 CD LYS A 60 -2.882 9.201 -15.808 1.00 4.14 C ATOM 844 CE LYS A 60 -3.607 10.535 -16.037 1.00 4.94 C ATOM 845 NZ LYS A 60 -3.901 10.757 -17.473 1.00 5.53 N ATOM 0 H LYS A 60 -3.671 8.257 -11.383 1.00 1.66 H new ATOM 0 HA LYS A 60 -2.480 5.884 -12.538 1.00 1.91 H new ATOM 0 HB2 LYS A 60 -1.450 7.213 -14.441 1.00 2.60 H new ATOM 0 HB3 LYS A 60 -3.147 6.812 -14.614 1.00 2.60 H new ATOM 0 HG2 LYS A 60 -3.704 9.169 -13.809 1.00 3.37 H new ATOM 0 HG3 LYS A 60 -1.991 9.534 -13.867 1.00 3.37 H new ATOM 0 HD2 LYS A 60 -1.888 9.238 -16.254 1.00 4.14 H new ATOM 0 HD3 LYS A 60 -3.424 8.395 -16.303 1.00 4.14 H new ATOM 0 HE2 LYS A 60 -4.537 10.547 -15.469 1.00 4.94 H new ATOM 0 HE3 LYS A 60 -2.993 11.353 -15.660 1.00 4.94 H new ATOM 0 HZ1 LYS A 60 -4.391 11.667 -17.590 1.00 5.53 H new ATOM 0 HZ2 LYS A 60 -3.011 10.771 -18.011 1.00 5.53 H new ATOM 0 HZ3 LYS A 60 -4.508 9.989 -17.826 1.00 5.53 H new ATOM 859 N LEU A 61 -1.103 6.737 -10.539 1.00 1.57 N ATOM 860 CA LEU A 61 0.135 6.735 -9.724 1.00 1.53 C ATOM 861 C LEU A 61 0.755 5.318 -9.640 1.00 1.23 C ATOM 862 O LEU A 61 0.115 4.361 -10.056 1.00 1.63 O ATOM 863 CB LEU A 61 -0.133 7.360 -8.330 1.00 2.13 C ATOM 864 CG LEU A 61 -0.598 8.840 -8.291 1.00 2.61 C ATOM 865 CD1 LEU A 61 -2.117 9.025 -8.451 1.00 2.81 C ATOM 866 CD2 LEU A 61 -0.164 9.476 -6.961 1.00 3.52 C ATOM 0 H LEU A 61 -1.882 6.259 -10.085 1.00 1.57 H new ATOM 0 HA LEU A 61 0.879 7.360 -10.218 1.00 1.53 H new ATOM 0 HB2 LEU A 61 -0.889 6.756 -7.829 1.00 2.13 H new ATOM 0 HB3 LEU A 61 0.781 7.278 -7.742 1.00 2.13 H new ATOM 0 HG LEU A 61 -0.128 9.327 -9.145 1.00 2.61 H new ATOM 0 HD11 LEU A 61 -2.360 10.087 -8.413 1.00 2.81 H new ATOM 0 HD12 LEU A 61 -2.435 8.614 -9.409 1.00 2.81 H new ATOM 0 HD13 LEU A 61 -2.634 8.505 -7.644 1.00 2.81 H new ATOM 0 HD21 LEU A 61 -0.490 10.516 -6.932 1.00 3.52 H new ATOM 0 HD22 LEU A 61 -0.616 8.931 -6.132 1.00 3.52 H new ATOM 0 HD23 LEU A 61 0.922 9.433 -6.874 1.00 3.52 H new ATOM 878 N VAL A 62 1.988 5.163 -9.133 1.00 1.10 N ATOM 879 CA VAL A 62 2.751 3.885 -9.158 1.00 1.12 C ATOM 880 C VAL A 62 2.524 2.982 -7.933 1.00 1.20 C ATOM 881 O VAL A 62 3.098 1.900 -7.856 1.00 1.78 O ATOM 882 CB VAL A 62 4.275 4.097 -9.363 1.00 1.55 C ATOM 883 CG1 VAL A 62 4.558 5.063 -10.526 1.00 2.27 C ATOM 884 CG2 VAL A 62 5.004 4.568 -8.092 1.00 2.28 C ATOM 0 H VAL A 62 2.498 5.925 -8.687 1.00 1.10 H new ATOM 0 HA VAL A 62 2.342 3.366 -10.024 1.00 1.12 H new ATOM 0 HB VAL A 62 4.675 3.114 -9.612 1.00 1.55 H new ATOM 0 HG11 VAL A 62 5.635 5.188 -10.641 1.00 2.27 H new ATOM 0 HG12 VAL A 62 4.139 4.656 -11.447 1.00 2.27 H new ATOM 0 HG13 VAL A 62 4.101 6.030 -10.315 1.00 2.27 H new ATOM 0 HG21 VAL A 62 6.065 4.696 -8.307 1.00 2.28 H new ATOM 0 HG22 VAL A 62 4.583 5.518 -7.762 1.00 2.28 H new ATOM 0 HG23 VAL A 62 4.881 3.824 -7.305 1.00 2.28 H new ATOM 894 N GLY A 63 1.710 3.431 -6.973 1.00 1.17 N ATOM 895 CA GLY A 63 1.450 2.764 -5.695 1.00 1.34 C ATOM 896 C GLY A 63 2.141 3.457 -4.517 1.00 1.07 C ATOM 897 O GLY A 63 2.709 4.546 -4.655 1.00 1.38 O ATOM 0 H GLY A 63 1.193 4.305 -7.070 1.00 1.17 H new ATOM 0 HA2 GLY A 63 0.375 2.737 -5.516 1.00 1.34 H new ATOM 0 HA3 GLY A 63 1.790 1.730 -5.753 1.00 1.34 H new ATOM 901 N ALA A 64 2.028 2.857 -3.332 1.00 1.06 N ATOM 902 CA ALA A 64 2.472 3.427 -2.060 1.00 1.00 C ATOM 903 C ALA A 64 3.906 3.030 -1.662 1.00 1.08 C ATOM 904 O ALA A 64 4.346 1.901 -1.880 1.00 1.33 O ATOM 905 CB ALA A 64 1.461 3.013 -0.981 1.00 1.29 C ATOM 0 H ALA A 64 1.612 1.932 -3.228 1.00 1.06 H new ATOM 0 HA ALA A 64 2.509 4.511 -2.168 1.00 1.00 H new ATOM 0 HB1 ALA A 64 1.767 3.424 -0.019 1.00 1.29 H new ATOM 0 HB2 ALA A 64 0.474 3.395 -1.242 1.00 1.29 H new ATOM 0 HB3 ALA A 64 1.424 1.926 -0.915 1.00 1.29 H new ATOM 911 N ALA A 65 4.588 3.960 -0.992 1.00 1.00 N ATOM 912 CA ALA A 65 5.842 3.779 -0.265 1.00 1.00 C ATOM 913 C ALA A 65 5.855 4.702 0.978 1.00 0.99 C ATOM 914 O ALA A 65 4.807 5.191 1.410 1.00 1.02 O ATOM 915 CB ALA A 65 7.005 4.058 -1.233 1.00 1.20 C ATOM 0 H ALA A 65 4.256 4.923 -0.940 1.00 1.00 H new ATOM 0 HA ALA A 65 5.949 2.758 0.102 1.00 1.00 H new ATOM 0 HB1 ALA A 65 7.953 3.928 -0.710 1.00 1.20 H new ATOM 0 HB2 ALA A 65 6.955 3.363 -2.071 1.00 1.20 H new ATOM 0 HB3 ALA A 65 6.932 5.080 -1.604 1.00 1.20 H new ATOM 921 N THR A 66 7.041 4.965 1.546 1.00 1.14 N ATOM 922 CA THR A 66 7.295 5.804 2.735 1.00 1.35 C ATOM 923 C THR A 66 8.798 5.806 3.043 1.00 1.49 C ATOM 924 O THR A 66 9.411 4.755 2.861 1.00 1.50 O ATOM 925 CB THR A 66 6.481 5.337 3.955 1.00 1.37 C ATOM 926 OG1 THR A 66 6.750 6.204 5.028 1.00 1.80 O ATOM 927 CG2 THR A 66 6.790 3.910 4.409 1.00 1.32 C ATOM 0 H THR A 66 7.904 4.575 1.167 1.00 1.14 H new ATOM 0 HA THR A 66 6.969 6.821 2.515 1.00 1.35 H new ATOM 0 HB THR A 66 5.434 5.352 3.651 1.00 1.37 H new ATOM 0 HG1 THR A 66 6.237 5.921 5.814 1.00 1.80 H new ATOM 0 HG21 THR A 66 6.174 3.661 5.273 1.00 1.32 H new ATOM 0 HG22 THR A 66 6.574 3.215 3.597 1.00 1.32 H new ATOM 0 HG23 THR A 66 7.843 3.835 4.681 1.00 1.32 H new ATOM 935 N PRO A 67 9.397 6.918 3.516 1.00 1.67 N ATOM 936 CA PRO A 67 10.794 6.955 3.947 1.00 1.84 C ATOM 937 C PRO A 67 11.016 6.491 5.399 1.00 1.85 C ATOM 938 O PRO A 67 12.166 6.407 5.820 1.00 2.07 O ATOM 939 CB PRO A 67 11.211 8.420 3.766 1.00 2.06 C ATOM 940 CG PRO A 67 9.923 9.185 4.065 1.00 2.06 C ATOM 941 CD PRO A 67 8.843 8.268 3.486 1.00 1.85 C ATOM 0 HA PRO A 67 11.392 6.258 3.360 1.00 1.84 H new ATOM 0 HB2 PRO A 67 12.013 8.698 4.449 1.00 2.06 H new ATOM 0 HB3 PRO A 67 11.571 8.615 2.756 1.00 2.06 H new ATOM 0 HG2 PRO A 67 9.787 9.346 5.134 1.00 2.06 H new ATOM 0 HG3 PRO A 67 9.916 10.167 3.592 1.00 2.06 H new ATOM 0 HD2 PRO A 67 7.927 8.326 4.074 1.00 1.85 H new ATOM 0 HD3 PRO A 67 8.588 8.562 2.468 1.00 1.85 H new ATOM 949 N LEU A 68 9.968 6.226 6.196 1.00 1.71 N ATOM 950 CA LEU A 68 10.132 5.966 7.638 1.00 1.83 C ATOM 951 C LEU A 68 10.614 4.540 7.950 1.00 1.54 C ATOM 952 O LEU A 68 11.365 4.334 8.905 1.00 1.93 O ATOM 953 CB LEU A 68 8.831 6.300 8.401 1.00 2.04 C ATOM 954 CG LEU A 68 8.418 7.791 8.498 1.00 2.52 C ATOM 955 CD1 LEU A 68 9.604 8.761 8.627 1.00 3.97 C ATOM 956 CD2 LEU A 68 7.526 8.241 7.335 1.00 3.17 C ATOM 0 H LEU A 68 9.002 6.186 5.870 1.00 1.71 H new ATOM 0 HA LEU A 68 10.924 6.629 7.986 1.00 1.83 H new ATOM 0 HB2 LEU A 68 8.014 5.755 7.927 1.00 2.04 H new ATOM 0 HB3 LEU A 68 8.927 5.911 9.415 1.00 2.04 H new ATOM 0 HG LEU A 68 7.845 7.838 9.424 1.00 2.52 H new ATOM 0 HD11 LEU A 68 9.232 9.784 8.690 1.00 3.97 H new ATOM 0 HD12 LEU A 68 10.171 8.525 9.528 1.00 3.97 H new ATOM 0 HD13 LEU A 68 10.251 8.663 7.755 1.00 3.97 H new ATOM 0 HD21 LEU A 68 7.270 9.293 7.459 1.00 3.17 H new ATOM 0 HD22 LEU A 68 8.059 8.105 6.394 1.00 3.17 H new ATOM 0 HD23 LEU A 68 6.614 7.645 7.324 1.00 3.17 H new ATOM 968 N ALA A 69 10.228 3.556 7.140 1.00 1.08 N ATOM 969 CA ALA A 69 10.853 2.238 7.150 1.00 1.01 C ATOM 970 C ALA A 69 12.189 2.299 6.410 1.00 1.08 C ATOM 971 O ALA A 69 12.283 2.906 5.345 1.00 1.36 O ATOM 972 CB ALA A 69 9.873 1.223 6.557 1.00 1.09 C ATOM 0 H ALA A 69 9.474 3.651 6.460 1.00 1.08 H new ATOM 0 HA ALA A 69 11.078 1.914 8.166 1.00 1.01 H new ATOM 0 HB1 ALA A 69 10.329 0.233 6.559 1.00 1.09 H new ATOM 0 HB2 ALA A 69 8.962 1.204 7.155 1.00 1.09 H new ATOM 0 HB3 ALA A 69 9.629 1.508 5.534 1.00 1.09 H new ATOM 978 N THR A 70 13.201 1.681 7.021 1.00 0.99 N ATOM 979 CA THR A 70 14.566 1.607 6.495 1.00 1.04 C ATOM 980 C THR A 70 14.608 0.868 5.170 1.00 0.98 C ATOM 981 O THR A 70 15.280 1.329 4.251 1.00 1.13 O ATOM 982 CB THR A 70 15.516 0.992 7.523 1.00 1.15 C ATOM 983 OG1 THR A 70 15.010 -0.202 8.065 1.00 2.53 O ATOM 984 CG2 THR A 70 15.810 1.948 8.679 1.00 2.27 C ATOM 0 H THR A 70 13.092 1.206 7.917 1.00 0.99 H new ATOM 0 HA THR A 70 14.909 2.624 6.303 1.00 1.04 H new ATOM 0 HB THR A 70 16.436 0.784 6.976 1.00 1.15 H new ATOM 0 HG1 THR A 70 14.327 0.007 8.736 1.00 2.53 H new ATOM 0 HG21 THR A 70 16.489 1.468 9.384 1.00 2.27 H new ATOM 0 HG22 THR A 70 16.272 2.856 8.292 1.00 2.27 H new ATOM 0 HG23 THR A 70 14.880 2.202 9.187 1.00 2.27 H new ATOM 992 N SER A 71 13.814 -0.193 5.022 1.00 0.89 N ATOM 993 CA SER A 71 13.518 -0.780 3.722 1.00 0.93 C ATOM 994 C SER A 71 11.993 -0.804 3.484 1.00 0.81 C ATOM 995 O SER A 71 11.290 -1.668 4.029 1.00 0.77 O ATOM 996 CB SER A 71 14.154 -2.171 3.636 1.00 1.02 C ATOM 997 OG SER A 71 14.274 -2.584 2.281 1.00 2.05 O ATOM 0 H SER A 71 13.360 -0.667 5.802 1.00 0.89 H new ATOM 0 HA SER A 71 13.949 -0.173 2.926 1.00 0.93 H new ATOM 0 HB2 SER A 71 15.137 -2.157 4.106 1.00 1.02 H new ATOM 0 HB3 SER A 71 13.547 -2.889 4.188 1.00 1.02 H new ATOM 0 HG SER A 71 14.684 -3.474 2.245 1.00 2.05 H new ATOM 1003 N PRO A 72 11.458 0.127 2.669 1.00 0.86 N ATOM 1004 CA PRO A 72 10.132 -0.018 2.097 1.00 0.84 C ATOM 1005 C PRO A 72 10.237 -1.044 0.961 1.00 0.83 C ATOM 1006 O PRO A 72 11.013 -0.865 0.019 1.00 0.97 O ATOM 1007 CB PRO A 72 9.745 1.384 1.615 1.00 0.97 C ATOM 1008 CG PRO A 72 11.085 2.026 1.250 1.00 1.06 C ATOM 1009 CD PRO A 72 12.098 1.340 2.171 1.00 1.04 C ATOM 0 HA PRO A 72 9.370 -0.380 2.787 1.00 0.84 H new ATOM 0 HB2 PRO A 72 9.075 1.341 0.757 1.00 0.97 H new ATOM 0 HB3 PRO A 72 9.230 1.947 2.394 1.00 0.97 H new ATOM 0 HG2 PRO A 72 11.330 1.865 0.200 1.00 1.06 H new ATOM 0 HG3 PRO A 72 11.067 3.104 1.412 1.00 1.06 H new ATOM 0 HD2 PRO A 72 13.013 1.100 1.629 1.00 1.04 H new ATOM 0 HD3 PRO A 72 12.378 1.996 2.995 1.00 1.04 H new ATOM 1017 N MET A 73 9.482 -2.138 1.068 1.00 0.78 N ATOM 1018 CA MET A 73 9.475 -3.232 0.093 1.00 0.80 C ATOM 1019 C MET A 73 8.068 -3.360 -0.485 1.00 0.80 C ATOM 1020 O MET A 73 7.186 -3.968 0.119 1.00 0.91 O ATOM 1021 CB MET A 73 9.982 -4.519 0.762 1.00 0.93 C ATOM 1022 CG MET A 73 10.194 -5.630 -0.278 1.00 1.34 C ATOM 1023 SD MET A 73 10.872 -7.187 0.366 1.00 2.14 S ATOM 1024 CE MET A 73 12.620 -6.731 0.505 1.00 2.30 C ATOM 0 H MET A 73 8.845 -2.293 1.850 1.00 0.78 H new ATOM 0 HA MET A 73 10.151 -3.031 -0.738 1.00 0.80 H new ATOM 0 HB2 MET A 73 10.919 -4.319 1.282 1.00 0.93 H new ATOM 0 HB3 MET A 73 9.265 -4.850 1.513 1.00 0.93 H new ATOM 0 HG2 MET A 73 9.238 -5.841 -0.758 1.00 1.34 H new ATOM 0 HG3 MET A 73 10.863 -5.255 -1.052 1.00 1.34 H new ATOM 0 HE1 MET A 73 13.188 -7.579 0.889 1.00 2.30 H new ATOM 0 HE2 MET A 73 13.003 -6.453 -0.477 1.00 2.30 H new ATOM 0 HE3 MET A 73 12.723 -5.887 1.187 1.00 2.30 H new ATOM 1034 N LEU A 74 7.852 -2.703 -1.626 1.00 1.15 N ATOM 1035 CA LEU A 74 6.550 -2.520 -2.273 1.00 1.30 C ATOM 1036 C LEU A 74 6.340 -3.459 -3.466 1.00 1.53 C ATOM 1037 O LEU A 74 7.223 -3.586 -4.316 1.00 1.57 O ATOM 1038 CB LEU A 74 6.340 -1.030 -2.636 1.00 1.54 C ATOM 1039 CG LEU A 74 7.062 -0.485 -3.892 1.00 1.85 C ATOM 1040 CD1 LEU A 74 6.561 0.934 -4.193 1.00 2.92 C ATOM 1041 CD2 LEU A 74 8.593 -0.456 -3.751 1.00 2.57 C ATOM 0 H LEU A 74 8.612 -2.265 -2.147 1.00 1.15 H new ATOM 0 HA LEU A 74 5.778 -2.802 -1.557 1.00 1.30 H new ATOM 0 HB2 LEU A 74 5.271 -0.864 -2.766 1.00 1.54 H new ATOM 0 HB3 LEU A 74 6.654 -0.430 -1.782 1.00 1.54 H new ATOM 0 HG LEU A 74 6.828 -1.168 -4.709 1.00 1.85 H new ATOM 0 HD11 LEU A 74 7.069 1.319 -5.077 1.00 2.92 H new ATOM 0 HD12 LEU A 74 5.486 0.910 -4.373 1.00 2.92 H new ATOM 0 HD13 LEU A 74 6.772 1.582 -3.342 1.00 2.92 H new ATOM 0 HD21 LEU A 74 9.035 -0.063 -4.667 1.00 2.57 H new ATOM 0 HD22 LEU A 74 8.869 0.183 -2.912 1.00 2.57 H new ATOM 0 HD23 LEU A 74 8.961 -1.467 -3.574 1.00 2.57 H new ATOM 1053 N MET A 75 5.142 -4.057 -3.554 1.00 1.88 N ATOM 1054 CA MET A 75 4.738 -4.983 -4.625 1.00 2.36 C ATOM 1055 C MET A 75 3.254 -5.388 -4.544 1.00 2.18 C ATOM 1056 O MET A 75 2.625 -5.231 -3.494 1.00 2.23 O ATOM 1057 CB MET A 75 5.671 -6.217 -4.679 1.00 2.70 C ATOM 1058 CG MET A 75 5.850 -6.919 -3.330 1.00 2.45 C ATOM 1059 SD MET A 75 7.556 -7.093 -2.751 1.00 3.07 S ATOM 1060 CE MET A 75 7.164 -7.543 -1.042 1.00 3.74 C ATOM 0 H MET A 75 4.407 -3.906 -2.863 1.00 1.88 H new ATOM 0 HA MET A 75 4.847 -4.440 -5.564 1.00 2.36 H new ATOM 0 HB2 MET A 75 5.271 -6.931 -5.399 1.00 2.70 H new ATOM 0 HB3 MET A 75 6.648 -5.906 -5.048 1.00 2.70 H new ATOM 0 HG2 MET A 75 5.286 -6.368 -2.578 1.00 2.45 H new ATOM 0 HG3 MET A 75 5.406 -7.912 -3.397 1.00 2.45 H new ATOM 0 HE1 MET A 75 8.064 -7.907 -0.546 1.00 3.74 H new ATOM 0 HE2 MET A 75 6.786 -6.668 -0.513 1.00 3.74 H new ATOM 0 HE3 MET A 75 6.405 -8.326 -1.037 1.00 3.74 H new ATOM 1070 N THR A 76 2.728 -5.912 -5.659 1.00 2.23 N ATOM 1071 CA THR A 76 1.418 -6.569 -5.869 1.00 2.05 C ATOM 1072 C THR A 76 1.340 -6.978 -7.333 1.00 2.84 C ATOM 1073 O THR A 76 2.103 -6.459 -8.140 1.00 3.52 O ATOM 1074 CB THR A 76 0.194 -5.733 -5.438 1.00 2.38 C ATOM 1075 OG1 THR A 76 -0.707 -6.625 -4.820 1.00 3.21 O ATOM 1076 CG2 THR A 76 -0.576 -5.052 -6.581 1.00 3.36 C ATOM 0 H THR A 76 3.259 -5.887 -6.529 1.00 2.23 H new ATOM 0 HA THR A 76 1.369 -7.438 -5.213 1.00 2.05 H new ATOM 0 HB THR A 76 0.573 -4.935 -4.800 1.00 2.38 H new ATOM 0 HG1 THR A 76 -0.320 -6.951 -3.981 1.00 3.21 H new ATOM 0 HG21 THR A 76 -1.416 -4.491 -6.171 1.00 3.36 H new ATOM 0 HG22 THR A 76 0.089 -4.372 -7.113 1.00 3.36 H new ATOM 0 HG23 THR A 76 -0.948 -5.809 -7.271 1.00 3.36 H new ATOM 1084 N THR A 77 0.466 -7.935 -7.654 1.00 2.86 N ATOM 1085 CA THR A 77 0.469 -8.693 -8.910 1.00 3.45 C ATOM 1086 C THR A 77 -0.811 -9.538 -9.038 1.00 2.83 C ATOM 1087 O THR A 77 -1.889 -8.959 -8.891 1.00 3.60 O ATOM 1088 CB THR A 77 1.827 -9.397 -9.123 1.00 4.16 C ATOM 1089 OG1 THR A 77 2.596 -9.535 -7.947 1.00 3.87 O ATOM 1090 CG2 THR A 77 2.634 -8.726 -10.239 1.00 5.89 C ATOM 0 H THR A 77 -0.289 -8.214 -7.027 1.00 2.86 H new ATOM 0 HA THR A 77 0.407 -8.030 -9.773 1.00 3.45 H new ATOM 0 HB THR A 77 1.582 -10.413 -9.432 1.00 4.16 H new ATOM 0 HG1 THR A 77 2.015 -9.809 -7.207 1.00 3.87 H new ATOM 0 HG21 THR A 77 3.584 -9.245 -10.364 1.00 5.89 H new ATOM 0 HG22 THR A 77 2.071 -8.770 -11.172 1.00 5.89 H new ATOM 0 HG23 THR A 77 2.821 -7.685 -9.977 1.00 5.89 H new ATOM 1098 N THR A 78 -0.730 -10.838 -9.364 1.00 2.06 N ATOM 1099 CA THR A 78 -1.827 -11.732 -9.770 1.00 1.78 C ATOM 1100 C THR A 78 -2.837 -11.006 -10.653 1.00 2.36 C ATOM 1101 O THR A 78 -2.427 -10.452 -11.666 1.00 3.62 O ATOM 1102 CB THR A 78 -2.394 -12.556 -8.596 1.00 2.83 C ATOM 1103 OG1 THR A 78 -3.023 -11.723 -7.656 1.00 3.65 O ATOM 1104 CG2 THR A 78 -1.290 -13.358 -7.898 1.00 4.38 C ATOM 0 H THR A 78 0.166 -11.326 -9.350 1.00 2.06 H new ATOM 0 HA THR A 78 -1.424 -12.510 -10.419 1.00 1.78 H new ATOM 0 HB THR A 78 -3.127 -13.247 -9.012 1.00 2.83 H new ATOM 0 HG1 THR A 78 -3.184 -12.225 -6.830 1.00 3.65 H new ATOM 0 HG21 THR A 78 -1.720 -13.929 -7.075 1.00 4.38 H new ATOM 0 HG22 THR A 78 -0.830 -14.041 -8.612 1.00 4.38 H new ATOM 0 HG23 THR A 78 -0.534 -12.675 -7.510 1.00 4.38 H new ATOM 1112 N HIS A 79 -4.117 -11.015 -10.303 1.00 2.28 N ATOM 1113 CA HIS A 79 -5.223 -10.489 -11.116 1.00 3.24 C ATOM 1114 C HIS A 79 -5.692 -9.089 -10.649 1.00 3.53 C ATOM 1115 O HIS A 79 -6.888 -8.798 -10.565 1.00 4.74 O ATOM 1116 CB HIS A 79 -6.338 -11.554 -11.155 1.00 4.45 C ATOM 1117 CG HIS A 79 -6.918 -11.932 -9.813 1.00 4.93 C ATOM 1118 ND1 HIS A 79 -7.650 -11.112 -8.991 1.00 6.23 N ATOM 1119 CD2 HIS A 79 -6.857 -13.155 -9.203 1.00 5.03 C ATOM 1120 CE1 HIS A 79 -8.019 -11.817 -7.909 1.00 6.90 C ATOM 1121 NE2 HIS A 79 -7.562 -13.076 -7.994 1.00 6.27 N ATOM 0 H HIS A 79 -4.432 -11.402 -9.413 1.00 2.28 H new ATOM 0 HA HIS A 79 -4.886 -10.311 -12.137 1.00 3.24 H new ATOM 0 HB2 HIS A 79 -7.144 -11.188 -11.791 1.00 4.45 H new ATOM 0 HB3 HIS A 79 -5.942 -12.453 -11.627 1.00 4.45 H new ATOM 0 HD1 HIS A 79 -7.875 -10.134 -9.171 1.00 6.23 H new ATOM 0 HD2 HIS A 79 -6.353 -14.030 -9.586 1.00 5.03 H new ATOM 0 HE1 HIS A 79 -8.601 -11.426 -7.087 1.00 6.90 H new ATOM 1129 N SER A 80 -4.757 -8.214 -10.276 1.00 3.30 N ATOM 1130 CA SER A 80 -5.071 -6.903 -9.687 1.00 4.31 C ATOM 1131 C SER A 80 -5.429 -5.844 -10.744 1.00 4.91 C ATOM 1132 O SER A 80 -4.649 -4.930 -11.005 1.00 6.46 O ATOM 1133 CB SER A 80 -3.938 -6.445 -8.758 1.00 4.93 C ATOM 1134 OG SER A 80 -3.697 -7.423 -7.764 1.00 5.54 O ATOM 0 H SER A 80 -3.757 -8.391 -10.372 1.00 3.30 H new ATOM 0 HA SER A 80 -5.971 -7.023 -9.083 1.00 4.31 H new ATOM 0 HB2 SER A 80 -3.031 -6.272 -9.337 1.00 4.93 H new ATOM 0 HB3 SER A 80 -4.202 -5.497 -8.290 1.00 4.93 H new ATOM 0 HG SER A 80 -2.834 -7.855 -7.933 1.00 5.54 H new ATOM 1140 N GLY A 81 -6.613 -5.980 -11.361 1.00 4.03 N ATOM 1141 CA GLY A 81 -7.259 -4.910 -12.130 1.00 4.88 C ATOM 1142 C GLY A 81 -6.702 -4.712 -13.539 1.00 4.86 C ATOM 1143 O GLY A 81 -6.415 -3.582 -13.916 1.00 6.12 O ATOM 0 H GLY A 81 -7.153 -6.845 -11.339 1.00 4.03 H new ATOM 0 HA2 GLY A 81 -8.325 -5.126 -12.202 1.00 4.88 H new ATOM 0 HA3 GLY A 81 -7.160 -3.974 -11.580 1.00 4.88 H new ATOM 1147 N GLY A 82 -6.560 -5.791 -14.315 1.00 3.79 N ATOM 1148 CA GLY A 82 -6.068 -5.750 -15.702 1.00 3.88 C ATOM 1149 C GLY A 82 -4.610 -6.186 -15.827 1.00 3.38 C ATOM 1150 O GLY A 82 -4.025 -6.097 -16.906 1.00 3.68 O ATOM 0 H GLY A 82 -6.786 -6.733 -13.996 1.00 3.79 H new ATOM 0 HA2 GLY A 82 -6.690 -6.396 -16.322 1.00 3.88 H new ATOM 0 HA3 GLY A 82 -6.174 -4.737 -16.090 1.00 3.88 H new ATOM 1154 N MET A 83 -4.015 -6.657 -14.725 1.00 2.81 N ATOM 1155 CA MET A 83 -2.671 -7.239 -14.687 1.00 2.41 C ATOM 1156 C MET A 83 -2.693 -8.764 -14.494 1.00 2.04 C ATOM 1157 O MET A 83 -3.753 -9.345 -14.238 1.00 2.46 O ATOM 1158 CB MET A 83 -1.828 -6.497 -13.633 1.00 2.83 C ATOM 1159 CG MET A 83 -0.583 -5.873 -14.278 1.00 3.19 C ATOM 1160 SD MET A 83 0.719 -7.056 -14.705 1.00 4.86 S ATOM 1161 CE MET A 83 1.981 -5.873 -15.219 1.00 5.27 C ATOM 0 H MET A 83 -4.468 -6.643 -13.811 1.00 2.81 H new ATOM 0 HA MET A 83 -2.195 -7.099 -15.658 1.00 2.41 H new ATOM 0 HB2 MET A 83 -2.428 -5.719 -13.161 1.00 2.83 H new ATOM 0 HB3 MET A 83 -1.528 -7.189 -12.846 1.00 2.83 H new ATOM 0 HG2 MET A 83 -0.885 -5.344 -15.182 1.00 3.19 H new ATOM 0 HG3 MET A 83 -0.171 -5.130 -13.596 1.00 3.19 H new ATOM 0 HE1 MET A 83 2.757 -6.391 -15.783 1.00 5.27 H new ATOM 0 HE2 MET A 83 1.527 -5.106 -15.846 1.00 5.27 H new ATOM 0 HE3 MET A 83 2.423 -5.407 -14.338 1.00 5.27 H new ATOM 1171 N ALA A 84 -1.525 -9.397 -14.676 1.00 2.03 N ATOM 1172 CA ALA A 84 -1.366 -10.853 -14.746 1.00 2.27 C ATOM 1173 C ALA A 84 0.100 -11.315 -14.581 1.00 2.52 C ATOM 1174 O ALA A 84 0.655 -11.936 -15.491 1.00 3.45 O ATOM 1175 CB ALA A 84 -2.014 -11.353 -16.054 1.00 2.96 C ATOM 0 H ALA A 84 -0.643 -8.895 -14.781 1.00 2.03 H new ATOM 0 HA ALA A 84 -1.880 -11.306 -13.898 1.00 2.27 H new ATOM 0 HB1 ALA A 84 -1.905 -12.435 -16.123 1.00 2.96 H new ATOM 0 HB2 ALA A 84 -3.073 -11.094 -16.058 1.00 2.96 H new ATOM 0 HB3 ALA A 84 -1.522 -10.884 -16.906 1.00 2.96 H new ATOM 1181 N GLY A 85 0.743 -11.028 -13.436 1.00 2.11 N ATOM 1182 CA GLY A 85 2.130 -11.436 -13.132 1.00 2.45 C ATOM 1183 C GLY A 85 2.372 -11.847 -11.673 1.00 2.07 C ATOM 1184 O GLY A 85 1.447 -12.236 -10.963 1.00 2.49 O ATOM 0 H GLY A 85 0.308 -10.497 -12.681 1.00 2.11 H new ATOM 0 HA2 GLY A 85 2.399 -12.270 -13.780 1.00 2.45 H new ATOM 0 HA3 GLY A 85 2.799 -10.612 -13.379 1.00 2.45 H new ATOM 1188 N MET A 86 3.626 -11.733 -11.216 1.00 2.05 N ATOM 1189 CA MET A 86 4.077 -11.941 -9.819 1.00 1.97 C ATOM 1190 C MET A 86 5.269 -11.024 -9.472 1.00 1.77 C ATOM 1191 O MET A 86 6.160 -10.859 -10.297 1.00 2.42 O ATOM 1192 CB MET A 86 4.450 -13.417 -9.591 1.00 3.08 C ATOM 1193 CG MET A 86 4.598 -13.726 -8.091 1.00 4.43 C ATOM 1194 SD MET A 86 5.295 -15.343 -7.666 1.00 5.51 S ATOM 1195 CE MET A 86 4.190 -16.469 -8.552 1.00 6.69 C ATOM 0 H MET A 86 4.397 -11.481 -11.835 1.00 2.05 H new ATOM 0 HA MET A 86 3.251 -11.680 -9.157 1.00 1.97 H new ATOM 0 HB2 MET A 86 3.684 -14.060 -10.024 1.00 3.08 H new ATOM 0 HB3 MET A 86 5.384 -13.643 -10.106 1.00 3.08 H new ATOM 0 HG2 MET A 86 5.226 -12.955 -7.644 1.00 4.43 H new ATOM 0 HG3 MET A 86 3.615 -13.645 -7.627 1.00 4.43 H new ATOM 0 HE1 MET A 86 4.471 -17.500 -8.335 1.00 6.69 H new ATOM 0 HE2 MET A 86 3.162 -16.298 -8.231 1.00 6.69 H new ATOM 0 HE3 MET A 86 4.270 -16.289 -9.624 1.00 6.69 H new ATOM 1205 N LYS A 87 5.285 -10.427 -8.269 1.00 1.54 N ATOM 1206 CA LYS A 87 6.431 -9.728 -7.651 1.00 1.71 C ATOM 1207 C LYS A 87 6.897 -8.481 -8.453 1.00 1.34 C ATOM 1208 O LYS A 87 8.082 -8.183 -8.527 1.00 1.79 O ATOM 1209 CB LYS A 87 7.530 -10.779 -7.312 1.00 2.99 C ATOM 1210 CG LYS A 87 8.773 -10.336 -6.503 1.00 3.73 C ATOM 1211 CD LYS A 87 8.507 -9.513 -5.233 1.00 5.19 C ATOM 1212 CE LYS A 87 7.786 -10.288 -4.122 1.00 6.31 C ATOM 1213 NZ LYS A 87 8.700 -11.068 -3.247 1.00 7.61 N ATOM 0 H LYS A 87 4.460 -10.416 -7.669 1.00 1.54 H new ATOM 0 HA LYS A 87 6.129 -9.274 -6.708 1.00 1.71 H new ATOM 0 HB2 LYS A 87 7.051 -11.589 -6.761 1.00 2.99 H new ATOM 0 HB3 LYS A 87 7.884 -11.199 -8.253 1.00 2.99 H new ATOM 0 HG2 LYS A 87 9.332 -11.228 -6.221 1.00 3.73 H new ATOM 0 HG3 LYS A 87 9.417 -9.751 -7.160 1.00 3.73 H new ATOM 0 HD2 LYS A 87 9.457 -9.145 -4.846 1.00 5.19 H new ATOM 0 HD3 LYS A 87 7.911 -8.640 -5.497 1.00 5.19 H new ATOM 0 HE2 LYS A 87 7.222 -9.585 -3.509 1.00 6.31 H new ATOM 0 HE3 LYS A 87 7.064 -10.967 -4.575 1.00 6.31 H new ATOM 0 HZ1 LYS A 87 8.145 -11.565 -2.521 1.00 7.61 H new ATOM 0 HZ2 LYS A 87 9.221 -11.762 -3.820 1.00 7.61 H new ATOM 0 HZ3 LYS A 87 9.374 -10.423 -2.787 1.00 7.61 H new ATOM 1227 N MET A 88 5.961 -7.715 -9.029 1.00 2.37 N ATOM 1228 CA MET A 88 6.219 -6.385 -9.625 1.00 3.06 C ATOM 1229 C MET A 88 5.791 -5.250 -8.676 1.00 2.30 C ATOM 1230 O MET A 88 5.236 -5.512 -7.617 1.00 3.12 O ATOM 1231 CB MET A 88 5.478 -6.270 -10.971 1.00 4.88 C ATOM 1232 CG MET A 88 5.879 -7.380 -11.952 1.00 5.99 C ATOM 1233 SD MET A 88 5.091 -7.267 -13.581 1.00 8.02 S ATOM 1234 CE MET A 88 6.125 -5.995 -14.354 1.00 7.95 C ATOM 0 H MET A 88 4.985 -8.002 -9.098 1.00 2.37 H new ATOM 0 HA MET A 88 7.291 -6.285 -9.792 1.00 3.06 H new ATOM 0 HB2 MET A 88 4.403 -6.313 -10.796 1.00 4.88 H new ATOM 0 HB3 MET A 88 5.690 -5.299 -11.418 1.00 4.88 H new ATOM 0 HG2 MET A 88 6.961 -7.357 -12.084 1.00 5.99 H new ATOM 0 HG3 MET A 88 5.632 -8.345 -11.509 1.00 5.99 H new ATOM 0 HE1 MET A 88 5.772 -5.806 -15.368 1.00 7.95 H new ATOM 0 HE2 MET A 88 6.067 -5.075 -13.772 1.00 7.95 H new ATOM 0 HE3 MET A 88 7.159 -6.338 -14.388 1.00 7.95 H new ATOM 1244 N VAL A 89 5.992 -3.986 -9.067 1.00 2.32 N ATOM 1245 CA VAL A 89 5.441 -2.789 -8.387 1.00 1.76 C ATOM 1246 C VAL A 89 3.928 -2.928 -8.140 1.00 1.49 C ATOM 1247 O VAL A 89 3.258 -3.577 -8.942 1.00 1.82 O ATOM 1248 CB VAL A 89 5.683 -1.481 -9.183 1.00 2.07 C ATOM 1249 CG1 VAL A 89 7.171 -1.114 -9.199 1.00 2.12 C ATOM 1250 CG2 VAL A 89 5.167 -1.529 -10.632 1.00 3.67 C ATOM 0 H VAL A 89 6.555 -3.752 -9.885 1.00 2.32 H new ATOM 0 HA VAL A 89 5.973 -2.726 -7.438 1.00 1.76 H new ATOM 0 HB VAL A 89 5.108 -0.719 -8.657 1.00 2.07 H new ATOM 0 HG11 VAL A 89 7.312 -0.193 -9.764 1.00 2.12 H new ATOM 0 HG12 VAL A 89 7.521 -0.970 -8.177 1.00 2.12 H new ATOM 0 HG13 VAL A 89 7.739 -1.918 -9.668 1.00 2.12 H new ATOM 0 HG21 VAL A 89 5.373 -0.578 -11.123 1.00 3.67 H new ATOM 0 HG22 VAL A 89 5.670 -2.332 -11.171 1.00 3.67 H new ATOM 0 HG23 VAL A 89 4.092 -1.711 -10.630 1.00 3.67 H new ATOM 1260 N PRO A 90 3.370 -2.317 -7.074 1.00 1.20 N ATOM 1261 CA PRO A 90 1.967 -2.502 -6.720 1.00 1.29 C ATOM 1262 C PRO A 90 0.964 -1.709 -7.559 1.00 1.72 C ATOM 1263 O PRO A 90 -0.218 -2.017 -7.458 1.00 3.44 O ATOM 1264 CB PRO A 90 1.841 -2.100 -5.252 1.00 1.40 C ATOM 1265 CG PRO A 90 3.002 -1.136 -5.026 1.00 1.31 C ATOM 1266 CD PRO A 90 4.065 -1.565 -6.036 1.00 1.20 C ATOM 0 HA PRO A 90 1.711 -3.543 -6.915 1.00 1.29 H new ATOM 0 HB2 PRO A 90 0.882 -1.622 -5.051 1.00 1.40 H new ATOM 0 HB3 PRO A 90 1.909 -2.967 -4.595 1.00 1.40 H new ATOM 0 HG2 PRO A 90 2.696 -0.103 -5.188 1.00 1.31 H new ATOM 0 HG3 PRO A 90 3.377 -1.201 -4.005 1.00 1.31 H new ATOM 0 HD2 PRO A 90 4.571 -0.697 -6.459 1.00 1.20 H new ATOM 0 HD3 PRO A 90 4.829 -2.178 -5.558 1.00 1.20 H new ATOM 1274 N TRP A 91 1.412 -0.703 -8.331 1.00 1.23 N ATOM 1275 CA TRP A 91 0.597 0.284 -9.065 1.00 1.48 C ATOM 1276 C TRP A 91 -0.466 1.028 -8.209 1.00 1.98 C ATOM 1277 O TRP A 91 -0.849 0.629 -7.110 1.00 2.52 O ATOM 1278 CB TRP A 91 0.086 -0.287 -10.413 1.00 1.76 C ATOM 1279 CG TRP A 91 -0.500 -1.670 -10.429 1.00 1.91 C ATOM 1280 CD1 TRP A 91 -1.745 -2.006 -10.030 1.00 1.76 C ATOM 1281 CD2 TRP A 91 0.128 -2.931 -10.826 1.00 2.56 C ATOM 1282 NE1 TRP A 91 -1.917 -3.372 -10.093 1.00 2.17 N ATOM 1283 CE2 TRP A 91 -0.779 -3.998 -10.548 1.00 2.72 C ATOM 1284 CE3 TRP A 91 1.376 -3.288 -11.383 1.00 3.19 C ATOM 1285 CZ2 TRP A 91 -0.446 -5.344 -10.759 1.00 3.47 C ATOM 1286 CZ3 TRP A 91 1.715 -4.634 -11.615 1.00 3.96 C ATOM 1287 CH2 TRP A 91 0.813 -5.662 -11.291 1.00 4.10 C ATOM 0 H TRP A 91 2.411 -0.547 -8.468 1.00 1.23 H new ATOM 0 HA TRP A 91 1.271 1.100 -9.326 1.00 1.48 H new ATOM 0 HB2 TRP A 91 -0.670 0.398 -10.798 1.00 1.76 H new ATOM 0 HB3 TRP A 91 0.918 -0.271 -11.117 1.00 1.76 H new ATOM 0 HD1 TRP A 91 -2.499 -1.304 -9.707 1.00 1.76 H new ATOM 0 HE1 TRP A 91 -2.777 -3.857 -9.836 1.00 2.17 H new ATOM 0 HE3 TRP A 91 2.084 -2.513 -11.636 1.00 3.19 H new ATOM 0 HZ2 TRP A 91 -1.150 -6.126 -10.515 1.00 3.47 H new ATOM 0 HZ3 TRP A 91 2.675 -4.879 -12.045 1.00 3.96 H new ATOM 0 HH2 TRP A 91 1.088 -6.694 -11.451 1.00 4.10 H new ATOM 1298 N LEU A 92 -0.950 2.176 -8.698 1.00 2.29 N ATOM 1299 CA LEU A 92 -2.183 2.826 -8.226 1.00 3.05 C ATOM 1300 C LEU A 92 -3.229 2.970 -9.342 1.00 2.67 C ATOM 1301 O LEU A 92 -4.278 3.580 -9.145 1.00 3.52 O ATOM 1302 CB LEU A 92 -1.886 4.195 -7.584 1.00 4.34 C ATOM 1303 CG LEU A 92 -2.864 4.478 -6.429 1.00 5.54 C ATOM 1304 CD1 LEU A 92 -2.282 3.969 -5.102 1.00 6.76 C ATOM 1305 CD2 LEU A 92 -3.219 5.964 -6.317 1.00 6.81 C ATOM 0 H LEU A 92 -0.488 2.691 -9.448 1.00 2.29 H new ATOM 0 HA LEU A 92 -2.606 2.172 -7.463 1.00 3.05 H new ATOM 0 HB2 LEU A 92 -0.861 4.213 -7.212 1.00 4.34 H new ATOM 0 HB3 LEU A 92 -1.966 4.980 -8.336 1.00 4.34 H new ATOM 0 HG LEU A 92 -3.787 3.942 -6.650 1.00 5.54 H new ATOM 0 HD11 LEU A 92 -2.984 4.176 -4.294 1.00 6.76 H new ATOM 0 HD12 LEU A 92 -2.111 2.895 -5.168 1.00 6.76 H new ATOM 0 HD13 LEU A 92 -1.338 4.475 -4.901 1.00 6.76 H new ATOM 0 HD21 LEU A 92 -3.911 6.111 -5.488 1.00 6.81 H new ATOM 0 HD22 LEU A 92 -2.312 6.542 -6.140 1.00 6.81 H new ATOM 0 HD23 LEU A 92 -3.687 6.297 -7.243 1.00 6.81 H new ATOM 1317 N THR A 93 -2.896 2.471 -10.534 1.00 2.00 N ATOM 1318 CA THR A 93 -3.514 2.751 -11.832 1.00 2.16 C ATOM 1319 C THR A 93 -4.866 2.059 -11.985 1.00 1.91 C ATOM 1320 O THR A 93 -5.046 1.184 -12.825 1.00 2.43 O ATOM 1321 CB THR A 93 -2.527 2.408 -12.961 1.00 3.15 C ATOM 1322 OG1 THR A 93 -1.250 2.905 -12.609 1.00 3.87 O ATOM 1323 CG2 THR A 93 -2.904 3.065 -14.289 1.00 4.02 C ATOM 0 H THR A 93 -2.126 1.808 -10.624 1.00 2.00 H new ATOM 0 HA THR A 93 -3.733 3.817 -11.896 1.00 2.16 H new ATOM 0 HB THR A 93 -2.543 1.325 -13.084 1.00 3.15 H new ATOM 0 HG1 THR A 93 -0.609 2.692 -13.319 1.00 3.87 H new ATOM 0 HG21 THR A 93 -2.175 2.790 -15.051 1.00 4.02 H new ATOM 0 HG22 THR A 93 -3.894 2.726 -14.595 1.00 4.02 H new ATOM 0 HG23 THR A 93 -2.913 4.148 -14.169 1.00 4.02 H new ATOM 1331 N ILE A 94 -5.842 2.441 -11.162 1.00 1.96 N ATOM 1332 CA ILE A 94 -7.231 1.988 -11.274 1.00 2.03 C ATOM 1333 C ILE A 94 -7.834 2.244 -12.678 1.00 1.96 C ATOM 1334 O ILE A 94 -8.059 3.407 -13.036 1.00 2.38 O ATOM 1335 CB ILE A 94 -8.108 2.586 -10.149 1.00 2.67 C ATOM 1336 CG1 ILE A 94 -8.113 4.136 -10.115 1.00 3.90 C ATOM 1337 CG2 ILE A 94 -7.731 1.919 -8.818 1.00 3.63 C ATOM 1338 CD1 ILE A 94 -8.340 4.780 -8.744 1.00 5.29 C ATOM 0 H ILE A 94 -5.689 3.084 -10.386 1.00 1.96 H new ATOM 0 HA ILE A 94 -7.221 0.906 -11.145 1.00 2.03 H new ATOM 0 HB ILE A 94 -9.153 2.355 -10.357 1.00 2.67 H new ATOM 0 HG12 ILE A 94 -7.160 4.491 -10.507 1.00 3.90 H new ATOM 0 HG13 ILE A 94 -8.889 4.491 -10.793 1.00 3.90 H new ATOM 0 HG21 ILE A 94 -8.343 2.333 -8.017 1.00 3.63 H new ATOM 0 HG22 ILE A 94 -7.903 0.845 -8.888 1.00 3.63 H new ATOM 0 HG23 ILE A 94 -6.679 2.105 -8.603 1.00 3.63 H new ATOM 0 HD11 ILE A 94 -8.323 5.865 -8.844 1.00 5.29 H new ATOM 0 HD12 ILE A 94 -9.307 4.467 -8.351 1.00 5.29 H new ATOM 0 HD13 ILE A 94 -7.552 4.467 -8.060 1.00 5.29 H new ATOM 1350 N PRO A 95 -8.180 1.186 -13.449 1.00 1.97 N ATOM 1351 CA PRO A 95 -8.799 1.275 -14.777 1.00 2.29 C ATOM 1352 C PRO A 95 -10.303 1.598 -14.673 1.00 2.28 C ATOM 1353 O PRO A 95 -11.135 0.925 -15.280 1.00 2.62 O ATOM 1354 CB PRO A 95 -8.531 -0.104 -15.399 1.00 2.76 C ATOM 1355 CG PRO A 95 -8.663 -1.026 -14.201 1.00 2.84 C ATOM 1356 CD PRO A 95 -7.966 -0.221 -13.115 1.00 2.29 C ATOM 0 HA PRO A 95 -8.391 2.081 -15.387 1.00 2.29 H new ATOM 0 HB2 PRO A 95 -9.252 -0.345 -16.180 1.00 2.76 H new ATOM 0 HB3 PRO A 95 -7.540 -0.162 -15.850 1.00 2.76 H new ATOM 0 HG2 PRO A 95 -9.705 -1.230 -13.954 1.00 2.84 H new ATOM 0 HG3 PRO A 95 -8.181 -1.989 -14.370 1.00 2.84 H new ATOM 0 HD2 PRO A 95 -8.377 -0.455 -12.133 1.00 2.29 H new ATOM 0 HD3 PRO A 95 -6.902 -0.455 -13.079 1.00 2.29 H new ATOM 1364 N ALA A 96 -10.666 2.569 -13.824 1.00 2.82 N ATOM 1365 CA ALA A 96 -12.032 2.805 -13.358 1.00 3.12 C ATOM 1366 C ALA A 96 -12.622 1.580 -12.649 1.00 3.38 C ATOM 1367 O ALA A 96 -12.472 1.461 -11.434 1.00 4.84 O ATOM 1368 CB ALA A 96 -12.894 3.391 -14.490 1.00 3.45 C ATOM 0 H ALA A 96 -9.994 3.230 -13.433 1.00 2.82 H new ATOM 0 HA ALA A 96 -12.018 3.567 -12.579 1.00 3.12 H new ATOM 0 HB1 ALA A 96 -13.907 3.560 -14.125 1.00 3.45 H new ATOM 0 HB2 ALA A 96 -12.465 4.337 -14.822 1.00 3.45 H new ATOM 0 HB3 ALA A 96 -12.921 2.692 -15.326 1.00 3.45 H new ATOM 1374 N ARG A 97 -13.258 0.663 -13.372 1.00 2.55 N ATOM 1375 CA ARG A 97 -13.928 -0.504 -12.796 1.00 2.69 C ATOM 1376 C ARG A 97 -12.958 -1.666 -12.469 1.00 2.41 C ATOM 1377 O ARG A 97 -13.227 -2.814 -12.813 1.00 2.36 O ATOM 1378 CB ARG A 97 -15.063 -0.945 -13.734 1.00 3.08 C ATOM 1379 CG ARG A 97 -16.192 0.098 -13.842 1.00 4.41 C ATOM 1380 CD ARG A 97 -17.317 -0.393 -14.761 1.00 5.09 C ATOM 1381 NE ARG A 97 -17.866 -1.684 -14.297 1.00 4.95 N ATOM 1382 CZ ARG A 97 -18.906 -2.320 -14.811 1.00 5.49 C ATOM 1383 NH1 ARG A 97 -19.626 -1.765 -15.765 1.00 6.38 N ATOM 1384 NH2 ARG A 97 -19.235 -3.514 -14.354 1.00 5.68 N ATOM 0 H ARG A 97 -13.325 0.708 -14.389 1.00 2.55 H new ATOM 0 HA ARG A 97 -14.348 -0.212 -11.833 1.00 2.69 H new ATOM 0 HB2 ARG A 97 -14.654 -1.134 -14.727 1.00 3.08 H new ATOM 0 HB3 ARG A 97 -15.478 -1.887 -13.375 1.00 3.08 H new ATOM 0 HG2 ARG A 97 -16.594 0.306 -12.850 1.00 4.41 H new ATOM 0 HG3 ARG A 97 -15.789 1.035 -14.226 1.00 4.41 H new ATOM 0 HD2 ARG A 97 -18.112 0.351 -14.795 1.00 5.09 H new ATOM 0 HD3 ARG A 97 -16.938 -0.501 -15.777 1.00 5.09 H new ATOM 0 HE ARG A 97 -17.399 -2.127 -13.506 1.00 4.95 H new ATOM 0 HH11 ARG A 97 -19.383 -0.838 -16.113 1.00 6.38 H new ATOM 0 HH12 ARG A 97 -20.426 -2.263 -16.155 1.00 6.38 H new ATOM 0 HH21 ARG A 97 -18.688 -3.943 -13.607 1.00 5.68 H new ATOM 0 HH22 ARG A 97 -20.036 -4.008 -14.748 1.00 5.68 H new ATOM 1398 N GLY A 98 -11.811 -1.373 -11.854 1.00 2.59 N ATOM 1399 CA GLY A 98 -10.773 -2.354 -11.519 1.00 2.41 C ATOM 1400 C GLY A 98 -10.719 -2.677 -10.029 1.00 2.26 C ATOM 1401 O GLY A 98 -11.674 -2.454 -9.286 1.00 3.34 O ATOM 0 H GLY A 98 -11.571 -0.424 -11.567 1.00 2.59 H new ATOM 0 HA2 GLY A 98 -10.954 -3.272 -12.078 1.00 2.41 H new ATOM 0 HA3 GLY A 98 -9.803 -1.972 -11.838 1.00 2.41 H new ATOM 1405 N THR A 99 -9.565 -3.187 -9.589 1.00 1.76 N ATOM 1406 CA THR A 99 -9.333 -3.607 -8.192 1.00 2.00 C ATOM 1407 C THR A 99 -7.867 -3.498 -7.799 1.00 1.76 C ATOM 1408 O THR A 99 -7.018 -4.272 -8.250 1.00 1.77 O ATOM 1409 CB THR A 99 -9.945 -4.988 -7.883 1.00 2.52 C ATOM 1410 OG1 THR A 99 -9.599 -5.339 -6.567 1.00 4.25 O ATOM 1411 CG2 THR A 99 -9.511 -6.136 -8.799 1.00 3.47 C ATOM 0 H THR A 99 -8.754 -3.324 -10.193 1.00 1.76 H new ATOM 0 HA THR A 99 -9.868 -2.902 -7.556 1.00 2.00 H new ATOM 0 HB THR A 99 -11.017 -4.868 -8.043 1.00 2.52 H new ATOM 0 HG1 THR A 99 -9.981 -6.215 -6.351 1.00 4.25 H new ATOM 0 HG21 THR A 99 -10.004 -7.057 -8.487 1.00 3.47 H new ATOM 0 HG22 THR A 99 -9.789 -5.906 -9.827 1.00 3.47 H new ATOM 0 HG23 THR A 99 -8.430 -6.264 -8.735 1.00 3.47 H new ATOM 1419 N LEU A 100 -7.548 -2.477 -7.000 1.00 2.03 N ATOM 1420 CA LEU A 100 -6.186 -2.153 -6.624 1.00 1.86 C ATOM 1421 C LEU A 100 -5.754 -2.858 -5.325 1.00 1.78 C ATOM 1422 O LEU A 100 -5.879 -2.311 -4.226 1.00 2.28 O ATOM 1423 CB LEU A 100 -6.122 -0.628 -6.542 1.00 2.43 C ATOM 1424 CG LEU A 100 -4.687 -0.151 -6.769 1.00 2.83 C ATOM 1425 CD1 LEU A 100 -4.376 -0.051 -8.266 1.00 3.21 C ATOM 1426 CD2 LEU A 100 -4.511 1.191 -6.071 1.00 4.27 C ATOM 0 H LEU A 100 -8.243 -1.849 -6.595 1.00 2.03 H new ATOM 0 HA LEU A 100 -5.472 -2.519 -7.362 1.00 1.86 H new ATOM 0 HB2 LEU A 100 -6.783 -0.188 -7.289 1.00 2.43 H new ATOM 0 HB3 LEU A 100 -6.475 -0.293 -5.567 1.00 2.43 H new ATOM 0 HG LEU A 100 -3.984 -0.871 -6.349 1.00 2.83 H new ATOM 0 HD11 LEU A 100 -3.350 0.290 -8.402 1.00 3.21 H new ATOM 0 HD12 LEU A 100 -4.497 -1.030 -8.729 1.00 3.21 H new ATOM 0 HD13 LEU A 100 -5.059 0.658 -8.733 1.00 3.21 H new ATOM 0 HD21 LEU A 100 -3.492 1.549 -6.221 1.00 4.27 H new ATOM 0 HD22 LEU A 100 -5.214 1.913 -6.487 1.00 4.27 H new ATOM 0 HD23 LEU A 100 -4.701 1.074 -5.004 1.00 4.27 H new ATOM 1438 N THR A 101 -5.248 -4.087 -5.464 1.00 1.47 N ATOM 1439 CA THR A 101 -4.869 -4.970 -4.351 1.00 1.66 C ATOM 1440 C THR A 101 -3.502 -4.645 -3.753 1.00 1.63 C ATOM 1441 O THR A 101 -2.667 -4.006 -4.377 1.00 2.39 O ATOM 1442 CB THR A 101 -5.051 -6.427 -4.802 1.00 2.45 C ATOM 1443 OG1 THR A 101 -6.401 -6.755 -4.566 1.00 3.13 O ATOM 1444 CG2 THR A 101 -4.215 -7.508 -4.118 1.00 3.51 C ATOM 0 H THR A 101 -5.085 -4.509 -6.378 1.00 1.47 H new ATOM 0 HA THR A 101 -5.535 -4.797 -3.506 1.00 1.66 H new ATOM 0 HB THR A 101 -4.717 -6.437 -5.840 1.00 2.45 H new ATOM 0 HG1 THR A 101 -6.566 -7.681 -4.842 1.00 3.13 H new ATOM 0 HG21 THR A 101 -4.458 -8.481 -4.546 1.00 3.51 H new ATOM 0 HG22 THR A 101 -3.156 -7.299 -4.269 1.00 3.51 H new ATOM 0 HG23 THR A 101 -4.434 -7.517 -3.050 1.00 3.51 H new ATOM 1452 N LEU A 102 -3.336 -5.083 -2.502 1.00 1.64 N ATOM 1453 CA LEU A 102 -2.133 -5.192 -1.671 1.00 1.95 C ATOM 1454 C LEU A 102 -2.410 -6.324 -0.663 1.00 1.86 C ATOM 1455 O LEU A 102 -2.837 -6.061 0.456 1.00 2.06 O ATOM 1456 CB LEU A 102 -1.893 -3.869 -0.901 1.00 2.54 C ATOM 1457 CG LEU A 102 -1.198 -2.721 -1.649 1.00 2.98 C ATOM 1458 CD1 LEU A 102 -1.194 -1.479 -0.740 1.00 4.44 C ATOM 1459 CD2 LEU A 102 0.235 -3.086 -2.056 1.00 3.92 C ATOM 0 H LEU A 102 -4.149 -5.412 -1.981 1.00 1.64 H new ATOM 0 HA LEU A 102 -1.252 -5.394 -2.280 1.00 1.95 H new ATOM 0 HB2 LEU A 102 -2.859 -3.505 -0.552 1.00 2.54 H new ATOM 0 HB3 LEU A 102 -1.300 -4.099 -0.016 1.00 2.54 H new ATOM 0 HG LEU A 102 -1.747 -2.519 -2.569 1.00 2.98 H new ATOM 0 HD11 LEU A 102 -0.704 -0.653 -1.255 1.00 4.44 H new ATOM 0 HD12 LEU A 102 -2.220 -1.200 -0.501 1.00 4.44 H new ATOM 0 HD13 LEU A 102 -0.655 -1.704 0.180 1.00 4.44 H new ATOM 0 HD21 LEU A 102 0.689 -2.246 -2.582 1.00 3.92 H new ATOM 0 HD22 LEU A 102 0.819 -3.315 -1.165 1.00 3.92 H new ATOM 0 HD23 LEU A 102 0.217 -3.957 -2.711 1.00 3.92 H new ATOM 1471 N GLN A 103 -2.257 -7.597 -1.031 1.00 1.82 N ATOM 1472 CA GLN A 103 -2.602 -8.743 -0.156 1.00 2.05 C ATOM 1473 C GLN A 103 -1.633 -9.884 -0.452 1.00 2.19 C ATOM 1474 O GLN A 103 -1.059 -9.895 -1.536 1.00 2.06 O ATOM 1475 CB GLN A 103 -4.049 -9.228 -0.397 1.00 2.15 C ATOM 1476 CG GLN A 103 -5.123 -8.172 -0.057 1.00 2.10 C ATOM 1477 CD GLN A 103 -6.515 -8.565 -0.528 1.00 2.55 C ATOM 1478 OE1 GLN A 103 -7.410 -8.888 0.244 1.00 2.83 O ATOM 1479 NE2 GLN A 103 -6.744 -8.527 -1.824 1.00 3.53 N ATOM 0 H GLN A 103 -1.891 -7.874 -1.942 1.00 1.82 H new ATOM 0 HA GLN A 103 -2.526 -8.424 0.883 1.00 2.05 H new ATOM 0 HB2 GLN A 103 -4.156 -9.518 -1.442 1.00 2.15 H new ATOM 0 HB3 GLN A 103 -4.228 -10.121 0.202 1.00 2.15 H new ATOM 0 HG2 GLN A 103 -5.141 -8.015 1.022 1.00 2.10 H new ATOM 0 HG3 GLN A 103 -4.846 -7.221 -0.513 1.00 2.10 H new ATOM 0 HE21 GLN A 103 -5.998 -8.258 -2.466 1.00 3.53 H new ATOM 0 HE22 GLN A 103 -7.667 -8.767 -2.186 1.00 3.53 H new ATOM 1488 N ARG A 104 -1.463 -10.879 0.427 1.00 2.66 N ATOM 1489 CA ARG A 104 -0.617 -12.026 0.062 1.00 3.05 C ATOM 1490 C ARG A 104 -1.189 -12.807 -1.139 1.00 3.12 C ATOM 1491 O ARG A 104 -0.427 -13.330 -1.949 1.00 3.71 O ATOM 1492 CB ARG A 104 -0.320 -12.914 1.279 1.00 3.69 C ATOM 1493 CG ARG A 104 0.717 -13.964 0.855 1.00 5.23 C ATOM 1494 CD ARG A 104 1.346 -14.765 1.989 1.00 5.55 C ATOM 1495 NE ARG A 104 2.250 -15.750 1.380 1.00 6.74 N ATOM 1496 CZ ARG A 104 2.668 -16.893 1.896 1.00 7.28 C ATOM 1497 NH1 ARG A 104 2.514 -17.175 3.174 1.00 6.96 N ATOM 1498 NH2 ARG A 104 3.286 -17.740 1.102 1.00 8.47 N ATOM 0 H ARG A 104 -1.879 -10.918 1.358 1.00 2.66 H new ATOM 0 HA ARG A 104 0.344 -11.636 -0.273 1.00 3.05 H new ATOM 0 HB2 ARG A 104 0.061 -12.314 2.105 1.00 3.69 H new ATOM 0 HB3 ARG A 104 -1.232 -13.398 1.630 1.00 3.69 H new ATOM 0 HG2 ARG A 104 0.241 -14.659 0.163 1.00 5.23 H new ATOM 0 HG3 ARG A 104 1.512 -13.461 0.305 1.00 5.23 H new ATOM 0 HD2 ARG A 104 1.893 -14.108 2.666 1.00 5.55 H new ATOM 0 HD3 ARG A 104 0.577 -15.263 2.580 1.00 5.55 H new ATOM 0 HE ARG A 104 2.597 -15.525 0.447 1.00 6.74 H new ATOM 0 HH11 ARG A 104 2.062 -16.503 3.794 1.00 6.96 H new ATOM 0 HH12 ARG A 104 2.847 -18.066 3.543 1.00 6.96 H new ATOM 0 HH21 ARG A 104 3.430 -17.506 0.120 1.00 8.47 H new ATOM 0 HH22 ARG A 104 3.621 -18.631 1.469 1.00 8.47 H new ATOM 1512 N ASP A 105 -2.508 -12.768 -1.347 1.00 2.80 N ATOM 1513 CA ASP A 105 -3.176 -13.280 -2.551 1.00 2.88 C ATOM 1514 C ASP A 105 -2.806 -12.529 -3.864 1.00 2.51 C ATOM 1515 O ASP A 105 -3.195 -12.962 -4.953 1.00 2.98 O ATOM 1516 CB ASP A 105 -4.697 -13.354 -2.301 1.00 2.98 C ATOM 1517 CG ASP A 105 -5.074 -14.435 -1.272 1.00 3.65 C ATOM 1518 OD1 ASP A 105 -4.871 -15.638 -1.566 1.00 4.65 O ATOM 1519 OD2 ASP A 105 -5.560 -14.070 -0.170 1.00 3.83 O ATOM 0 H ASP A 105 -3.158 -12.371 -0.668 1.00 2.80 H new ATOM 0 HA ASP A 105 -2.799 -14.287 -2.729 1.00 2.88 H new ATOM 0 HB2 ASP A 105 -5.052 -12.385 -1.951 1.00 2.98 H new ATOM 0 HB3 ASP A 105 -5.207 -13.559 -3.242 1.00 2.98 H new ATOM 1524 N GLY A 106 -2.020 -11.440 -3.795 1.00 2.08 N ATOM 1525 CA GLY A 106 -1.382 -10.796 -4.954 1.00 2.17 C ATOM 1526 C GLY A 106 0.094 -10.413 -4.800 1.00 2.18 C ATOM 1527 O GLY A 106 0.684 -9.971 -5.783 1.00 2.73 O ATOM 0 H GLY A 106 -1.807 -10.974 -2.913 1.00 2.08 H new ATOM 0 HA2 GLY A 106 -1.473 -11.466 -5.809 1.00 2.17 H new ATOM 0 HA3 GLY A 106 -1.945 -9.894 -5.195 1.00 2.17 H new ATOM 1531 N ASP A 107 0.664 -10.556 -3.603 1.00 2.47 N ATOM 1532 CA ASP A 107 1.887 -9.916 -3.061 1.00 3.04 C ATOM 1533 C ASP A 107 1.535 -8.504 -2.516 1.00 2.32 C ATOM 1534 O ASP A 107 0.511 -7.919 -2.885 1.00 2.37 O ATOM 1535 CB ASP A 107 3.089 -9.941 -4.043 1.00 4.54 C ATOM 1536 CG ASP A 107 4.373 -10.508 -3.426 1.00 6.16 C ATOM 1537 OD1 ASP A 107 4.804 -9.997 -2.368 1.00 6.71 O ATOM 1538 OD2 ASP A 107 4.948 -11.460 -4.012 1.00 7.31 O ATOM 0 H ASP A 107 0.249 -11.182 -2.913 1.00 2.47 H new ATOM 0 HA ASP A 107 2.246 -10.513 -2.223 1.00 3.04 H new ATOM 0 HB2 ASP A 107 2.822 -10.536 -4.916 1.00 4.54 H new ATOM 0 HB3 ASP A 107 3.281 -8.927 -4.395 1.00 4.54 H new ATOM 1543 N HIS A 108 2.327 -7.927 -1.607 1.00 1.95 N ATOM 1544 CA HIS A 108 1.925 -6.711 -0.874 1.00 1.41 C ATOM 1545 C HIS A 108 3.104 -5.816 -0.446 1.00 1.19 C ATOM 1546 O HIS A 108 4.251 -6.236 -0.494 1.00 1.42 O ATOM 1547 CB HIS A 108 1.085 -7.115 0.355 1.00 1.26 C ATOM 1548 CG HIS A 108 1.914 -7.708 1.465 1.00 1.46 C ATOM 1549 ND1 HIS A 108 2.642 -7.005 2.398 1.00 2.28 N ATOM 1550 CD2 HIS A 108 2.202 -9.032 1.646 1.00 2.32 C ATOM 1551 CE1 HIS A 108 3.379 -7.881 3.097 1.00 2.58 C ATOM 1552 NE2 HIS A 108 3.133 -9.132 2.685 1.00 2.45 N ATOM 0 H HIS A 108 3.251 -8.279 -1.357 1.00 1.95 H new ATOM 0 HA HIS A 108 1.336 -6.107 -1.564 1.00 1.41 H new ATOM 0 HB2 HIS A 108 0.557 -6.239 0.731 1.00 1.26 H new ATOM 0 HB3 HIS A 108 0.327 -7.837 0.049 1.00 1.26 H new ATOM 0 HD1 HIS A 108 2.624 -5.994 2.534 1.00 2.28 H new ATOM 0 HD2 HIS A 108 1.784 -9.855 1.086 1.00 2.32 H new ATOM 0 HE1 HIS A 108 4.073 -7.616 3.881 1.00 2.58 H new ATOM 1560 N VAL A 109 2.822 -4.601 0.037 1.00 1.02 N ATOM 1561 CA VAL A 109 3.830 -3.665 0.566 1.00 0.83 C ATOM 1562 C VAL A 109 4.155 -3.955 2.040 1.00 0.78 C ATOM 1563 O VAL A 109 3.265 -4.182 2.861 1.00 0.93 O ATOM 1564 CB VAL A 109 3.433 -2.190 0.320 1.00 0.96 C ATOM 1565 CG1 VAL A 109 2.135 -1.770 1.028 1.00 1.95 C ATOM 1566 CG2 VAL A 109 4.549 -1.210 0.727 1.00 1.51 C ATOM 0 H VAL A 109 1.872 -4.231 0.074 1.00 1.02 H new ATOM 0 HA VAL A 109 4.752 -3.829 0.008 1.00 0.83 H new ATOM 0 HB VAL A 109 3.266 -2.137 -0.756 1.00 0.96 H new ATOM 0 HG11 VAL A 109 1.923 -0.724 0.808 1.00 1.95 H new ATOM 0 HG12 VAL A 109 1.311 -2.390 0.674 1.00 1.95 H new ATOM 0 HG13 VAL A 109 2.250 -1.898 2.104 1.00 1.95 H new ATOM 0 HG21 VAL A 109 4.223 -0.188 0.536 1.00 1.51 H new ATOM 0 HG22 VAL A 109 4.768 -1.328 1.788 1.00 1.51 H new ATOM 0 HG23 VAL A 109 5.447 -1.419 0.146 1.00 1.51 H new ATOM 1576 N MET A 110 5.449 -3.973 2.363 1.00 0.76 N ATOM 1577 CA MET A 110 5.987 -4.218 3.703 1.00 0.76 C ATOM 1578 C MET A 110 6.892 -3.067 4.147 1.00 0.75 C ATOM 1579 O MET A 110 7.663 -2.502 3.363 1.00 0.87 O ATOM 1580 CB MET A 110 6.723 -5.566 3.723 1.00 0.87 C ATOM 1581 CG MET A 110 7.156 -5.988 5.133 1.00 1.82 C ATOM 1582 SD MET A 110 7.756 -7.689 5.209 1.00 1.97 S ATOM 1583 CE MET A 110 8.239 -7.747 6.952 1.00 2.68 C ATOM 0 H MET A 110 6.181 -3.811 1.671 1.00 0.76 H new ATOM 0 HA MET A 110 5.165 -4.267 4.418 1.00 0.76 H new ATOM 0 HB2 MET A 110 6.075 -6.335 3.302 1.00 0.87 H new ATOM 0 HB3 MET A 110 7.602 -5.504 3.082 1.00 0.87 H new ATOM 0 HG2 MET A 110 7.940 -5.316 5.482 1.00 1.82 H new ATOM 0 HG3 MET A 110 6.313 -5.875 5.815 1.00 1.82 H new ATOM 0 HE1 MET A 110 8.638 -8.734 7.186 1.00 2.68 H new ATOM 0 HE2 MET A 110 9.002 -6.993 7.143 1.00 2.68 H new ATOM 0 HE3 MET A 110 7.369 -7.549 7.578 1.00 2.68 H new ATOM 1593 N LEU A 111 6.782 -2.733 5.435 1.00 0.69 N ATOM 1594 CA LEU A 111 7.482 -1.631 6.086 1.00 0.70 C ATOM 1595 C LEU A 111 8.563 -2.223 7.003 1.00 0.71 C ATOM 1596 O LEU A 111 8.379 -2.338 8.219 1.00 0.83 O ATOM 1597 CB LEU A 111 6.442 -0.771 6.846 1.00 0.80 C ATOM 1598 CG LEU A 111 5.272 -0.214 6.003 1.00 1.05 C ATOM 1599 CD1 LEU A 111 4.416 0.715 6.876 1.00 2.15 C ATOM 1600 CD2 LEU A 111 5.762 0.540 4.761 1.00 2.20 C ATOM 0 H LEU A 111 6.177 -3.246 6.076 1.00 0.69 H new ATOM 0 HA LEU A 111 7.981 -0.978 5.370 1.00 0.70 H new ATOM 0 HB2 LEU A 111 6.026 -1.371 7.655 1.00 0.80 H new ATOM 0 HB3 LEU A 111 6.962 0.068 7.307 1.00 0.80 H new ATOM 0 HG LEU A 111 4.677 -1.058 5.655 1.00 1.05 H new ATOM 0 HD11 LEU A 111 3.590 1.110 6.285 1.00 2.15 H new ATOM 0 HD12 LEU A 111 4.021 0.156 7.724 1.00 2.15 H new ATOM 0 HD13 LEU A 111 5.029 1.540 7.239 1.00 2.15 H new ATOM 0 HD21 LEU A 111 4.905 0.913 4.200 1.00 2.20 H new ATOM 0 HD22 LEU A 111 6.388 1.378 5.068 1.00 2.20 H new ATOM 0 HD23 LEU A 111 6.342 -0.134 4.131 1.00 2.20 H new ATOM 1612 N MET A 112 9.679 -2.652 6.399 1.00 0.69 N ATOM 1613 CA MET A 112 10.745 -3.369 7.110 1.00 0.76 C ATOM 1614 C MET A 112 11.716 -2.397 7.805 1.00 0.80 C ATOM 1615 O MET A 112 12.167 -1.399 7.224 1.00 0.82 O ATOM 1616 CB MET A 112 11.440 -4.362 6.163 1.00 0.85 C ATOM 1617 CG MET A 112 12.324 -5.342 6.943 1.00 1.16 C ATOM 1618 SD MET A 112 13.117 -6.629 5.944 1.00 1.72 S ATOM 1619 CE MET A 112 14.011 -7.460 7.284 1.00 2.26 C ATOM 0 H MET A 112 9.868 -2.512 5.406 1.00 0.69 H new ATOM 0 HA MET A 112 10.303 -3.957 7.914 1.00 0.76 H new ATOM 0 HB2 MET A 112 10.690 -4.915 5.597 1.00 0.85 H new ATOM 0 HB3 MET A 112 12.047 -3.816 5.440 1.00 0.85 H new ATOM 0 HG2 MET A 112 13.099 -4.775 7.459 1.00 1.16 H new ATOM 0 HG3 MET A 112 11.717 -5.823 7.710 1.00 1.16 H new ATOM 0 HE1 MET A 112 14.576 -8.300 6.879 1.00 2.26 H new ATOM 0 HE2 MET A 112 14.696 -6.756 7.756 1.00 2.26 H new ATOM 0 HE3 MET A 112 13.299 -7.825 8.025 1.00 2.26 H new ATOM 1629 N GLY A 113 11.982 -2.686 9.082 1.00 0.92 N ATOM 1630 CA GLY A 113 12.743 -1.821 9.979 1.00 1.08 C ATOM 1631 C GLY A 113 12.110 -0.440 10.082 1.00 1.18 C ATOM 1632 O GLY A 113 12.728 0.552 9.684 1.00 1.56 O ATOM 0 H GLY A 113 11.666 -3.547 9.528 1.00 0.92 H new ATOM 0 HA2 GLY A 113 12.795 -2.275 10.969 1.00 1.08 H new ATOM 0 HA3 GLY A 113 13.767 -1.728 9.617 1.00 1.08 H new ATOM 1636 N LEU A 114 10.869 -0.377 10.574 1.00 1.20 N ATOM 1637 CA LEU A 114 10.179 0.834 11.012 1.00 1.42 C ATOM 1638 C LEU A 114 10.786 1.284 12.362 1.00 1.38 C ATOM 1639 O LEU A 114 11.894 0.884 12.719 1.00 2.12 O ATOM 1640 CB LEU A 114 8.673 0.462 11.041 1.00 1.93 C ATOM 1641 CG LEU A 114 7.648 1.612 11.064 1.00 2.49 C ATOM 1642 CD1 LEU A 114 7.745 2.524 9.830 1.00 3.28 C ATOM 1643 CD2 LEU A 114 6.221 1.055 11.163 1.00 3.53 C ATOM 0 H LEU A 114 10.293 -1.212 10.682 1.00 1.20 H new ATOM 0 HA LEU A 114 10.297 1.697 10.356 1.00 1.42 H new ATOM 0 HB2 LEU A 114 8.464 -0.155 10.167 1.00 1.93 H new ATOM 0 HB3 LEU A 114 8.499 -0.159 11.919 1.00 1.93 H new ATOM 0 HG LEU A 114 7.883 2.214 11.942 1.00 2.49 H new ATOM 0 HD11 LEU A 114 6.999 3.315 9.903 1.00 3.28 H new ATOM 0 HD12 LEU A 114 8.740 2.967 9.782 1.00 3.28 H new ATOM 0 HD13 LEU A 114 7.565 1.937 8.929 1.00 3.28 H new ATOM 0 HD21 LEU A 114 5.509 1.880 11.178 1.00 3.53 H new ATOM 0 HD22 LEU A 114 6.019 0.417 10.303 1.00 3.53 H new ATOM 0 HD23 LEU A 114 6.121 0.472 12.079 1.00 3.53 H new ATOM 1655 N LYS A 115 10.085 2.103 13.155 1.00 1.26 N ATOM 1656 CA LYS A 115 10.497 2.450 14.537 1.00 1.61 C ATOM 1657 C LYS A 115 9.351 2.965 15.446 1.00 1.82 C ATOM 1658 O LYS A 115 9.271 2.556 16.607 1.00 2.52 O ATOM 1659 CB LYS A 115 11.687 3.435 14.490 1.00 1.91 C ATOM 1660 CG LYS A 115 11.340 4.782 13.834 1.00 2.55 C ATOM 1661 CD LYS A 115 12.476 5.371 12.994 1.00 2.69 C ATOM 1662 CE LYS A 115 12.511 4.564 11.699 1.00 2.59 C ATOM 1663 NZ LYS A 115 13.373 5.165 10.660 1.00 3.24 N ATOM 0 H LYS A 115 9.215 2.548 12.865 1.00 1.26 H new ATOM 0 HA LYS A 115 10.809 1.520 15.012 1.00 1.61 H new ATOM 0 HB2 LYS A 115 12.041 3.614 15.505 1.00 1.91 H new ATOM 0 HB3 LYS A 115 12.509 2.974 13.943 1.00 1.91 H new ATOM 0 HG2 LYS A 115 10.462 4.652 13.201 1.00 2.55 H new ATOM 0 HG3 LYS A 115 11.069 5.495 14.612 1.00 2.55 H new ATOM 0 HD2 LYS A 115 12.302 6.427 12.790 1.00 2.69 H new ATOM 0 HD3 LYS A 115 13.427 5.301 13.522 1.00 2.69 H new ATOM 0 HE2 LYS A 115 12.864 3.556 11.916 1.00 2.59 H new ATOM 0 HE3 LYS A 115 11.497 4.469 11.310 1.00 2.59 H new ATOM 0 HZ1 LYS A 115 12.922 5.056 9.729 1.00 3.24 H new ATOM 0 HZ2 LYS A 115 13.508 6.176 10.863 1.00 3.24 H new ATOM 0 HZ3 LYS A 115 14.296 4.686 10.655 1.00 3.24 H new ATOM 1677 N ARG A 116 8.445 3.797 14.916 1.00 1.64 N ATOM 1678 CA ARG A 116 7.277 4.312 15.645 1.00 2.01 C ATOM 1679 C ARG A 116 6.225 3.198 15.819 1.00 1.55 C ATOM 1680 O ARG A 116 5.996 2.464 14.851 1.00 1.12 O ATOM 1681 CB ARG A 116 6.735 5.525 14.867 1.00 2.55 C ATOM 1682 CG ARG A 116 5.997 6.556 15.736 1.00 3.46 C ATOM 1683 CD ARG A 116 5.624 7.825 14.953 1.00 4.07 C ATOM 1684 NE ARG A 116 6.804 8.469 14.337 1.00 4.71 N ATOM 1685 CZ ARG A 116 6.996 9.757 14.080 1.00 5.79 C ATOM 1686 NH1 ARG A 116 6.145 10.703 14.421 1.00 6.23 N ATOM 1687 NH2 ARG A 116 8.079 10.135 13.441 1.00 6.98 N ATOM 0 H ARG A 116 8.503 4.136 13.956 1.00 1.64 H new ATOM 0 HA ARG A 116 7.548 4.634 16.650 1.00 2.01 H new ATOM 0 HB2 ARG A 116 7.566 6.020 14.364 1.00 2.55 H new ATOM 0 HB3 ARG A 116 6.057 5.170 14.090 1.00 2.55 H new ATOM 0 HG2 ARG A 116 5.092 6.104 16.141 1.00 3.46 H new ATOM 0 HG3 ARG A 116 6.625 6.828 16.584 1.00 3.46 H new ATOM 0 HD2 ARG A 116 4.904 7.571 14.175 1.00 4.07 H new ATOM 0 HD3 ARG A 116 5.135 8.532 15.623 1.00 4.07 H new ATOM 0 HE ARG A 116 7.567 7.844 14.077 1.00 4.71 H new ATOM 0 HH11 ARG A 116 5.283 10.462 14.910 1.00 6.23 H new ATOM 0 HH12 ARG A 116 6.348 11.677 14.196 1.00 6.23 H new ATOM 0 HH21 ARG A 116 8.765 9.441 13.146 1.00 6.98 H new ATOM 0 HH22 ARG A 116 8.234 11.123 13.240 1.00 6.98 H new ATOM 1701 N PRO A 117 5.589 3.059 17.000 1.00 2.01 N ATOM 1702 CA PRO A 117 4.508 2.099 17.217 1.00 1.89 C ATOM 1703 C PRO A 117 3.236 2.560 16.501 1.00 1.65 C ATOM 1704 O PRO A 117 3.063 3.755 16.260 1.00 2.19 O ATOM 1705 CB PRO A 117 4.289 2.069 18.731 1.00 2.89 C ATOM 1706 CG PRO A 117 4.689 3.475 19.169 1.00 3.46 C ATOM 1707 CD PRO A 117 5.846 3.806 18.225 1.00 2.94 C ATOM 0 HA PRO A 117 4.755 1.113 16.824 1.00 1.89 H new ATOM 0 HB2 PRO A 117 3.252 1.848 18.984 1.00 2.89 H new ATOM 0 HB3 PRO A 117 4.903 1.307 19.212 1.00 2.89 H new ATOM 0 HG2 PRO A 117 3.866 4.181 19.063 1.00 3.46 H new ATOM 0 HG3 PRO A 117 4.999 3.501 20.214 1.00 3.46 H new ATOM 0 HD2 PRO A 117 5.894 4.877 18.027 1.00 2.94 H new ATOM 0 HD3 PRO A 117 6.802 3.520 18.664 1.00 2.94 H new ATOM 1715 N LEU A 118 2.346 1.609 16.185 1.00 1.31 N ATOM 1716 CA LEU A 118 1.035 1.863 15.584 1.00 1.39 C ATOM 1717 C LEU A 118 -0.038 0.896 16.115 1.00 1.40 C ATOM 1718 O LEU A 118 0.178 -0.329 16.097 1.00 1.51 O ATOM 1719 CB LEU A 118 1.120 1.738 14.049 1.00 1.51 C ATOM 1720 CG LEU A 118 2.111 2.658 13.308 1.00 1.61 C ATOM 1721 CD1 LEU A 118 2.248 2.194 11.849 1.00 2.39 C ATOM 1722 CD2 LEU A 118 1.655 4.128 13.331 1.00 2.17 C ATOM 0 H LEU A 118 2.525 0.618 16.345 1.00 1.31 H new ATOM 0 HA LEU A 118 0.744 2.877 15.859 1.00 1.39 H new ATOM 0 HB2 LEU A 118 1.378 0.706 13.810 1.00 1.51 H new ATOM 0 HB3 LEU A 118 0.125 1.920 13.642 1.00 1.51 H new ATOM 0 HG LEU A 118 3.071 2.594 13.820 1.00 1.61 H new ATOM 0 HD11 LEU A 118 2.948 2.844 11.325 1.00 2.39 H new ATOM 0 HD12 LEU A 118 2.618 1.169 11.826 1.00 2.39 H new ATOM 0 HD13 LEU A 118 1.275 2.240 11.360 1.00 2.39 H new ATOM 0 HD21 LEU A 118 2.381 4.742 12.798 1.00 2.17 H new ATOM 0 HD22 LEU A 118 0.682 4.215 12.848 1.00 2.17 H new ATOM 0 HD23 LEU A 118 1.579 4.469 14.363 1.00 2.17 H new ATOM 1734 N LYS A 119 -1.207 1.417 16.547 1.00 1.47 N ATOM 1735 CA LYS A 119 -2.352 0.635 17.051 1.00 1.54 C ATOM 1736 C LYS A 119 -3.647 0.833 16.243 1.00 1.47 C ATOM 1737 O LYS A 119 -3.795 1.783 15.486 1.00 1.56 O ATOM 1738 CB LYS A 119 -2.564 0.898 18.556 1.00 1.79 C ATOM 1739 CG LYS A 119 -3.219 2.253 18.876 1.00 1.92 C ATOM 1740 CD LYS A 119 -3.501 2.352 20.380 1.00 2.48 C ATOM 1741 CE LYS A 119 -4.265 3.638 20.716 1.00 3.63 C ATOM 1742 NZ LYS A 119 -4.583 3.708 22.160 1.00 4.39 N ATOM 0 H LYS A 119 -1.383 2.422 16.554 1.00 1.47 H new ATOM 0 HA LYS A 119 -2.095 -0.415 16.913 1.00 1.54 H new ATOM 0 HB2 LYS A 119 -3.184 0.102 18.968 1.00 1.79 H new ATOM 0 HB3 LYS A 119 -1.600 0.845 19.061 1.00 1.79 H new ATOM 0 HG2 LYS A 119 -2.563 3.066 18.565 1.00 1.92 H new ATOM 0 HG3 LYS A 119 -4.147 2.360 18.315 1.00 1.92 H new ATOM 0 HD2 LYS A 119 -4.080 1.487 20.702 1.00 2.48 H new ATOM 0 HD3 LYS A 119 -2.561 2.329 20.931 1.00 2.48 H new ATOM 0 HE2 LYS A 119 -3.669 4.504 20.430 1.00 3.63 H new ATOM 0 HE3 LYS A 119 -5.186 3.679 20.135 1.00 3.63 H new ATOM 0 HZ1 LYS A 119 -5.100 4.588 22.359 1.00 4.39 H new ATOM 0 HZ2 LYS A 119 -5.172 2.893 22.426 1.00 4.39 H new ATOM 0 HZ3 LYS A 119 -3.701 3.692 22.711 1.00 4.39 H new ATOM 1756 N VAL A 120 -4.615 -0.050 16.458 1.00 1.54 N ATOM 1757 CA VAL A 120 -5.897 -0.198 15.698 1.00 1.66 C ATOM 1758 C VAL A 120 -6.890 1.002 15.583 1.00 1.82 C ATOM 1759 O VAL A 120 -7.987 0.853 15.042 1.00 2.49 O ATOM 1760 CB VAL A 120 -6.659 -1.462 16.154 1.00 1.82 C ATOM 1761 CG1 VAL A 120 -5.723 -2.670 15.965 1.00 2.98 C ATOM 1762 CG2 VAL A 120 -7.096 -1.386 17.627 1.00 2.39 C ATOM 0 H VAL A 120 -4.542 -0.735 17.210 1.00 1.54 H new ATOM 0 HA VAL A 120 -5.515 -0.266 14.679 1.00 1.66 H new ATOM 0 HB VAL A 120 -7.565 -1.554 15.555 1.00 1.82 H new ATOM 0 HG11 VAL A 120 -6.235 -3.580 16.279 1.00 2.98 H new ATOM 0 HG12 VAL A 120 -5.446 -2.754 14.914 1.00 2.98 H new ATOM 0 HG13 VAL A 120 -4.825 -2.532 16.567 1.00 2.98 H new ATOM 0 HG21 VAL A 120 -7.627 -2.299 17.897 1.00 2.39 H new ATOM 0 HG22 VAL A 120 -6.217 -1.277 18.262 1.00 2.39 H new ATOM 0 HG23 VAL A 120 -7.754 -0.528 17.768 1.00 2.39 H new ATOM 1772 N GLY A 121 -6.534 2.189 16.088 1.00 1.51 N ATOM 1773 CA GLY A 121 -7.276 3.447 15.902 1.00 1.68 C ATOM 1774 C GLY A 121 -6.436 4.555 15.264 1.00 1.69 C ATOM 1775 O GLY A 121 -6.823 5.719 15.343 1.00 1.73 O ATOM 0 H GLY A 121 -5.695 2.307 16.656 1.00 1.51 H new ATOM 0 HA2 GLY A 121 -8.149 3.257 15.278 1.00 1.68 H new ATOM 0 HA3 GLY A 121 -7.644 3.790 16.869 1.00 1.68 H new ATOM 1779 N GLU A 122 -5.269 4.228 14.710 1.00 1.81 N ATOM 1780 CA GLU A 122 -4.220 5.186 14.391 1.00 1.80 C ATOM 1781 C GLU A 122 -4.095 5.418 12.877 1.00 1.89 C ATOM 1782 O GLU A 122 -4.386 4.539 12.057 1.00 1.98 O ATOM 1783 CB GLU A 122 -2.929 4.673 15.048 1.00 1.82 C ATOM 1784 CG GLU A 122 -1.821 5.715 15.190 1.00 1.84 C ATOM 1785 CD GLU A 122 -0.986 5.474 16.454 1.00 1.88 C ATOM 1786 OE1 GLU A 122 -0.786 4.312 16.865 1.00 2.83 O ATOM 1787 OE2 GLU A 122 -0.568 6.473 17.076 1.00 1.91 O ATOM 0 H GLU A 122 -5.025 3.268 14.467 1.00 1.81 H new ATOM 0 HA GLU A 122 -4.456 6.173 14.788 1.00 1.80 H new ATOM 0 HB2 GLU A 122 -3.172 4.285 16.037 1.00 1.82 H new ATOM 0 HB3 GLU A 122 -2.548 3.837 14.462 1.00 1.82 H new ATOM 0 HG2 GLU A 122 -1.174 5.683 14.313 1.00 1.84 H new ATOM 0 HG3 GLU A 122 -2.260 6.712 15.226 1.00 1.84 H new ATOM 1794 N THR A 123 -3.678 6.638 12.516 1.00 1.98 N ATOM 1795 CA THR A 123 -3.457 7.110 11.140 1.00 2.19 C ATOM 1796 C THR A 123 -1.953 7.204 10.903 1.00 1.89 C ATOM 1797 O THR A 123 -1.206 7.662 11.763 1.00 1.90 O ATOM 1798 CB THR A 123 -4.150 8.461 10.917 1.00 2.67 C ATOM 1799 OG1 THR A 123 -5.497 8.343 11.300 1.00 3.72 O ATOM 1800 CG2 THR A 123 -4.157 8.900 9.453 1.00 3.63 C ATOM 0 H THR A 123 -3.475 7.359 13.208 1.00 1.98 H new ATOM 0 HA THR A 123 -3.890 6.410 10.425 1.00 2.19 H new ATOM 0 HB THR A 123 -3.596 9.195 11.502 1.00 2.67 H new ATOM 0 HG1 THR A 123 -5.952 9.200 11.164 1.00 3.72 H new ATOM 0 HG21 THR A 123 -4.662 9.862 9.364 1.00 3.63 H new ATOM 0 HG22 THR A 123 -3.131 8.994 9.096 1.00 3.63 H new ATOM 0 HG23 THR A 123 -4.683 8.158 8.853 1.00 3.63 H new ATOM 1808 N VAL A 124 -1.516 6.757 9.733 1.00 1.78 N ATOM 1809 CA VAL A 124 -0.124 6.449 9.377 1.00 1.68 C ATOM 1810 C VAL A 124 0.296 7.334 8.211 1.00 1.40 C ATOM 1811 O VAL A 124 -0.509 7.633 7.332 1.00 1.40 O ATOM 1812 CB VAL A 124 0.055 4.973 8.954 1.00 1.95 C ATOM 1813 CG1 VAL A 124 1.545 4.582 8.914 1.00 2.05 C ATOM 1814 CG2 VAL A 124 -0.689 4.011 9.883 1.00 3.09 C ATOM 0 H VAL A 124 -2.156 6.587 8.957 1.00 1.78 H new ATOM 0 HA VAL A 124 0.491 6.631 10.259 1.00 1.68 H new ATOM 0 HB VAL A 124 -0.372 4.888 7.955 1.00 1.95 H new ATOM 0 HG11 VAL A 124 1.639 3.539 8.613 1.00 2.05 H new ATOM 0 HG12 VAL A 124 2.068 5.215 8.197 1.00 2.05 H new ATOM 0 HG13 VAL A 124 1.983 4.716 9.903 1.00 2.05 H new ATOM 0 HG21 VAL A 124 -0.534 2.986 9.546 1.00 3.09 H new ATOM 0 HG22 VAL A 124 -0.310 4.120 10.899 1.00 3.09 H new ATOM 0 HG23 VAL A 124 -1.754 4.241 9.867 1.00 3.09 H new ATOM 1824 N ASN A 125 1.559 7.745 8.202 1.00 1.31 N ATOM 1825 CA ASN A 125 2.084 8.676 7.204 1.00 1.11 C ATOM 1826 C ASN A 125 2.745 7.906 6.045 1.00 0.93 C ATOM 1827 O ASN A 125 3.718 7.179 6.241 1.00 0.97 O ATOM 1828 CB ASN A 125 3.035 9.667 7.903 1.00 1.28 C ATOM 1829 CG ASN A 125 2.298 10.709 8.750 1.00 1.63 C ATOM 1830 OD1 ASN A 125 2.481 11.903 8.584 1.00 2.31 O ATOM 1831 ND2 ASN A 125 1.445 10.322 9.677 1.00 2.18 N ATOM 0 H ASN A 125 2.251 7.443 8.887 1.00 1.31 H new ATOM 0 HA ASN A 125 1.278 9.255 6.754 1.00 1.11 H new ATOM 0 HB2 ASN A 125 3.725 9.112 8.539 1.00 1.28 H new ATOM 0 HB3 ASN A 125 3.636 10.178 7.150 1.00 1.28 H new ATOM 0 HD21 ASN A 125 0.953 11.016 10.239 1.00 2.18 H new ATOM 0 HD22 ASN A 125 1.277 9.328 9.832 1.00 2.18 H new ATOM 1838 N ILE A 126 2.193 8.052 4.832 1.00 0.96 N ATOM 1839 CA ILE A 126 2.509 7.271 3.622 1.00 0.95 C ATOM 1840 C ILE A 126 2.700 8.203 2.415 1.00 0.93 C ATOM 1841 O ILE A 126 2.241 9.352 2.405 1.00 0.93 O ATOM 1842 CB ILE A 126 1.396 6.203 3.425 1.00 1.06 C ATOM 1843 CG1 ILE A 126 1.502 5.041 4.447 1.00 1.52 C ATOM 1844 CG2 ILE A 126 1.293 5.621 2.007 1.00 2.19 C ATOM 1845 CD1 ILE A 126 2.815 4.245 4.462 1.00 2.71 C ATOM 0 H ILE A 126 1.475 8.755 4.657 1.00 0.96 H new ATOM 0 HA ILE A 126 3.456 6.743 3.729 1.00 0.95 H new ATOM 0 HB ILE A 126 0.480 6.767 3.601 1.00 1.06 H new ATOM 0 HG12 ILE A 126 1.343 5.451 5.444 1.00 1.52 H new ATOM 0 HG13 ILE A 126 0.686 4.345 4.255 1.00 1.52 H new ATOM 0 HG21 ILE A 126 0.489 4.886 1.973 1.00 2.19 H new ATOM 0 HG22 ILE A 126 1.083 6.423 1.299 1.00 2.19 H new ATOM 0 HG23 ILE A 126 2.235 5.140 1.742 1.00 2.19 H new ATOM 0 HD11 ILE A 126 2.758 3.464 5.220 1.00 2.71 H new ATOM 0 HD12 ILE A 126 2.976 3.791 3.484 1.00 2.71 H new ATOM 0 HD13 ILE A 126 3.644 4.914 4.692 1.00 2.71 H new ATOM 1857 N THR A 127 3.457 7.754 1.408 1.00 0.94 N ATOM 1858 CA THR A 127 3.923 8.612 0.314 1.00 0.87 C ATOM 1859 C THR A 127 3.980 7.811 -0.983 1.00 1.08 C ATOM 1860 O THR A 127 4.738 6.853 -1.102 1.00 1.42 O ATOM 1861 CB THR A 127 5.279 9.220 0.676 1.00 0.94 C ATOM 1862 OG1 THR A 127 5.213 9.781 1.967 1.00 1.57 O ATOM 1863 CG2 THR A 127 5.633 10.354 -0.270 1.00 1.31 C ATOM 0 H THR A 127 3.764 6.785 1.329 1.00 0.94 H new ATOM 0 HA THR A 127 3.224 9.434 0.161 1.00 0.87 H new ATOM 0 HB THR A 127 6.023 8.426 0.616 1.00 0.94 H new ATOM 0 HG1 THR A 127 6.082 10.169 2.200 1.00 1.57 H new ATOM 0 HG21 THR A 127 6.601 10.770 0.007 1.00 1.31 H new ATOM 0 HG22 THR A 127 5.680 9.975 -1.291 1.00 1.31 H new ATOM 0 HG23 THR A 127 4.872 11.132 -0.207 1.00 1.31 H new ATOM 1871 N LEU A 128 3.151 8.192 -1.952 1.00 1.17 N ATOM 1872 CA LEU A 128 3.045 7.588 -3.283 1.00 1.53 C ATOM 1873 C LEU A 128 3.938 8.350 -4.272 1.00 1.96 C ATOM 1874 O LEU A 128 4.460 9.410 -3.932 1.00 2.71 O ATOM 1875 CB LEU A 128 1.572 7.656 -3.744 1.00 1.83 C ATOM 1876 CG LEU A 128 0.570 6.731 -3.018 1.00 2.14 C ATOM 1877 CD1 LEU A 128 0.538 6.842 -1.489 1.00 2.82 C ATOM 1878 CD2 LEU A 128 -0.821 7.035 -3.578 1.00 2.45 C ATOM 0 H LEU A 128 2.502 8.969 -1.827 1.00 1.17 H new ATOM 0 HA LEU A 128 3.372 6.549 -3.245 1.00 1.53 H new ATOM 0 HB2 LEU A 128 1.228 8.684 -3.631 1.00 1.83 H new ATOM 0 HB3 LEU A 128 1.538 7.424 -4.808 1.00 1.83 H new ATOM 0 HG LEU A 128 0.900 5.710 -3.207 1.00 2.14 H new ATOM 0 HD11 LEU A 128 -0.201 6.147 -1.089 1.00 2.82 H new ATOM 0 HD12 LEU A 128 1.521 6.598 -1.086 1.00 2.82 H new ATOM 0 HD13 LEU A 128 0.271 7.860 -1.204 1.00 2.82 H new ATOM 0 HD21 LEU A 128 -1.558 6.399 -3.088 1.00 2.45 H new ATOM 0 HD22 LEU A 128 -1.066 8.081 -3.395 1.00 2.45 H new ATOM 0 HD23 LEU A 128 -0.832 6.842 -4.651 1.00 2.45 H new ATOM 1890 N LYS A 129 4.048 7.867 -5.514 1.00 1.83 N ATOM 1891 CA LYS A 129 4.617 8.633 -6.638 1.00 1.97 C ATOM 1892 C LYS A 129 3.703 8.565 -7.876 1.00 1.64 C ATOM 1893 O LYS A 129 3.251 7.483 -8.260 1.00 1.48 O ATOM 1894 CB LYS A 129 6.051 8.149 -6.956 1.00 2.36 C ATOM 1895 CG LYS A 129 6.990 8.210 -5.735 1.00 3.18 C ATOM 1896 CD LYS A 129 8.477 7.990 -6.047 1.00 3.78 C ATOM 1897 CE LYS A 129 8.828 6.575 -6.536 1.00 4.46 C ATOM 1898 NZ LYS A 129 10.301 6.381 -6.610 1.00 5.23 N ATOM 0 H LYS A 129 3.744 6.929 -5.774 1.00 1.83 H new ATOM 0 HA LYS A 129 4.679 9.680 -6.343 1.00 1.97 H new ATOM 0 HB2 LYS A 129 6.010 7.124 -7.325 1.00 2.36 H new ATOM 0 HB3 LYS A 129 6.466 8.760 -7.758 1.00 2.36 H new ATOM 0 HG2 LYS A 129 6.875 9.182 -5.256 1.00 3.18 H new ATOM 0 HG3 LYS A 129 6.671 7.459 -5.013 1.00 3.18 H new ATOM 0 HD2 LYS A 129 8.785 8.709 -6.806 1.00 3.78 H new ATOM 0 HD3 LYS A 129 9.058 8.204 -5.150 1.00 3.78 H new ATOM 0 HE2 LYS A 129 8.395 5.836 -5.861 1.00 4.46 H new ATOM 0 HE3 LYS A 129 8.387 6.407 -7.518 1.00 4.46 H new ATOM 0 HZ1 LYS A 129 10.508 5.418 -6.943 1.00 5.23 H new ATOM 0 HZ2 LYS A 129 10.709 7.071 -7.272 1.00 5.23 H new ATOM 0 HZ3 LYS A 129 10.717 6.518 -5.667 1.00 5.23 H new ATOM 1912 N ALA A 130 3.414 9.693 -8.529 1.00 1.78 N ATOM 1913 CA ALA A 130 2.697 9.713 -9.808 1.00 1.60 C ATOM 1914 C ALA A 130 3.562 9.143 -10.946 1.00 1.67 C ATOM 1915 O ALA A 130 4.775 9.350 -10.928 1.00 2.17 O ATOM 1916 CB ALA A 130 2.182 11.130 -10.084 1.00 2.06 C ATOM 0 H ALA A 130 3.670 10.619 -8.187 1.00 1.78 H new ATOM 0 HA ALA A 130 1.829 9.057 -9.750 1.00 1.60 H new ATOM 0 HB1 ALA A 130 1.649 11.145 -11.035 1.00 2.06 H new ATOM 0 HB2 ALA A 130 1.506 11.434 -9.284 1.00 2.06 H new ATOM 0 HB3 ALA A 130 3.024 11.821 -10.129 1.00 2.06 H new ATOM 1922 N THR A 131 2.955 8.433 -11.915 1.00 1.49 N ATOM 1923 CA THR A 131 3.696 7.686 -12.948 1.00 1.92 C ATOM 1924 C THR A 131 4.478 8.558 -13.936 1.00 2.42 C ATOM 1925 O THR A 131 5.353 8.029 -14.614 1.00 3.21 O ATOM 1926 CB THR A 131 2.771 6.695 -13.663 1.00 2.02 C ATOM 1927 OG1 THR A 131 3.582 5.757 -14.309 1.00 2.71 O ATOM 1928 CG2 THR A 131 1.849 7.333 -14.704 1.00 2.34 C ATOM 0 H THR A 131 1.941 8.361 -12.004 1.00 1.49 H new ATOM 0 HA THR A 131 4.468 7.130 -12.416 1.00 1.92 H new ATOM 0 HB THR A 131 2.121 6.255 -12.907 1.00 2.02 H new ATOM 0 HG1 THR A 131 4.377 6.204 -14.668 1.00 2.71 H new ATOM 0 HG21 THR A 131 1.229 6.562 -15.162 1.00 2.34 H new ATOM 0 HG22 THR A 131 1.211 8.072 -14.220 1.00 2.34 H new ATOM 0 HG23 THR A 131 2.450 7.819 -15.473 1.00 2.34 H new ATOM 1936 N ASP A 132 4.185 9.854 -14.006 1.00 2.30 N ATOM 1937 CA ASP A 132 4.900 10.869 -14.796 1.00 3.00 C ATOM 1938 C ASP A 132 4.608 12.258 -14.190 1.00 3.23 C ATOM 1939 O ASP A 132 4.024 13.137 -14.821 1.00 3.68 O ATOM 1940 CB ASP A 132 4.531 10.762 -16.297 1.00 3.40 C ATOM 1941 CG ASP A 132 5.345 11.712 -17.193 1.00 3.52 C ATOM 1942 OD1 ASP A 132 6.535 11.932 -16.923 1.00 4.09 O ATOM 1943 OD2 ASP A 132 4.745 12.168 -18.220 1.00 3.86 O ATOM 0 H ASP A 132 3.402 10.252 -13.488 1.00 2.30 H new ATOM 0 HA ASP A 132 5.976 10.703 -14.750 1.00 3.00 H new ATOM 0 HB2 ASP A 132 4.688 9.736 -16.630 1.00 3.40 H new ATOM 0 HB3 ASP A 132 3.470 10.978 -16.419 1.00 3.40 H new ATOM 1948 N GLY A 133 4.923 12.415 -12.898 1.00 3.24 N ATOM 1949 CA GLY A 133 4.603 13.625 -12.132 1.00 3.60 C ATOM 1950 C GLY A 133 5.549 13.854 -10.962 1.00 3.87 C ATOM 1951 O GLY A 133 6.610 14.452 -11.143 1.00 4.74 O ATOM 0 H GLY A 133 5.409 11.703 -12.353 1.00 3.24 H new ATOM 0 HA2 GLY A 133 4.639 14.489 -12.796 1.00 3.60 H new ATOM 0 HA3 GLY A 133 3.582 13.552 -11.758 1.00 3.60 H new ATOM 1955 N ARG A 134 5.153 13.402 -9.762 1.00 3.59 N ATOM 1956 CA ARG A 134 5.899 13.569 -8.522 1.00 4.16 C ATOM 1957 C ARG A 134 5.343 12.756 -7.345 1.00 4.15 C ATOM 1958 O ARG A 134 4.293 12.114 -7.413 1.00 4.49 O ATOM 1959 CB ARG A 134 6.037 15.071 -8.186 1.00 4.71 C ATOM 1960 CG ARG A 134 7.521 15.465 -8.165 1.00 6.34 C ATOM 1961 CD ARG A 134 7.706 16.973 -8.335 1.00 6.98 C ATOM 1962 NE ARG A 134 9.131 17.329 -8.317 1.00 8.51 N ATOM 1963 CZ ARG A 134 10.000 17.263 -9.316 1.00 9.77 C ATOM 1964 NH1 ARG A 134 9.685 16.830 -10.520 1.00 10.05 N ATOM 1965 NH2 ARG A 134 11.209 17.718 -9.075 1.00 11.10 N ATOM 0 H ARG A 134 4.277 12.896 -9.633 1.00 3.59 H new ATOM 0 HA ARG A 134 6.893 13.154 -8.690 1.00 4.16 H new ATOM 0 HB2 ARG A 134 5.503 15.669 -8.925 1.00 4.71 H new ATOM 0 HB3 ARG A 134 5.582 15.280 -7.218 1.00 4.71 H new ATOM 0 HG2 ARG A 134 7.969 15.147 -7.224 1.00 6.34 H new ATOM 0 HG3 ARG A 134 8.048 14.941 -8.962 1.00 6.34 H new ATOM 0 HD2 ARG A 134 7.258 17.295 -9.275 1.00 6.98 H new ATOM 0 HD3 ARG A 134 7.185 17.500 -7.536 1.00 6.98 H new ATOM 0 HE ARG A 134 9.497 17.668 -7.427 1.00 8.51 H new ATOM 0 HH11 ARG A 134 8.732 16.525 -10.719 1.00 10.05 H new ATOM 0 HH12 ARG A 134 10.394 16.800 -11.253 1.00 10.05 H new ATOM 0 HH21 ARG A 134 11.438 18.097 -8.156 1.00 11.10 H new ATOM 0 HH22 ARG A 134 11.919 17.692 -9.807 1.00 11.10 H new ATOM 1979 N THR A 135 6.134 12.784 -6.284 1.00 4.44 N ATOM 1980 CA THR A 135 5.948 12.160 -4.966 1.00 4.59 C ATOM 1981 C THR A 135 4.866 12.887 -4.168 1.00 2.91 C ATOM 1982 O THR A 135 4.778 14.111 -4.239 1.00 3.13 O ATOM 1983 CB THR A 135 7.293 12.226 -4.238 1.00 6.32 C ATOM 1984 OG1 THR A 135 8.325 11.873 -5.137 1.00 7.67 O ATOM 1985 CG2 THR A 135 7.390 11.323 -3.018 1.00 7.19 C ATOM 0 H THR A 135 7.016 13.295 -6.320 1.00 4.44 H new ATOM 0 HA THR A 135 5.622 11.126 -5.077 1.00 4.59 H new ATOM 0 HB THR A 135 7.391 13.251 -3.880 1.00 6.32 H new ATOM 0 HG1 THR A 135 9.189 11.915 -4.676 1.00 7.67 H new ATOM 0 HG21 THR A 135 8.374 11.431 -2.562 1.00 7.19 H new ATOM 0 HG22 THR A 135 6.623 11.603 -2.296 1.00 7.19 H new ATOM 0 HG23 THR A 135 7.242 10.286 -3.320 1.00 7.19 H new ATOM 1993 N LEU A 136 4.033 12.152 -3.420 1.00 2.08 N ATOM 1994 CA LEU A 136 2.739 12.635 -2.889 1.00 1.40 C ATOM 1995 C LEU A 136 2.322 12.016 -1.534 1.00 1.33 C ATOM 1996 O LEU A 136 2.110 10.813 -1.405 1.00 1.41 O ATOM 1997 CB LEU A 136 1.673 12.447 -3.999 1.00 3.08 C ATOM 1998 CG LEU A 136 0.429 13.358 -3.876 1.00 3.98 C ATOM 1999 CD1 LEU A 136 -0.278 13.451 -5.237 1.00 5.87 C ATOM 2000 CD2 LEU A 136 -0.585 12.861 -2.836 1.00 4.57 C ATOM 0 H LEU A 136 4.237 11.187 -3.159 1.00 2.08 H new ATOM 0 HA LEU A 136 2.842 13.691 -2.641 1.00 1.40 H new ATOM 0 HB2 LEU A 136 2.142 12.628 -4.966 1.00 3.08 H new ATOM 0 HB3 LEU A 136 1.345 11.408 -3.993 1.00 3.08 H new ATOM 0 HG LEU A 136 0.791 14.332 -3.547 1.00 3.98 H new ATOM 0 HD11 LEU A 136 -1.154 14.093 -5.149 1.00 5.87 H new ATOM 0 HD12 LEU A 136 0.406 13.870 -5.975 1.00 5.87 H new ATOM 0 HD13 LEU A 136 -0.588 12.456 -5.555 1.00 5.87 H new ATOM 0 HD21 LEU A 136 -1.433 13.545 -2.799 1.00 4.57 H new ATOM 0 HD22 LEU A 136 -0.933 11.866 -3.113 1.00 4.57 H new ATOM 0 HD23 LEU A 136 -0.110 12.819 -1.856 1.00 4.57 H new ATOM 2012 N ASN A 137 2.165 12.877 -0.525 1.00 1.50 N ATOM 2013 CA ASN A 137 1.838 12.618 0.878 1.00 1.57 C ATOM 2014 C ASN A 137 0.355 12.264 1.115 1.00 1.79 C ATOM 2015 O ASN A 137 -0.559 13.075 0.963 1.00 2.23 O ATOM 2016 CB ASN A 137 2.265 13.842 1.714 1.00 1.78 C ATOM 2017 CG ASN A 137 1.886 15.181 1.075 1.00 2.91 C ATOM 2018 OD1 ASN A 137 2.620 15.715 0.262 1.00 4.15 O ATOM 2019 ND2 ASN A 137 0.728 15.737 1.361 1.00 3.64 N ATOM 0 H ASN A 137 2.276 13.878 -0.689 1.00 1.50 H new ATOM 0 HA ASN A 137 2.389 11.732 1.192 1.00 1.57 H new ATOM 0 HB2 ASN A 137 1.806 13.776 2.700 1.00 1.78 H new ATOM 0 HB3 ASN A 137 3.344 13.812 1.862 1.00 1.78 H new ATOM 0 HD21 ASN A 137 0.453 16.606 0.904 1.00 3.64 H new ATOM 0 HD22 ASN A 137 0.106 15.299 2.040 1.00 3.64 H new ATOM 2026 N VAL A 138 0.154 11.033 1.569 1.00 1.60 N ATOM 2027 CA VAL A 138 -1.144 10.367 1.792 1.00 1.93 C ATOM 2028 C VAL A 138 -1.257 9.817 3.221 1.00 1.73 C ATOM 2029 O VAL A 138 -0.283 9.330 3.798 1.00 1.57 O ATOM 2030 CB VAL A 138 -1.346 9.240 0.746 1.00 2.33 C ATOM 2031 CG1 VAL A 138 -2.550 8.328 1.018 1.00 2.72 C ATOM 2032 CG2 VAL A 138 -1.517 9.858 -0.653 1.00 2.70 C ATOM 0 H VAL A 138 0.937 10.426 1.810 1.00 1.60 H new ATOM 0 HA VAL A 138 -1.934 11.108 1.669 1.00 1.93 H new ATOM 0 HB VAL A 138 -0.454 8.617 0.813 1.00 2.33 H new ATOM 0 HG11 VAL A 138 -2.615 7.569 0.238 1.00 2.72 H new ATOM 0 HG12 VAL A 138 -2.428 7.843 1.986 1.00 2.72 H new ATOM 0 HG13 VAL A 138 -3.463 8.923 1.023 1.00 2.72 H new ATOM 0 HG21 VAL A 138 -1.659 9.064 -1.387 1.00 2.70 H new ATOM 0 HG22 VAL A 138 -2.387 10.515 -0.657 1.00 2.70 H new ATOM 0 HG23 VAL A 138 -0.627 10.433 -0.908 1.00 2.70 H new ATOM 2042 N ALA A 139 -2.469 9.869 3.776 1.00 1.98 N ATOM 2043 CA ALA A 139 -2.820 9.215 5.037 1.00 2.01 C ATOM 2044 C ALA A 139 -3.263 7.757 4.798 1.00 2.08 C ATOM 2045 O ALA A 139 -4.164 7.510 3.996 1.00 2.23 O ATOM 2046 CB ALA A 139 -3.926 10.042 5.707 1.00 2.31 C ATOM 0 H ALA A 139 -3.247 10.376 3.354 1.00 1.98 H new ATOM 0 HA ALA A 139 -1.951 9.169 5.694 1.00 2.01 H new ATOM 0 HB1 ALA A 139 -4.207 9.576 6.651 1.00 2.31 H new ATOM 0 HB2 ALA A 139 -3.562 11.052 5.895 1.00 2.31 H new ATOM 0 HB3 ALA A 139 -4.795 10.086 5.051 1.00 2.31 H new ATOM 2052 N ALA A 140 -2.646 6.812 5.508 1.00 2.09 N ATOM 2053 CA ALA A 140 -3.060 5.408 5.635 1.00 2.07 C ATOM 2054 C ALA A 140 -3.483 5.116 7.088 1.00 1.95 C ATOM 2055 O ALA A 140 -3.426 6.021 7.926 1.00 1.96 O ATOM 2056 CB ALA A 140 -1.884 4.551 5.161 1.00 2.06 C ATOM 0 H ALA A 140 -1.799 7.013 6.039 1.00 2.09 H new ATOM 0 HA ALA A 140 -3.931 5.177 5.021 1.00 2.07 H new ATOM 0 HB1 ALA A 140 -2.148 3.496 5.238 1.00 2.06 H new ATOM 0 HB2 ALA A 140 -1.653 4.792 4.123 1.00 2.06 H new ATOM 0 HB3 ALA A 140 -1.012 4.753 5.783 1.00 2.06 H new ATOM 2062 N THR A 141 -3.892 3.880 7.407 1.00 1.89 N ATOM 2063 CA THR A 141 -4.610 3.562 8.665 1.00 1.81 C ATOM 2064 C THR A 141 -4.076 2.301 9.324 1.00 1.53 C ATOM 2065 O THR A 141 -3.494 1.435 8.673 1.00 1.53 O ATOM 2066 CB THR A 141 -6.114 3.439 8.368 1.00 2.13 C ATOM 2067 OG1 THR A 141 -6.523 4.671 7.829 1.00 2.04 O ATOM 2068 CG2 THR A 141 -6.988 3.217 9.609 1.00 2.53 C ATOM 0 H THR A 141 -3.739 3.070 6.807 1.00 1.89 H new ATOM 0 HA THR A 141 -4.444 4.373 9.374 1.00 1.81 H new ATOM 0 HB THR A 141 -6.238 2.578 7.712 1.00 2.13 H new ATOM 0 HG1 THR A 141 -7.480 4.636 7.622 1.00 2.04 H new ATOM 0 HG21 THR A 141 -8.033 3.141 9.309 1.00 2.53 H new ATOM 0 HG22 THR A 141 -6.686 2.296 10.107 1.00 2.53 H new ATOM 0 HG23 THR A 141 -6.867 4.056 10.294 1.00 2.53 H new ATOM 2076 N VAL A 142 -4.297 2.149 10.621 1.00 1.49 N ATOM 2077 CA VAL A 142 -4.089 0.874 11.315 1.00 1.39 C ATOM 2078 C VAL A 142 -5.422 0.438 11.900 1.00 1.34 C ATOM 2079 O VAL A 142 -6.011 1.139 12.710 1.00 1.38 O ATOM 2080 CB VAL A 142 -2.998 1.049 12.398 1.00 1.29 C ATOM 2081 CG1 VAL A 142 -2.765 -0.242 13.196 1.00 1.70 C ATOM 2082 CG2 VAL A 142 -1.663 1.447 11.754 1.00 1.60 C ATOM 0 H VAL A 142 -4.625 2.901 11.227 1.00 1.49 H new ATOM 0 HA VAL A 142 -3.739 0.099 10.633 1.00 1.39 H new ATOM 0 HB VAL A 142 -3.353 1.829 13.072 1.00 1.29 H new ATOM 0 HG11 VAL A 142 -1.991 -0.072 13.945 1.00 1.70 H new ATOM 0 HG12 VAL A 142 -3.691 -0.536 13.691 1.00 1.70 H new ATOM 0 HG13 VAL A 142 -2.448 -1.036 12.520 1.00 1.70 H new ATOM 0 HG21 VAL A 142 -0.906 1.566 12.529 1.00 1.60 H new ATOM 0 HG22 VAL A 142 -1.349 0.670 11.057 1.00 1.60 H new ATOM 0 HG23 VAL A 142 -1.784 2.388 11.218 1.00 1.60 H new ATOM 2092 N LYS A 143 -5.821 -0.794 11.572 1.00 1.46 N ATOM 2093 CA LYS A 143 -6.835 -1.584 12.354 1.00 1.52 C ATOM 2094 C LYS A 143 -6.469 -3.107 12.441 1.00 1.62 C ATOM 2095 O LYS A 143 -7.156 -3.879 13.113 1.00 3.02 O ATOM 2096 CB LYS A 143 -8.211 -1.365 11.660 1.00 1.80 C ATOM 2097 CG LYS A 143 -8.396 -1.991 10.252 1.00 2.39 C ATOM 2098 CD LYS A 143 -9.788 -2.632 10.059 1.00 2.99 C ATOM 2099 CE LYS A 143 -9.838 -3.465 8.765 1.00 4.51 C ATOM 2100 NZ LYS A 143 -11.164 -4.093 8.522 1.00 5.18 N ATOM 0 H LYS A 143 -5.462 -1.292 10.758 1.00 1.46 H new ATOM 0 HA LYS A 143 -6.861 -1.238 13.387 1.00 1.52 H new ATOM 0 HB2 LYS A 143 -8.987 -1.764 12.313 1.00 1.80 H new ATOM 0 HB3 LYS A 143 -8.383 -0.292 11.579 1.00 1.80 H new ATOM 0 HG2 LYS A 143 -8.248 -1.221 9.495 1.00 2.39 H new ATOM 0 HG3 LYS A 143 -7.628 -2.747 10.092 1.00 2.39 H new ATOM 0 HD2 LYS A 143 -10.021 -3.267 10.914 1.00 2.99 H new ATOM 0 HD3 LYS A 143 -10.549 -1.853 10.024 1.00 2.99 H new ATOM 0 HE2 LYS A 143 -9.586 -2.825 7.919 1.00 4.51 H new ATOM 0 HE3 LYS A 143 -9.078 -4.244 8.813 1.00 4.51 H new ATOM 0 HZ1 LYS A 143 -11.133 -4.639 7.637 1.00 5.18 H new ATOM 0 HZ2 LYS A 143 -11.398 -4.727 9.312 1.00 5.18 H new ATOM 0 HZ3 LYS A 143 -11.890 -3.352 8.446 1.00 5.18 H new ATOM 2114 N LYS A 144 -5.395 -3.541 11.725 1.00 1.93 N ATOM 2115 CA LYS A 144 -5.254 -4.811 10.975 1.00 2.70 C ATOM 2116 C LYS A 144 -6.509 -5.720 11.022 1.00 2.47 C ATOM 2117 O LYS A 144 -7.608 -5.242 10.740 1.00 3.21 O ATOM 2118 CB LYS A 144 -3.909 -5.461 11.387 1.00 3.79 C ATOM 2119 CG LYS A 144 -3.331 -6.503 10.403 1.00 5.83 C ATOM 2120 CD LYS A 144 -2.829 -5.916 9.067 1.00 7.94 C ATOM 2121 CE LYS A 144 -2.224 -6.947 8.101 1.00 9.74 C ATOM 2122 NZ LYS A 144 -3.176 -8.028 7.734 1.00 10.49 N ATOM 0 H LYS A 144 -4.552 -2.972 11.655 1.00 1.93 H new ATOM 0 HA LYS A 144 -5.205 -4.613 9.904 1.00 2.70 H new ATOM 0 HB2 LYS A 144 -3.172 -4.669 11.521 1.00 3.79 H new ATOM 0 HB3 LYS A 144 -4.042 -5.941 12.357 1.00 3.79 H new ATOM 0 HG2 LYS A 144 -2.506 -7.023 10.889 1.00 5.83 H new ATOM 0 HG3 LYS A 144 -4.098 -7.248 10.192 1.00 5.83 H new ATOM 0 HD2 LYS A 144 -3.660 -5.416 8.570 1.00 7.94 H new ATOM 0 HD3 LYS A 144 -2.080 -5.153 9.279 1.00 7.94 H new ATOM 0 HE2 LYS A 144 -1.894 -6.438 7.195 1.00 9.74 H new ATOM 0 HE3 LYS A 144 -1.339 -7.390 8.558 1.00 9.74 H new ATOM 0 HZ1 LYS A 144 -3.003 -8.324 6.752 1.00 10.49 H new ATOM 0 HZ2 LYS A 144 -3.041 -8.840 8.369 1.00 10.49 H new ATOM 0 HZ3 LYS A 144 -4.151 -7.677 7.823 1.00 10.49 H new ATOM 2136 N ASN A 145 -6.371 -6.997 11.409 1.00 2.37 N ATOM 2137 CA ASN A 145 -7.529 -7.889 11.667 1.00 3.22 C ATOM 2138 C ASN A 145 -7.332 -8.775 12.921 1.00 3.56 C ATOM 2139 O ASN A 145 -8.004 -9.789 13.085 1.00 4.73 O ATOM 2140 CB ASN A 145 -7.926 -8.662 10.385 1.00 4.51 C ATOM 2141 CG ASN A 145 -6.940 -9.751 9.966 1.00 4.93 C ATOM 2142 OD1 ASN A 145 -6.878 -10.810 10.575 1.00 5.21 O ATOM 2143 ND2 ASN A 145 -6.130 -9.531 8.947 1.00 5.95 N ATOM 0 H ASN A 145 -5.466 -7.444 11.553 1.00 2.37 H new ATOM 0 HA ASN A 145 -8.388 -7.268 11.920 1.00 3.22 H new ATOM 0 HB2 ASN A 145 -8.905 -9.117 10.539 1.00 4.51 H new ATOM 0 HB3 ASN A 145 -8.031 -7.951 9.566 1.00 4.51 H new ATOM 0 HD21 ASN A 145 -5.455 -10.243 8.669 1.00 5.95 H new ATOM 0 HD22 ASN A 145 -6.180 -8.649 8.437 1.00 5.95 H new ATOM 2150 N ILE A 146 -6.412 -8.395 13.818 1.00 3.52 N ATOM 2151 CA ILE A 146 -5.945 -9.222 14.958 1.00 4.69 C ATOM 2152 C ILE A 146 -5.998 -8.499 16.316 1.00 5.86 C ATOM 2153 O ILE A 146 -6.312 -9.131 17.317 1.00 6.75 O ATOM 2154 CB ILE A 146 -4.526 -9.758 14.630 1.00 5.05 C ATOM 2155 CG1 ILE A 146 -4.041 -10.758 15.708 1.00 6.74 C ATOM 2156 CG2 ILE A 146 -3.495 -8.629 14.413 1.00 5.44 C ATOM 2157 CD1 ILE A 146 -2.739 -11.482 15.334 1.00 7.40 C ATOM 0 H ILE A 146 -5.956 -7.484 13.777 1.00 3.52 H new ATOM 0 HA ILE A 146 -6.637 -10.056 15.077 1.00 4.69 H new ATOM 0 HB ILE A 146 -4.608 -10.290 13.682 1.00 5.05 H new ATOM 0 HG12 ILE A 146 -3.893 -10.224 16.647 1.00 6.74 H new ATOM 0 HG13 ILE A 146 -4.822 -11.499 15.882 1.00 6.74 H new ATOM 0 HG21 ILE A 146 -2.521 -9.064 14.187 1.00 5.44 H new ATOM 0 HG22 ILE A 146 -3.813 -8.000 13.581 1.00 5.44 H new ATOM 0 HG23 ILE A 146 -3.421 -8.025 15.317 1.00 5.44 H new ATOM 0 HD11 ILE A 146 -2.460 -12.166 16.135 1.00 7.40 H new ATOM 0 HD12 ILE A 146 -2.887 -12.044 14.412 1.00 7.40 H new ATOM 0 HD13 ILE A 146 -1.945 -10.750 15.189 1.00 7.40 H new ATOM 2169 N GLU A 147 -5.707 -7.192 16.348 1.00 6.21 N ATOM 2170 CA GLU A 147 -5.885 -6.272 17.482 1.00 7.84 C ATOM 2171 C GLU A 147 -5.423 -6.794 18.865 1.00 7.65 C ATOM 2172 O GLU A 147 -6.052 -6.504 19.884 1.00 8.84 O ATOM 2173 CB GLU A 147 -7.317 -5.693 17.434 1.00 9.67 C ATOM 2174 CG GLU A 147 -8.498 -6.632 17.717 1.00 10.89 C ATOM 2175 CD GLU A 147 -9.757 -5.808 18.015 1.00 12.80 C ATOM 2176 OE1 GLU A 147 -9.951 -5.524 19.221 1.00 13.61 O ATOM 2177 OE2 GLU A 147 -10.529 -5.498 17.074 1.00 13.66 O ATOM 0 H GLU A 147 -5.317 -6.718 15.533 1.00 6.21 H new ATOM 0 HA GLU A 147 -5.178 -5.452 17.355 1.00 7.84 H new ATOM 0 HB2 GLU A 147 -7.367 -4.873 18.150 1.00 9.67 H new ATOM 0 HB3 GLU A 147 -7.467 -5.261 16.444 1.00 9.67 H new ATOM 0 HG2 GLU A 147 -8.672 -7.281 16.859 1.00 10.89 H new ATOM 0 HG3 GLU A 147 -8.266 -7.278 18.564 1.00 10.89 H new ATOM 2184 N GLY A 148 -4.339 -7.589 18.898 1.00 6.42 N ATOM 2185 CA GLY A 148 -4.208 -8.671 19.887 1.00 6.43 C ATOM 2186 C GLY A 148 -2.986 -8.598 20.797 1.00 6.27 C ATOM 2187 O GLY A 148 -2.948 -9.308 21.808 1.00 7.04 O ATOM 0 H GLY A 148 -3.549 -7.504 18.258 1.00 6.42 H new ATOM 0 HA2 GLY A 148 -5.102 -8.677 20.511 1.00 6.43 H new ATOM 0 HA3 GLY A 148 -4.185 -9.622 19.355 1.00 6.43 H new ATOM 2191 N ARG A 149 -2.007 -7.752 20.475 1.00 5.74 N ATOM 2192 CA ARG A 149 -0.894 -7.376 21.343 1.00 6.23 C ATOM 2193 C ARG A 149 -0.267 -6.068 20.878 1.00 6.76 C ATOM 2194 O ARG A 149 0.385 -5.441 21.717 1.00 7.83 O ATOM 2195 CB ARG A 149 0.136 -8.518 21.494 1.00 6.07 C ATOM 2196 CG ARG A 149 0.799 -8.464 22.883 1.00 7.19 C ATOM 2197 CD ARG A 149 1.646 -9.710 23.178 1.00 7.56 C ATOM 2198 NE ARG A 149 2.089 -9.708 24.582 1.00 8.91 N ATOM 2199 CZ ARG A 149 2.228 -10.740 25.392 1.00 9.58 C ATOM 2200 NH1 ARG A 149 2.111 -11.984 25.031 1.00 9.36 N ATOM 2201 NH2 ARG A 149 2.466 -10.539 26.648 1.00 10.84 N ATOM 2202 OXT ARG A 149 -0.532 -5.684 19.703 1.00 6.81 O ATOM 0 H ARG A 149 -1.967 -7.292 19.565 1.00 5.74 H new ATOM 0 HA ARG A 149 -1.289 -7.204 22.344 1.00 6.23 H new ATOM 0 HB2 ARG A 149 -0.356 -9.481 21.356 1.00 6.07 H new ATOM 0 HB3 ARG A 149 0.897 -8.435 20.718 1.00 6.07 H new ATOM 0 HG2 ARG A 149 1.429 -7.577 22.947 1.00 7.19 H new ATOM 0 HG3 ARG A 149 0.028 -8.364 23.647 1.00 7.19 H new ATOM 0 HD2 ARG A 149 1.065 -10.609 22.975 1.00 7.56 H new ATOM 0 HD3 ARG A 149 2.512 -9.734 22.517 1.00 7.56 H new ATOM 0 HE ARG A 149 2.317 -8.796 24.977 1.00 8.91 H new ATOM 0 HH11 ARG A 149 1.897 -12.216 24.061 1.00 9.36 H new ATOM 0 HH12 ARG A 149 2.233 -12.728 25.718 1.00 9.36 H new ATOM 0 HH21 ARG A 149 2.545 -9.587 27.006 1.00 10.84 H new ATOM 0 HH22 ARG A 149 2.575 -11.332 27.280 1.00 10.84 H new TER 2216 ARG A 149