USER MOD reduce.3.24.130724 H: found=0, std=0, add=998, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 998 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 102 TYR OH : rot 149:sc= 1.53 USER MOD Set 1.2: A 118 LYS NZ :NH3+ -146:sc= 0.329 (180deg=-0.0515) USER MOD Set 2.1: A 47 THR OG1 : rot 160:sc= 0.676 USER MOD Set 2.2: A 71 GLN : amide:sc= 0.909 K(o=1.6,f=0.11) USER MOD Set 3.1: A 45 LYS NZ :NH3+ -153:sc= 1.09 (180deg=0.248) USER MOD Set 3.2: A 73 THR OG1 : rot 180:sc= 0.99 USER MOD Set 4.1: A 17 GLN : amide:sc= 0.837 K(o=1.9,f=-0.39) USER MOD Set 4.2: A 21 SER OG : rot 116:sc= 1.01 USER MOD Single : A 1 MET CE :methyl -167:sc= -0.0447 (180deg=-0.275) USER MOD Single : A 1 MET N :NH3+ -168:sc= -0.0552 (180deg=-0.229) USER MOD Single : A 3 HIS :FLIP no HE2:sc= 0.155 F(o=-0.6,f=0.15) USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=-0.00033) USER MOD Single : A 6 HIS :FLIP no HD1:sc=-0.00719 F(o=-1.2,f=-0.0072) USER MOD Single : A 7 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 8 HIS : no HD1:sc= -0.0356 X(o=-0.036,f=-0.036) USER MOD Single : A 9 MET CE :methyl -162:sc= -0.132 (180deg=-0.719) USER MOD Single : A 11 THR OG1 : rot 180:sc= -0.187 USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 25 GLN :FLIP amide:sc= -0.0472 F(o=-0.89,f=-0.047) USER MOD Single : A 28 LYS NZ :NH3+ 164:sc= -0.0408 (180deg=-0.312) USER MOD Single : A 29 LYS NZ :NH3+ -168:sc= 1.2 (180deg=0.896) USER MOD Single : A 32 THR OG1 : rot 180:sc=-0.00205 USER MOD Single : A 38 THR OG1 : rot 39:sc= -2.92! USER MOD Single : A 39 LYS NZ :NH3+ -166:sc= 0.0653 (180deg=-0.209) USER MOD Single : A 41 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 HIS : +bothHN:sc= -1.66! C(o=-1.7!,f=-6.1!) USER MOD Single : A 50 TYR OH : rot 174:sc= -0.164 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 GLN : amide:sc= 1.35 K(o=1.4,f=-1.9!) USER MOD Single : A 62 SER OG : rot 170:sc= 0 USER MOD Single : A 63 SER OG : rot 170:sc= 0 USER MOD Single : A 65 SER OG : rot -37:sc= 0.366 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ -172:sc= 1.12 (180deg=0.965) USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 89 THR OG1 : rot -29:sc= 0.0199 USER MOD Single : A 90 MET CE :methyl -108:sc= -2.35 (180deg=-6.86!) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ -156:sc= 2.01 (180deg=-0.188) USER MOD Single : A 99 THR OG1 : rot 173:sc= 0.211 USER MOD Single : A 103 GLN :FLIP amide:sc= 0 F(o=-0.51,f=0) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -45.271 -25.849 -30.019 1.00 3.40 N ATOM 2 CA MET A 1 -43.857 -25.858 -29.569 1.00 10.21 C ATOM 3 C MET A 1 -43.361 -27.289 -29.357 1.00 31.33 C ATOM 4 O MET A 1 -42.160 -27.563 -29.457 1.00 3.30 O ATOM 5 CB MET A 1 -43.707 -25.051 -28.266 1.00 73.31 C ATOM 6 CG MET A 1 -42.284 -25.024 -27.715 1.00 65.15 C ATOM 7 SD MET A 1 -42.166 -24.254 -26.083 1.00 4.42 S ATOM 8 CE MET A 1 -42.721 -22.587 -26.439 1.00 65.21 C ATOM 0 H1 MET A 1 -45.524 -24.896 -30.350 1.00 3.40 H new ATOM 0 H2 MET A 1 -45.392 -26.529 -30.797 1.00 3.40 H new ATOM 0 H3 MET A 1 -45.889 -26.116 -29.226 1.00 3.40 H new ATOM 0 HA MET A 1 -43.250 -25.395 -30.347 1.00 10.21 H new ATOM 0 HB2 MET A 1 -44.036 -24.027 -28.444 1.00 73.31 H new ATOM 0 HB3 MET A 1 -44.371 -25.472 -27.511 1.00 73.31 H new ATOM 0 HG2 MET A 1 -41.905 -26.044 -27.656 1.00 65.15 H new ATOM 0 HG3 MET A 1 -41.642 -24.485 -28.411 1.00 65.15 H new ATOM 0 HE1 MET A 1 -42.487 -21.938 -25.595 1.00 65.21 H new ATOM 0 HE2 MET A 1 -42.216 -22.218 -27.332 1.00 65.21 H new ATOM 0 HE3 MET A 1 -43.798 -22.590 -26.607 1.00 65.21 H new ATOM 20 N ALA A 2 -44.284 -28.202 -29.070 1.00 11.55 N ATOM 21 CA ALA A 2 -43.940 -29.588 -28.775 1.00 5.04 C ATOM 22 C ALA A 2 -43.395 -30.313 -30.009 1.00 60.10 C ATOM 23 O ALA A 2 -44.143 -30.939 -30.764 1.00 53.10 O ATOM 24 CB ALA A 2 -45.152 -30.322 -28.203 1.00 52.24 C ATOM 0 H ALA A 2 -45.284 -28.004 -29.036 1.00 11.55 H new ATOM 0 HA ALA A 2 -43.146 -29.584 -28.028 1.00 5.04 H new ATOM 0 HB1 ALA A 2 -44.883 -31.356 -27.987 1.00 52.24 H new ATOM 0 HB2 ALA A 2 -45.474 -29.831 -27.285 1.00 52.24 H new ATOM 0 HB3 ALA A 2 -45.965 -30.303 -28.929 1.00 52.24 H new ATOM 30 N HIS A 3 -42.093 -30.186 -30.224 1.00 21.32 N ATOM 31 CA HIS A 3 -41.403 -30.933 -31.270 1.00 71.41 C ATOM 32 C HIS A 3 -40.709 -32.140 -30.649 1.00 74.23 C ATOM 33 O HIS A 3 -39.805 -31.978 -29.830 1.00 21.43 O ATOM 34 CB HIS A 3 -40.372 -30.053 -31.995 1.00 10.53 C ATOM 35 CG HIS A 3 -40.978 -28.962 -32.822 1.00 12.00 C ATOM 36 ND1 HIS A 3 -41.461 -27.747 -32.472 1.00 64.50 N flip ATOM 37 CD2 HIS A 3 -41.126 -29.051 -34.189 1.00 70.35 C flip ATOM 38 CE1 HIS A 3 -41.886 -27.132 -33.620 1.00 44.42 C flip ATOM 39 NE2 HIS A 3 -41.672 -27.939 -34.643 1.00 50.14 N flip ATOM 0 H HIS A 3 -41.488 -29.568 -29.684 1.00 21.32 H new ATOM 0 HA HIS A 3 -42.138 -31.262 -32.005 1.00 71.41 H new ATOM 0 HB2 HIS A 3 -39.706 -29.608 -31.256 1.00 10.53 H new ATOM 0 HB3 HIS A 3 -39.758 -30.684 -32.638 1.00 10.53 H new ATOM 0 HD1 HIS A 3 -41.501 -27.361 -31.529 1.00 64.50 H new ATOM 0 HD2 HIS A 3 -40.840 -29.898 -34.794 1.00 70.35 H new ATOM 0 HE1 HIS A 3 -42.325 -26.147 -33.679 1.00 44.42 H new ATOM 48 N HIS A 4 -41.147 -33.340 -31.024 1.00 41.44 N ATOM 49 CA HIS A 4 -40.565 -34.573 -30.495 1.00 61.42 C ATOM 50 C HIS A 4 -39.091 -34.651 -30.879 1.00 34.24 C ATOM 51 O HIS A 4 -38.740 -35.057 -31.989 1.00 73.23 O ATOM 52 CB HIS A 4 -41.337 -35.802 -31.005 1.00 70.34 C ATOM 53 CG HIS A 4 -42.785 -35.798 -30.606 1.00 12.14 C ATOM 54 ND1 HIS A 4 -43.221 -36.202 -29.364 1.00 24.54 N ATOM 55 CD2 HIS A 4 -43.893 -35.415 -31.283 1.00 32.52 C ATOM 56 CE1 HIS A 4 -44.531 -36.066 -29.294 1.00 45.00 C ATOM 57 NE2 HIS A 4 -44.965 -35.591 -30.444 1.00 44.43 N ATOM 0 H HIS A 4 -41.903 -33.485 -31.693 1.00 41.44 H new ATOM 0 HA HIS A 4 -40.642 -34.565 -29.408 1.00 61.42 H new ATOM 0 HB2 HIS A 4 -41.266 -35.842 -32.092 1.00 70.34 H new ATOM 0 HB3 HIS A 4 -40.863 -36.706 -30.621 1.00 70.34 H new ATOM 0 HD2 HIS A 4 -43.927 -35.040 -32.295 1.00 32.52 H new ATOM 0 HE1 HIS A 4 -45.145 -36.304 -28.438 1.00 45.00 H new ATOM 0 HE2 HIS A 4 -45.938 -35.388 -30.673 1.00 44.43 H new ATOM 66 N HIS A 5 -38.238 -34.219 -29.956 1.00 33.34 N ATOM 67 CA HIS A 5 -36.810 -34.077 -30.212 1.00 30.04 C ATOM 68 C HIS A 5 -36.100 -35.426 -30.208 1.00 71.42 C ATOM 69 O HIS A 5 -36.496 -36.351 -29.494 1.00 43.00 O ATOM 70 CB HIS A 5 -36.167 -33.165 -29.157 1.00 43.53 C ATOM 71 CG HIS A 5 -36.737 -31.778 -29.114 1.00 2.34 C ATOM 72 ND1 HIS A 5 -37.407 -31.269 -28.023 1.00 73.32 N ATOM 73 CD2 HIS A 5 -36.710 -30.783 -30.030 1.00 13.00 C ATOM 74 CE1 HIS A 5 -37.766 -30.024 -28.271 1.00 45.42 C ATOM 75 NE2 HIS A 5 -37.355 -29.703 -29.483 1.00 75.32 N ATOM 0 H HIS A 5 -38.517 -33.958 -29.010 1.00 33.34 H new ATOM 0 HA HIS A 5 -36.701 -33.633 -31.201 1.00 30.04 H new ATOM 0 HB2 HIS A 5 -36.284 -33.625 -28.176 1.00 43.53 H new ATOM 0 HB3 HIS A 5 -35.097 -33.100 -29.353 1.00 43.53 H new ATOM 0 HD2 HIS A 5 -36.263 -30.830 -31.012 1.00 13.00 H new ATOM 0 HE1 HIS A 5 -38.306 -29.377 -27.596 1.00 45.42 H new ATOM 0 HE2 HIS A 5 -37.494 -28.801 -29.938 1.00 75.32 H new ATOM 84 N HIS A 6 -35.057 -35.524 -31.025 1.00 63.13 N ATOM 85 CA HIS A 6 -34.150 -36.665 -31.000 1.00 11.21 C ATOM 86 C HIS A 6 -33.496 -36.758 -29.624 1.00 65.13 C ATOM 87 O HIS A 6 -32.796 -35.832 -29.213 1.00 22.35 O ATOM 88 CB HIS A 6 -33.077 -36.501 -32.092 1.00 13.32 C ATOM 89 CG HIS A 6 -31.994 -37.541 -32.061 1.00 73.33 C ATOM 90 ND1 HIS A 6 -30.856 -37.618 -31.328 1.00 11.11 N flip ATOM 91 CD2 HIS A 6 -31.993 -38.654 -32.873 1.00 2.41 C flip ATOM 92 CE1 HIS A 6 -30.202 -38.761 -31.704 1.00 15.55 C flip ATOM 93 NE2 HIS A 6 -30.908 -39.368 -32.636 1.00 40.03 N flip ATOM 0 H HIS A 6 -34.817 -34.818 -31.721 1.00 63.13 H new ATOM 0 HA HIS A 6 -34.707 -37.582 -31.194 1.00 11.21 H new ATOM 0 HB2 HIS A 6 -33.562 -36.529 -33.068 1.00 13.32 H new ATOM 0 HB3 HIS A 6 -32.621 -35.516 -31.991 1.00 13.32 H new ATOM 0 HD2 HIS A 6 -32.760 -38.903 -33.591 1.00 2.41 H new ATOM 0 HE1 HIS A 6 -29.261 -39.108 -31.302 1.00 15.55 H new ATOM 0 HE2 HIS A 6 -30.658 -40.243 -33.097 1.00 40.03 H new ATOM 102 N HIS A 7 -33.732 -37.861 -28.917 1.00 35.24 N ATOM 103 CA HIS A 7 -33.210 -38.021 -27.561 1.00 21.22 C ATOM 104 C HIS A 7 -31.686 -37.928 -27.573 1.00 62.14 C ATOM 105 O HIS A 7 -31.001 -38.810 -28.097 1.00 65.32 O ATOM 106 CB HIS A 7 -33.660 -39.353 -26.947 1.00 40.00 C ATOM 107 CG HIS A 7 -33.337 -39.473 -25.485 1.00 5.42 C ATOM 108 ND1 HIS A 7 -32.279 -40.212 -24.999 1.00 32.01 N ATOM 109 CD2 HIS A 7 -33.950 -38.944 -24.400 1.00 63.42 C ATOM 110 CE1 HIS A 7 -32.259 -40.135 -23.682 1.00 15.31 C ATOM 111 NE2 HIS A 7 -33.259 -39.370 -23.294 1.00 2.11 N ATOM 0 H HIS A 7 -34.278 -38.653 -29.257 1.00 35.24 H new ATOM 0 HA HIS A 7 -33.611 -37.217 -26.944 1.00 21.22 H new ATOM 0 HB2 HIS A 7 -34.736 -39.463 -27.085 1.00 40.00 H new ATOM 0 HB3 HIS A 7 -33.184 -40.172 -27.486 1.00 40.00 H new ATOM 0 HD2 HIS A 7 -34.821 -38.305 -24.404 1.00 63.42 H new ATOM 0 HE1 HIS A 7 -31.544 -40.617 -23.032 1.00 15.31 H new ATOM 0 HE2 HIS A 7 -33.483 -39.133 -22.328 1.00 2.11 H new ATOM 120 N HIS A 8 -31.170 -36.844 -27.013 1.00 54.52 N ATOM 121 CA HIS A 8 -29.741 -36.570 -27.013 1.00 71.42 C ATOM 122 C HIS A 8 -29.423 -35.527 -25.950 1.00 60.23 C ATOM 123 O HIS A 8 -30.254 -34.662 -25.659 1.00 64.12 O ATOM 124 CB HIS A 8 -29.300 -36.069 -28.399 1.00 2.44 C ATOM 125 CG HIS A 8 -27.855 -35.670 -28.479 1.00 43.31 C ATOM 126 ND1 HIS A 8 -27.445 -34.372 -28.699 1.00 41.21 N ATOM 127 CD2 HIS A 8 -26.724 -36.405 -28.372 1.00 73.24 C ATOM 128 CE1 HIS A 8 -26.127 -34.326 -28.720 1.00 22.34 C ATOM 129 NE2 HIS A 8 -25.665 -35.546 -28.524 1.00 54.34 N ATOM 0 H HIS A 8 -31.730 -36.130 -26.546 1.00 54.52 H new ATOM 0 HA HIS A 8 -29.198 -37.488 -26.787 1.00 71.42 H new ATOM 0 HB2 HIS A 8 -29.490 -36.852 -29.133 1.00 2.44 H new ATOM 0 HB3 HIS A 8 -29.917 -35.215 -28.677 1.00 2.44 H new ATOM 0 HD2 HIS A 8 -26.666 -37.469 -28.199 1.00 73.24 H new ATOM 0 HE1 HIS A 8 -25.528 -33.440 -28.872 1.00 22.34 H new ATOM 0 HE2 HIS A 8 -24.680 -35.808 -28.491 1.00 54.34 H new ATOM 138 N MET A 9 -28.243 -35.630 -25.351 1.00 34.13 N ATOM 139 CA MET A 9 -27.790 -34.642 -24.375 1.00 52.34 C ATOM 140 C MET A 9 -27.633 -33.272 -25.037 1.00 10.22 C ATOM 141 O MET A 9 -26.584 -32.959 -25.609 1.00 4.13 O ATOM 142 CB MET A 9 -26.466 -35.081 -23.729 1.00 35.21 C ATOM 143 CG MET A 9 -25.905 -34.082 -22.720 1.00 10.04 C ATOM 144 SD MET A 9 -24.389 -34.670 -21.936 1.00 4.34 S ATOM 145 CE MET A 9 -24.996 -36.112 -21.058 1.00 21.11 C ATOM 0 H MET A 9 -27.581 -36.387 -25.523 1.00 34.13 H new ATOM 0 HA MET A 9 -28.543 -34.566 -23.591 1.00 52.34 H new ATOM 0 HB2 MET A 9 -26.617 -36.039 -23.231 1.00 35.21 H new ATOM 0 HB3 MET A 9 -25.727 -35.243 -24.514 1.00 35.21 H new ATOM 0 HG2 MET A 9 -25.707 -33.135 -23.222 1.00 10.04 H new ATOM 0 HG3 MET A 9 -26.654 -33.885 -21.953 1.00 10.04 H new ATOM 0 HE1 MET A 9 -24.281 -36.396 -20.286 1.00 21.11 H new ATOM 0 HE2 MET A 9 -25.955 -35.879 -20.596 1.00 21.11 H new ATOM 0 HE3 MET A 9 -25.122 -36.938 -21.758 1.00 21.11 H new ATOM 155 N GLY A 10 -28.703 -32.486 -24.999 1.00 72.52 N ATOM 156 CA GLY A 10 -28.672 -31.138 -25.541 1.00 63.23 C ATOM 157 C GLY A 10 -28.193 -30.125 -24.520 1.00 1.24 C ATOM 158 O GLY A 10 -27.721 -30.501 -23.442 1.00 31.32 O ATOM 0 H GLY A 10 -29.600 -32.761 -24.599 1.00 72.52 H new ATOM 0 HA2 GLY A 10 -28.017 -31.113 -26.412 1.00 63.23 H new ATOM 0 HA3 GLY A 10 -29.669 -30.863 -25.884 1.00 63.23 H new ATOM 162 N THR A 11 -28.323 -28.845 -24.845 1.00 0.32 N ATOM 163 CA THR A 11 -27.882 -27.779 -23.957 1.00 22.11 C ATOM 164 C THR A 11 -28.432 -26.431 -24.419 1.00 23.13 C ATOM 165 O THR A 11 -29.063 -26.329 -25.477 1.00 3.55 O ATOM 166 CB THR A 11 -26.334 -27.707 -23.872 1.00 61.11 C ATOM 167 OG1 THR A 11 -25.937 -26.738 -22.886 1.00 12.15 O ATOM 168 CG2 THR A 11 -25.720 -27.352 -25.226 1.00 23.11 C ATOM 0 H THR A 11 -28.732 -28.520 -25.721 1.00 0.32 H new ATOM 0 HA THR A 11 -28.269 -28.007 -22.964 1.00 22.11 H new ATOM 0 HB THR A 11 -25.968 -28.691 -23.580 1.00 61.11 H new ATOM 0 HG1 THR A 11 -24.959 -26.701 -22.839 1.00 12.15 H new ATOM 0 HG21 THR A 11 -24.635 -27.309 -25.133 1.00 23.11 H new ATOM 0 HG22 THR A 11 -25.992 -28.111 -25.959 1.00 23.11 H new ATOM 0 HG23 THR A 11 -26.095 -26.382 -25.552 1.00 23.11 H new ATOM 176 N LEU A 12 -28.184 -25.405 -23.613 1.00 23.05 N ATOM 177 CA LEU A 12 -28.621 -24.050 -23.917 1.00 13.01 C ATOM 178 C LEU A 12 -27.532 -23.325 -24.704 1.00 72.23 C ATOM 179 O LEU A 12 -26.341 -23.591 -24.515 1.00 0.21 O ATOM 180 CB LEU A 12 -28.945 -23.276 -22.624 1.00 64.41 C ATOM 181 CG LEU A 12 -30.131 -23.810 -21.795 1.00 51.22 C ATOM 182 CD1 LEU A 12 -29.816 -25.172 -21.174 1.00 51.14 C ATOM 183 CD2 LEU A 12 -30.524 -22.803 -20.714 1.00 60.24 C ATOM 0 H LEU A 12 -27.676 -25.490 -22.733 1.00 23.05 H new ATOM 0 HA LEU A 12 -29.529 -24.102 -24.518 1.00 13.01 H new ATOM 0 HB2 LEU A 12 -28.057 -23.276 -21.992 1.00 64.41 H new ATOM 0 HB3 LEU A 12 -29.149 -22.238 -22.887 1.00 64.41 H new ATOM 0 HG LEU A 12 -30.975 -23.945 -22.472 1.00 51.22 H new ATOM 0 HD11 LEU A 12 -30.675 -25.516 -20.597 1.00 51.14 H new ATOM 0 HD12 LEU A 12 -29.598 -25.890 -21.964 1.00 51.14 H new ATOM 0 HD13 LEU A 12 -28.951 -25.081 -20.517 1.00 51.14 H new ATOM 0 HD21 LEU A 12 -31.362 -23.196 -20.138 1.00 60.24 H new ATOM 0 HD22 LEU A 12 -29.676 -22.632 -20.050 1.00 60.24 H new ATOM 0 HD23 LEU A 12 -30.814 -21.862 -21.181 1.00 60.24 H new ATOM 195 N GLU A 13 -27.948 -22.416 -25.580 1.00 22.00 N ATOM 196 CA GLU A 13 -27.026 -21.677 -26.444 1.00 22.14 C ATOM 197 C GLU A 13 -26.037 -20.844 -25.627 1.00 41.33 C ATOM 198 O GLU A 13 -26.306 -20.488 -24.477 1.00 42.24 O ATOM 199 CB GLU A 13 -27.823 -20.764 -27.380 1.00 43.13 C ATOM 200 CG GLU A 13 -28.772 -21.514 -28.308 1.00 63.33 C ATOM 201 CD GLU A 13 -29.757 -20.592 -29.006 1.00 30.35 C ATOM 202 OE1 GLU A 13 -29.366 -19.921 -29.985 1.00 14.15 O ATOM 203 OE2 GLU A 13 -30.927 -20.526 -28.574 1.00 43.21 O ATOM 0 H GLU A 13 -28.929 -22.170 -25.713 1.00 22.00 H new ATOM 0 HA GLU A 13 -26.454 -22.399 -27.027 1.00 22.14 H new ATOM 0 HB2 GLU A 13 -28.398 -20.058 -26.781 1.00 43.13 H new ATOM 0 HB3 GLU A 13 -27.127 -20.179 -27.982 1.00 43.13 H new ATOM 0 HG2 GLU A 13 -28.192 -22.053 -29.057 1.00 63.33 H new ATOM 0 HG3 GLU A 13 -29.322 -22.259 -27.734 1.00 63.33 H new ATOM 210 N ALA A 14 -24.895 -20.540 -26.232 1.00 14.03 N ATOM 211 CA ALA A 14 -23.865 -19.727 -25.598 1.00 33.23 C ATOM 212 C ALA A 14 -23.149 -18.877 -26.645 1.00 11.25 C ATOM 213 O ALA A 14 -22.993 -19.300 -27.795 1.00 22.03 O ATOM 214 CB ALA A 14 -22.874 -20.620 -24.857 1.00 1.45 C ATOM 0 H ALA A 14 -24.657 -20.850 -27.174 1.00 14.03 H new ATOM 0 HA ALA A 14 -24.334 -19.059 -24.875 1.00 33.23 H new ATOM 0 HB1 ALA A 14 -22.109 -20.002 -24.387 1.00 1.45 H new ATOM 0 HB2 ALA A 14 -23.400 -21.191 -24.092 1.00 1.45 H new ATOM 0 HB3 ALA A 14 -22.404 -21.306 -25.562 1.00 1.45 H new ATOM 220 N GLN A 15 -22.726 -17.677 -26.250 1.00 71.12 N ATOM 221 CA GLN A 15 -22.014 -16.778 -27.154 1.00 54.40 C ATOM 222 C GLN A 15 -20.715 -17.427 -27.640 1.00 43.42 C ATOM 223 O GLN A 15 -19.720 -17.490 -26.918 1.00 31.11 O ATOM 224 CB GLN A 15 -21.741 -15.420 -26.483 1.00 11.24 C ATOM 225 CG GLN A 15 -21.007 -15.511 -25.148 1.00 43.33 C ATOM 226 CD GLN A 15 -20.700 -14.147 -24.557 1.00 41.31 C ATOM 227 OE1 GLN A 15 -19.644 -13.569 -24.812 1.00 20.25 O ATOM 228 NE2 GLN A 15 -21.621 -13.621 -23.766 1.00 24.31 N ATOM 0 H GLN A 15 -22.864 -17.306 -25.310 1.00 71.12 H new ATOM 0 HA GLN A 15 -22.647 -16.593 -28.022 1.00 54.40 H new ATOM 0 HB2 GLN A 15 -21.155 -14.803 -27.164 1.00 11.24 H new ATOM 0 HB3 GLN A 15 -22.691 -14.908 -26.327 1.00 11.24 H new ATOM 0 HG2 GLN A 15 -21.612 -16.081 -24.443 1.00 43.33 H new ATOM 0 HG3 GLN A 15 -20.076 -16.061 -25.286 1.00 43.33 H new ATOM 0 HE21 GLN A 15 -22.484 -14.131 -23.579 1.00 24.31 H new ATOM 0 HE22 GLN A 15 -21.468 -12.705 -23.344 1.00 24.31 H new ATOM 237 N THR A 16 -20.748 -17.932 -28.867 1.00 0.12 N ATOM 238 CA THR A 16 -19.614 -18.641 -29.450 1.00 75.23 C ATOM 239 C THR A 16 -18.683 -17.668 -30.194 1.00 40.03 C ATOM 240 O THR A 16 -17.850 -18.080 -30.999 1.00 21.31 O ATOM 241 CB THR A 16 -20.118 -19.745 -30.416 1.00 75.20 C ATOM 242 OG1 THR A 16 -21.284 -20.376 -29.858 1.00 44.10 O ATOM 243 CG2 THR A 16 -19.046 -20.808 -30.667 1.00 2.15 C ATOM 0 H THR A 16 -21.557 -17.863 -29.484 1.00 0.12 H new ATOM 0 HA THR A 16 -19.047 -19.105 -28.643 1.00 75.23 H new ATOM 0 HB THR A 16 -20.359 -19.271 -31.368 1.00 75.20 H new ATOM 0 HG1 THR A 16 -21.603 -21.072 -30.469 1.00 44.10 H new ATOM 0 HG21 THR A 16 -19.436 -21.564 -31.348 1.00 2.15 H new ATOM 0 HG22 THR A 16 -18.166 -20.340 -31.109 1.00 2.15 H new ATOM 0 HG23 THR A 16 -18.771 -21.278 -29.723 1.00 2.15 H new ATOM 251 N GLN A 17 -18.823 -16.370 -29.905 1.00 23.22 N ATOM 252 CA GLN A 17 -18.005 -15.341 -30.550 1.00 3.02 C ATOM 253 C GLN A 17 -17.188 -14.582 -29.506 1.00 51.13 C ATOM 254 O GLN A 17 -17.629 -14.409 -28.368 1.00 53.23 O ATOM 255 CB GLN A 17 -18.882 -14.363 -31.345 1.00 70.42 C ATOM 256 CG GLN A 17 -19.831 -15.045 -32.324 1.00 72.33 C ATOM 257 CD GLN A 17 -20.370 -14.087 -33.370 1.00 71.23 C ATOM 258 OE1 GLN A 17 -19.792 -13.947 -34.443 1.00 71.31 O ATOM 259 NE2 GLN A 17 -21.461 -13.406 -33.060 1.00 44.13 N ATOM 0 H GLN A 17 -19.495 -16.008 -29.229 1.00 23.22 H new ATOM 0 HA GLN A 17 -17.324 -15.834 -31.244 1.00 3.02 H new ATOM 0 HB2 GLN A 17 -19.465 -13.762 -30.647 1.00 70.42 H new ATOM 0 HB3 GLN A 17 -18.238 -13.677 -31.895 1.00 70.42 H new ATOM 0 HG2 GLN A 17 -19.310 -15.864 -32.820 1.00 72.33 H new ATOM 0 HG3 GLN A 17 -20.663 -15.483 -31.773 1.00 72.33 H new ATOM 0 HE21 GLN A 17 -21.913 -13.551 -32.157 1.00 44.13 H new ATOM 0 HE22 GLN A 17 -21.850 -12.736 -33.724 1.00 44.13 H new ATOM 268 N GLY A 18 -16.003 -14.125 -29.906 1.00 10.21 N ATOM 269 CA GLY A 18 -15.091 -13.458 -28.985 1.00 61.13 C ATOM 270 C GLY A 18 -14.954 -11.961 -29.242 1.00 70.32 C ATOM 271 O GLY A 18 -15.305 -11.157 -28.377 1.00 74.25 O ATOM 0 H GLY A 18 -15.654 -14.205 -30.861 1.00 10.21 H new ATOM 0 HA2 GLY A 18 -15.441 -13.613 -27.964 1.00 61.13 H new ATOM 0 HA3 GLY A 18 -14.108 -13.923 -29.059 1.00 61.13 H new ATOM 275 N PRO A 19 -14.464 -11.550 -30.437 1.00 71.50 N ATOM 276 CA PRO A 19 -14.147 -10.136 -30.737 1.00 35.41 C ATOM 277 C PRO A 19 -15.382 -9.235 -30.900 1.00 54.13 C ATOM 278 O PRO A 19 -15.314 -8.200 -31.563 1.00 73.40 O ATOM 279 CB PRO A 19 -13.372 -10.233 -32.060 1.00 23.33 C ATOM 280 CG PRO A 19 -13.904 -11.463 -32.710 1.00 14.54 C ATOM 281 CD PRO A 19 -14.167 -12.430 -31.588 1.00 31.43 C ATOM 0 HA PRO A 19 -13.597 -9.672 -29.918 1.00 35.41 H new ATOM 0 HB2 PRO A 19 -13.535 -9.353 -32.682 1.00 23.33 H new ATOM 0 HB3 PRO A 19 -12.298 -10.307 -31.887 1.00 23.33 H new ATOM 0 HG2 PRO A 19 -14.817 -11.249 -33.266 1.00 14.54 H new ATOM 0 HG3 PRO A 19 -13.186 -11.873 -33.421 1.00 14.54 H new ATOM 0 HD2 PRO A 19 -15.004 -13.090 -31.815 1.00 31.43 H new ATOM 0 HD3 PRO A 19 -13.303 -13.066 -31.395 1.00 31.43 H new ATOM 289 N GLY A 20 -16.496 -9.623 -30.288 1.00 31.23 N ATOM 290 CA GLY A 20 -17.698 -8.808 -30.323 1.00 1.24 C ATOM 291 C GLY A 20 -18.277 -8.655 -31.717 1.00 25.15 C ATOM 292 O GLY A 20 -18.888 -7.629 -32.028 1.00 53.44 O ATOM 0 H GLY A 20 -16.588 -10.494 -29.765 1.00 31.23 H new ATOM 0 HA2 GLY A 20 -18.450 -9.253 -29.671 1.00 1.24 H new ATOM 0 HA3 GLY A 20 -17.471 -7.821 -29.920 1.00 1.24 H new ATOM 296 N SER A 21 -18.087 -9.672 -32.555 1.00 21.21 N ATOM 297 CA SER A 21 -18.645 -9.681 -33.903 1.00 53.15 C ATOM 298 C SER A 21 -20.175 -9.747 -33.849 1.00 14.20 C ATOM 299 O SER A 21 -20.784 -10.805 -34.019 1.00 73.52 O ATOM 300 CB SER A 21 -18.050 -10.846 -34.706 1.00 54.50 C ATOM 301 OG SER A 21 -17.863 -11.986 -33.882 1.00 2.55 O ATOM 0 H SER A 21 -17.547 -10.505 -32.321 1.00 21.21 H new ATOM 0 HA SER A 21 -18.379 -8.754 -34.411 1.00 53.15 H new ATOM 0 HB2 SER A 21 -18.711 -11.096 -35.535 1.00 54.50 H new ATOM 0 HB3 SER A 21 -17.096 -10.545 -35.139 1.00 54.50 H new ATOM 0 HG SER A 21 -18.438 -12.715 -34.196 1.00 2.55 H new ATOM 307 N MET A 22 -20.770 -8.594 -33.566 1.00 23.10 N ATOM 308 CA MET A 22 -22.211 -8.452 -33.389 1.00 1.00 C ATOM 309 C MET A 22 -22.527 -6.995 -33.069 1.00 72.15 C ATOM 310 O MET A 22 -23.602 -6.489 -33.396 1.00 54.32 O ATOM 311 CB MET A 22 -22.728 -9.366 -32.260 1.00 40.45 C ATOM 312 CG MET A 22 -22.142 -9.057 -30.886 1.00 23.11 C ATOM 313 SD MET A 22 -22.755 -10.170 -29.599 1.00 11.22 S ATOM 314 CE MET A 22 -21.906 -9.527 -28.157 1.00 2.32 C ATOM 0 H MET A 22 -20.258 -7.719 -33.451 1.00 23.10 H new ATOM 0 HA MET A 22 -22.711 -8.750 -34.311 1.00 1.00 H new ATOM 0 HB2 MET A 22 -23.813 -9.280 -32.207 1.00 40.45 H new ATOM 0 HB3 MET A 22 -22.502 -10.402 -32.514 1.00 40.45 H new ATOM 0 HG2 MET A 22 -21.055 -9.128 -30.935 1.00 23.11 H new ATOM 0 HG3 MET A 22 -22.382 -8.029 -30.616 1.00 23.11 H new ATOM 0 HE1 MET A 22 -22.183 -10.112 -27.280 1.00 2.32 H new ATOM 0 HE2 MET A 22 -20.829 -9.591 -28.310 1.00 2.32 H new ATOM 0 HE3 MET A 22 -22.189 -8.486 -28.002 1.00 2.32 H new ATOM 324 N SER A 23 -21.573 -6.329 -32.426 1.00 10.14 N ATOM 325 CA SER A 23 -21.691 -4.916 -32.101 1.00 32.11 C ATOM 326 C SER A 23 -20.909 -4.081 -33.119 1.00 62.52 C ATOM 327 O SER A 23 -20.236 -4.635 -33.993 1.00 32.10 O ATOM 328 CB SER A 23 -21.160 -4.678 -30.683 1.00 71.33 C ATOM 329 OG SER A 23 -21.791 -5.544 -29.749 1.00 5.30 O ATOM 0 H SER A 23 -20.699 -6.755 -32.117 1.00 10.14 H new ATOM 0 HA SER A 23 -22.738 -4.614 -32.142 1.00 32.11 H new ATOM 0 HB2 SER A 23 -20.082 -4.839 -30.663 1.00 71.33 H new ATOM 0 HB3 SER A 23 -21.332 -3.641 -30.396 1.00 71.33 H new ATOM 0 HG SER A 23 -21.434 -5.374 -28.852 1.00 5.30 H new ATOM 335 N ALA A 24 -20.998 -2.757 -33.009 1.00 60.44 N ATOM 336 CA ALA A 24 -20.307 -1.857 -33.928 1.00 54.02 C ATOM 337 C ALA A 24 -19.023 -1.320 -33.292 1.00 62.11 C ATOM 338 O ALA A 24 -19.063 -0.388 -32.483 1.00 62.02 O ATOM 339 CB ALA A 24 -21.228 -0.708 -34.344 1.00 34.21 C ATOM 0 H ALA A 24 -21.544 -2.283 -32.290 1.00 60.44 H new ATOM 0 HA ALA A 24 -20.034 -2.418 -34.822 1.00 54.02 H new ATOM 0 HB1 ALA A 24 -20.698 -0.046 -35.029 1.00 34.21 H new ATOM 0 HB2 ALA A 24 -22.111 -1.111 -34.840 1.00 34.21 H new ATOM 0 HB3 ALA A 24 -21.532 -0.147 -33.460 1.00 34.21 H new ATOM 345 N GLN A 25 -17.897 -1.938 -33.628 1.00 52.11 N ATOM 346 CA GLN A 25 -16.588 -1.488 -33.156 1.00 33.31 C ATOM 347 C GLN A 25 -15.810 -0.851 -34.302 1.00 11.54 C ATOM 348 O GLN A 25 -15.895 -1.306 -35.443 1.00 33.33 O ATOM 349 CB GLN A 25 -15.790 -2.666 -32.571 1.00 24.32 C ATOM 350 CG GLN A 25 -16.381 -3.247 -31.289 1.00 62.34 C ATOM 351 CD GLN A 25 -16.392 -2.261 -30.131 1.00 50.24 C ATOM 352 OE1 GLN A 25 -15.421 -1.358 -30.092 1.00 54.31 O flip ATOM 353 NE2 GLN A 25 -17.263 -2.320 -29.262 1.00 0.52 N flip ATOM 0 H GLN A 25 -17.862 -2.760 -34.231 1.00 52.11 H new ATOM 0 HA GLN A 25 -16.739 -0.747 -32.371 1.00 33.31 H new ATOM 0 HB2 GLN A 25 -15.728 -3.456 -33.320 1.00 24.32 H new ATOM 0 HB3 GLN A 25 -14.771 -2.336 -32.371 1.00 24.32 H new ATOM 0 HG2 GLN A 25 -17.401 -3.578 -31.485 1.00 62.34 H new ATOM 0 HG3 GLN A 25 -15.809 -4.129 -31.001 1.00 62.34 H new ATOM 0 HE21 GLN A 25 -17.996 -3.027 -29.322 1.00 0.52 H new ATOM 0 HE22 GLN A 25 -17.251 -1.662 -28.483 1.00 0.52 H new ATOM 362 N LEU A 26 -15.063 0.200 -33.992 1.00 30.13 N ATOM 363 CA LEU A 26 -14.260 0.902 -34.985 1.00 12.14 C ATOM 364 C LEU A 26 -12.809 0.949 -34.514 1.00 51.43 C ATOM 365 O LEU A 26 -12.519 1.452 -33.424 1.00 61.15 O ATOM 366 CB LEU A 26 -14.817 2.327 -35.204 1.00 71.53 C ATOM 367 CG LEU A 26 -14.315 3.080 -36.459 1.00 4.02 C ATOM 368 CD1 LEU A 26 -15.201 4.293 -36.739 1.00 1.33 C ATOM 369 CD2 LEU A 26 -12.857 3.526 -36.309 1.00 14.44 C ATOM 0 H LEU A 26 -14.996 0.588 -33.051 1.00 30.13 H new ATOM 0 HA LEU A 26 -14.304 0.373 -35.937 1.00 12.14 H new ATOM 0 HB2 LEU A 26 -15.904 2.264 -35.256 1.00 71.53 H new ATOM 0 HB3 LEU A 26 -14.574 2.927 -34.327 1.00 71.53 H new ATOM 0 HG LEU A 26 -14.370 2.388 -37.299 1.00 4.02 H new ATOM 0 HD11 LEU A 26 -14.836 4.813 -37.625 1.00 1.33 H new ATOM 0 HD12 LEU A 26 -16.226 3.963 -36.908 1.00 1.33 H new ATOM 0 HD13 LEU A 26 -15.174 4.969 -35.884 1.00 1.33 H new ATOM 0 HD21 LEU A 26 -12.542 4.051 -37.211 1.00 14.44 H new ATOM 0 HD22 LEU A 26 -12.767 4.192 -35.451 1.00 14.44 H new ATOM 0 HD23 LEU A 26 -12.223 2.652 -36.158 1.00 14.44 H new ATOM 381 N GLU A 27 -11.908 0.401 -35.324 1.00 2.20 N ATOM 382 CA GLU A 27 -10.481 0.412 -35.015 1.00 14.02 C ATOM 383 C GLU A 27 -9.684 0.926 -36.209 1.00 65.33 C ATOM 384 O GLU A 27 -9.577 0.248 -37.232 1.00 60.33 O ATOM 385 CB GLU A 27 -9.982 -0.988 -34.631 1.00 53.11 C ATOM 386 CG GLU A 27 -10.711 -1.608 -33.445 1.00 1.14 C ATOM 387 CD GLU A 27 -10.058 -2.893 -32.962 1.00 4.22 C ATOM 388 OE1 GLU A 27 -10.254 -3.941 -33.604 1.00 35.30 O ATOM 389 OE2 GLU A 27 -9.328 -2.846 -31.946 1.00 43.34 O ATOM 0 H GLU A 27 -12.142 -0.059 -36.204 1.00 2.20 H new ATOM 0 HA GLU A 27 -10.333 1.077 -34.164 1.00 14.02 H new ATOM 0 HB2 GLU A 27 -10.087 -1.648 -35.492 1.00 53.11 H new ATOM 0 HB3 GLU A 27 -8.918 -0.932 -34.400 1.00 53.11 H new ATOM 0 HG2 GLU A 27 -10.740 -0.890 -32.626 1.00 1.14 H new ATOM 0 HG3 GLU A 27 -11.744 -1.813 -33.726 1.00 1.14 H new ATOM 396 N LYS A 28 -9.156 2.139 -36.081 1.00 20.23 N ATOM 397 CA LYS A 28 -8.261 2.711 -37.086 1.00 1.42 C ATOM 398 C LYS A 28 -6.839 2.774 -36.522 1.00 24.22 C ATOM 399 O LYS A 28 -6.518 3.642 -35.710 1.00 43.22 O ATOM 400 CB LYS A 28 -8.747 4.109 -37.520 1.00 13.42 C ATOM 401 CG LYS A 28 -8.911 5.104 -36.370 1.00 53.12 C ATOM 402 CD LYS A 28 -9.323 6.493 -36.856 1.00 50.34 C ATOM 403 CE LYS A 28 -9.341 7.504 -35.711 1.00 71.00 C ATOM 404 NZ LYS A 28 -7.997 7.680 -35.091 1.00 31.34 N ATOM 0 H LYS A 28 -9.333 2.751 -35.285 1.00 20.23 H new ATOM 0 HA LYS A 28 -8.263 2.075 -37.971 1.00 1.42 H new ATOM 0 HB2 LYS A 28 -8.040 4.519 -38.241 1.00 13.42 H new ATOM 0 HB3 LYS A 28 -9.703 4.005 -38.034 1.00 13.42 H new ATOM 0 HG2 LYS A 28 -9.660 4.729 -35.673 1.00 53.12 H new ATOM 0 HG3 LYS A 28 -7.973 5.178 -35.820 1.00 53.12 H new ATOM 0 HD2 LYS A 28 -8.632 6.829 -37.629 1.00 50.34 H new ATOM 0 HD3 LYS A 28 -10.311 6.441 -37.313 1.00 50.34 H new ATOM 0 HE2 LYS A 28 -9.696 8.465 -36.083 1.00 71.00 H new ATOM 0 HE3 LYS A 28 -10.049 7.176 -34.950 1.00 71.00 H new ATOM 0 HZ1 LYS A 28 -7.990 8.548 -34.519 1.00 31.34 H new ATOM 0 HZ2 LYS A 28 -7.785 6.863 -34.483 1.00 31.34 H new ATOM 0 HZ3 LYS A 28 -7.277 7.752 -35.838 1.00 31.34 H new ATOM 418 N LYS A 29 -5.999 1.827 -36.925 1.00 10.31 N ATOM 419 CA LYS A 29 -4.646 1.712 -36.383 1.00 4.51 C ATOM 420 C LYS A 29 -3.613 1.883 -37.491 1.00 32.22 C ATOM 421 O LYS A 29 -3.481 1.028 -38.362 1.00 50.14 O ATOM 422 CB LYS A 29 -4.484 0.340 -35.708 1.00 34.44 C ATOM 423 CG LYS A 29 -5.556 0.051 -34.660 1.00 63.44 C ATOM 424 CD LYS A 29 -5.529 -1.401 -34.188 1.00 73.32 C ATOM 425 CE LYS A 29 -6.643 -1.676 -33.186 1.00 34.34 C ATOM 426 NZ LYS A 29 -6.736 -3.112 -32.814 1.00 5.41 N ATOM 0 H LYS A 29 -6.230 1.125 -37.628 1.00 10.31 H new ATOM 0 HA LYS A 29 -4.486 2.498 -35.645 1.00 4.51 H new ATOM 0 HB2 LYS A 29 -4.513 -0.438 -36.471 1.00 34.44 H new ATOM 0 HB3 LYS A 29 -3.502 0.288 -35.237 1.00 34.44 H new ATOM 0 HG2 LYS A 29 -5.412 0.711 -33.805 1.00 63.44 H new ATOM 0 HG3 LYS A 29 -6.538 0.277 -35.076 1.00 63.44 H new ATOM 0 HD2 LYS A 29 -5.635 -2.067 -35.045 1.00 73.32 H new ATOM 0 HD3 LYS A 29 -4.564 -1.620 -33.732 1.00 73.32 H new ATOM 0 HE2 LYS A 29 -6.473 -1.082 -32.288 1.00 34.34 H new ATOM 0 HE3 LYS A 29 -7.594 -1.351 -33.608 1.00 34.34 H new ATOM 0 HZ1 LYS A 29 -7.623 -3.280 -32.297 1.00 5.41 H new ATOM 0 HZ2 LYS A 29 -6.721 -3.695 -33.675 1.00 5.41 H new ATOM 0 HZ3 LYS A 29 -5.929 -3.367 -32.209 1.00 5.41 H new ATOM 440 N VAL A 30 -2.889 2.991 -37.462 1.00 1.11 N ATOM 441 CA VAL A 30 -1.850 3.245 -38.449 1.00 62.04 C ATOM 442 C VAL A 30 -0.684 2.273 -38.246 1.00 61.23 C ATOM 443 O VAL A 30 -0.068 2.242 -37.180 1.00 52.32 O ATOM 444 CB VAL A 30 -1.349 4.712 -38.387 1.00 12.12 C ATOM 445 CG1 VAL A 30 -0.844 5.071 -36.993 1.00 33.10 C ATOM 446 CG2 VAL A 30 -0.276 4.965 -39.442 1.00 70.43 C ATOM 0 H VAL A 30 -3.001 3.729 -36.766 1.00 1.11 H new ATOM 0 HA VAL A 30 -2.280 3.086 -39.438 1.00 62.04 H new ATOM 0 HB VAL A 30 -2.197 5.361 -38.605 1.00 12.12 H new ATOM 0 HG11 VAL A 30 -0.501 6.106 -36.986 1.00 33.10 H new ATOM 0 HG12 VAL A 30 -1.652 4.952 -36.271 1.00 33.10 H new ATOM 0 HG13 VAL A 30 -0.018 4.413 -36.725 1.00 33.10 H new ATOM 0 HG21 VAL A 30 0.059 6.000 -39.379 1.00 70.43 H new ATOM 0 HG22 VAL A 30 0.569 4.298 -39.269 1.00 70.43 H new ATOM 0 HG23 VAL A 30 -0.689 4.777 -40.433 1.00 70.43 H new ATOM 456 N LEU A 31 -0.402 1.464 -39.260 1.00 3.31 N ATOM 457 CA LEU A 31 0.662 0.467 -39.169 1.00 51.44 C ATOM 458 C LEU A 31 1.955 1.030 -39.751 1.00 63.53 C ATOM 459 O LEU A 31 3.055 0.686 -39.316 1.00 71.22 O ATOM 460 CB LEU A 31 0.253 -0.825 -39.895 1.00 73.13 C ATOM 461 CG LEU A 31 1.212 -2.020 -39.713 1.00 33.10 C ATOM 462 CD1 LEU A 31 1.366 -2.371 -38.235 1.00 41.32 C ATOM 463 CD2 LEU A 31 0.724 -3.235 -40.503 1.00 61.33 C ATOM 0 H LEU A 31 -0.893 1.477 -40.154 1.00 3.31 H new ATOM 0 HA LEU A 31 0.830 0.225 -38.120 1.00 51.44 H new ATOM 0 HB2 LEU A 31 -0.737 -1.119 -39.546 1.00 73.13 H new ATOM 0 HB3 LEU A 31 0.165 -0.611 -40.960 1.00 73.13 H new ATOM 0 HG LEU A 31 2.188 -1.729 -40.101 1.00 33.10 H new ATOM 0 HD11 LEU A 31 2.046 -3.216 -38.131 1.00 41.32 H new ATOM 0 HD12 LEU A 31 1.769 -1.513 -37.697 1.00 41.32 H new ATOM 0 HD13 LEU A 31 0.393 -2.635 -37.820 1.00 41.32 H new ATOM 0 HD21 LEU A 31 1.416 -4.065 -40.359 1.00 61.33 H new ATOM 0 HD22 LEU A 31 -0.267 -3.524 -40.151 1.00 61.33 H new ATOM 0 HD23 LEU A 31 0.674 -2.984 -41.563 1.00 61.33 H new ATOM 475 N THR A 32 1.804 1.907 -40.735 1.00 73.42 N ATOM 476 CA THR A 32 2.931 2.596 -41.347 1.00 63.14 C ATOM 477 C THR A 32 2.497 4.000 -41.778 1.00 74.03 C ATOM 478 O THR A 32 1.684 4.144 -42.691 1.00 24.43 O ATOM 479 CB THR A 32 3.465 1.805 -42.566 1.00 71.24 C ATOM 480 OG1 THR A 32 3.802 0.469 -42.162 1.00 42.12 O ATOM 481 CG2 THR A 32 4.695 2.483 -43.165 1.00 61.24 C ATOM 0 H THR A 32 0.898 2.160 -41.130 1.00 73.42 H new ATOM 0 HA THR A 32 3.735 2.672 -40.615 1.00 63.14 H new ATOM 0 HB THR A 32 2.684 1.777 -43.326 1.00 71.24 H new ATOM 0 HG1 THR A 32 4.138 -0.031 -42.935 1.00 42.12 H new ATOM 0 HG21 THR A 32 5.049 1.906 -44.019 1.00 61.24 H new ATOM 0 HG22 THR A 32 4.433 3.490 -43.490 1.00 61.24 H new ATOM 0 HG23 THR A 32 5.482 2.538 -42.413 1.00 61.24 H new ATOM 489 N PRO A 33 3.010 5.050 -41.102 1.00 53.10 N ATOM 490 CA PRO A 33 2.610 6.442 -41.359 1.00 31.44 C ATOM 491 C PRO A 33 3.014 6.922 -42.750 1.00 3.51 C ATOM 492 O PRO A 33 4.053 6.518 -43.283 1.00 22.31 O ATOM 493 CB PRO A 33 3.347 7.250 -40.272 1.00 1.05 C ATOM 494 CG PRO A 33 3.773 6.240 -39.259 1.00 71.12 C ATOM 495 CD PRO A 33 4.011 4.970 -40.027 1.00 42.35 C ATOM 0 HA PRO A 33 1.527 6.557 -41.325 1.00 31.44 H new ATOM 0 HB2 PRO A 33 4.205 7.778 -40.687 1.00 1.05 H new ATOM 0 HB3 PRO A 33 2.694 8.002 -39.829 1.00 1.05 H new ATOM 0 HG2 PRO A 33 4.678 6.561 -38.743 1.00 71.12 H new ATOM 0 HG3 PRO A 33 3.005 6.100 -38.499 1.00 71.12 H new ATOM 0 HD2 PRO A 33 5.026 4.920 -40.422 1.00 42.35 H new ATOM 0 HD3 PRO A 33 3.867 4.087 -39.404 1.00 42.35 H new ATOM 503 N GLY A 34 2.185 7.783 -43.330 1.00 1.22 N ATOM 504 CA GLY A 34 2.481 8.354 -44.632 1.00 71.12 C ATOM 505 C GLY A 34 3.131 9.714 -44.519 1.00 51.22 C ATOM 506 O GLY A 34 3.697 10.049 -43.474 1.00 33.52 O ATOM 0 H GLY A 34 1.307 8.098 -42.918 1.00 1.22 H new ATOM 0 HA2 GLY A 34 3.140 7.682 -45.181 1.00 71.12 H new ATOM 0 HA3 GLY A 34 1.560 8.439 -45.209 1.00 71.12 H new ATOM 510 N ASP A 35 3.052 10.509 -45.582 1.00 1.32 N ATOM 511 CA ASP A 35 3.642 11.847 -45.568 1.00 65.45 C ATOM 512 C ASP A 35 2.840 12.776 -44.668 1.00 14.34 C ATOM 513 O ASP A 35 3.371 13.375 -43.731 1.00 32.43 O ATOM 514 CB ASP A 35 3.712 12.446 -46.981 1.00 64.24 C ATOM 515 CG ASP A 35 4.767 11.786 -47.850 1.00 72.41 C ATOM 516 OD1 ASP A 35 5.970 11.992 -47.586 1.00 4.21 O ATOM 517 OD2 ASP A 35 4.400 11.073 -48.805 1.00 51.11 O ATOM 0 H ASP A 35 2.591 10.255 -46.456 1.00 1.32 H new ATOM 0 HA ASP A 35 4.656 11.749 -45.181 1.00 65.45 H new ATOM 0 HB2 ASP A 35 2.739 12.346 -47.461 1.00 64.24 H new ATOM 0 HB3 ASP A 35 3.924 13.513 -46.908 1.00 64.24 H new ATOM 522 N GLY A 36 1.556 12.893 -44.972 1.00 33.03 N ATOM 523 CA GLY A 36 0.677 13.796 -44.248 1.00 42.44 C ATOM 524 C GLY A 36 0.748 15.213 -44.792 1.00 51.13 C ATOM 525 O GLY A 36 -0.237 15.950 -44.751 1.00 23.41 O ATOM 0 H GLY A 36 1.099 12.371 -45.719 1.00 33.03 H new ATOM 0 HA2 GLY A 36 -0.349 13.433 -44.312 1.00 42.44 H new ATOM 0 HA3 GLY A 36 0.949 13.798 -43.192 1.00 42.44 H new ATOM 529 N VAL A 37 1.915 15.584 -45.322 1.00 62.44 N ATOM 530 CA VAL A 37 2.104 16.893 -45.943 1.00 70.24 C ATOM 531 C VAL A 37 1.508 16.902 -47.348 1.00 51.32 C ATOM 532 O VAL A 37 1.014 17.926 -47.825 1.00 73.24 O ATOM 533 CB VAL A 37 3.603 17.292 -46.002 1.00 11.24 C ATOM 534 CG1 VAL A 37 4.176 17.429 -44.592 1.00 11.54 C ATOM 535 CG2 VAL A 37 4.412 16.281 -46.819 1.00 52.31 C ATOM 0 H VAL A 37 2.746 14.992 -45.333 1.00 62.44 H new ATOM 0 HA VAL A 37 1.587 17.627 -45.324 1.00 70.24 H new ATOM 0 HB VAL A 37 3.676 18.259 -46.501 1.00 11.24 H new ATOM 0 HG11 VAL A 37 5.228 17.709 -44.652 1.00 11.54 H new ATOM 0 HG12 VAL A 37 3.626 18.198 -44.049 1.00 11.54 H new ATOM 0 HG13 VAL A 37 4.083 16.478 -44.068 1.00 11.54 H new ATOM 0 HG21 VAL A 37 5.458 16.586 -46.843 1.00 52.31 H new ATOM 0 HG22 VAL A 37 4.332 15.295 -46.360 1.00 52.31 H new ATOM 0 HG23 VAL A 37 4.023 16.240 -47.836 1.00 52.31 H new ATOM 545 N THR A 38 1.557 15.749 -48.006 1.00 10.01 N ATOM 546 CA THR A 38 0.923 15.573 -49.300 1.00 12.05 C ATOM 547 C THR A 38 -0.598 15.552 -49.121 1.00 25.34 C ATOM 548 O THR A 38 -1.161 14.580 -48.610 1.00 54.22 O ATOM 549 CB THR A 38 1.417 14.272 -49.980 1.00 44.23 C ATOM 550 OG1 THR A 38 1.485 13.213 -49.011 1.00 15.11 O ATOM 551 CG2 THR A 38 2.793 14.465 -50.615 1.00 33.03 C ATOM 0 H THR A 38 2.035 14.918 -47.658 1.00 10.01 H new ATOM 0 HA THR A 38 1.193 16.407 -49.948 1.00 12.05 H new ATOM 0 HB THR A 38 0.708 14.013 -50.766 1.00 44.23 H new ATOM 0 HG1 THR A 38 0.721 13.278 -48.401 1.00 15.11 H new ATOM 0 HG21 THR A 38 3.111 13.534 -51.084 1.00 33.03 H new ATOM 0 HG22 THR A 38 2.739 15.251 -51.369 1.00 33.03 H new ATOM 0 HG23 THR A 38 3.512 14.748 -49.846 1.00 33.03 H new ATOM 559 N LYS A 39 -1.243 16.646 -49.517 1.00 43.31 N ATOM 560 CA LYS A 39 -2.662 16.859 -49.250 1.00 13.11 C ATOM 561 C LYS A 39 -3.522 16.333 -50.406 1.00 41.21 C ATOM 562 O LYS A 39 -3.513 16.905 -51.501 1.00 63.14 O ATOM 563 CB LYS A 39 -2.914 18.366 -49.018 1.00 22.03 C ATOM 564 CG LYS A 39 -4.246 18.705 -48.341 1.00 14.54 C ATOM 565 CD LYS A 39 -5.444 18.602 -49.285 1.00 41.50 C ATOM 566 CE LYS A 39 -6.755 18.852 -48.549 1.00 4.21 C ATOM 567 NZ LYS A 39 -6.981 17.850 -47.473 1.00 32.51 N ATOM 0 H LYS A 39 -0.798 17.407 -50.030 1.00 43.31 H new ATOM 0 HA LYS A 39 -2.945 16.305 -48.355 1.00 13.11 H new ATOM 0 HB2 LYS A 39 -2.103 18.765 -48.409 1.00 22.03 H new ATOM 0 HB3 LYS A 39 -2.872 18.878 -49.979 1.00 22.03 H new ATOM 0 HG2 LYS A 39 -4.398 18.033 -47.496 1.00 14.54 H new ATOM 0 HG3 LYS A 39 -4.195 19.717 -47.938 1.00 14.54 H new ATOM 0 HD2 LYS A 39 -5.335 19.325 -50.093 1.00 41.50 H new ATOM 0 HD3 LYS A 39 -5.465 17.613 -49.742 1.00 41.50 H new ATOM 0 HE2 LYS A 39 -6.745 19.853 -48.118 1.00 4.21 H new ATOM 0 HE3 LYS A 39 -7.583 18.818 -49.258 1.00 4.21 H new ATOM 0 HZ1 LYS A 39 -7.970 17.899 -47.155 1.00 32.51 H new ATOM 0 HZ2 LYS A 39 -6.781 16.897 -47.839 1.00 32.51 H new ATOM 0 HZ3 LYS A 39 -6.350 18.053 -46.672 1.00 32.51 H new ATOM 581 N PRO A 40 -4.256 15.223 -50.183 1.00 42.33 N ATOM 582 CA PRO A 40 -5.229 14.698 -51.132 1.00 34.02 C ATOM 583 C PRO A 40 -6.648 15.179 -50.803 1.00 15.53 C ATOM 584 O PRO A 40 -6.867 15.824 -49.771 1.00 20.24 O ATOM 585 CB PRO A 40 -5.092 13.191 -50.911 1.00 14.44 C ATOM 586 CG PRO A 40 -4.801 13.050 -49.445 1.00 71.04 C ATOM 587 CD PRO A 40 -4.179 14.359 -48.987 1.00 13.23 C ATOM 0 HA PRO A 40 -5.058 15.015 -52.161 1.00 34.02 H new ATOM 0 HB2 PRO A 40 -6.006 12.665 -51.186 1.00 14.44 H new ATOM 0 HB3 PRO A 40 -4.288 12.773 -51.517 1.00 14.44 H new ATOM 0 HG2 PRO A 40 -5.715 12.842 -48.889 1.00 71.04 H new ATOM 0 HG3 PRO A 40 -4.122 12.217 -49.265 1.00 71.04 H new ATOM 0 HD2 PRO A 40 -4.725 14.789 -48.147 1.00 13.23 H new ATOM 0 HD3 PRO A 40 -3.149 14.220 -48.660 1.00 13.23 H new ATOM 595 N GLN A 41 -7.604 14.864 -51.670 1.00 71.30 N ATOM 596 CA GLN A 41 -8.995 15.256 -51.457 1.00 74.23 C ATOM 597 C GLN A 41 -9.945 14.292 -52.165 1.00 54.51 C ATOM 598 O GLN A 41 -9.534 13.530 -53.044 1.00 73.51 O ATOM 599 CB GLN A 41 -9.233 16.698 -51.928 1.00 32.32 C ATOM 600 CG GLN A 41 -8.790 16.975 -53.361 1.00 20.14 C ATOM 601 CD GLN A 41 -9.112 18.394 -53.806 1.00 75.11 C ATOM 602 OE1 GLN A 41 -10.102 18.983 -53.372 1.00 42.13 O ATOM 603 NE2 GLN A 41 -8.271 18.959 -54.659 1.00 32.25 N ATOM 0 H GLN A 41 -7.442 14.338 -52.529 1.00 71.30 H new ATOM 0 HA GLN A 41 -9.200 15.210 -50.387 1.00 74.23 H new ATOM 0 HB2 GLN A 41 -10.295 16.926 -51.839 1.00 32.32 H new ATOM 0 HB3 GLN A 41 -8.704 17.377 -51.260 1.00 32.32 H new ATOM 0 HG2 GLN A 41 -7.716 16.806 -53.445 1.00 20.14 H new ATOM 0 HG3 GLN A 41 -9.278 16.268 -54.032 1.00 20.14 H new ATOM 0 HE21 GLN A 41 -7.461 18.439 -54.997 1.00 32.25 H new ATOM 0 HE22 GLN A 41 -8.433 19.914 -54.978 1.00 32.25 H new ATOM 612 N ALA A 42 -11.213 14.332 -51.764 1.00 32.14 N ATOM 613 CA ALA A 42 -12.235 13.431 -52.295 1.00 64.43 C ATOM 614 C ALA A 42 -12.648 13.822 -53.712 1.00 53.00 C ATOM 615 O ALA A 42 -12.339 14.921 -54.182 1.00 74.42 O ATOM 616 CB ALA A 42 -13.447 13.412 -51.373 1.00 22.33 C ATOM 0 H ALA A 42 -11.561 14.987 -51.064 1.00 32.14 H new ATOM 0 HA ALA A 42 -11.807 12.430 -52.342 1.00 64.43 H new ATOM 0 HB1 ALA A 42 -14.202 12.738 -51.778 1.00 22.33 H new ATOM 0 HB2 ALA A 42 -13.146 13.067 -50.384 1.00 22.33 H new ATOM 0 HB3 ALA A 42 -13.862 14.417 -51.297 1.00 22.33 H new ATOM 622 N GLY A 43 -13.349 12.914 -54.386 1.00 22.23 N ATOM 623 CA GLY A 43 -13.798 13.167 -55.743 1.00 40.21 C ATOM 624 C GLY A 43 -12.724 12.877 -56.771 1.00 65.14 C ATOM 625 O GLY A 43 -12.891 13.176 -57.955 1.00 43.04 O ATOM 0 H GLY A 43 -13.615 12.003 -54.013 1.00 22.23 H new ATOM 0 HA2 GLY A 43 -14.674 12.553 -55.953 1.00 40.21 H new ATOM 0 HA3 GLY A 43 -14.110 14.208 -55.831 1.00 40.21 H new ATOM 629 N LYS A 44 -11.619 12.291 -56.321 1.00 15.02 N ATOM 630 CA LYS A 44 -10.494 11.982 -57.198 1.00 4.12 C ATOM 631 C LYS A 44 -10.231 10.481 -57.219 1.00 2.42 C ATOM 632 O LYS A 44 -10.587 9.768 -56.278 1.00 21.32 O ATOM 633 CB LYS A 44 -9.237 12.739 -56.740 1.00 74.43 C ATOM 634 CG LYS A 44 -9.404 14.258 -56.731 1.00 13.21 C ATOM 635 CD LYS A 44 -9.789 14.791 -58.109 1.00 25.44 C ATOM 636 CE LYS A 44 -10.043 16.293 -58.089 1.00 74.31 C ATOM 637 NZ LYS A 44 -10.533 16.782 -59.405 1.00 24.40 N ATOM 0 H LYS A 44 -11.478 12.019 -55.348 1.00 15.02 H new ATOM 0 HA LYS A 44 -10.745 12.303 -58.209 1.00 4.12 H new ATOM 0 HB2 LYS A 44 -8.968 12.406 -55.738 1.00 74.43 H new ATOM 0 HB3 LYS A 44 -8.407 12.477 -57.396 1.00 74.43 H new ATOM 0 HG2 LYS A 44 -10.169 14.536 -56.006 1.00 13.21 H new ATOM 0 HG3 LYS A 44 -8.474 14.725 -56.407 1.00 13.21 H new ATOM 0 HD2 LYS A 44 -8.993 14.567 -58.820 1.00 25.44 H new ATOM 0 HD3 LYS A 44 -10.684 14.277 -58.460 1.00 25.44 H new ATOM 0 HE2 LYS A 44 -10.775 16.529 -57.317 1.00 74.31 H new ATOM 0 HE3 LYS A 44 -9.123 16.815 -57.826 1.00 74.31 H new ATOM 0 HZ1 LYS A 44 -10.695 17.808 -59.356 1.00 24.40 H new ATOM 0 HZ2 LYS A 44 -9.823 16.579 -60.137 1.00 24.40 H new ATOM 0 HZ3 LYS A 44 -11.424 16.302 -59.644 1.00 24.40 H new ATOM 651 N LYS A 45 -9.613 10.014 -58.298 1.00 31.54 N ATOM 652 CA LYS A 45 -9.278 8.603 -58.457 1.00 2.24 C ATOM 653 C LYS A 45 -7.994 8.299 -57.689 1.00 43.32 C ATOM 654 O LYS A 45 -6.928 8.802 -58.041 1.00 1.42 O ATOM 655 CB LYS A 45 -9.097 8.269 -59.948 1.00 23.45 C ATOM 656 CG LYS A 45 -8.968 6.778 -60.248 1.00 51.53 C ATOM 657 CD LYS A 45 -10.284 6.037 -60.030 1.00 61.23 C ATOM 658 CE LYS A 45 -11.396 6.561 -60.933 1.00 43.20 C ATOM 659 NZ LYS A 45 -12.656 5.783 -60.772 1.00 55.24 N ATOM 0 H LYS A 45 -9.331 10.600 -59.084 1.00 31.54 H new ATOM 0 HA LYS A 45 -10.088 7.991 -58.060 1.00 2.24 H new ATOM 0 HB2 LYS A 45 -9.947 8.667 -60.503 1.00 23.45 H new ATOM 0 HB3 LYS A 45 -8.208 8.780 -60.317 1.00 23.45 H new ATOM 0 HG2 LYS A 45 -8.642 6.642 -61.279 1.00 51.53 H new ATOM 0 HG3 LYS A 45 -8.198 6.345 -59.610 1.00 51.53 H new ATOM 0 HD2 LYS A 45 -10.136 4.974 -60.218 1.00 61.23 H new ATOM 0 HD3 LYS A 45 -10.587 6.137 -58.988 1.00 61.23 H new ATOM 0 HE2 LYS A 45 -11.585 7.610 -60.704 1.00 43.20 H new ATOM 0 HE3 LYS A 45 -11.071 6.515 -61.973 1.00 43.20 H new ATOM 0 HZ1 LYS A 45 -13.208 5.831 -61.652 1.00 55.24 H new ATOM 0 HZ2 LYS A 45 -12.427 4.791 -60.560 1.00 55.24 H new ATOM 0 HZ3 LYS A 45 -13.214 6.184 -59.991 1.00 55.24 H new ATOM 673 N VAL A 46 -8.100 7.491 -56.640 1.00 62.24 N ATOM 674 CA VAL A 46 -6.958 7.168 -55.789 1.00 12.10 C ATOM 675 C VAL A 46 -6.470 5.739 -56.028 1.00 64.05 C ATOM 676 O VAL A 46 -7.267 4.834 -56.325 1.00 45.11 O ATOM 677 CB VAL A 46 -7.298 7.351 -54.285 1.00 33.35 C ATOM 678 CG1 VAL A 46 -7.686 8.800 -53.989 1.00 13.43 C ATOM 679 CG2 VAL A 46 -8.410 6.397 -53.848 1.00 33.14 C ATOM 0 H VAL A 46 -8.972 7.044 -56.356 1.00 62.24 H new ATOM 0 HA VAL A 46 -6.162 7.863 -56.057 1.00 12.10 H new ATOM 0 HB VAL A 46 -6.404 7.109 -53.711 1.00 33.35 H new ATOM 0 HG11 VAL A 46 -7.920 8.905 -52.930 1.00 13.43 H new ATOM 0 HG12 VAL A 46 -6.856 9.458 -54.244 1.00 13.43 H new ATOM 0 HG13 VAL A 46 -8.559 9.071 -54.582 1.00 13.43 H new ATOM 0 HG21 VAL A 46 -8.625 6.549 -52.790 1.00 33.14 H new ATOM 0 HG22 VAL A 46 -9.308 6.593 -54.433 1.00 33.14 H new ATOM 0 HG23 VAL A 46 -8.090 5.367 -54.009 1.00 33.14 H new ATOM 689 N THR A 47 -5.154 5.562 -55.910 1.00 20.33 N ATOM 690 CA THR A 47 -4.508 4.258 -56.019 1.00 43.45 C ATOM 691 C THR A 47 -4.229 3.690 -54.624 1.00 3.34 C ATOM 692 O THR A 47 -3.340 4.186 -53.905 1.00 53.32 O ATOM 693 CB THR A 47 -3.177 4.356 -56.802 1.00 31.33 C ATOM 694 OG1 THR A 47 -3.408 4.942 -58.089 1.00 10.14 O ATOM 695 CG2 THR A 47 -2.534 2.982 -56.979 1.00 54.21 C ATOM 0 H THR A 47 -4.503 6.327 -55.735 1.00 20.33 H new ATOM 0 HA THR A 47 -5.185 3.597 -56.560 1.00 43.45 H new ATOM 0 HB THR A 47 -2.497 4.984 -56.226 1.00 31.33 H new ATOM 0 HG1 THR A 47 -2.565 5.293 -58.444 1.00 10.14 H new ATOM 0 HG21 THR A 47 -1.601 3.086 -57.533 1.00 54.21 H new ATOM 0 HG22 THR A 47 -2.329 2.547 -56.001 1.00 54.21 H new ATOM 0 HG23 THR A 47 -3.213 2.331 -57.530 1.00 54.21 H new ATOM 703 N VAL A 48 -4.997 2.660 -54.268 1.00 1.43 N ATOM 704 CA VAL A 48 -4.940 2.025 -52.957 1.00 41.03 C ATOM 705 C VAL A 48 -4.463 0.571 -53.055 1.00 2.14 C ATOM 706 O VAL A 48 -4.203 0.053 -54.145 1.00 5.01 O ATOM 707 CB VAL A 48 -6.323 2.050 -52.260 1.00 25.31 C ATOM 708 CG1 VAL A 48 -6.797 3.484 -52.048 1.00 2.44 C ATOM 709 CG2 VAL A 48 -7.347 1.243 -53.057 1.00 31.14 C ATOM 0 H VAL A 48 -5.685 2.240 -54.893 1.00 1.43 H new ATOM 0 HA VAL A 48 -4.225 2.597 -52.366 1.00 41.03 H new ATOM 0 HB VAL A 48 -6.219 1.584 -51.280 1.00 25.31 H new ATOM 0 HG11 VAL A 48 -7.770 3.477 -51.557 1.00 2.44 H new ATOM 0 HG12 VAL A 48 -6.079 4.016 -51.423 1.00 2.44 H new ATOM 0 HG13 VAL A 48 -6.881 3.986 -53.012 1.00 2.44 H new ATOM 0 HG21 VAL A 48 -8.311 1.275 -52.549 1.00 31.14 H new ATOM 0 HG22 VAL A 48 -7.449 1.669 -54.055 1.00 31.14 H new ATOM 0 HG23 VAL A 48 -7.013 0.209 -53.137 1.00 31.14 H new ATOM 719 N HIS A 49 -4.355 -0.067 -51.893 1.00 0.12 N ATOM 720 CA HIS A 49 -3.864 -1.436 -51.760 1.00 21.40 C ATOM 721 C HIS A 49 -4.488 -2.042 -50.499 1.00 62.51 C ATOM 722 O HIS A 49 -4.580 -1.364 -49.475 1.00 12.42 O ATOM 723 CB HIS A 49 -2.328 -1.389 -51.669 1.00 65.53 C ATOM 724 CG HIS A 49 -1.616 -2.707 -51.655 1.00 3.22 C ATOM 725 ND1 HIS A 49 -0.528 -2.943 -50.845 1.00 4.14 N ATOM 726 CD2 HIS A 49 -1.776 -3.827 -52.397 1.00 44.34 C ATOM 727 CE1 HIS A 49 -0.049 -4.142 -51.091 1.00 71.41 C ATOM 728 NE2 HIS A 49 -0.785 -4.706 -52.030 1.00 60.41 N ATOM 0 H HIS A 49 -4.610 0.360 -51.002 1.00 0.12 H new ATOM 0 HA HIS A 49 -4.139 -2.054 -52.615 1.00 21.40 H new ATOM 0 HB2 HIS A 49 -1.954 -0.809 -52.513 1.00 65.53 H new ATOM 0 HB3 HIS A 49 -2.057 -0.846 -50.764 1.00 65.53 H new ATOM 0 HD1 HIS A 49 -0.152 -2.288 -50.160 1.00 4.14 H new ATOM 0 HD2 HIS A 49 -2.541 -3.999 -53.140 1.00 44.34 H new ATOM 0 HE1 HIS A 49 0.805 -4.591 -50.605 1.00 71.41 H new ATOM 0 HE2 HIS A 49 -0.642 -5.638 -52.418 1.00 60.41 H new ATOM 737 N TYR A 50 -4.952 -3.291 -50.577 1.00 14.34 N ATOM 738 CA TYR A 50 -5.673 -3.913 -49.457 1.00 11.42 C ATOM 739 C TYR A 50 -5.062 -5.255 -49.065 1.00 70.24 C ATOM 740 O TYR A 50 -4.463 -5.938 -49.899 1.00 63.33 O ATOM 741 CB TYR A 50 -7.150 -4.143 -49.819 1.00 61.52 C ATOM 742 CG TYR A 50 -7.931 -2.884 -50.150 1.00 44.20 C ATOM 743 CD1 TYR A 50 -8.247 -1.958 -49.163 1.00 71.34 C ATOM 744 CD2 TYR A 50 -8.370 -2.634 -51.447 1.00 44.43 C ATOM 745 CE1 TYR A 50 -8.974 -0.821 -49.457 1.00 2.23 C ATOM 746 CE2 TYR A 50 -9.095 -1.497 -51.748 1.00 51.13 C ATOM 747 CZ TYR A 50 -9.395 -0.595 -50.749 1.00 62.13 C ATOM 748 OH TYR A 50 -10.119 0.538 -51.039 1.00 33.15 O ATOM 0 H TYR A 50 -4.844 -3.890 -51.395 1.00 14.34 H new ATOM 0 HA TYR A 50 -5.594 -3.224 -48.616 1.00 11.42 H new ATOM 0 HB2 TYR A 50 -7.199 -4.818 -50.673 1.00 61.52 H new ATOM 0 HB3 TYR A 50 -7.639 -4.648 -48.986 1.00 61.52 H new ATOM 0 HD1 TYR A 50 -7.918 -2.130 -48.149 1.00 71.34 H new ATOM 0 HD2 TYR A 50 -8.140 -3.340 -52.231 1.00 44.43 H new ATOM 0 HE1 TYR A 50 -9.211 -0.112 -48.677 1.00 2.23 H new ATOM 0 HE2 TYR A 50 -9.425 -1.316 -52.760 1.00 51.13 H new ATOM 0 HH TYR A 50 -10.257 0.599 -52.007 1.00 33.15 H new ATOM 758 N ASP A 51 -5.211 -5.615 -47.789 1.00 4.52 N ATOM 759 CA ASP A 51 -4.884 -6.968 -47.313 1.00 51.23 C ATOM 760 C ASP A 51 -5.947 -7.448 -46.322 1.00 52.23 C ATOM 761 O ASP A 51 -6.148 -6.829 -45.277 1.00 72.43 O ATOM 762 CB ASP A 51 -3.498 -6.999 -46.656 1.00 43.42 C ATOM 763 CG ASP A 51 -3.029 -8.414 -46.339 1.00 52.30 C ATOM 764 OD1 ASP A 51 -2.799 -9.189 -47.288 1.00 54.15 O ATOM 765 OD2 ASP A 51 -2.871 -8.758 -45.149 1.00 62.22 O ATOM 0 H ASP A 51 -5.557 -4.989 -47.062 1.00 4.52 H new ATOM 0 HA ASP A 51 -4.869 -7.638 -48.173 1.00 51.23 H new ATOM 0 HB2 ASP A 51 -2.776 -6.521 -47.318 1.00 43.42 H new ATOM 0 HB3 ASP A 51 -3.523 -6.414 -45.736 1.00 43.42 H new ATOM 770 N GLY A 52 -6.635 -8.540 -46.663 1.00 64.23 N ATOM 771 CA GLY A 52 -7.711 -9.054 -45.821 1.00 20.04 C ATOM 772 C GLY A 52 -7.205 -9.965 -44.719 1.00 41.33 C ATOM 773 O GLY A 52 -6.328 -10.800 -44.957 1.00 22.22 O ATOM 0 H GLY A 52 -6.466 -9.081 -47.511 1.00 64.23 H new ATOM 0 HA2 GLY A 52 -8.251 -8.218 -45.377 1.00 20.04 H new ATOM 0 HA3 GLY A 52 -8.423 -9.600 -46.440 1.00 20.04 H new ATOM 777 N ARG A 53 -7.768 -9.829 -43.516 1.00 44.32 N ATOM 778 CA ARG A 53 -7.293 -10.583 -42.360 1.00 1.42 C ATOM 779 C ARG A 53 -8.369 -10.702 -41.280 1.00 33.53 C ATOM 780 O ARG A 53 -9.221 -9.820 -41.121 1.00 63.13 O ATOM 781 CB ARG A 53 -6.046 -9.896 -41.787 1.00 71.31 C ATOM 782 CG ARG A 53 -5.266 -10.731 -40.770 1.00 52.10 C ATOM 783 CD ARG A 53 -3.967 -10.040 -40.373 1.00 42.02 C ATOM 784 NE ARG A 53 -3.231 -9.579 -41.553 1.00 21.24 N ATOM 785 CZ ARG A 53 -2.402 -8.535 -41.568 1.00 61.51 C ATOM 786 NH1 ARG A 53 -2.062 -7.920 -40.440 1.00 32.45 N ATOM 787 NH2 ARG A 53 -1.887 -8.120 -42.713 1.00 4.41 N ATOM 0 H ARG A 53 -8.551 -9.205 -43.320 1.00 44.32 H new ATOM 0 HA ARG A 53 -7.046 -11.593 -42.688 1.00 1.42 H new ATOM 0 HB2 ARG A 53 -5.380 -9.636 -42.610 1.00 71.31 H new ATOM 0 HB3 ARG A 53 -6.348 -8.961 -41.314 1.00 71.31 H new ATOM 0 HG2 ARG A 53 -5.879 -10.896 -39.884 1.00 52.10 H new ATOM 0 HG3 ARG A 53 -5.046 -11.711 -41.192 1.00 52.10 H new ATOM 0 HD2 ARG A 53 -4.186 -9.192 -39.724 1.00 42.02 H new ATOM 0 HD3 ARG A 53 -3.346 -10.728 -39.800 1.00 42.02 H new ATOM 0 HE ARG A 53 -3.362 -10.093 -42.424 1.00 21.24 H new ATOM 0 HH11 ARG A 53 -2.436 -8.246 -39.549 1.00 32.45 H new ATOM 0 HH12 ARG A 53 -1.427 -7.122 -40.465 1.00 32.45 H new ATOM 0 HH21 ARG A 53 -2.124 -8.598 -43.582 1.00 4.41 H new ATOM 0 HH22 ARG A 53 -1.253 -7.321 -42.727 1.00 4.41 H new ATOM 801 N PHE A 54 -8.325 -11.805 -40.542 1.00 54.13 N ATOM 802 CA PHE A 54 -9.209 -12.016 -39.402 1.00 71.03 C ATOM 803 C PHE A 54 -8.569 -11.414 -38.145 1.00 14.50 C ATOM 804 O PHE A 54 -7.340 -11.311 -38.065 1.00 62.12 O ATOM 805 CB PHE A 54 -9.478 -13.517 -39.204 1.00 75.12 C ATOM 806 CG PHE A 54 -10.206 -14.169 -40.360 1.00 4.21 C ATOM 807 CD1 PHE A 54 -9.507 -14.646 -41.461 1.00 10.32 C ATOM 808 CD2 PHE A 54 -11.592 -14.301 -40.348 1.00 43.03 C ATOM 809 CE1 PHE A 54 -10.168 -15.237 -42.521 1.00 10.31 C ATOM 810 CE2 PHE A 54 -12.257 -14.892 -41.407 1.00 64.24 C ATOM 811 CZ PHE A 54 -11.544 -15.360 -42.495 1.00 33.43 C ATOM 0 H PHE A 54 -7.679 -12.575 -40.716 1.00 54.13 H new ATOM 0 HA PHE A 54 -10.163 -11.523 -39.589 1.00 71.03 H new ATOM 0 HB2 PHE A 54 -8.528 -14.029 -39.051 1.00 75.12 H new ATOM 0 HB3 PHE A 54 -10.064 -13.654 -38.295 1.00 75.12 H new ATOM 0 HD1 PHE A 54 -8.431 -14.554 -41.489 1.00 10.32 H new ATOM 0 HD2 PHE A 54 -12.155 -13.937 -39.501 1.00 43.03 H new ATOM 0 HE1 PHE A 54 -9.609 -15.603 -43.370 1.00 10.31 H new ATOM 0 HE2 PHE A 54 -13.332 -14.988 -41.384 1.00 64.24 H new ATOM 0 HZ PHE A 54 -12.062 -15.821 -43.323 1.00 33.43 H new ATOM 821 N PRO A 55 -9.379 -11.016 -37.142 1.00 32.51 N ATOM 822 CA PRO A 55 -8.878 -10.325 -35.940 1.00 12.25 C ATOM 823 C PRO A 55 -7.852 -11.146 -35.148 1.00 74.21 C ATOM 824 O PRO A 55 -7.079 -10.591 -34.363 1.00 2.34 O ATOM 825 CB PRO A 55 -10.147 -10.084 -35.099 1.00 42.22 C ATOM 826 CG PRO A 55 -11.153 -11.051 -35.630 1.00 14.43 C ATOM 827 CD PRO A 55 -10.844 -11.196 -37.096 1.00 41.45 C ATOM 0 HA PRO A 55 -8.345 -9.412 -36.206 1.00 12.25 H new ATOM 0 HB2 PRO A 55 -9.956 -10.255 -34.039 1.00 42.22 H new ATOM 0 HB3 PRO A 55 -10.497 -9.056 -35.198 1.00 42.22 H new ATOM 0 HG2 PRO A 55 -11.082 -12.011 -35.118 1.00 14.43 H new ATOM 0 HG3 PRO A 55 -12.168 -10.683 -35.478 1.00 14.43 H new ATOM 0 HD2 PRO A 55 -11.144 -12.172 -37.478 1.00 41.45 H new ATOM 0 HD3 PRO A 55 -11.362 -10.447 -37.694 1.00 41.45 H new ATOM 835 N ASP A 56 -7.841 -12.463 -35.358 1.00 72.30 N ATOM 836 CA ASP A 56 -6.958 -13.357 -34.602 1.00 2.21 C ATOM 837 C ASP A 56 -5.606 -13.521 -35.299 1.00 31.10 C ATOM 838 O ASP A 56 -4.753 -14.282 -34.840 1.00 51.45 O ATOM 839 CB ASP A 56 -7.621 -14.731 -34.394 1.00 33.21 C ATOM 840 CG ASP A 56 -7.676 -15.577 -35.660 1.00 3.34 C ATOM 841 OD1 ASP A 56 -8.393 -15.196 -36.606 1.00 1.05 O ATOM 842 OD2 ASP A 56 -7.016 -16.641 -35.700 1.00 33.45 O ATOM 0 H ASP A 56 -8.431 -12.935 -36.043 1.00 72.30 H new ATOM 0 HA ASP A 56 -6.784 -12.902 -33.627 1.00 2.21 H new ATOM 0 HB2 ASP A 56 -7.074 -15.277 -33.625 1.00 33.21 H new ATOM 0 HB3 ASP A 56 -8.634 -14.584 -34.021 1.00 33.21 H new ATOM 847 N GLY A 57 -5.413 -12.800 -36.400 1.00 5.43 N ATOM 848 CA GLY A 57 -4.148 -12.840 -37.119 1.00 3.42 C ATOM 849 C GLY A 57 -4.217 -13.725 -38.348 1.00 52.54 C ATOM 850 O GLY A 57 -3.539 -13.470 -39.349 1.00 13.40 O ATOM 0 H GLY A 57 -6.115 -12.184 -36.811 1.00 5.43 H new ATOM 0 HA2 GLY A 57 -3.869 -11.829 -37.416 1.00 3.42 H new ATOM 0 HA3 GLY A 57 -3.365 -13.205 -36.454 1.00 3.42 H new ATOM 854 N LYS A 58 -5.036 -14.768 -38.265 1.00 22.23 N ATOM 855 CA LYS A 58 -5.256 -15.687 -39.377 1.00 64.14 C ATOM 856 C LYS A 58 -5.854 -14.933 -40.565 1.00 44.42 C ATOM 857 O LYS A 58 -6.624 -13.992 -40.378 1.00 32.12 O ATOM 858 CB LYS A 58 -6.212 -16.804 -38.930 1.00 2.04 C ATOM 859 CG LYS A 58 -6.427 -17.920 -39.954 1.00 64.13 C ATOM 860 CD LYS A 58 -7.587 -18.834 -39.549 1.00 2.12 C ATOM 861 CE LYS A 58 -7.378 -19.465 -38.171 1.00 51.22 C ATOM 862 NZ LYS A 58 -8.610 -20.143 -37.681 1.00 12.14 N ATOM 0 H LYS A 58 -5.566 -15.000 -37.425 1.00 22.23 H new ATOM 0 HA LYS A 58 -4.305 -16.124 -39.681 1.00 64.14 H new ATOM 0 HB2 LYS A 58 -5.827 -17.245 -38.010 1.00 2.04 H new ATOM 0 HB3 LYS A 58 -7.178 -16.360 -38.691 1.00 2.04 H new ATOM 0 HG2 LYS A 58 -6.630 -17.484 -40.932 1.00 64.13 H new ATOM 0 HG3 LYS A 58 -5.515 -18.508 -40.050 1.00 64.13 H new ATOM 0 HD2 LYS A 58 -8.514 -18.261 -39.546 1.00 2.12 H new ATOM 0 HD3 LYS A 58 -7.702 -19.622 -40.293 1.00 2.12 H new ATOM 0 HE2 LYS A 58 -6.562 -20.186 -38.221 1.00 51.22 H new ATOM 0 HE3 LYS A 58 -7.080 -18.695 -37.460 1.00 51.22 H new ATOM 0 HZ1 LYS A 58 -8.429 -20.558 -36.745 1.00 12.14 H new ATOM 0 HZ2 LYS A 58 -9.382 -19.450 -37.609 1.00 12.14 H new ATOM 0 HZ3 LYS A 58 -8.881 -20.895 -38.347 1.00 12.14 H new ATOM 876 N GLN A 59 -5.498 -15.326 -41.781 1.00 62.31 N ATOM 877 CA GLN A 59 -6.086 -14.720 -42.971 1.00 30.32 C ATOM 878 C GLN A 59 -6.095 -15.712 -44.126 1.00 0.55 C ATOM 879 O GLN A 59 -5.211 -16.566 -44.229 1.00 71.44 O ATOM 880 CB GLN A 59 -5.351 -13.425 -43.357 1.00 41.23 C ATOM 881 CG GLN A 59 -3.937 -13.615 -43.889 1.00 10.35 C ATOM 882 CD GLN A 59 -3.223 -12.289 -44.098 1.00 72.33 C ATOM 883 OE1 GLN A 59 -2.511 -11.804 -43.215 1.00 24.21 O ATOM 884 NE2 GLN A 59 -3.437 -11.674 -45.250 1.00 55.00 N ATOM 0 H GLN A 59 -4.811 -16.056 -41.970 1.00 62.31 H new ATOM 0 HA GLN A 59 -7.118 -14.455 -42.742 1.00 30.32 H new ATOM 0 HB2 GLN A 59 -5.939 -12.904 -44.112 1.00 41.23 H new ATOM 0 HB3 GLN A 59 -5.309 -12.776 -42.482 1.00 41.23 H new ATOM 0 HG2 GLN A 59 -3.366 -14.228 -43.191 1.00 10.35 H new ATOM 0 HG3 GLN A 59 -3.975 -14.159 -44.833 1.00 10.35 H new ATOM 0 HE21 GLN A 59 -4.032 -12.107 -45.956 1.00 55.00 H new ATOM 0 HE22 GLN A 59 -3.007 -10.767 -45.432 1.00 55.00 H new ATOM 893 N PHE A 60 -7.111 -15.600 -44.976 1.00 4.41 N ATOM 894 CA PHE A 60 -7.310 -16.527 -46.088 1.00 50.42 C ATOM 895 C PHE A 60 -6.141 -16.475 -47.070 1.00 13.13 C ATOM 896 O PHE A 60 -5.717 -17.502 -47.600 1.00 51.22 O ATOM 897 CB PHE A 60 -8.630 -16.209 -46.815 1.00 41.42 C ATOM 898 CG PHE A 60 -8.687 -14.827 -47.433 1.00 61.13 C ATOM 899 CD1 PHE A 60 -8.919 -13.705 -46.648 1.00 40.54 C ATOM 900 CD2 PHE A 60 -8.508 -14.651 -48.801 1.00 12.31 C ATOM 901 CE1 PHE A 60 -8.969 -12.443 -47.210 1.00 73.53 C ATOM 902 CE2 PHE A 60 -8.559 -13.390 -49.366 1.00 10.14 C ATOM 903 CZ PHE A 60 -8.789 -12.285 -48.571 1.00 13.11 C ATOM 0 H PHE A 60 -7.818 -14.867 -44.915 1.00 4.41 H new ATOM 0 HA PHE A 60 -7.361 -17.536 -45.680 1.00 50.42 H new ATOM 0 HB2 PHE A 60 -8.787 -16.951 -47.598 1.00 41.42 H new ATOM 0 HB3 PHE A 60 -9.454 -16.312 -46.109 1.00 41.42 H new ATOM 0 HD1 PHE A 60 -9.062 -13.820 -45.584 1.00 40.54 H new ATOM 0 HD2 PHE A 60 -8.327 -15.510 -49.430 1.00 12.31 H new ATOM 0 HE1 PHE A 60 -9.149 -11.580 -46.585 1.00 73.53 H new ATOM 0 HE2 PHE A 60 -8.419 -13.269 -50.430 1.00 10.14 H new ATOM 0 HZ PHE A 60 -8.828 -11.300 -49.012 1.00 13.11 H new ATOM 913 N ASP A 61 -5.622 -15.274 -47.300 1.00 72.13 N ATOM 914 CA ASP A 61 -4.539 -15.066 -48.260 1.00 21.25 C ATOM 915 C ASP A 61 -3.927 -13.682 -48.074 1.00 45.30 C ATOM 916 O ASP A 61 -4.577 -12.782 -47.541 1.00 20.32 O ATOM 917 CB ASP A 61 -5.062 -15.226 -49.696 1.00 71.44 C ATOM 918 CG ASP A 61 -4.021 -14.883 -50.749 1.00 31.53 C ATOM 919 OD1 ASP A 61 -2.883 -15.383 -50.649 1.00 42.41 O ATOM 920 OD2 ASP A 61 -4.332 -14.111 -51.681 1.00 45.10 O ATOM 0 H ASP A 61 -5.935 -14.423 -46.832 1.00 72.13 H new ATOM 0 HA ASP A 61 -3.768 -15.816 -48.083 1.00 21.25 H new ATOM 0 HB2 ASP A 61 -5.395 -16.253 -49.843 1.00 71.44 H new ATOM 0 HB3 ASP A 61 -5.934 -14.586 -49.833 1.00 71.44 H new ATOM 925 N SER A 62 -2.681 -13.520 -48.503 1.00 2.52 N ATOM 926 CA SER A 62 -1.998 -12.242 -48.403 1.00 22.13 C ATOM 927 C SER A 62 -2.306 -11.402 -49.639 1.00 22.13 C ATOM 928 O SER A 62 -1.570 -11.438 -50.631 1.00 25.20 O ATOM 929 CB SER A 62 -0.485 -12.447 -48.250 1.00 73.41 C ATOM 930 OG SER A 62 0.180 -11.218 -47.992 1.00 51.41 O ATOM 0 H SER A 62 -2.124 -14.263 -48.925 1.00 2.52 H new ATOM 0 HA SER A 62 -2.355 -11.716 -47.518 1.00 22.13 H new ATOM 0 HB2 SER A 62 -0.291 -13.145 -47.436 1.00 73.41 H new ATOM 0 HB3 SER A 62 -0.083 -12.896 -49.158 1.00 73.41 H new ATOM 0 HG SER A 62 1.110 -11.396 -47.741 1.00 51.41 H new ATOM 936 N SER A 63 -3.411 -10.669 -49.578 1.00 2.54 N ATOM 937 CA SER A 63 -3.863 -9.847 -50.691 1.00 61.15 C ATOM 938 C SER A 63 -2.806 -8.800 -51.046 1.00 30.33 C ATOM 939 O SER A 63 -2.670 -8.400 -52.207 1.00 20.53 O ATOM 940 CB SER A 63 -5.190 -9.168 -50.328 1.00 5.12 C ATOM 941 OG SER A 63 -6.131 -10.114 -49.838 1.00 11.23 O ATOM 0 H SER A 63 -4.016 -10.628 -48.758 1.00 2.54 H new ATOM 0 HA SER A 63 -4.018 -10.484 -51.562 1.00 61.15 H new ATOM 0 HB2 SER A 63 -5.015 -8.400 -49.574 1.00 5.12 H new ATOM 0 HB3 SER A 63 -5.597 -8.666 -51.206 1.00 5.12 H new ATOM 0 HG SER A 63 -6.905 -9.642 -49.465 1.00 11.23 H new ATOM 947 N ARG A 64 -2.045 -8.376 -50.041 1.00 62.05 N ATOM 948 CA ARG A 64 -1.002 -7.379 -50.241 1.00 51.31 C ATOM 949 C ARG A 64 0.175 -7.967 -51.020 1.00 11.31 C ATOM 950 O ARG A 64 0.668 -7.349 -51.966 1.00 41.21 O ATOM 951 CB ARG A 64 -0.528 -6.802 -48.895 1.00 11.31 C ATOM 952 CG ARG A 64 0.111 -7.823 -47.958 1.00 31.34 C ATOM 953 CD ARG A 64 0.509 -7.195 -46.628 1.00 61.25 C ATOM 954 NE ARG A 64 1.155 -8.158 -45.734 1.00 63.21 N ATOM 955 CZ ARG A 64 1.300 -7.984 -44.420 1.00 44.35 C ATOM 956 NH1 ARG A 64 0.815 -6.896 -43.832 1.00 70.45 N ATOM 957 NH2 ARG A 64 1.920 -8.904 -43.693 1.00 74.42 N ATOM 0 H ARG A 64 -2.132 -8.708 -49.081 1.00 62.05 H new ATOM 0 HA ARG A 64 -1.426 -6.565 -50.830 1.00 51.31 H new ATOM 0 HB2 ARG A 64 0.191 -6.006 -49.089 1.00 11.31 H new ATOM 0 HB3 ARG A 64 -1.380 -6.347 -48.389 1.00 11.31 H new ATOM 0 HG2 ARG A 64 -0.587 -8.641 -47.780 1.00 31.34 H new ATOM 0 HG3 ARG A 64 0.991 -8.254 -48.435 1.00 31.34 H new ATOM 0 HD2 ARG A 64 1.186 -6.360 -46.810 1.00 61.25 H new ATOM 0 HD3 ARG A 64 -0.377 -6.787 -46.141 1.00 61.25 H new ATOM 0 HE ARG A 64 1.518 -9.019 -46.143 1.00 63.21 H new ATOM 0 HH11 ARG A 64 0.330 -6.190 -44.386 1.00 70.45 H new ATOM 0 HH12 ARG A 64 0.928 -6.766 -42.827 1.00 70.45 H new ATOM 0 HH21 ARG A 64 2.286 -9.745 -44.139 1.00 74.42 H new ATOM 0 HH22 ARG A 64 2.031 -8.770 -42.688 1.00 74.42 H new ATOM 971 N SER A 65 0.593 -9.177 -50.649 1.00 10.31 N ATOM 972 CA SER A 65 1.769 -9.809 -51.247 1.00 43.24 C ATOM 973 C SER A 65 1.473 -10.292 -52.670 1.00 30.11 C ATOM 974 O SER A 65 2.366 -10.786 -53.365 1.00 40.21 O ATOM 975 CB SER A 65 2.250 -10.976 -50.370 1.00 13.31 C ATOM 976 OG SER A 65 3.481 -11.509 -50.837 1.00 52.33 O ATOM 0 H SER A 65 0.133 -9.741 -49.934 1.00 10.31 H new ATOM 0 HA SER A 65 2.562 -9.064 -51.305 1.00 43.24 H new ATOM 0 HB2 SER A 65 2.368 -10.634 -49.342 1.00 13.31 H new ATOM 0 HB3 SER A 65 1.493 -11.761 -50.361 1.00 13.31 H new ATOM 0 HG SER A 65 3.495 -11.491 -51.817 1.00 52.33 H new ATOM 982 N ARG A 66 0.219 -10.157 -53.096 1.00 45.31 N ATOM 983 CA ARG A 66 -0.183 -10.540 -54.448 1.00 14.00 C ATOM 984 C ARG A 66 0.268 -9.494 -55.467 1.00 1.23 C ATOM 985 O ARG A 66 0.241 -9.740 -56.674 1.00 33.32 O ATOM 986 CB ARG A 66 -1.703 -10.742 -54.523 1.00 41.14 C ATOM 987 CG ARG A 66 -2.208 -11.920 -53.693 1.00 42.33 C ATOM 988 CD ARG A 66 -1.568 -13.230 -54.138 1.00 1.51 C ATOM 989 NE ARG A 66 -2.039 -14.377 -53.363 1.00 14.23 N ATOM 990 CZ ARG A 66 -1.925 -15.643 -53.762 1.00 13.50 C ATOM 991 NH1 ARG A 66 -1.339 -15.932 -54.916 1.00 2.55 N ATOM 992 NH2 ARG A 66 -2.381 -16.620 -52.992 1.00 75.44 N ATOM 0 H ARG A 66 -0.538 -9.784 -52.523 1.00 45.31 H new ATOM 0 HA ARG A 66 0.304 -11.485 -54.691 1.00 14.00 H new ATOM 0 HB2 ARG A 66 -2.199 -9.832 -54.185 1.00 41.14 H new ATOM 0 HB3 ARG A 66 -1.990 -10.893 -55.564 1.00 41.14 H new ATOM 0 HG2 ARG A 66 -1.988 -11.745 -52.640 1.00 42.33 H new ATOM 0 HG3 ARG A 66 -3.292 -11.993 -53.785 1.00 42.33 H new ATOM 0 HD2 ARG A 66 -1.784 -13.396 -55.193 1.00 1.51 H new ATOM 0 HD3 ARG A 66 -0.485 -13.152 -54.043 1.00 1.51 H new ATOM 0 HE ARG A 66 -2.482 -14.197 -52.462 1.00 14.23 H new ATOM 0 HH11 ARG A 66 -0.973 -15.183 -55.504 1.00 2.55 H new ATOM 0 HH12 ARG A 66 -1.255 -16.903 -55.216 1.00 2.55 H new ATOM 0 HH21 ARG A 66 -2.818 -16.402 -52.096 1.00 75.44 H new ATOM 0 HH22 ARG A 66 -2.295 -17.590 -53.295 1.00 75.44 H new ATOM 1006 N GLY A 67 0.689 -8.331 -54.972 1.00 34.51 N ATOM 1007 CA GLY A 67 1.145 -7.267 -55.849 1.00 34.10 C ATOM 1008 C GLY A 67 0.021 -6.689 -56.683 1.00 63.33 C ATOM 1009 O GLY A 67 0.236 -6.261 -57.817 1.00 1.24 O ATOM 0 H GLY A 67 0.722 -8.108 -53.977 1.00 34.51 H new ATOM 0 HA2 GLY A 67 1.596 -6.475 -55.251 1.00 34.10 H new ATOM 0 HA3 GLY A 67 1.923 -7.651 -56.508 1.00 34.10 H new ATOM 1013 N LYS A 68 -1.184 -6.682 -56.120 1.00 75.34 N ATOM 1014 CA LYS A 68 -2.369 -6.201 -56.826 1.00 45.14 C ATOM 1015 C LYS A 68 -2.854 -4.878 -56.233 1.00 23.21 C ATOM 1016 O LYS A 68 -3.422 -4.852 -55.137 1.00 4.34 O ATOM 1017 CB LYS A 68 -3.484 -7.260 -56.755 1.00 40.24 C ATOM 1018 CG LYS A 68 -4.773 -6.872 -57.484 1.00 60.33 C ATOM 1019 CD LYS A 68 -5.781 -8.022 -57.490 1.00 74.22 C ATOM 1020 CE LYS A 68 -7.052 -7.673 -58.261 1.00 64.14 C ATOM 1021 NZ LYS A 68 -7.885 -6.659 -57.560 1.00 71.10 N ATOM 0 H LYS A 68 -1.367 -7.006 -55.170 1.00 75.34 H new ATOM 0 HA LYS A 68 -2.107 -6.028 -57.870 1.00 45.14 H new ATOM 0 HB2 LYS A 68 -3.110 -8.193 -57.176 1.00 40.24 H new ATOM 0 HB3 LYS A 68 -3.718 -7.454 -55.708 1.00 40.24 H new ATOM 0 HG2 LYS A 68 -5.216 -6.001 -57.002 1.00 60.33 H new ATOM 0 HG3 LYS A 68 -4.540 -6.585 -58.510 1.00 60.33 H new ATOM 0 HD2 LYS A 68 -5.320 -8.904 -57.934 1.00 74.22 H new ATOM 0 HD3 LYS A 68 -6.041 -8.280 -56.463 1.00 74.22 H new ATOM 0 HE2 LYS A 68 -6.782 -7.297 -59.248 1.00 64.14 H new ATOM 0 HE3 LYS A 68 -7.640 -8.578 -58.414 1.00 64.14 H new ATOM 0 HZ1 LYS A 68 -8.735 -6.458 -58.125 1.00 71.10 H new ATOM 0 HZ2 LYS A 68 -8.167 -7.025 -56.628 1.00 71.10 H new ATOM 0 HZ3 LYS A 68 -7.336 -5.784 -57.436 1.00 71.10 H new ATOM 1035 N PRO A 69 -2.599 -3.752 -56.926 1.00 1.43 N ATOM 1036 CA PRO A 69 -3.131 -2.443 -56.544 1.00 41.05 C ATOM 1037 C PRO A 69 -4.575 -2.279 -57.019 1.00 63.34 C ATOM 1038 O PRO A 69 -5.055 -3.061 -57.841 1.00 73.21 O ATOM 1039 CB PRO A 69 -2.197 -1.440 -57.259 1.00 65.54 C ATOM 1040 CG PRO A 69 -1.167 -2.270 -57.975 1.00 33.42 C ATOM 1041 CD PRO A 69 -1.759 -3.646 -58.124 1.00 34.41 C ATOM 0 HA PRO A 69 -3.155 -2.299 -55.464 1.00 41.05 H new ATOM 0 HB2 PRO A 69 -2.755 -0.820 -57.961 1.00 65.54 H new ATOM 0 HB3 PRO A 69 -1.726 -0.767 -56.543 1.00 65.54 H new ATOM 0 HG2 PRO A 69 -0.931 -1.841 -58.949 1.00 33.42 H new ATOM 0 HG3 PRO A 69 -0.236 -2.307 -57.409 1.00 33.42 H new ATOM 0 HD2 PRO A 69 -2.342 -3.742 -59.040 1.00 34.41 H new ATOM 0 HD3 PRO A 69 -0.991 -4.419 -58.153 1.00 34.41 H new ATOM 1049 N PHE A 70 -5.266 -1.267 -56.506 1.00 41.12 N ATOM 1050 CA PHE A 70 -6.654 -1.010 -56.884 1.00 52.04 C ATOM 1051 C PHE A 70 -6.905 0.494 -56.937 1.00 55.23 C ATOM 1052 O PHE A 70 -6.528 1.215 -56.023 1.00 31.10 O ATOM 1053 CB PHE A 70 -7.607 -1.677 -55.877 1.00 51.25 C ATOM 1054 CG PHE A 70 -9.068 -1.585 -56.254 1.00 44.01 C ATOM 1055 CD1 PHE A 70 -9.629 -2.498 -57.137 1.00 50.33 C ATOM 1056 CD2 PHE A 70 -9.877 -0.587 -55.729 1.00 54.02 C ATOM 1057 CE1 PHE A 70 -10.965 -2.419 -57.486 1.00 71.23 C ATOM 1058 CE2 PHE A 70 -11.214 -0.505 -56.077 1.00 42.20 C ATOM 1059 CZ PHE A 70 -11.757 -1.422 -56.955 1.00 20.44 C ATOM 0 H PHE A 70 -4.888 -0.608 -55.825 1.00 41.12 H new ATOM 0 HA PHE A 70 -6.840 -1.433 -57.871 1.00 52.04 H new ATOM 0 HB2 PHE A 70 -7.334 -2.728 -55.777 1.00 51.25 H new ATOM 0 HB3 PHE A 70 -7.466 -1.216 -54.899 1.00 51.25 H new ATOM 0 HD1 PHE A 70 -9.014 -3.280 -57.557 1.00 50.33 H new ATOM 0 HD2 PHE A 70 -9.459 0.133 -55.042 1.00 54.02 H new ATOM 0 HE1 PHE A 70 -11.388 -3.137 -58.173 1.00 71.23 H new ATOM 0 HE2 PHE A 70 -11.833 0.277 -55.662 1.00 42.20 H new ATOM 0 HZ PHE A 70 -12.801 -1.359 -57.226 1.00 20.44 H new ATOM 1069 N GLN A 71 -7.523 0.966 -58.015 1.00 45.33 N ATOM 1070 CA GLN A 71 -7.819 2.391 -58.168 1.00 52.35 C ATOM 1071 C GLN A 71 -9.323 2.630 -58.135 1.00 12.44 C ATOM 1072 O GLN A 71 -10.083 1.943 -58.824 1.00 73.44 O ATOM 1073 CB GLN A 71 -7.230 2.928 -59.480 1.00 41.45 C ATOM 1074 CG GLN A 71 -5.705 2.947 -59.511 1.00 24.22 C ATOM 1075 CD GLN A 71 -5.151 3.519 -60.806 1.00 52.53 C ATOM 1076 OE1 GLN A 71 -5.757 3.384 -61.869 1.00 33.44 O ATOM 1077 NE2 GLN A 71 -3.999 4.164 -60.727 1.00 75.03 N ATOM 0 H GLN A 71 -7.829 0.386 -58.796 1.00 45.33 H new ATOM 0 HA GLN A 71 -7.360 2.925 -57.336 1.00 52.35 H new ATOM 0 HB2 GLN A 71 -7.593 2.317 -60.307 1.00 41.45 H new ATOM 0 HB3 GLN A 71 -7.600 3.940 -59.645 1.00 41.45 H new ATOM 0 HG2 GLN A 71 -5.336 3.536 -58.671 1.00 24.22 H new ATOM 0 HG3 GLN A 71 -5.330 1.932 -59.377 1.00 24.22 H new ATOM 0 HE21 GLN A 71 -3.526 4.255 -59.828 1.00 75.03 H new ATOM 0 HE22 GLN A 71 -3.583 4.570 -61.565 1.00 75.03 H new ATOM 1086 N PHE A 72 -9.751 3.606 -57.338 1.00 73.33 N ATOM 1087 CA PHE A 72 -11.172 3.951 -57.250 1.00 2.55 C ATOM 1088 C PHE A 72 -11.343 5.407 -56.821 1.00 20.34 C ATOM 1089 O PHE A 72 -10.419 6.014 -56.284 1.00 61.22 O ATOM 1090 CB PHE A 72 -11.908 3.019 -56.275 1.00 25.13 C ATOM 1091 CG PHE A 72 -11.657 3.313 -54.817 1.00 43.44 C ATOM 1092 CD1 PHE A 72 -10.528 2.826 -54.178 1.00 1.40 C ATOM 1093 CD2 PHE A 72 -12.561 4.073 -54.085 1.00 73.40 C ATOM 1094 CE1 PHE A 72 -10.308 3.093 -52.841 1.00 5.31 C ATOM 1095 CE2 PHE A 72 -12.344 4.341 -52.752 1.00 1.11 C ATOM 1096 CZ PHE A 72 -11.217 3.852 -52.129 1.00 32.03 C ATOM 0 H PHE A 72 -9.141 4.170 -56.747 1.00 73.33 H new ATOM 0 HA PHE A 72 -11.611 3.822 -58.240 1.00 2.55 H new ATOM 0 HB2 PHE A 72 -12.979 3.086 -56.467 1.00 25.13 H new ATOM 0 HB3 PHE A 72 -11.611 1.991 -56.481 1.00 25.13 H new ATOM 0 HD1 PHE A 72 -9.814 2.233 -54.730 1.00 1.40 H new ATOM 0 HD2 PHE A 72 -13.446 4.459 -54.568 1.00 73.40 H new ATOM 0 HE1 PHE A 72 -9.425 2.708 -52.352 1.00 5.31 H new ATOM 0 HE2 PHE A 72 -13.056 4.933 -52.196 1.00 1.11 H new ATOM 0 HZ PHE A 72 -11.044 4.062 -51.084 1.00 32.03 H new ATOM 1106 N THR A 73 -12.522 5.956 -57.071 1.00 51.11 N ATOM 1107 CA THR A 73 -12.819 7.342 -56.734 1.00 1.20 C ATOM 1108 C THR A 73 -13.094 7.489 -55.234 1.00 62.13 C ATOM 1109 O THR A 73 -14.055 6.921 -54.713 1.00 74.23 O ATOM 1110 CB THR A 73 -14.035 7.844 -57.536 1.00 52.41 C ATOM 1111 OG1 THR A 73 -13.893 7.457 -58.913 1.00 54.54 O ATOM 1112 CG2 THR A 73 -14.175 9.361 -57.440 1.00 75.20 C ATOM 0 H THR A 73 -13.296 5.458 -57.510 1.00 51.11 H new ATOM 0 HA THR A 73 -11.948 7.945 -56.993 1.00 1.20 H new ATOM 0 HB THR A 73 -14.933 7.394 -57.113 1.00 52.41 H new ATOM 0 HG1 THR A 73 -14.667 7.774 -59.424 1.00 54.54 H new ATOM 0 HG21 THR A 73 -15.042 9.684 -58.016 1.00 75.20 H new ATOM 0 HG22 THR A 73 -14.305 9.649 -56.397 1.00 75.20 H new ATOM 0 HG23 THR A 73 -13.278 9.835 -57.838 1.00 75.20 H new ATOM 1120 N LEU A 74 -12.233 8.240 -54.550 1.00 41.42 N ATOM 1121 CA LEU A 74 -12.364 8.469 -53.111 1.00 2.01 C ATOM 1122 C LEU A 74 -13.657 9.225 -52.790 1.00 50.22 C ATOM 1123 O LEU A 74 -13.922 10.283 -53.368 1.00 44.43 O ATOM 1124 CB LEU A 74 -11.151 9.260 -52.590 1.00 4.02 C ATOM 1125 CG LEU A 74 -11.193 9.637 -51.099 1.00 75.13 C ATOM 1126 CD1 LEU A 74 -11.277 8.386 -50.226 1.00 51.31 C ATOM 1127 CD2 LEU A 74 -9.973 10.478 -50.721 1.00 40.31 C ATOM 0 H LEU A 74 -11.430 8.705 -54.973 1.00 41.42 H new ATOM 0 HA LEU A 74 -12.402 7.499 -52.615 1.00 2.01 H new ATOM 0 HB2 LEU A 74 -10.251 8.672 -52.772 1.00 4.02 H new ATOM 0 HB3 LEU A 74 -11.058 10.175 -53.175 1.00 4.02 H new ATOM 0 HG LEU A 74 -12.088 10.234 -50.924 1.00 75.13 H new ATOM 0 HD11 LEU A 74 -11.306 8.676 -49.176 1.00 51.31 H new ATOM 0 HD12 LEU A 74 -12.181 7.830 -50.473 1.00 51.31 H new ATOM 0 HD13 LEU A 74 -10.404 7.758 -50.405 1.00 51.31 H new ATOM 0 HD21 LEU A 74 -10.022 10.734 -49.663 1.00 40.31 H new ATOM 0 HD22 LEU A 74 -9.064 9.908 -50.915 1.00 40.31 H new ATOM 0 HD23 LEU A 74 -9.963 11.392 -51.315 1.00 40.31 H new ATOM 1139 N GLY A 75 -14.446 8.682 -51.863 1.00 21.12 N ATOM 1140 CA GLY A 75 -15.687 9.321 -51.465 1.00 51.53 C ATOM 1141 C GLY A 75 -16.824 8.996 -52.412 1.00 33.31 C ATOM 1142 O GLY A 75 -17.599 9.879 -52.789 1.00 41.10 O ATOM 0 H GLY A 75 -14.244 7.807 -51.380 1.00 21.12 H new ATOM 0 HA2 GLY A 75 -15.952 9.001 -50.457 1.00 51.53 H new ATOM 0 HA3 GLY A 75 -15.543 10.401 -51.429 1.00 51.53 H new ATOM 1146 N ALA A 76 -16.930 7.731 -52.800 1.00 23.41 N ATOM 1147 CA ALA A 76 -17.954 7.296 -53.747 1.00 10.02 C ATOM 1148 C ALA A 76 -18.330 5.835 -53.514 1.00 2.44 C ATOM 1149 O ALA A 76 -17.695 5.139 -52.722 1.00 74.43 O ATOM 1150 CB ALA A 76 -17.464 7.496 -55.178 1.00 13.12 C ATOM 0 H ALA A 76 -16.317 6.984 -52.473 1.00 23.41 H new ATOM 0 HA ALA A 76 -18.845 7.903 -53.589 1.00 10.02 H new ATOM 0 HB1 ALA A 76 -18.235 7.169 -55.876 1.00 13.12 H new ATOM 0 HB2 ALA A 76 -17.248 8.551 -55.345 1.00 13.12 H new ATOM 0 HB3 ALA A 76 -16.558 6.911 -55.338 1.00 13.12 H new ATOM 1156 N GLY A 77 -19.349 5.367 -54.238 1.00 45.30 N ATOM 1157 CA GLY A 77 -19.818 3.994 -54.093 1.00 54.35 C ATOM 1158 C GLY A 77 -18.976 3.001 -54.878 1.00 33.32 C ATOM 1159 O GLY A 77 -19.470 1.945 -55.292 1.00 54.41 O ATOM 0 H GLY A 77 -19.861 5.918 -54.927 1.00 45.30 H new ATOM 0 HA2 GLY A 77 -19.807 3.720 -53.038 1.00 54.35 H new ATOM 0 HA3 GLY A 77 -20.853 3.931 -54.428 1.00 54.35 H new ATOM 1163 N GLU A 78 -17.708 3.343 -55.083 1.00 32.55 N ATOM 1164 CA GLU A 78 -16.767 2.496 -55.812 1.00 75.44 C ATOM 1165 C GLU A 78 -16.525 1.195 -55.049 1.00 54.02 C ATOM 1166 O GLU A 78 -16.503 0.108 -55.630 1.00 2.52 O ATOM 1167 CB GLU A 78 -15.442 3.242 -55.988 1.00 2.50 C ATOM 1168 CG GLU A 78 -15.555 4.546 -56.774 1.00 4.04 C ATOM 1169 CD GLU A 78 -15.481 4.345 -58.281 1.00 63.04 C ATOM 1170 OE1 GLU A 78 -16.464 3.861 -58.875 1.00 75.43 O ATOM 1171 OE2 GLU A 78 -14.434 4.684 -58.878 1.00 1.53 O ATOM 0 H GLU A 78 -17.302 4.217 -54.748 1.00 32.55 H new ATOM 0 HA GLU A 78 -17.187 2.258 -56.789 1.00 75.44 H new ATOM 0 HB2 GLU A 78 -15.027 3.459 -55.004 1.00 2.50 H new ATOM 0 HB3 GLU A 78 -14.734 2.586 -56.494 1.00 2.50 H new ATOM 0 HG2 GLU A 78 -16.498 5.033 -56.525 1.00 4.04 H new ATOM 0 HG3 GLU A 78 -14.757 5.220 -56.464 1.00 4.04 H new ATOM 1178 N VAL A 79 -16.346 1.325 -53.738 1.00 13.45 N ATOM 1179 CA VAL A 79 -16.066 0.191 -52.859 1.00 1.34 C ATOM 1180 C VAL A 79 -16.996 0.220 -51.649 1.00 20.50 C ATOM 1181 O VAL A 79 -17.833 1.121 -51.521 1.00 12.22 O ATOM 1182 CB VAL A 79 -14.593 0.194 -52.364 1.00 22.51 C ATOM 1183 CG1 VAL A 79 -13.624 0.056 -53.538 1.00 2.53 C ATOM 1184 CG2 VAL A 79 -14.294 1.458 -51.552 1.00 32.01 C ATOM 0 H VAL A 79 -16.391 2.221 -53.253 1.00 13.45 H new ATOM 0 HA VAL A 79 -16.233 -0.716 -53.440 1.00 1.34 H new ATOM 0 HB VAL A 79 -14.454 -0.667 -51.710 1.00 22.51 H new ATOM 0 HG11 VAL A 79 -12.599 0.061 -53.166 1.00 2.53 H new ATOM 0 HG12 VAL A 79 -13.816 -0.881 -54.060 1.00 2.53 H new ATOM 0 HG13 VAL A 79 -13.764 0.890 -54.226 1.00 2.53 H new ATOM 0 HG21 VAL A 79 -13.257 1.438 -51.216 1.00 32.01 H new ATOM 0 HG22 VAL A 79 -14.457 2.338 -52.175 1.00 32.01 H new ATOM 0 HG23 VAL A 79 -14.955 1.499 -50.686 1.00 32.01 H new ATOM 1194 N ILE A 80 -16.870 -0.778 -50.780 1.00 75.42 N ATOM 1195 CA ILE A 80 -17.631 -0.806 -49.537 1.00 23.41 C ATOM 1196 C ILE A 80 -17.252 0.392 -48.664 1.00 60.52 C ATOM 1197 O ILE A 80 -16.085 0.807 -48.633 1.00 13.14 O ATOM 1198 CB ILE A 80 -17.407 -2.123 -48.751 1.00 73.33 C ATOM 1199 CG1 ILE A 80 -15.922 -2.296 -48.387 1.00 72.25 C ATOM 1200 CG2 ILE A 80 -17.910 -3.318 -49.562 1.00 24.01 C ATOM 1201 CD1 ILE A 80 -15.628 -3.551 -47.588 1.00 43.25 C ATOM 0 H ILE A 80 -16.249 -1.576 -50.914 1.00 75.42 H new ATOM 0 HA ILE A 80 -18.688 -0.751 -49.797 1.00 23.41 H new ATOM 0 HB ILE A 80 -17.977 -2.072 -47.823 1.00 73.33 H new ATOM 0 HG12 ILE A 80 -15.333 -2.314 -49.304 1.00 72.25 H new ATOM 0 HG13 ILE A 80 -15.595 -1.428 -47.815 1.00 72.25 H new ATOM 0 HG21 ILE A 80 -17.746 -4.236 -48.997 1.00 24.01 H new ATOM 0 HG22 ILE A 80 -18.975 -3.200 -49.761 1.00 24.01 H new ATOM 0 HG23 ILE A 80 -17.368 -3.371 -50.506 1.00 24.01 H new ATOM 0 HD11 ILE A 80 -14.561 -3.602 -47.370 1.00 43.25 H new ATOM 0 HD12 ILE A 80 -16.188 -3.527 -46.653 1.00 43.25 H new ATOM 0 HD13 ILE A 80 -15.923 -4.427 -48.165 1.00 43.25 H new ATOM 1213 N LYS A 81 -18.236 0.947 -47.958 1.00 23.20 N ATOM 1214 CA LYS A 81 -18.032 2.164 -47.169 1.00 11.25 C ATOM 1215 C LYS A 81 -16.924 1.960 -46.129 1.00 2.21 C ATOM 1216 O LYS A 81 -16.297 2.921 -45.683 1.00 14.32 O ATOM 1217 CB LYS A 81 -19.349 2.596 -46.494 1.00 0.11 C ATOM 1218 CG LYS A 81 -19.708 4.068 -46.721 1.00 41.11 C ATOM 1219 CD LYS A 81 -18.667 5.017 -46.125 1.00 62.14 C ATOM 1220 CE LYS A 81 -18.965 6.474 -46.463 1.00 73.31 C ATOM 1221 NZ LYS A 81 -18.901 6.736 -47.929 1.00 30.33 N ATOM 0 H LYS A 81 -19.184 0.574 -47.915 1.00 23.20 H new ATOM 0 HA LYS A 81 -17.716 2.961 -47.842 1.00 11.25 H new ATOM 0 HB2 LYS A 81 -20.160 1.972 -46.869 1.00 0.11 H new ATOM 0 HB3 LYS A 81 -19.274 2.411 -45.422 1.00 0.11 H new ATOM 0 HG2 LYS A 81 -19.799 4.257 -47.791 1.00 41.11 H new ATOM 0 HG3 LYS A 81 -20.682 4.275 -46.277 1.00 41.11 H new ATOM 0 HD2 LYS A 81 -18.641 4.894 -45.042 1.00 62.14 H new ATOM 0 HD3 LYS A 81 -17.678 4.752 -46.500 1.00 62.14 H new ATOM 0 HE2 LYS A 81 -19.956 6.736 -46.092 1.00 73.31 H new ATOM 0 HE3 LYS A 81 -18.251 7.118 -45.949 1.00 73.31 H new ATOM 0 HZ1 LYS A 81 -18.975 7.759 -48.102 1.00 30.33 H new ATOM 0 HZ2 LYS A 81 -17.997 6.386 -48.305 1.00 30.33 H new ATOM 0 HZ3 LYS A 81 -19.686 6.247 -48.404 1.00 30.33 H new ATOM 1235 N GLY A 82 -16.689 0.703 -45.754 1.00 34.43 N ATOM 1236 CA GLY A 82 -15.598 0.385 -44.851 1.00 31.53 C ATOM 1237 C GLY A 82 -14.251 0.783 -45.430 1.00 11.44 C ATOM 1238 O GLY A 82 -13.465 1.474 -44.779 1.00 11.05 O ATOM 0 H GLY A 82 -17.237 -0.101 -46.061 1.00 34.43 H new ATOM 0 HA2 GLY A 82 -15.751 0.898 -43.901 1.00 31.53 H new ATOM 0 HA3 GLY A 82 -15.601 -0.684 -44.640 1.00 31.53 H new ATOM 1242 N TRP A 83 -13.994 0.366 -46.668 1.00 20.04 N ATOM 1243 CA TRP A 83 -12.744 0.697 -47.348 1.00 54.32 C ATOM 1244 C TRP A 83 -12.700 2.184 -47.670 1.00 71.34 C ATOM 1245 O TRP A 83 -11.669 2.835 -47.493 1.00 52.20 O ATOM 1246 CB TRP A 83 -12.585 -0.123 -48.638 1.00 1.15 C ATOM 1247 CG TRP A 83 -12.384 -1.596 -48.413 1.00 60.24 C ATOM 1248 CD1 TRP A 83 -12.120 -2.227 -47.230 1.00 62.11 C ATOM 1249 CD2 TRP A 83 -12.420 -2.623 -49.412 1.00 23.23 C ATOM 1250 NE1 TRP A 83 -12.000 -3.580 -47.434 1.00 5.04 N ATOM 1251 CE2 TRP A 83 -12.176 -3.848 -48.764 1.00 4.34 C ATOM 1252 CE3 TRP A 83 -12.634 -2.623 -50.794 1.00 42.12 C ATOM 1253 CZ2 TRP A 83 -12.147 -5.060 -49.450 1.00 13.44 C ATOM 1254 CZ3 TRP A 83 -12.605 -3.825 -51.474 1.00 3.14 C ATOM 1255 CH2 TRP A 83 -12.360 -5.030 -50.801 1.00 54.32 C ATOM 0 H TRP A 83 -14.636 -0.202 -47.221 1.00 20.04 H new ATOM 0 HA TRP A 83 -11.919 0.450 -46.680 1.00 54.32 H new ATOM 0 HB2 TRP A 83 -13.470 0.021 -49.258 1.00 1.15 H new ATOM 0 HB3 TRP A 83 -11.736 0.266 -49.200 1.00 1.15 H new ATOM 0 HD1 TRP A 83 -12.020 -1.734 -46.274 1.00 62.11 H new ATOM 0 HE1 TRP A 83 -11.810 -4.273 -46.710 1.00 5.04 H new ATOM 0 HE3 TRP A 83 -12.819 -1.699 -51.321 1.00 42.12 H new ATOM 0 HZ2 TRP A 83 -11.963 -5.990 -48.934 1.00 13.44 H new ATOM 0 HZ3 TRP A 83 -12.774 -3.837 -52.541 1.00 3.14 H new ATOM 0 HH2 TRP A 83 -12.339 -5.954 -51.360 1.00 54.32 H new ATOM 1266 N ASP A 84 -13.835 2.710 -48.131 1.00 72.43 N ATOM 1267 CA ASP A 84 -13.956 4.130 -48.476 1.00 32.24 C ATOM 1268 C ASP A 84 -13.530 5.009 -47.299 1.00 32.32 C ATOM 1269 O ASP A 84 -12.701 5.909 -47.448 1.00 11.55 O ATOM 1270 CB ASP A 84 -15.399 4.454 -48.895 1.00 51.14 C ATOM 1271 CG ASP A 84 -15.611 5.932 -49.201 1.00 24.20 C ATOM 1272 OD1 ASP A 84 -15.184 6.390 -50.280 1.00 41.55 O ATOM 1273 OD2 ASP A 84 -16.225 6.633 -48.363 1.00 3.24 O ATOM 0 H ASP A 84 -14.689 2.172 -48.275 1.00 72.43 H new ATOM 0 HA ASP A 84 -13.293 4.340 -49.316 1.00 32.24 H new ATOM 0 HB2 ASP A 84 -15.657 3.865 -49.775 1.00 51.14 H new ATOM 0 HB3 ASP A 84 -16.080 4.152 -48.099 1.00 51.14 H new ATOM 1278 N GLN A 85 -14.076 4.722 -46.121 1.00 53.44 N ATOM 1279 CA GLN A 85 -13.731 5.464 -44.912 1.00 73.31 C ATOM 1280 C GLN A 85 -12.287 5.175 -44.500 1.00 50.41 C ATOM 1281 O GLN A 85 -11.545 6.087 -44.114 1.00 43.23 O ATOM 1282 CB GLN A 85 -14.692 5.103 -43.772 1.00 11.22 C ATOM 1283 CG GLN A 85 -14.399 5.827 -42.462 1.00 25.14 C ATOM 1284 CD GLN A 85 -15.452 5.563 -41.400 1.00 22.14 C ATOM 1285 OE1 GLN A 85 -15.345 4.617 -40.619 1.00 20.15 O ATOM 1286 NE2 GLN A 85 -16.482 6.395 -41.363 1.00 2.41 N ATOM 0 H GLN A 85 -14.760 3.980 -45.978 1.00 53.44 H new ATOM 0 HA GLN A 85 -13.824 6.529 -45.123 1.00 73.31 H new ATOM 0 HB2 GLN A 85 -15.711 5.333 -44.083 1.00 11.22 H new ATOM 0 HB3 GLN A 85 -14.647 4.028 -43.599 1.00 11.22 H new ATOM 0 HG2 GLN A 85 -13.425 5.513 -42.088 1.00 25.14 H new ATOM 0 HG3 GLN A 85 -14.338 6.899 -42.649 1.00 25.14 H new ATOM 0 HE21 GLN A 85 -16.537 7.168 -42.026 1.00 2.41 H new ATOM 0 HE22 GLN A 85 -17.220 6.263 -40.671 1.00 2.41 H new ATOM 1295 N GLY A 86 -11.896 3.903 -44.608 1.00 70.40 N ATOM 1296 CA GLY A 86 -10.551 3.486 -44.247 1.00 62.34 C ATOM 1297 C GLY A 86 -9.483 4.320 -44.931 1.00 13.43 C ATOM 1298 O GLY A 86 -8.550 4.801 -44.287 1.00 1.43 O ATOM 0 H GLY A 86 -12.496 3.149 -44.943 1.00 70.40 H new ATOM 0 HA2 GLY A 86 -10.429 3.559 -43.166 1.00 62.34 H new ATOM 0 HA3 GLY A 86 -10.415 2.438 -44.513 1.00 62.34 H new ATOM 1302 N VAL A 87 -9.622 4.493 -46.241 1.00 54.13 N ATOM 1303 CA VAL A 87 -8.699 5.329 -47.003 1.00 50.24 C ATOM 1304 C VAL A 87 -8.979 6.817 -46.762 1.00 54.40 C ATOM 1305 O VAL A 87 -8.058 7.630 -46.697 1.00 10.11 O ATOM 1306 CB VAL A 87 -8.760 5.016 -48.520 1.00 55.44 C ATOM 1307 CG1 VAL A 87 -10.168 5.221 -49.067 1.00 34.31 C ATOM 1308 CG2 VAL A 87 -7.752 5.867 -49.295 1.00 62.31 C ATOM 0 H VAL A 87 -10.363 4.067 -46.797 1.00 54.13 H new ATOM 0 HA VAL A 87 -7.694 5.098 -46.651 1.00 50.24 H new ATOM 0 HB VAL A 87 -8.495 3.967 -48.653 1.00 55.44 H new ATOM 0 HG11 VAL A 87 -10.181 4.994 -50.133 1.00 34.31 H new ATOM 0 HG12 VAL A 87 -10.860 4.559 -48.547 1.00 34.31 H new ATOM 0 HG13 VAL A 87 -10.471 6.257 -48.913 1.00 34.31 H new ATOM 0 HG21 VAL A 87 -7.815 5.628 -50.357 1.00 62.31 H new ATOM 0 HG22 VAL A 87 -7.977 6.923 -49.146 1.00 62.31 H new ATOM 0 HG23 VAL A 87 -6.745 5.657 -48.935 1.00 62.31 H new ATOM 1318 N ALA A 88 -10.255 7.167 -46.612 1.00 43.42 N ATOM 1319 CA ALA A 88 -10.654 8.565 -46.436 1.00 63.54 C ATOM 1320 C ALA A 88 -10.047 9.178 -45.173 1.00 61.41 C ATOM 1321 O ALA A 88 -9.795 10.383 -45.119 1.00 62.12 O ATOM 1322 CB ALA A 88 -12.171 8.687 -46.394 1.00 72.34 C ATOM 0 H ALA A 88 -11.030 6.504 -46.609 1.00 43.42 H new ATOM 0 HA ALA A 88 -10.272 9.119 -47.293 1.00 63.54 H new ATOM 0 HB1 ALA A 88 -12.448 9.733 -46.263 1.00 72.34 H new ATOM 0 HB2 ALA A 88 -12.592 8.314 -47.328 1.00 72.34 H new ATOM 0 HB3 ALA A 88 -12.560 8.101 -45.561 1.00 72.34 H new ATOM 1328 N THR A 89 -9.825 8.349 -44.157 1.00 71.10 N ATOM 1329 CA THR A 89 -9.313 8.833 -42.876 1.00 21.14 C ATOM 1330 C THR A 89 -7.781 8.949 -42.872 1.00 72.32 C ATOM 1331 O THR A 89 -7.212 9.690 -42.061 1.00 61.43 O ATOM 1332 CB THR A 89 -9.779 7.920 -41.710 1.00 10.23 C ATOM 1333 OG1 THR A 89 -9.395 8.483 -40.447 1.00 70.41 O ATOM 1334 CG2 THR A 89 -9.200 6.514 -41.829 1.00 23.35 C ATOM 0 H THR A 89 -9.990 7.343 -44.194 1.00 71.10 H new ATOM 0 HA THR A 89 -9.724 9.832 -42.731 1.00 21.14 H new ATOM 0 HB THR A 89 -10.865 7.853 -41.768 1.00 10.23 H new ATOM 0 HG1 THR A 89 -8.574 9.007 -40.558 1.00 70.41 H new ATOM 0 HG21 THR A 89 -9.549 5.905 -40.995 1.00 23.35 H new ATOM 0 HG22 THR A 89 -9.525 6.065 -42.767 1.00 23.35 H new ATOM 0 HG23 THR A 89 -8.111 6.566 -41.810 1.00 23.35 H new ATOM 1342 N MET A 90 -7.111 8.243 -43.785 1.00 23.21 N ATOM 1343 CA MET A 90 -5.641 8.204 -43.796 1.00 52.35 C ATOM 1344 C MET A 90 -5.060 9.342 -44.637 1.00 34.44 C ATOM 1345 O MET A 90 -5.791 10.210 -45.123 1.00 64.34 O ATOM 1346 CB MET A 90 -5.123 6.859 -44.334 1.00 2.44 C ATOM 1347 CG MET A 90 -5.293 6.683 -45.839 1.00 20.52 C ATOM 1348 SD MET A 90 -4.543 5.168 -46.454 1.00 33.02 S ATOM 1349 CE MET A 90 -5.423 3.954 -45.487 1.00 71.33 C ATOM 0 H MET A 90 -7.555 7.694 -44.521 1.00 23.21 H new ATOM 0 HA MET A 90 -5.313 8.324 -42.763 1.00 52.35 H new ATOM 0 HB2 MET A 90 -4.066 6.763 -44.085 1.00 2.44 H new ATOM 0 HB3 MET A 90 -5.645 6.050 -43.823 1.00 2.44 H new ATOM 0 HG2 MET A 90 -6.356 6.681 -46.082 1.00 20.52 H new ATOM 0 HG3 MET A 90 -4.850 7.536 -46.352 1.00 20.52 H new ATOM 0 HE1 MET A 90 -4.754 3.532 -44.737 1.00 71.33 H new ATOM 0 HE2 MET A 90 -6.270 4.428 -44.991 1.00 71.33 H new ATOM 0 HE3 MET A 90 -5.783 3.160 -46.141 1.00 71.33 H new ATOM 1359 N THR A 91 -3.736 9.322 -44.801 1.00 54.53 N ATOM 1360 CA THR A 91 -3.028 10.298 -45.626 1.00 60.53 C ATOM 1361 C THR A 91 -2.292 9.592 -46.771 1.00 4.54 C ATOM 1362 O THR A 91 -2.341 8.365 -46.878 1.00 62.15 O ATOM 1363 CB THR A 91 -2.029 11.122 -44.779 1.00 2.34 C ATOM 1364 OG1 THR A 91 -1.152 10.242 -44.061 1.00 75.53 O ATOM 1365 CG2 THR A 91 -2.761 12.027 -43.792 1.00 54.53 C ATOM 0 H THR A 91 -3.127 8.629 -44.366 1.00 54.53 H new ATOM 0 HA THR A 91 -3.765 10.983 -46.046 1.00 60.53 H new ATOM 0 HB THR A 91 -1.448 11.747 -45.457 1.00 2.34 H new ATOM 0 HG1 THR A 91 -0.522 10.771 -43.529 1.00 75.53 H new ATOM 0 HG21 THR A 91 -2.034 12.594 -43.210 1.00 54.53 H new ATOM 0 HG22 THR A 91 -3.405 12.716 -44.339 1.00 54.53 H new ATOM 0 HG23 THR A 91 -3.367 11.418 -43.121 1.00 54.53 H new ATOM 1373 N LEU A 92 -1.619 10.364 -47.625 1.00 74.01 N ATOM 1374 CA LEU A 92 -0.942 9.807 -48.797 1.00 25.41 C ATOM 1375 C LEU A 92 0.307 9.021 -48.387 1.00 32.24 C ATOM 1376 O LEU A 92 1.118 9.493 -47.577 1.00 31.23 O ATOM 1377 CB LEU A 92 -0.591 10.935 -49.791 1.00 14.43 C ATOM 1378 CG LEU A 92 -0.058 10.492 -51.176 1.00 74.12 C ATOM 1379 CD1 LEU A 92 -0.297 11.582 -52.219 1.00 1.01 C ATOM 1380 CD2 LEU A 92 1.434 10.147 -51.116 1.00 24.41 C ATOM 0 H LEU A 92 -1.528 11.375 -47.528 1.00 74.01 H new ATOM 0 HA LEU A 92 -1.618 9.110 -49.292 1.00 25.41 H new ATOM 0 HB2 LEU A 92 -1.482 11.543 -49.947 1.00 14.43 H new ATOM 0 HB3 LEU A 92 0.157 11.579 -49.327 1.00 14.43 H new ATOM 0 HG LEU A 92 -0.606 9.595 -51.466 1.00 74.12 H new ATOM 0 HD11 LEU A 92 0.085 11.251 -53.185 1.00 1.01 H new ATOM 0 HD12 LEU A 92 -1.366 11.780 -52.300 1.00 1.01 H new ATOM 0 HD13 LEU A 92 0.219 12.493 -51.918 1.00 1.01 H new ATOM 0 HD21 LEU A 92 1.776 9.840 -52.104 1.00 24.41 H new ATOM 0 HD22 LEU A 92 1.997 11.022 -50.793 1.00 24.41 H new ATOM 0 HD23 LEU A 92 1.591 9.333 -50.408 1.00 24.41 H new ATOM 1392 N GLY A 93 0.439 7.817 -48.955 1.00 34.21 N ATOM 1393 CA GLY A 93 1.596 6.973 -48.709 1.00 5.55 C ATOM 1394 C GLY A 93 1.543 6.310 -47.350 1.00 72.25 C ATOM 1395 O GLY A 93 2.576 6.095 -46.713 1.00 64.11 O ATOM 0 H GLY A 93 -0.249 7.411 -49.590 1.00 34.21 H new ATOM 0 HA2 GLY A 93 1.656 6.207 -49.482 1.00 5.55 H new ATOM 0 HA3 GLY A 93 2.503 7.573 -48.783 1.00 5.55 H new ATOM 1399 N GLU A 94 0.337 5.960 -46.914 1.00 71.34 N ATOM 1400 CA GLU A 94 0.122 5.474 -45.554 1.00 13.03 C ATOM 1401 C GLU A 94 -0.592 4.120 -45.545 1.00 35.11 C ATOM 1402 O GLU A 94 -1.520 3.886 -46.325 1.00 11.33 O ATOM 1403 CB GLU A 94 -0.681 6.523 -44.767 1.00 33.44 C ATOM 1404 CG GLU A 94 -0.913 6.182 -43.300 1.00 42.11 C ATOM 1405 CD GLU A 94 -1.253 7.414 -42.473 1.00 1.35 C ATOM 1406 OE1 GLU A 94 -2.380 7.938 -42.602 1.00 22.02 O ATOM 1407 OE2 GLU A 94 -0.381 7.883 -41.710 1.00 1.51 O ATOM 0 H GLU A 94 -0.508 6.004 -47.483 1.00 71.34 H new ATOM 0 HA GLU A 94 1.091 5.324 -45.078 1.00 13.03 H new ATOM 0 HB2 GLU A 94 -0.159 7.478 -44.825 1.00 33.44 H new ATOM 0 HB3 GLU A 94 -1.648 6.658 -45.251 1.00 33.44 H new ATOM 0 HG2 GLU A 94 -1.723 5.457 -43.220 1.00 42.11 H new ATOM 0 HG3 GLU A 94 -0.020 5.708 -42.893 1.00 42.11 H new ATOM 1414 N LYS A 95 -0.125 3.231 -44.665 1.00 63.35 N ATOM 1415 CA LYS A 95 -0.741 1.921 -44.454 1.00 74.54 C ATOM 1416 C LYS A 95 -1.464 1.902 -43.112 1.00 2.34 C ATOM 1417 O LYS A 95 -0.832 1.985 -42.049 1.00 24.43 O ATOM 1418 CB LYS A 95 0.318 0.804 -44.472 1.00 62.30 C ATOM 1419 CG LYS A 95 -0.229 -0.572 -44.067 1.00 64.33 C ATOM 1420 CD LYS A 95 0.883 -1.563 -43.709 1.00 65.41 C ATOM 1421 CE LYS A 95 1.646 -2.061 -44.931 1.00 1.24 C ATOM 1422 NZ LYS A 95 0.782 -2.881 -45.819 1.00 21.52 N ATOM 0 H LYS A 95 0.692 3.401 -44.078 1.00 63.35 H new ATOM 0 HA LYS A 95 -1.450 1.745 -45.263 1.00 74.54 H new ATOM 0 HB2 LYS A 95 0.744 0.735 -45.473 1.00 62.30 H new ATOM 0 HB3 LYS A 95 1.130 1.075 -43.798 1.00 62.30 H new ATOM 0 HG2 LYS A 95 -0.897 -0.457 -43.214 1.00 64.33 H new ATOM 0 HG3 LYS A 95 -0.824 -0.978 -44.885 1.00 64.33 H new ATOM 0 HD2 LYS A 95 1.580 -1.086 -43.020 1.00 65.41 H new ATOM 0 HD3 LYS A 95 0.450 -2.415 -43.185 1.00 65.41 H new ATOM 0 HE2 LYS A 95 2.037 -1.210 -45.488 1.00 1.24 H new ATOM 0 HE3 LYS A 95 2.503 -2.652 -44.609 1.00 1.24 H new ATOM 0 HZ1 LYS A 95 1.375 -3.520 -46.387 1.00 21.52 H new ATOM 0 HZ2 LYS A 95 0.123 -3.442 -45.241 1.00 21.52 H new ATOM 0 HZ3 LYS A 95 0.242 -2.256 -46.451 1.00 21.52 H new ATOM 1436 N ALA A 96 -2.781 1.790 -43.158 1.00 20.50 N ATOM 1437 CA ALA A 96 -3.592 1.729 -41.952 1.00 55.24 C ATOM 1438 C ALA A 96 -4.270 0.369 -41.828 1.00 22.35 C ATOM 1439 O ALA A 96 -4.844 -0.140 -42.790 1.00 52.31 O ATOM 1440 CB ALA A 96 -4.633 2.845 -41.954 1.00 14.21 C ATOM 0 H ALA A 96 -3.316 1.739 -44.025 1.00 20.50 H new ATOM 0 HA ALA A 96 -2.938 1.866 -41.091 1.00 55.24 H new ATOM 0 HB1 ALA A 96 -5.232 2.786 -41.045 1.00 14.21 H new ATOM 0 HB2 ALA A 96 -4.130 3.811 -41.995 1.00 14.21 H new ATOM 0 HB3 ALA A 96 -5.281 2.736 -42.823 1.00 14.21 H new ATOM 1446 N LEU A 97 -4.186 -0.219 -40.647 1.00 62.33 N ATOM 1447 CA LEU A 97 -4.905 -1.444 -40.336 1.00 4.54 C ATOM 1448 C LEU A 97 -6.258 -1.057 -39.755 1.00 23.15 C ATOM 1449 O LEU A 97 -6.343 -0.533 -38.637 1.00 2.53 O ATOM 1450 CB LEU A 97 -4.082 -2.306 -39.351 1.00 62.35 C ATOM 1451 CG LEU A 97 -4.667 -3.691 -38.974 1.00 23.42 C ATOM 1452 CD1 LEU A 97 -3.557 -4.627 -38.491 1.00 52.33 C ATOM 1453 CD2 LEU A 97 -5.745 -3.572 -37.892 1.00 12.41 C ATOM 0 H LEU A 97 -3.619 0.138 -39.878 1.00 62.33 H new ATOM 0 HA LEU A 97 -5.059 -2.045 -41.233 1.00 4.54 H new ATOM 0 HB2 LEU A 97 -3.093 -2.461 -39.781 1.00 62.35 H new ATOM 0 HB3 LEU A 97 -3.945 -1.734 -38.433 1.00 62.35 H new ATOM 0 HG LEU A 97 -5.127 -4.105 -39.871 1.00 23.42 H new ATOM 0 HD11 LEU A 97 -3.985 -5.595 -38.230 1.00 52.33 H new ATOM 0 HD12 LEU A 97 -2.820 -4.758 -39.284 1.00 52.33 H new ATOM 0 HD13 LEU A 97 -3.074 -4.196 -37.614 1.00 52.33 H new ATOM 0 HD21 LEU A 97 -6.132 -4.563 -37.653 1.00 12.41 H new ATOM 0 HD22 LEU A 97 -5.314 -3.126 -36.996 1.00 12.41 H new ATOM 0 HD23 LEU A 97 -6.558 -2.943 -38.256 1.00 12.41 H new ATOM 1465 N PHE A 98 -7.309 -1.273 -40.530 1.00 33.43 N ATOM 1466 CA PHE A 98 -8.644 -0.836 -40.149 1.00 22.33 C ATOM 1467 C PHE A 98 -9.557 -2.043 -39.978 1.00 65.01 C ATOM 1468 O PHE A 98 -9.699 -2.860 -40.896 1.00 52.24 O ATOM 1469 CB PHE A 98 -9.204 0.117 -41.220 1.00 14.23 C ATOM 1470 CG PHE A 98 -10.378 0.958 -40.764 1.00 54.22 C ATOM 1471 CD1 PHE A 98 -11.647 0.408 -40.635 1.00 1.45 C ATOM 1472 CD2 PHE A 98 -10.211 2.305 -40.476 1.00 54.43 C ATOM 1473 CE1 PHE A 98 -12.718 1.182 -40.229 1.00 61.40 C ATOM 1474 CE2 PHE A 98 -11.280 3.083 -40.073 1.00 53.50 C ATOM 1475 CZ PHE A 98 -12.535 2.520 -39.949 1.00 43.13 C ATOM 0 H PHE A 98 -7.263 -1.750 -41.430 1.00 33.43 H new ATOM 0 HA PHE A 98 -8.592 -0.304 -39.199 1.00 22.33 H new ATOM 0 HB2 PHE A 98 -8.405 0.781 -41.550 1.00 14.23 H new ATOM 0 HB3 PHE A 98 -9.509 -0.470 -42.086 1.00 14.23 H new ATOM 0 HD1 PHE A 98 -11.799 -0.638 -40.855 1.00 1.45 H new ATOM 0 HD2 PHE A 98 -9.232 2.752 -40.568 1.00 54.43 H new ATOM 0 HE1 PHE A 98 -13.698 0.739 -40.131 1.00 61.40 H new ATOM 0 HE2 PHE A 98 -11.134 4.131 -39.855 1.00 53.50 H new ATOM 0 HZ PHE A 98 -13.371 3.126 -39.633 1.00 43.13 H new ATOM 1485 N THR A 99 -10.153 -2.167 -38.800 1.00 0.52 N ATOM 1486 CA THR A 99 -11.121 -3.222 -38.543 1.00 41.40 C ATOM 1487 C THR A 99 -12.486 -2.811 -39.101 1.00 32.20 C ATOM 1488 O THR A 99 -13.160 -1.937 -38.547 1.00 23.33 O ATOM 1489 CB THR A 99 -11.232 -3.515 -37.029 1.00 71.14 C ATOM 1490 OG1 THR A 99 -9.921 -3.729 -36.482 1.00 32.31 O ATOM 1491 CG2 THR A 99 -12.098 -4.743 -36.761 1.00 45.34 C ATOM 0 H THR A 99 -9.982 -1.549 -38.007 1.00 0.52 H new ATOM 0 HA THR A 99 -10.784 -4.132 -39.039 1.00 41.40 H new ATOM 0 HB THR A 99 -11.702 -2.654 -36.553 1.00 71.14 H new ATOM 0 HG1 THR A 99 -9.982 -3.806 -35.507 1.00 32.31 H new ATOM 0 HG21 THR A 99 -12.155 -4.921 -35.687 1.00 45.34 H new ATOM 0 HG22 THR A 99 -13.100 -4.574 -37.155 1.00 45.34 H new ATOM 0 HG23 THR A 99 -11.658 -5.612 -37.250 1.00 45.34 H new ATOM 1499 N ILE A 100 -12.869 -3.434 -40.211 1.00 21.32 N ATOM 1500 CA ILE A 100 -14.096 -3.091 -40.920 1.00 55.40 C ATOM 1501 C ILE A 100 -15.316 -3.693 -40.217 1.00 14.24 C ATOM 1502 O ILE A 100 -15.450 -4.925 -40.137 1.00 1.33 O ATOM 1503 CB ILE A 100 -14.061 -3.595 -42.390 1.00 12.11 C ATOM 1504 CG1 ILE A 100 -12.829 -3.040 -43.128 1.00 60.11 C ATOM 1505 CG2 ILE A 100 -15.351 -3.217 -43.128 1.00 11.45 C ATOM 1506 CD1 ILE A 100 -12.796 -1.531 -43.236 1.00 2.12 C ATOM 0 H ILE A 100 -12.338 -4.190 -40.644 1.00 21.32 H new ATOM 0 HA ILE A 100 -14.173 -2.004 -40.920 1.00 55.40 H new ATOM 0 HB ILE A 100 -13.987 -4.682 -42.373 1.00 12.11 H new ATOM 0 HG12 ILE A 100 -11.929 -3.376 -42.612 1.00 60.11 H new ATOM 0 HG13 ILE A 100 -12.799 -3.465 -44.131 1.00 60.11 H new ATOM 0 HG21 ILE A 100 -15.303 -3.580 -44.155 1.00 11.45 H new ATOM 0 HG22 ILE A 100 -16.205 -3.669 -42.623 1.00 11.45 H new ATOM 0 HG23 ILE A 100 -15.464 -2.133 -43.132 1.00 11.45 H new ATOM 0 HD11 ILE A 100 -11.896 -1.224 -43.769 1.00 2.12 H new ATOM 0 HD12 ILE A 100 -13.675 -1.186 -43.780 1.00 2.12 H new ATOM 0 HD13 ILE A 100 -12.792 -1.095 -42.237 1.00 2.12 H new ATOM 1518 N PRO A 101 -16.209 -2.829 -39.684 1.00 5.44 N ATOM 1519 CA PRO A 101 -17.474 -3.262 -39.083 1.00 42.13 C ATOM 1520 C PRO A 101 -18.388 -3.891 -40.131 1.00 14.34 C ATOM 1521 O PRO A 101 -18.468 -3.407 -41.265 1.00 14.05 O ATOM 1522 CB PRO A 101 -18.093 -1.965 -38.529 1.00 51.24 C ATOM 1523 CG PRO A 101 -16.975 -0.976 -38.502 1.00 0.42 C ATOM 1524 CD PRO A 101 -16.053 -1.364 -39.623 1.00 24.24 C ATOM 0 HA PRO A 101 -17.330 -4.020 -38.313 1.00 42.13 H new ATOM 0 HB2 PRO A 101 -18.910 -1.618 -39.161 1.00 51.24 H new ATOM 0 HB3 PRO A 101 -18.505 -2.120 -37.532 1.00 51.24 H new ATOM 0 HG2 PRO A 101 -17.348 0.039 -38.637 1.00 0.42 H new ATOM 0 HG3 PRO A 101 -16.456 -1.000 -37.544 1.00 0.42 H new ATOM 0 HD2 PRO A 101 -16.336 -0.888 -40.562 1.00 24.24 H new ATOM 0 HD3 PRO A 101 -15.022 -1.075 -39.417 1.00 24.24 H new ATOM 1532 N TYR A 102 -19.091 -4.949 -39.744 1.00 62.24 N ATOM 1533 CA TYR A 102 -19.894 -5.728 -40.685 1.00 42.32 C ATOM 1534 C TYR A 102 -20.953 -4.882 -41.401 1.00 55.45 C ATOM 1535 O TYR A 102 -21.362 -5.214 -42.513 1.00 63.25 O ATOM 1536 CB TYR A 102 -20.550 -6.917 -39.970 1.00 22.34 C ATOM 1537 CG TYR A 102 -21.542 -6.560 -38.869 1.00 74.23 C ATOM 1538 CD1 TYR A 102 -22.863 -6.245 -39.174 1.00 52.43 C ATOM 1539 CD2 TYR A 102 -21.172 -6.581 -37.526 1.00 34.34 C ATOM 1540 CE1 TYR A 102 -23.782 -5.959 -38.185 1.00 11.43 C ATOM 1541 CE2 TYR A 102 -22.092 -6.305 -36.528 1.00 44.51 C ATOM 1542 CZ TYR A 102 -23.395 -5.994 -36.865 1.00 3.53 C ATOM 1543 OH TYR A 102 -24.322 -5.736 -35.879 1.00 60.43 O ATOM 0 H TYR A 102 -19.122 -5.289 -38.783 1.00 62.24 H new ATOM 0 HA TYR A 102 -19.214 -6.098 -41.452 1.00 42.32 H new ATOM 0 HB2 TYR A 102 -21.064 -7.526 -40.714 1.00 22.34 H new ATOM 0 HB3 TYR A 102 -19.764 -7.537 -39.539 1.00 22.34 H new ATOM 0 HD1 TYR A 102 -23.176 -6.224 -40.208 1.00 52.43 H new ATOM 0 HD2 TYR A 102 -20.152 -6.816 -37.259 1.00 34.34 H new ATOM 0 HE1 TYR A 102 -24.800 -5.709 -38.446 1.00 11.43 H new ATOM 0 HE2 TYR A 102 -21.792 -6.333 -35.491 1.00 44.51 H new ATOM 0 HH TYR A 102 -24.093 -6.246 -35.074 1.00 60.43 H new ATOM 1553 N GLN A 103 -21.380 -3.787 -40.772 1.00 54.01 N ATOM 1554 CA GLN A 103 -22.439 -2.939 -41.334 1.00 73.14 C ATOM 1555 C GLN A 103 -21.916 -2.087 -42.495 1.00 73.11 C ATOM 1556 O GLN A 103 -22.694 -1.503 -43.248 1.00 64.20 O ATOM 1557 CB GLN A 103 -23.041 -2.029 -40.251 1.00 20.21 C ATOM 1558 CG GLN A 103 -22.052 -1.030 -39.655 1.00 52.32 C ATOM 1559 CD GLN A 103 -22.716 0.003 -38.752 1.00 12.35 C ATOM 1560 OE1 GLN A 103 -23.805 -0.377 -38.093 1.00 44.32 O flip ATOM 1561 NE2 GLN A 103 -22.254 1.139 -38.650 1.00 41.41 N flip ATOM 0 H GLN A 103 -21.013 -3.465 -39.877 1.00 54.01 H new ATOM 0 HA GLN A 103 -23.217 -3.600 -41.716 1.00 73.14 H new ATOM 0 HB2 GLN A 103 -23.881 -1.481 -40.678 1.00 20.21 H new ATOM 0 HB3 GLN A 103 -23.440 -2.651 -39.450 1.00 20.21 H new ATOM 0 HG2 GLN A 103 -21.298 -1.571 -39.084 1.00 52.32 H new ATOM 0 HG3 GLN A 103 -21.532 -0.516 -40.464 1.00 52.32 H new ATOM 0 HE21 GLN A 103 -21.416 1.397 -39.171 1.00 41.41 H new ATOM 0 HE22 GLN A 103 -22.709 1.822 -38.045 1.00 41.41 H new ATOM 1570 N LEU A 104 -20.594 -2.016 -42.634 1.00 62.14 N ATOM 1571 CA LEU A 104 -19.969 -1.218 -43.690 1.00 32.30 C ATOM 1572 C LEU A 104 -19.502 -2.119 -44.832 1.00 63.52 C ATOM 1573 O LEU A 104 -18.700 -1.705 -45.677 1.00 31.32 O ATOM 1574 CB LEU A 104 -18.784 -0.416 -43.126 1.00 72.14 C ATOM 1575 CG LEU A 104 -19.137 0.622 -42.047 1.00 20.21 C ATOM 1576 CD1 LEU A 104 -17.884 1.360 -41.578 1.00 1.30 C ATOM 1577 CD2 LEU A 104 -20.187 1.606 -42.563 1.00 71.42 C ATOM 0 H LEU A 104 -19.933 -2.502 -42.028 1.00 62.14 H new ATOM 0 HA LEU A 104 -20.709 -0.518 -44.078 1.00 32.30 H new ATOM 0 HB2 LEU A 104 -18.061 -1.116 -42.708 1.00 72.14 H new ATOM 0 HB3 LEU A 104 -18.291 0.098 -43.951 1.00 72.14 H new ATOM 0 HG LEU A 104 -19.560 0.094 -41.192 1.00 20.21 H new ATOM 0 HD11 LEU A 104 -18.156 2.090 -40.815 1.00 1.30 H new ATOM 0 HD12 LEU A 104 -17.175 0.645 -41.160 1.00 1.30 H new ATOM 0 HD13 LEU A 104 -17.426 1.873 -42.424 1.00 1.30 H new ATOM 0 HD21 LEU A 104 -20.421 2.331 -41.783 1.00 71.42 H new ATOM 0 HD22 LEU A 104 -19.798 2.127 -43.438 1.00 71.42 H new ATOM 0 HD23 LEU A 104 -21.091 1.063 -42.837 1.00 71.42 H new ATOM 1589 N ALA A 105 -20.027 -3.343 -44.858 1.00 62.01 N ATOM 1590 CA ALA A 105 -19.649 -4.337 -45.855 1.00 15.02 C ATOM 1591 C ALA A 105 -20.722 -5.422 -45.964 1.00 14.10 C ATOM 1592 O ALA A 105 -21.778 -5.335 -45.335 1.00 75.53 O ATOM 1593 CB ALA A 105 -18.301 -4.958 -45.497 1.00 53.05 C ATOM 0 H ALA A 105 -20.724 -3.671 -44.189 1.00 62.01 H new ATOM 0 HA ALA A 105 -19.560 -3.842 -46.822 1.00 15.02 H new ATOM 0 HB1 ALA A 105 -18.030 -5.699 -46.249 1.00 53.05 H new ATOM 0 HB2 ALA A 105 -17.539 -4.179 -45.464 1.00 53.05 H new ATOM 0 HB3 ALA A 105 -18.370 -5.440 -44.522 1.00 53.05 H new ATOM 1599 N TYR A 106 -20.437 -6.448 -46.761 1.00 54.43 N ATOM 1600 CA TYR A 106 -21.343 -7.590 -46.918 1.00 22.33 C ATOM 1601 C TYR A 106 -21.263 -8.506 -45.693 1.00 52.22 C ATOM 1602 O TYR A 106 -22.023 -9.469 -45.570 1.00 2.43 O ATOM 1603 CB TYR A 106 -20.995 -8.376 -48.195 1.00 62.33 C ATOM 1604 CG TYR A 106 -19.614 -9.015 -48.174 1.00 72.41 C ATOM 1605 CD1 TYR A 106 -18.471 -8.249 -48.384 1.00 61.54 C ATOM 1606 CD2 TYR A 106 -19.455 -10.379 -47.939 1.00 15.41 C ATOM 1607 CE1 TYR A 106 -17.215 -8.821 -48.361 1.00 50.11 C ATOM 1608 CE2 TYR A 106 -18.201 -10.956 -47.914 1.00 43.13 C ATOM 1609 CZ TYR A 106 -17.086 -10.173 -48.127 1.00 60.03 C ATOM 1610 OH TYR A 106 -15.836 -10.744 -48.101 1.00 3.12 O ATOM 0 H TYR A 106 -19.582 -6.515 -47.313 1.00 54.43 H new ATOM 0 HA TYR A 106 -22.363 -7.215 -47.006 1.00 22.33 H new ATOM 0 HB2 TYR A 106 -21.742 -9.156 -48.344 1.00 62.33 H new ATOM 0 HB3 TYR A 106 -21.060 -7.705 -49.051 1.00 62.33 H new ATOM 0 HD1 TYR A 106 -18.568 -7.189 -48.568 1.00 61.54 H new ATOM 0 HD2 TYR A 106 -20.327 -10.995 -47.774 1.00 15.41 H new ATOM 0 HE1 TYR A 106 -16.338 -8.212 -48.525 1.00 50.11 H new ATOM 0 HE2 TYR A 106 -18.094 -12.015 -47.729 1.00 43.13 H new ATOM 0 HH TYR A 106 -15.919 -11.704 -47.923 1.00 3.12 H new ATOM 1620 N GLY A 107 -20.338 -8.184 -44.787 1.00 75.14 N ATOM 1621 CA GLY A 107 -20.090 -9.009 -43.615 1.00 10.44 C ATOM 1622 C GLY A 107 -21.303 -9.156 -42.713 1.00 30.53 C ATOM 1623 O GLY A 107 -21.382 -10.100 -41.925 1.00 60.22 O ATOM 0 H GLY A 107 -19.749 -7.353 -44.848 1.00 75.14 H new ATOM 0 HA2 GLY A 107 -19.765 -9.998 -43.938 1.00 10.44 H new ATOM 0 HA3 GLY A 107 -19.271 -8.576 -43.042 1.00 10.44 H new ATOM 1627 N GLU A 108 -22.247 -8.216 -42.812 1.00 42.23 N ATOM 1628 CA GLU A 108 -23.464 -8.276 -42.003 1.00 2.53 C ATOM 1629 C GLU A 108 -24.270 -9.529 -42.330 1.00 1.12 C ATOM 1630 O GLU A 108 -24.768 -10.214 -41.433 1.00 70.21 O ATOM 1631 CB GLU A 108 -24.339 -7.028 -42.203 1.00 42.32 C ATOM 1632 CG GLU A 108 -24.878 -6.848 -43.618 1.00 4.21 C ATOM 1633 CD GLU A 108 -26.030 -5.856 -43.678 1.00 31.05 C ATOM 1634 OE1 GLU A 108 -27.166 -6.241 -43.322 1.00 64.21 O ATOM 1635 OE2 GLU A 108 -25.809 -4.693 -44.068 1.00 42.51 O ATOM 0 H GLU A 108 -22.192 -7.413 -43.438 1.00 42.23 H new ATOM 0 HA GLU A 108 -23.155 -8.313 -40.958 1.00 2.53 H new ATOM 0 HB2 GLU A 108 -25.180 -7.076 -41.512 1.00 42.32 H new ATOM 0 HB3 GLU A 108 -23.757 -6.146 -41.936 1.00 42.32 H new ATOM 0 HG2 GLU A 108 -24.074 -6.506 -44.270 1.00 4.21 H new ATOM 0 HG3 GLU A 108 -25.212 -7.812 -44.002 1.00 4.21 H new ATOM 1642 N ARG A 109 -24.369 -9.831 -43.620 1.00 41.24 N ATOM 1643 CA ARG A 109 -25.174 -10.946 -44.100 1.00 2.14 C ATOM 1644 C ARG A 109 -24.323 -12.206 -44.213 1.00 64.15 C ATOM 1645 O ARG A 109 -24.752 -13.295 -43.828 1.00 50.12 O ATOM 1646 CB ARG A 109 -25.786 -10.605 -45.469 1.00 42.44 C ATOM 1647 CG ARG A 109 -26.834 -11.609 -45.936 1.00 24.32 C ATOM 1648 CD ARG A 109 -27.285 -11.339 -47.367 1.00 60.10 C ATOM 1649 NE ARG A 109 -27.723 -9.952 -47.568 1.00 12.51 N ATOM 1650 CZ ARG A 109 -28.908 -9.605 -48.070 1.00 71.52 C ATOM 1651 NH1 ARG A 109 -29.847 -10.523 -48.267 1.00 63.01 N ATOM 1652 NH2 ARG A 109 -29.163 -8.328 -48.329 1.00 72.20 N ATOM 0 H ARG A 109 -23.895 -9.312 -44.359 1.00 41.24 H new ATOM 0 HA ARG A 109 -25.977 -11.127 -43.385 1.00 2.14 H new ATOM 0 HB2 ARG A 109 -26.240 -9.615 -45.418 1.00 42.44 H new ATOM 0 HB3 ARG A 109 -24.989 -10.552 -46.211 1.00 42.44 H new ATOM 0 HG2 ARG A 109 -26.426 -12.617 -45.869 1.00 24.32 H new ATOM 0 HG3 ARG A 109 -27.696 -11.569 -45.270 1.00 24.32 H new ATOM 0 HD2 ARG A 109 -26.465 -11.560 -48.050 1.00 60.10 H new ATOM 0 HD3 ARG A 109 -28.102 -12.015 -47.620 1.00 60.10 H new ATOM 0 HE ARG A 109 -27.079 -9.206 -47.307 1.00 12.51 H new ATOM 0 HH11 ARG A 109 -29.663 -11.499 -48.034 1.00 63.01 H new ATOM 0 HH12 ARG A 109 -30.752 -10.252 -48.651 1.00 63.01 H new ATOM 0 HH21 ARG A 109 -28.454 -7.619 -48.144 1.00 72.20 H new ATOM 0 HH22 ARG A 109 -30.068 -8.056 -48.713 1.00 72.20 H new ATOM 1666 N GLY A 110 -23.110 -12.041 -44.733 1.00 51.44 N ATOM 1667 CA GLY A 110 -22.234 -13.174 -44.973 1.00 74.31 C ATOM 1668 C GLY A 110 -22.551 -13.857 -46.291 1.00 44.44 C ATOM 1669 O GLY A 110 -23.719 -13.969 -46.672 1.00 52.23 O ATOM 0 H GLY A 110 -22.716 -11.137 -44.994 1.00 51.44 H new ATOM 0 HA2 GLY A 110 -21.197 -12.838 -44.977 1.00 74.31 H new ATOM 0 HA3 GLY A 110 -22.334 -13.891 -44.158 1.00 74.31 H new ATOM 1673 N TYR A 111 -21.516 -14.294 -47.001 1.00 14.34 N ATOM 1674 CA TYR A 111 -21.685 -15.000 -48.273 1.00 51.25 C ATOM 1675 C TYR A 111 -20.735 -16.204 -48.362 1.00 15.01 C ATOM 1676 O TYR A 111 -21.197 -17.335 -48.527 1.00 51.22 O ATOM 1677 CB TYR A 111 -21.490 -14.051 -49.475 1.00 51.01 C ATOM 1678 CG TYR A 111 -22.691 -13.174 -49.786 1.00 1.55 C ATOM 1679 CD1 TYR A 111 -22.864 -11.935 -49.173 1.00 62.24 C ATOM 1680 CD2 TYR A 111 -23.654 -13.589 -50.705 1.00 14.33 C ATOM 1681 CE1 TYR A 111 -23.957 -11.140 -49.467 1.00 42.35 C ATOM 1682 CE2 TYR A 111 -24.746 -12.798 -51.003 1.00 51.32 C ATOM 1683 CZ TYR A 111 -24.893 -11.575 -50.382 1.00 75.40 C ATOM 1684 OH TYR A 111 -25.983 -10.786 -50.678 1.00 34.13 O ATOM 0 H TYR A 111 -20.544 -14.172 -46.717 1.00 14.34 H new ATOM 0 HA TYR A 111 -22.709 -15.373 -48.311 1.00 51.25 H new ATOM 0 HB2 TYR A 111 -20.629 -13.411 -49.281 1.00 51.01 H new ATOM 0 HB3 TYR A 111 -21.252 -14.646 -50.357 1.00 51.01 H new ATOM 0 HD1 TYR A 111 -22.133 -11.590 -48.457 1.00 62.24 H new ATOM 0 HD2 TYR A 111 -23.544 -14.546 -51.193 1.00 14.33 H new ATOM 0 HE1 TYR A 111 -24.077 -10.182 -48.982 1.00 42.35 H new ATOM 0 HE2 TYR A 111 -25.481 -13.135 -51.719 1.00 51.32 H new ATOM 0 HH TYR A 111 -26.544 -11.239 -51.342 1.00 34.13 H new ATOM 1694 N PRO A 112 -19.396 -16.004 -48.252 1.00 71.14 N ATOM 1695 CA PRO A 112 -18.438 -17.117 -48.285 1.00 74.05 C ATOM 1696 C PRO A 112 -18.486 -17.928 -46.985 1.00 44.53 C ATOM 1697 O PRO A 112 -18.734 -17.366 -45.919 1.00 35.22 O ATOM 1698 CB PRO A 112 -17.065 -16.425 -48.448 1.00 3.14 C ATOM 1699 CG PRO A 112 -17.369 -14.989 -48.732 1.00 55.31 C ATOM 1700 CD PRO A 112 -18.700 -14.716 -48.091 1.00 34.32 C ATOM 0 HA PRO A 112 -18.652 -17.825 -49.086 1.00 74.05 H new ATOM 0 HB2 PRO A 112 -16.465 -16.527 -47.544 1.00 3.14 H new ATOM 0 HB3 PRO A 112 -16.494 -16.873 -49.261 1.00 3.14 H new ATOM 0 HG2 PRO A 112 -16.597 -14.338 -48.322 1.00 55.31 H new ATOM 0 HG3 PRO A 112 -17.407 -14.802 -49.805 1.00 55.31 H new ATOM 0 HD2 PRO A 112 -18.597 -14.438 -47.042 1.00 34.32 H new ATOM 0 HD3 PRO A 112 -19.230 -13.902 -48.586 1.00 34.32 H new ATOM 1708 N PRO A 113 -18.236 -19.251 -47.049 1.00 75.52 N ATOM 1709 CA PRO A 113 -18.297 -20.129 -45.866 1.00 14.13 C ATOM 1710 C PRO A 113 -17.293 -19.714 -44.785 1.00 51.33 C ATOM 1711 O PRO A 113 -17.430 -20.086 -43.618 1.00 50.55 O ATOM 1712 CB PRO A 113 -17.958 -21.521 -46.427 1.00 71.32 C ATOM 1713 CG PRO A 113 -17.265 -21.262 -47.725 1.00 43.15 C ATOM 1714 CD PRO A 113 -17.880 -20.000 -48.270 1.00 14.23 C ATOM 0 HA PRO A 113 -19.270 -20.088 -45.376 1.00 14.13 H new ATOM 0 HB2 PRO A 113 -17.317 -22.076 -45.742 1.00 71.32 H new ATOM 0 HB3 PRO A 113 -18.859 -22.117 -46.574 1.00 71.32 H new ATOM 0 HG2 PRO A 113 -16.191 -21.143 -47.579 1.00 43.15 H new ATOM 0 HG3 PRO A 113 -17.402 -22.094 -48.415 1.00 43.15 H new ATOM 0 HD2 PRO A 113 -17.179 -19.446 -48.894 1.00 14.23 H new ATOM 0 HD3 PRO A 113 -18.755 -20.210 -48.884 1.00 14.23 H new ATOM 1722 N VAL A 114 -16.290 -18.942 -45.188 1.00 63.42 N ATOM 1723 CA VAL A 114 -15.262 -18.458 -44.268 1.00 23.21 C ATOM 1724 C VAL A 114 -15.701 -17.159 -43.584 1.00 74.31 C ATOM 1725 O VAL A 114 -15.141 -16.769 -42.560 1.00 2.15 O ATOM 1726 CB VAL A 114 -13.911 -18.238 -44.997 1.00 34.22 C ATOM 1727 CG1 VAL A 114 -13.387 -19.555 -45.579 1.00 33.32 C ATOM 1728 CG2 VAL A 114 -14.050 -17.174 -46.090 1.00 53.14 C ATOM 0 H VAL A 114 -16.165 -18.635 -46.153 1.00 63.42 H new ATOM 0 HA VAL A 114 -15.124 -19.226 -43.507 1.00 23.21 H new ATOM 0 HB VAL A 114 -13.185 -17.879 -44.267 1.00 34.22 H new ATOM 0 HG11 VAL A 114 -12.439 -19.377 -46.086 1.00 33.32 H new ATOM 0 HG12 VAL A 114 -13.239 -20.275 -44.774 1.00 33.32 H new ATOM 0 HG13 VAL A 114 -14.110 -19.951 -46.292 1.00 33.32 H new ATOM 0 HG21 VAL A 114 -13.090 -17.036 -46.588 1.00 53.14 H new ATOM 0 HG22 VAL A 114 -14.794 -17.496 -46.819 1.00 53.14 H new ATOM 0 HG23 VAL A 114 -14.365 -16.231 -45.642 1.00 53.14 H new ATOM 1738 N ILE A 115 -16.701 -16.492 -44.159 1.00 51.04 N ATOM 1739 CA ILE A 115 -17.210 -15.231 -43.622 1.00 15.41 C ATOM 1740 C ILE A 115 -18.657 -15.404 -43.130 1.00 5.40 C ATOM 1741 O ILE A 115 -19.596 -15.454 -43.930 1.00 35.31 O ATOM 1742 CB ILE A 115 -17.161 -14.100 -44.688 1.00 64.33 C ATOM 1743 CG1 ILE A 115 -15.725 -13.887 -45.213 1.00 53.33 C ATOM 1744 CG2 ILE A 115 -17.728 -12.793 -44.125 1.00 50.30 C ATOM 1745 CD1 ILE A 115 -14.740 -13.442 -44.151 1.00 54.20 C ATOM 0 H ILE A 115 -17.178 -16.807 -45.004 1.00 51.04 H new ATOM 0 HA ILE A 115 -16.570 -14.949 -42.786 1.00 15.41 H new ATOM 0 HB ILE A 115 -17.783 -14.411 -45.527 1.00 64.33 H new ATOM 0 HG12 ILE A 115 -15.370 -14.817 -45.657 1.00 53.33 H new ATOM 0 HG13 ILE A 115 -15.747 -13.142 -46.009 1.00 53.33 H new ATOM 0 HG21 ILE A 115 -17.683 -12.018 -44.890 1.00 50.30 H new ATOM 0 HG22 ILE A 115 -18.764 -12.946 -43.824 1.00 50.30 H new ATOM 0 HG23 ILE A 115 -17.141 -12.484 -43.260 1.00 50.30 H new ATOM 0 HD11 ILE A 115 -13.755 -13.314 -44.599 1.00 54.20 H new ATOM 0 HD12 ILE A 115 -15.069 -12.495 -43.723 1.00 54.20 H new ATOM 0 HD13 ILE A 115 -14.686 -14.196 -43.366 1.00 54.20 H new ATOM 1757 N PRO A 116 -18.849 -15.525 -41.807 1.00 1.54 N ATOM 1758 CA PRO A 116 -20.183 -15.681 -41.210 1.00 4.42 C ATOM 1759 C PRO A 116 -20.956 -14.351 -41.167 1.00 1.54 C ATOM 1760 O PRO A 116 -20.397 -13.295 -41.468 1.00 44.24 O ATOM 1761 CB PRO A 116 -19.859 -16.182 -39.794 1.00 0.11 C ATOM 1762 CG PRO A 116 -18.541 -15.561 -39.481 1.00 2.34 C ATOM 1763 CD PRO A 116 -17.785 -15.522 -40.784 1.00 73.41 C ATOM 0 HA PRO A 116 -20.826 -16.354 -41.777 1.00 4.42 H new ATOM 0 HB2 PRO A 116 -20.623 -15.877 -39.079 1.00 0.11 H new ATOM 0 HB3 PRO A 116 -19.805 -17.270 -39.759 1.00 0.11 H new ATOM 0 HG2 PRO A 116 -18.668 -14.558 -39.073 1.00 2.34 H new ATOM 0 HG3 PRO A 116 -18.002 -16.143 -38.734 1.00 2.34 H new ATOM 0 HD2 PRO A 116 -17.161 -14.631 -40.858 1.00 73.41 H new ATOM 0 HD3 PRO A 116 -17.125 -16.383 -40.890 1.00 73.41 H new ATOM 1771 N PRO A 117 -22.263 -14.390 -40.822 1.00 32.11 N ATOM 1772 CA PRO A 117 -23.069 -13.175 -40.638 1.00 23.42 C ATOM 1773 C PRO A 117 -22.531 -12.305 -39.498 1.00 61.41 C ATOM 1774 O PRO A 117 -22.034 -12.824 -38.495 1.00 22.34 O ATOM 1775 CB PRO A 117 -24.475 -13.711 -40.297 1.00 44.33 C ATOM 1776 CG PRO A 117 -24.475 -15.124 -40.775 1.00 52.33 C ATOM 1777 CD PRO A 117 -23.062 -15.609 -40.610 1.00 32.41 C ATOM 0 HA PRO A 117 -23.057 -12.537 -41.522 1.00 23.42 H new ATOM 0 HB2 PRO A 117 -24.669 -13.657 -39.226 1.00 44.33 H new ATOM 0 HB3 PRO A 117 -25.251 -13.127 -40.792 1.00 44.33 H new ATOM 0 HG2 PRO A 117 -25.168 -15.733 -40.195 1.00 52.33 H new ATOM 0 HG3 PRO A 117 -24.791 -15.185 -41.816 1.00 52.33 H new ATOM 0 HD2 PRO A 117 -22.895 -16.033 -39.620 1.00 32.41 H new ATOM 0 HD3 PRO A 117 -22.815 -16.384 -41.335 1.00 32.41 H new ATOM 1785 N LYS A 118 -22.638 -10.987 -39.667 1.00 12.23 N ATOM 1786 CA LYS A 118 -22.147 -10.012 -38.685 1.00 22.13 C ATOM 1787 C LYS A 118 -20.633 -10.128 -38.479 1.00 41.51 C ATOM 1788 O LYS A 118 -20.108 -9.747 -37.428 1.00 20.11 O ATOM 1789 CB LYS A 118 -22.877 -10.158 -37.337 1.00 64.12 C ATOM 1790 CG LYS A 118 -24.333 -9.699 -37.359 1.00 0.22 C ATOM 1791 CD LYS A 118 -24.952 -9.768 -35.964 1.00 12.22 C ATOM 1792 CE LYS A 118 -26.397 -9.282 -35.940 1.00 54.44 C ATOM 1793 NZ LYS A 118 -26.527 -7.837 -36.288 1.00 73.32 N ATOM 0 H LYS A 118 -23.068 -10.562 -40.489 1.00 12.23 H new ATOM 0 HA LYS A 118 -22.360 -9.022 -39.089 1.00 22.13 H new ATOM 0 HB2 LYS A 118 -22.842 -11.203 -37.029 1.00 64.12 H new ATOM 0 HB3 LYS A 118 -22.339 -9.585 -36.582 1.00 64.12 H new ATOM 0 HG2 LYS A 118 -24.390 -8.678 -37.736 1.00 0.22 H new ATOM 0 HG3 LYS A 118 -24.904 -10.324 -38.045 1.00 0.22 H new ATOM 0 HD2 LYS A 118 -24.912 -10.796 -35.603 1.00 12.22 H new ATOM 0 HD3 LYS A 118 -24.358 -9.165 -35.277 1.00 12.22 H new ATOM 0 HE2 LYS A 118 -26.986 -9.874 -36.640 1.00 54.44 H new ATOM 0 HE3 LYS A 118 -26.816 -9.451 -34.948 1.00 54.44 H new ATOM 0 HZ1 LYS A 118 -27.310 -7.418 -35.746 1.00 73.32 H new ATOM 0 HZ2 LYS A 118 -25.642 -7.343 -36.056 1.00 73.32 H new ATOM 0 HZ3 LYS A 118 -26.720 -7.741 -37.305 1.00 73.32 H new ATOM 1807 N ALA A 119 -19.933 -10.606 -39.501 1.00 25.12 N ATOM 1808 CA ALA A 119 -18.491 -10.799 -39.415 1.00 55.24 C ATOM 1809 C ALA A 119 -17.740 -9.477 -39.558 1.00 12.24 C ATOM 1810 O ALA A 119 -17.623 -8.934 -40.659 1.00 74.12 O ATOM 1811 CB ALA A 119 -18.020 -11.788 -40.474 1.00 71.50 C ATOM 0 H ALA A 119 -20.341 -10.867 -40.399 1.00 25.12 H new ATOM 0 HA ALA A 119 -18.271 -11.205 -38.428 1.00 55.24 H new ATOM 0 HB1 ALA A 119 -16.941 -11.920 -40.395 1.00 71.50 H new ATOM 0 HB2 ALA A 119 -18.515 -12.747 -40.322 1.00 71.50 H new ATOM 0 HB3 ALA A 119 -18.267 -11.406 -41.464 1.00 71.50 H new ATOM 1817 N THR A 120 -17.265 -8.949 -38.436 1.00 51.12 N ATOM 1818 CA THR A 120 -16.356 -7.812 -38.446 1.00 71.23 C ATOM 1819 C THR A 120 -14.977 -8.291 -38.912 1.00 20.24 C ATOM 1820 O THR A 120 -14.394 -9.196 -38.305 1.00 3.02 O ATOM 1821 CB THR A 120 -16.253 -7.182 -37.036 1.00 65.31 C ATOM 1822 OG1 THR A 120 -17.567 -6.856 -36.550 1.00 65.31 O ATOM 1823 CG2 THR A 120 -15.392 -5.924 -37.043 1.00 44.33 C ATOM 0 H THR A 120 -17.496 -9.293 -37.504 1.00 51.12 H new ATOM 0 HA THR A 120 -16.735 -7.050 -39.127 1.00 71.23 H new ATOM 0 HB THR A 120 -15.782 -7.914 -36.380 1.00 65.31 H new ATOM 0 HG1 THR A 120 -17.496 -6.459 -35.657 1.00 65.31 H new ATOM 0 HG21 THR A 120 -15.344 -5.511 -36.036 1.00 44.33 H new ATOM 0 HG22 THR A 120 -14.386 -6.173 -37.382 1.00 44.33 H new ATOM 0 HG23 THR A 120 -15.830 -5.187 -37.717 1.00 44.33 H new ATOM 1831 N LEU A 121 -14.456 -7.694 -39.981 1.00 2.41 N ATOM 1832 CA LEU A 121 -13.275 -8.242 -40.665 1.00 73.03 C ATOM 1833 C LEU A 121 -12.176 -7.181 -40.743 1.00 70.13 C ATOM 1834 O LEU A 121 -12.466 -6.004 -40.915 1.00 70.31 O ATOM 1835 CB LEU A 121 -13.682 -8.739 -42.074 1.00 5.25 C ATOM 1836 CG LEU A 121 -12.849 -9.899 -42.668 1.00 44.23 C ATOM 1837 CD1 LEU A 121 -11.465 -9.431 -43.111 1.00 63.11 C ATOM 1838 CD2 LEU A 121 -12.734 -11.046 -41.663 1.00 11.54 C ATOM 0 H LEU A 121 -14.825 -6.838 -40.394 1.00 2.41 H new ATOM 0 HA LEU A 121 -12.881 -9.088 -40.102 1.00 73.03 H new ATOM 0 HB2 LEU A 121 -14.725 -9.054 -42.036 1.00 5.25 H new ATOM 0 HB3 LEU A 121 -13.629 -7.895 -42.761 1.00 5.25 H new ATOM 0 HG LEU A 121 -13.372 -10.260 -43.554 1.00 44.23 H new ATOM 0 HD11 LEU A 121 -10.910 -10.274 -43.523 1.00 63.11 H new ATOM 0 HD12 LEU A 121 -11.569 -8.658 -43.873 1.00 63.11 H new ATOM 0 HD13 LEU A 121 -10.926 -9.026 -42.254 1.00 63.11 H new ATOM 0 HD21 LEU A 121 -12.145 -11.853 -42.098 1.00 11.54 H new ATOM 0 HD22 LEU A 121 -12.246 -10.688 -40.757 1.00 11.54 H new ATOM 0 HD23 LEU A 121 -13.730 -11.415 -41.417 1.00 11.54 H new ATOM 1850 N VAL A 122 -10.913 -7.599 -40.630 1.00 31.41 N ATOM 1851 CA VAL A 122 -9.796 -6.658 -40.587 1.00 43.23 C ATOM 1852 C VAL A 122 -9.149 -6.536 -41.963 1.00 70.11 C ATOM 1853 O VAL A 122 -8.889 -7.538 -42.626 1.00 44.44 O ATOM 1854 CB VAL A 122 -8.726 -7.104 -39.556 1.00 61.11 C ATOM 1855 CG1 VAL A 122 -7.548 -6.135 -39.530 1.00 50.24 C ATOM 1856 CG2 VAL A 122 -9.341 -7.251 -38.162 1.00 74.23 C ATOM 0 H VAL A 122 -10.641 -8.580 -40.567 1.00 31.41 H new ATOM 0 HA VAL A 122 -10.193 -5.689 -40.283 1.00 43.23 H new ATOM 0 HB VAL A 122 -8.349 -8.079 -39.866 1.00 61.11 H new ATOM 0 HG11 VAL A 122 -6.814 -6.474 -38.798 1.00 50.24 H new ATOM 0 HG12 VAL A 122 -7.086 -6.098 -40.516 1.00 50.24 H new ATOM 0 HG13 VAL A 122 -7.901 -5.141 -39.257 1.00 50.24 H new ATOM 0 HG21 VAL A 122 -8.572 -7.564 -37.456 1.00 74.23 H new ATOM 0 HG22 VAL A 122 -9.756 -6.294 -37.845 1.00 74.23 H new ATOM 0 HG23 VAL A 122 -10.133 -7.999 -38.191 1.00 74.23 H new ATOM 1866 N PHE A 123 -8.904 -5.306 -42.395 1.00 33.02 N ATOM 1867 CA PHE A 123 -8.258 -5.054 -43.676 1.00 14.15 C ATOM 1868 C PHE A 123 -7.135 -4.039 -43.517 1.00 24.01 C ATOM 1869 O PHE A 123 -7.342 -2.959 -42.956 1.00 14.25 O ATOM 1870 CB PHE A 123 -9.271 -4.529 -44.711 1.00 30.11 C ATOM 1871 CG PHE A 123 -10.234 -5.569 -45.233 1.00 10.14 C ATOM 1872 CD1 PHE A 123 -9.918 -6.319 -46.357 1.00 52.10 C ATOM 1873 CD2 PHE A 123 -11.456 -5.788 -44.612 1.00 51.11 C ATOM 1874 CE1 PHE A 123 -10.798 -7.264 -46.846 1.00 34.12 C ATOM 1875 CE2 PHE A 123 -12.340 -6.729 -45.101 1.00 23.22 C ATOM 1876 CZ PHE A 123 -12.011 -7.468 -46.217 1.00 24.21 C ATOM 0 H PHE A 123 -9.145 -4.463 -41.874 1.00 33.02 H new ATOM 0 HA PHE A 123 -7.847 -5.999 -44.029 1.00 14.15 H new ATOM 0 HB2 PHE A 123 -9.843 -3.717 -44.261 1.00 30.11 H new ATOM 0 HB3 PHE A 123 -8.724 -4.105 -45.553 1.00 30.11 H new ATOM 0 HD1 PHE A 123 -8.973 -6.162 -46.855 1.00 52.10 H new ATOM 0 HD2 PHE A 123 -11.719 -5.215 -43.735 1.00 51.11 H new ATOM 0 HE1 PHE A 123 -10.538 -7.843 -47.720 1.00 34.12 H new ATOM 0 HE2 PHE A 123 -13.289 -6.886 -44.609 1.00 23.22 H new ATOM 0 HZ PHE A 123 -12.701 -8.206 -46.599 1.00 24.21 H new ATOM 1886 N GLU A 124 -5.945 -4.385 -43.988 1.00 64.31 N ATOM 1887 CA GLU A 124 -4.894 -3.402 -44.154 1.00 51.31 C ATOM 1888 C GLU A 124 -5.226 -2.566 -45.377 1.00 24.30 C ATOM 1889 O GLU A 124 -5.157 -3.057 -46.513 1.00 64.22 O ATOM 1890 CB GLU A 124 -3.505 -4.048 -44.303 1.00 15.04 C ATOM 1891 CG GLU A 124 -2.889 -4.526 -42.993 1.00 23.21 C ATOM 1892 CD GLU A 124 -1.435 -4.975 -43.136 1.00 12.02 C ATOM 1893 OE1 GLU A 124 -0.782 -4.637 -44.156 1.00 32.21 O ATOM 1894 OE2 GLU A 124 -0.928 -5.659 -42.217 1.00 21.31 O ATOM 0 H GLU A 124 -5.688 -5.334 -44.259 1.00 64.31 H new ATOM 0 HA GLU A 124 -4.847 -2.780 -43.260 1.00 51.31 H new ATOM 0 HB2 GLU A 124 -3.583 -4.895 -44.984 1.00 15.04 H new ATOM 0 HB3 GLU A 124 -2.831 -3.328 -44.766 1.00 15.04 H new ATOM 0 HG2 GLU A 124 -2.943 -3.722 -42.260 1.00 23.21 H new ATOM 0 HG3 GLU A 124 -3.481 -5.354 -42.602 1.00 23.21 H new ATOM 1901 N VAL A 125 -5.651 -1.334 -45.133 1.00 22.33 N ATOM 1902 CA VAL A 125 -5.950 -0.380 -46.188 1.00 0.42 C ATOM 1903 C VAL A 125 -4.744 0.531 -46.392 1.00 41.00 C ATOM 1904 O VAL A 125 -4.202 1.081 -45.434 1.00 20.15 O ATOM 1905 CB VAL A 125 -7.225 0.450 -45.858 1.00 20.05 C ATOM 1906 CG1 VAL A 125 -8.468 -0.436 -45.900 1.00 34.15 C ATOM 1907 CG2 VAL A 125 -7.108 1.130 -44.496 1.00 11.44 C ATOM 0 H VAL A 125 -5.798 -0.968 -44.192 1.00 22.33 H new ATOM 0 HA VAL A 125 -6.154 -0.924 -47.110 1.00 0.42 H new ATOM 0 HB VAL A 125 -7.320 1.227 -46.617 1.00 20.05 H new ATOM 0 HG11 VAL A 125 -9.349 0.162 -45.667 1.00 34.15 H new ATOM 0 HG12 VAL A 125 -8.575 -0.866 -46.896 1.00 34.15 H new ATOM 0 HG13 VAL A 125 -8.369 -1.237 -45.167 1.00 34.15 H new ATOM 0 HG21 VAL A 125 -8.014 1.701 -44.296 1.00 11.44 H new ATOM 0 HG22 VAL A 125 -6.977 0.374 -43.722 1.00 11.44 H new ATOM 0 HG23 VAL A 125 -6.249 1.801 -44.497 1.00 11.44 H new ATOM 1917 N GLU A 126 -4.308 0.665 -47.634 1.00 43.13 N ATOM 1918 CA GLU A 126 -3.047 1.333 -47.936 1.00 63.02 C ATOM 1919 C GLU A 126 -3.223 2.300 -49.106 1.00 75.21 C ATOM 1920 O GLU A 126 -3.627 1.891 -50.190 1.00 73.13 O ATOM 1921 CB GLU A 126 -2.020 0.245 -48.271 1.00 51.44 C ATOM 1922 CG GLU A 126 -0.586 0.715 -48.436 1.00 43.20 C ATOM 1923 CD GLU A 126 0.331 -0.451 -48.769 1.00 3.30 C ATOM 1924 OE1 GLU A 126 0.593 -1.279 -47.874 1.00 33.31 O ATOM 1925 OE2 GLU A 126 0.752 -0.577 -49.936 1.00 32.43 O ATOM 0 H GLU A 126 -4.808 0.320 -48.453 1.00 43.13 H new ATOM 0 HA GLU A 126 -2.707 1.920 -47.083 1.00 63.02 H new ATOM 0 HB2 GLU A 126 -2.047 -0.508 -47.483 1.00 51.44 H new ATOM 0 HB3 GLU A 126 -2.329 -0.248 -49.193 1.00 51.44 H new ATOM 0 HG2 GLU A 126 -0.533 1.463 -49.227 1.00 43.20 H new ATOM 0 HG3 GLU A 126 -0.249 1.198 -47.519 1.00 43.20 H new ATOM 1932 N LEU A 127 -2.947 3.581 -48.880 1.00 44.31 N ATOM 1933 CA LEU A 127 -3.048 4.591 -49.940 1.00 71.21 C ATOM 1934 C LEU A 127 -1.666 4.835 -50.540 1.00 21.13 C ATOM 1935 O LEU A 127 -0.791 5.404 -49.885 1.00 72.31 O ATOM 1936 CB LEU A 127 -3.646 5.904 -49.384 1.00 2.35 C ATOM 1937 CG LEU A 127 -4.048 6.990 -50.417 1.00 62.44 C ATOM 1938 CD1 LEU A 127 -2.834 7.702 -51.008 1.00 31.13 C ATOM 1939 CD2 LEU A 127 -4.900 6.387 -51.531 1.00 41.12 C ATOM 0 H LEU A 127 -2.652 3.948 -47.975 1.00 44.31 H new ATOM 0 HA LEU A 127 -3.715 4.227 -50.722 1.00 71.21 H new ATOM 0 HB2 LEU A 127 -4.529 5.652 -48.797 1.00 2.35 H new ATOM 0 HB3 LEU A 127 -2.921 6.342 -48.697 1.00 2.35 H new ATOM 0 HG LEU A 127 -4.637 7.735 -49.882 1.00 62.44 H new ATOM 0 HD11 LEU A 127 -3.166 8.453 -51.725 1.00 31.13 H new ATOM 0 HD12 LEU A 127 -2.272 8.186 -50.210 1.00 31.13 H new ATOM 0 HD13 LEU A 127 -2.196 6.976 -51.512 1.00 31.13 H new ATOM 0 HD21 LEU A 127 -5.171 7.166 -52.244 1.00 41.12 H new ATOM 0 HD22 LEU A 127 -4.333 5.608 -52.042 1.00 41.12 H new ATOM 0 HD23 LEU A 127 -5.805 5.956 -51.104 1.00 41.12 H new ATOM 1951 N LEU A 128 -1.474 4.400 -51.782 1.00 14.43 N ATOM 1952 CA LEU A 128 -0.191 4.561 -52.461 1.00 30.41 C ATOM 1953 C LEU A 128 -0.118 5.909 -53.154 1.00 2.23 C ATOM 1954 O LEU A 128 0.849 6.654 -52.974 1.00 15.42 O ATOM 1955 CB LEU A 128 0.040 3.440 -53.488 1.00 73.21 C ATOM 1956 CG LEU A 128 0.355 2.052 -52.905 1.00 25.15 C ATOM 1957 CD1 LEU A 128 1.623 2.091 -52.055 1.00 61.42 C ATOM 1958 CD2 LEU A 128 -0.820 1.523 -52.094 1.00 51.52 C ATOM 0 H LEU A 128 -2.190 3.933 -52.339 1.00 14.43 H new ATOM 0 HA LEU A 128 0.590 4.505 -51.703 1.00 30.41 H new ATOM 0 HB2 LEU A 128 -0.849 3.357 -54.113 1.00 73.21 H new ATOM 0 HB3 LEU A 128 0.862 3.734 -54.140 1.00 73.21 H new ATOM 0 HG LEU A 128 0.527 1.371 -53.738 1.00 25.15 H new ATOM 0 HD11 LEU A 128 1.823 1.097 -51.655 1.00 61.42 H new ATOM 0 HD12 LEU A 128 2.464 2.411 -52.670 1.00 61.42 H new ATOM 0 HD13 LEU A 128 1.488 2.793 -51.232 1.00 61.42 H new ATOM 0 HD21 LEU A 128 -0.572 0.540 -51.693 1.00 51.52 H new ATOM 0 HD22 LEU A 128 -1.033 2.207 -51.273 1.00 51.52 H new ATOM 0 HD23 LEU A 128 -1.698 1.442 -52.735 1.00 51.52 H new ATOM 1970 N ALA A 129 -1.140 6.233 -53.942 1.00 4.43 N ATOM 1971 CA ALA A 129 -1.103 7.455 -54.747 1.00 1.24 C ATOM 1972 C ALA A 129 -2.497 7.946 -55.108 1.00 55.22 C ATOM 1973 O ALA A 129 -3.500 7.373 -54.683 1.00 1.51 O ATOM 1974 CB ALA A 129 -0.280 7.220 -56.010 1.00 14.11 C ATOM 0 H ALA A 129 -1.991 5.679 -54.041 1.00 4.43 H new ATOM 0 HA ALA A 129 -0.633 8.233 -54.145 1.00 1.24 H new ATOM 0 HB1 ALA A 129 -0.257 8.133 -56.604 1.00 14.11 H new ATOM 0 HB2 ALA A 129 0.737 6.940 -55.735 1.00 14.11 H new ATOM 0 HB3 ALA A 129 -0.731 6.418 -56.594 1.00 14.11 H new ATOM 1980 N VAL A 130 -2.538 9.020 -55.892 1.00 71.35 N ATOM 1981 CA VAL A 130 -3.782 9.586 -56.395 1.00 3.33 C ATOM 1982 C VAL A 130 -3.526 10.255 -57.758 1.00 10.44 C ATOM 1983 O VAL A 130 -3.162 11.446 -57.809 1.00 70.32 O ATOM 1984 CB VAL A 130 -4.425 10.574 -55.370 1.00 20.24 C ATOM 1985 CG1 VAL A 130 -3.405 11.587 -54.846 1.00 51.34 C ATOM 1986 CG2 VAL A 130 -5.645 11.281 -55.973 1.00 32.12 C ATOM 1987 OXT VAL A 130 -3.630 9.549 -58.782 1.00 0.00 O ATOM 0 H VAL A 130 -1.704 9.523 -56.196 1.00 71.35 H new ATOM 0 HA VAL A 130 -4.504 8.781 -56.533 1.00 3.33 H new ATOM 0 HB VAL A 130 -4.765 9.984 -54.519 1.00 20.24 H new ATOM 0 HG11 VAL A 130 -3.889 12.257 -54.136 1.00 51.34 H new ATOM 0 HG12 VAL A 130 -2.590 11.060 -54.350 1.00 51.34 H new ATOM 0 HG13 VAL A 130 -3.007 12.167 -55.679 1.00 51.34 H new ATOM 0 HG21 VAL A 130 -6.072 11.962 -55.237 1.00 32.12 H new ATOM 0 HG22 VAL A 130 -5.340 11.844 -56.855 1.00 32.12 H new ATOM 0 HG23 VAL A 130 -6.392 10.539 -56.257 1.00 32.12 H new TER 1997 VAL A 130