USER MOD reduce.3.24.130724 H: found=0, std=0, add=1236, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1236 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 111 GLN : amide:sc= -3.14! C(o=-3.1!,f=-3!) USER MOD Set 1.2: A 147 GLN : amide:sc= 0 X(o=-3.1,f=-3) USER MOD Set 2.1: A 88 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 104 SER OG : rot 170:sc= 0.074 USER MOD Set 2.3: A 106 LYS NZ :NH3+ 170:sc= 1.25 (180deg=-0.0871) USER MOD Set 2.4: A 115 GLN : amide:sc= 1.07 K(o=2.4,f=-6.3) USER MOD Set 3.1: A 110 ASN : amide:sc= 1.39 K(o=1.7,f=-1.3) USER MOD Set 3.2: A 144 GLN : amide:sc= 0.351 K(o=1.7,f=1.1) USER MOD Set 4.1: A 100 GLN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Set 4.2: A 102 HIS : no HE2:sc= 0 K(o=0,f=-0.81) USER MOD Set 5.1: A 79 MET CE :methyl 164:sc= -0.0857 (180deg=-0.473) USER MOD Set 5.2: A 141 SER OG : rot 180:sc= 0 USER MOD Set 6.1: A 72 GLN : amide:sc= -0.0725 K(o=-0.12,f=-0.97) USER MOD Set 6.2: A 75 SER OG : rot 75:sc= 1.07 USER MOD Set 6.3: A 133 MET CE :methyl 162:sc= -1.12 (180deg=-1.68!) USER MOD Set 7.1: A 62 SER OG : rot -86:sc= 1.13 USER MOD Set 7.2: A 94 HIS : no HD1:sc= 0.955 K(o=2.1,f=-9!) USER MOD Set 8.1: A 42 MET CE :methyl -162:sc= 0 (180deg=-0.122) USER MOD Set 8.2: A 44 THR OG1 : rot 76:sc= -0.223 USER MOD Set 9.1: A 37 THR OG1 : rot 180:sc= 0.00208 USER MOD Set 9.2: A 38 HIS : no HD1:sc= 0 X(o=0.0021,f=0.0016) USER MOD Single : A 1 HIS : no HD1:sc= 0 X(o=0,f=-0.0036) USER MOD Single : A 1 HIS N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 MET CE :methyl -158:sc= -0.152 (180deg=-0.735) USER MOD Single : A 4 SER OG : rot 51:sc= 0.0618 USER MOD Single : A 9 THR OG1 : rot 180:sc=-0.00101 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 180:sc= -0.0832 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 168:sc= 1.25 (180deg=0.985) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 29:sc= 0.285 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 GLN :FLIP amide:sc=-0.00271 F(o=-1.2,f=-0.0027) USER MOD Single : A 57 SER OG : rot 180:sc= -0.022 USER MOD Single : A 67 SER OG : rot 180:sc= -0.0151 USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 71 GLN : amide:sc= -1.38 K(o=-1.4,f=-9!) USER MOD Single : A 73 THR OG1 : rot 76:sc= 0.897 USER MOD Single : A 76 GLN : amide:sc= -0.165 X(o=-0.16,f=-0.28) USER MOD Single : A 77 GLN : amide:sc= -2 K(o=-2,f=-3.7!) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 GLN :FLIP amide:sc= -1.42 F(o=-2.7!,f=-1.4) USER MOD Single : A 86 GLN : amide:sc= -0.24 X(o=-0.24,f=0) USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 90 GLN :FLIP amide:sc= 0 F(o=-0.53,f=0) USER MOD Single : A 113 GLN : amide:sc= -0.0072 K(o=-0.0072,f=-1.2) USER MOD Single : A 116 MET CE :methyl -149:sc= -0.319 (180deg=-2.02) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 120 HIS : no HD1:sc= -0.16 X(o=-0.16,f=-0.17) USER MOD Single : A 121 SER OG : rot 180:sc= 0.0525 USER MOD Single : A 122 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 136 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 GLN : amide:sc= 0.582 K(o=0.58,f=-0.51) USER MOD Single : A 148 SER OG : rot 180:sc= 0 USER MOD Single : A 149 SER OG : rot 180:sc=-0.00454 USER MOD Single : A 151 SER OG : rot 180:sc= 0 USER MOD Single : A 152 SER OG : rot -160:sc= -0.379 USER MOD Single : A 154 SER OG : rot -2:sc= 0.408 USER MOD Single : A 158 GLN : amide:sc= -0.0553 K(o=-0.055,f=-0.63) USER MOD Single : A 159 GLN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 160 GLN : amide:sc= -0.0333 K(o=-0.033,f=-1.2!) USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 162 SER OG : rot 180:sc= 0 USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD Single : A 164 GLN : amide:sc= 0 K(o=0,f=-0.68) USER MOD Single : A 165 GLN :FLIP amide:sc= 0 F(o=-0.98,f=0) USER MOD Single : A 166 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 167 SER OG : rot -13:sc= 0.733 USER MOD Single : A 168 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A 1 63.102 86.525 -28.800 1.00 60.21 N ATOM 2 CA HIS A 1 63.646 86.048 -27.515 1.00 61.00 C ATOM 3 C HIS A 1 64.380 84.740 -27.719 1.00 42.23 C ATOM 4 O HIS A 1 63.907 83.867 -28.449 1.00 33.14 O ATOM 5 CB HIS A 1 62.523 85.850 -26.484 1.00 64.50 C ATOM 6 CG HIS A 1 61.837 87.112 -26.062 1.00 51.21 C ATOM 7 ND1 HIS A 1 60.601 87.497 -26.538 1.00 0.13 N ATOM 8 CD2 HIS A 1 62.210 88.070 -25.184 1.00 71.13 C ATOM 9 CE1 HIS A 1 60.249 88.634 -25.972 1.00 72.42 C ATOM 10 NE2 HIS A 1 61.207 89.002 -25.148 1.00 75.14 N ATOM 0 H1 HIS A 1 62.599 87.423 -28.652 1.00 60.21 H new ATOM 0 H2 HIS A 1 63.881 86.671 -29.474 1.00 60.21 H new ATOM 0 H3 HIS A 1 62.442 85.818 -29.181 1.00 60.21 H new ATOM 0 HA HIS A 1 64.337 86.801 -27.137 1.00 61.00 H new ATOM 0 HB2 HIS A 1 61.780 85.170 -26.901 1.00 64.50 H new ATOM 0 HB3 HIS A 1 62.939 85.365 -25.601 1.00 64.50 H new ATOM 0 HD2 HIS A 1 63.128 88.096 -24.616 1.00 71.13 H new ATOM 0 HE1 HIS A 1 59.330 89.172 -26.154 1.00 72.42 H new ATOM 0 HE2 HIS A 1 61.203 89.846 -24.575 1.00 75.14 H new ATOM 21 N MET A 2 65.534 84.599 -27.089 1.00 15.23 N ATOM 22 CA MET A 2 66.317 83.379 -27.210 1.00 15.22 C ATOM 23 C MET A 2 67.268 83.217 -26.034 1.00 2.02 C ATOM 24 O MET A 2 67.635 84.196 -25.378 1.00 55.10 O ATOM 25 CB MET A 2 67.109 83.356 -28.527 1.00 43.12 C ATOM 26 CG MET A 2 68.187 84.426 -28.626 1.00 2.22 C ATOM 27 SD MET A 2 69.133 84.322 -30.161 1.00 13.31 S ATOM 28 CE MET A 2 69.878 82.697 -29.997 1.00 41.25 C ATOM 0 H MET A 2 65.950 85.312 -26.490 1.00 15.23 H new ATOM 0 HA MET A 2 65.616 82.544 -27.209 1.00 15.22 H new ATOM 0 HB2 MET A 2 67.574 82.377 -28.641 1.00 43.12 H new ATOM 0 HB3 MET A 2 66.414 83.478 -29.358 1.00 43.12 H new ATOM 0 HG2 MET A 2 67.724 85.410 -28.555 1.00 2.22 H new ATOM 0 HG3 MET A 2 68.866 84.332 -27.778 1.00 2.22 H new ATOM 0 HE1 MET A 2 70.764 82.637 -30.629 1.00 41.25 H new ATOM 0 HE2 MET A 2 70.162 82.530 -28.958 1.00 41.25 H new ATOM 0 HE3 MET A 2 69.161 81.935 -30.304 1.00 41.25 H new ATOM 38 N ALA A 3 67.667 81.979 -25.793 1.00 43.02 N ATOM 39 CA ALA A 3 68.582 81.628 -24.718 1.00 45.12 C ATOM 40 C ALA A 3 68.955 80.160 -24.832 1.00 23.22 C ATOM 41 O ALA A 3 68.301 79.294 -24.248 1.00 71.30 O ATOM 42 CB ALA A 3 67.963 81.915 -23.353 1.00 14.43 C ATOM 0 H ALA A 3 67.361 81.178 -26.346 1.00 43.02 H new ATOM 0 HA ALA A 3 69.480 82.239 -24.810 1.00 45.12 H new ATOM 0 HB1 ALA A 3 68.669 81.643 -22.569 1.00 14.43 H new ATOM 0 HB2 ALA A 3 67.727 82.976 -23.276 1.00 14.43 H new ATOM 0 HB3 ALA A 3 67.050 81.331 -23.237 1.00 14.43 H new ATOM 48 N SER A 4 69.974 79.883 -25.619 1.00 4.04 N ATOM 49 CA SER A 4 70.412 78.525 -25.856 1.00 31.23 C ATOM 50 C SER A 4 71.260 77.985 -24.701 1.00 73.04 C ATOM 51 O SER A 4 72.480 78.171 -24.666 1.00 21.53 O ATOM 52 CB SER A 4 71.176 78.450 -27.182 1.00 21.31 C ATOM 53 OG SER A 4 72.088 79.537 -27.307 1.00 23.22 O ATOM 0 H SER A 4 70.520 80.591 -26.110 1.00 4.04 H new ATOM 0 HA SER A 4 69.527 77.891 -25.918 1.00 31.23 H new ATOM 0 HB2 SER A 4 71.719 77.507 -27.240 1.00 21.31 H new ATOM 0 HB3 SER A 4 70.471 78.464 -28.013 1.00 21.31 H new ATOM 0 HG SER A 4 72.639 79.596 -26.499 1.00 23.22 H new ATOM 59 N ASP A 5 70.605 77.345 -23.745 1.00 3.52 N ATOM 60 CA ASP A 5 71.305 76.741 -22.618 1.00 30.20 C ATOM 61 C ASP A 5 71.816 75.367 -23.012 1.00 51.32 C ATOM 62 O ASP A 5 73.003 75.070 -22.867 1.00 12.11 O ATOM 63 CB ASP A 5 70.386 76.642 -21.394 1.00 23.11 C ATOM 64 CG ASP A 5 71.067 76.004 -20.200 1.00 11.14 C ATOM 65 OD1 ASP A 5 71.932 76.660 -19.579 1.00 55.22 O ATOM 66 OD2 ASP A 5 70.727 74.854 -19.861 1.00 54.44 O ATOM 0 H ASP A 5 69.592 77.230 -23.725 1.00 3.52 H new ATOM 0 HA ASP A 5 72.151 77.374 -22.351 1.00 30.20 H new ATOM 0 HB2 ASP A 5 70.043 77.640 -21.121 1.00 23.11 H new ATOM 0 HB3 ASP A 5 69.501 76.061 -21.655 1.00 23.11 H new ATOM 71 N ASP A 6 70.900 74.545 -23.535 1.00 11.43 N ATOM 72 CA ASP A 6 71.205 73.189 -24.024 1.00 24.52 C ATOM 73 C ASP A 6 71.707 72.261 -22.928 1.00 41.33 C ATOM 74 O ASP A 6 70.922 71.566 -22.279 1.00 24.10 O ATOM 75 CB ASP A 6 72.217 73.214 -25.184 1.00 71.13 C ATOM 76 CG ASP A 6 71.637 73.743 -26.470 1.00 1.32 C ATOM 77 OD1 ASP A 6 71.003 72.963 -27.209 1.00 24.34 O ATOM 78 OD2 ASP A 6 71.829 74.942 -26.769 1.00 62.23 O ATOM 0 H ASP A 6 69.917 74.801 -23.633 1.00 11.43 H new ATOM 0 HA ASP A 6 70.257 72.792 -24.387 1.00 24.52 H new ATOM 0 HB2 ASP A 6 73.071 73.829 -24.899 1.00 71.13 H new ATOM 0 HB3 ASP A 6 72.593 72.204 -25.351 1.00 71.13 H new ATOM 83 N ARG A 7 73.004 72.268 -22.718 1.00 20.01 N ATOM 84 CA ARG A 7 73.643 71.377 -21.772 1.00 22.54 C ATOM 85 C ARG A 7 74.909 72.031 -21.231 1.00 41.20 C ATOM 86 O ARG A 7 75.424 72.977 -21.828 1.00 64.10 O ATOM 87 CB ARG A 7 74.005 70.065 -22.483 1.00 33.40 C ATOM 88 CG ARG A 7 74.596 68.998 -21.578 1.00 32.40 C ATOM 89 CD ARG A 7 75.361 67.970 -22.378 1.00 63.01 C ATOM 90 NE ARG A 7 75.953 66.944 -21.526 1.00 25.45 N ATOM 91 CZ ARG A 7 77.258 66.850 -21.256 1.00 35.20 C ATOM 92 NH1 ARG A 7 78.112 67.755 -21.734 1.00 42.44 N ATOM 93 NH2 ARG A 7 77.705 65.858 -20.495 1.00 11.13 N ATOM 0 H ARG A 7 73.649 72.894 -23.200 1.00 20.01 H new ATOM 0 HA ARG A 7 72.964 71.171 -20.945 1.00 22.54 H new ATOM 0 HB2 ARG A 7 73.109 69.665 -22.957 1.00 33.40 H new ATOM 0 HB3 ARG A 7 74.717 70.283 -23.279 1.00 33.40 H new ATOM 0 HG2 ARG A 7 75.259 69.462 -20.848 1.00 32.40 H new ATOM 0 HG3 ARG A 7 73.799 68.509 -21.019 1.00 32.40 H new ATOM 0 HD2 ARG A 7 74.692 67.501 -23.099 1.00 63.01 H new ATOM 0 HD3 ARG A 7 76.147 68.466 -22.948 1.00 63.01 H new ATOM 0 HE ARG A 7 75.329 66.253 -21.109 1.00 25.45 H new ATOM 0 HH11 ARG A 7 77.770 68.525 -22.309 1.00 42.44 H new ATOM 0 HH12 ARG A 7 79.107 67.678 -21.524 1.00 42.44 H new ATOM 0 HH21 ARG A 7 77.053 65.170 -20.118 1.00 11.13 H new ATOM 0 HH22 ARG A 7 78.701 65.784 -20.287 1.00 11.13 H new ATOM 107 N ALA A 8 75.401 71.536 -20.111 1.00 14.21 N ATOM 108 CA ALA A 8 76.622 72.048 -19.528 1.00 74.33 C ATOM 109 C ALA A 8 77.829 71.627 -20.362 1.00 33.45 C ATOM 110 O ALA A 8 77.786 70.616 -21.065 1.00 14.00 O ATOM 111 CB ALA A 8 76.769 71.561 -18.098 1.00 74.22 C ATOM 0 H ALA A 8 74.969 70.776 -19.586 1.00 14.21 H new ATOM 0 HA ALA A 8 76.572 73.137 -19.520 1.00 74.33 H new ATOM 0 HB1 ALA A 8 77.692 71.954 -17.673 1.00 74.22 H new ATOM 0 HB2 ALA A 8 75.921 71.907 -17.507 1.00 74.22 H new ATOM 0 HB3 ALA A 8 76.799 70.471 -18.086 1.00 74.22 H new ATOM 117 N THR A 9 78.893 72.403 -20.289 1.00 71.00 N ATOM 118 CA THR A 9 80.094 72.106 -21.042 1.00 12.34 C ATOM 119 C THR A 9 81.059 71.254 -20.211 1.00 10.22 C ATOM 120 O THR A 9 80.995 71.247 -18.975 1.00 21.35 O ATOM 121 CB THR A 9 80.805 73.403 -21.525 1.00 71.30 C ATOM 122 OG1 THR A 9 81.922 73.073 -22.364 1.00 55.32 O ATOM 123 CG2 THR A 9 81.287 74.242 -20.346 1.00 31.21 C ATOM 0 H THR A 9 78.949 73.244 -19.715 1.00 71.00 H new ATOM 0 HA THR A 9 79.792 71.540 -21.923 1.00 12.34 H new ATOM 0 HB THR A 9 80.080 73.987 -22.092 1.00 71.30 H new ATOM 0 HG1 THR A 9 82.361 73.897 -22.663 1.00 55.32 H new ATOM 0 HG21 THR A 9 81.779 75.141 -20.716 1.00 31.21 H new ATOM 0 HG22 THR A 9 80.435 74.524 -19.727 1.00 31.21 H new ATOM 0 HG23 THR A 9 81.992 73.662 -19.750 1.00 31.21 H new ATOM 131 N GLY A 10 81.931 70.534 -20.891 1.00 31.01 N ATOM 132 CA GLY A 10 82.895 69.695 -20.224 1.00 4.32 C ATOM 133 C GLY A 10 83.609 68.793 -21.204 1.00 62.34 C ATOM 134 O GLY A 10 83.386 68.904 -22.414 1.00 15.24 O ATOM 0 H GLY A 10 81.988 70.517 -21.909 1.00 31.01 H new ATOM 0 HA2 GLY A 10 83.622 70.317 -19.702 1.00 4.32 H new ATOM 0 HA3 GLY A 10 82.393 69.090 -19.469 1.00 4.32 H new ATOM 138 N PRO A 11 84.489 67.907 -20.726 1.00 20.04 N ATOM 139 CA PRO A 11 85.205 66.964 -21.585 1.00 15.21 C ATOM 140 C PRO A 11 84.268 65.901 -22.126 1.00 75.12 C ATOM 141 O PRO A 11 83.304 65.519 -21.462 1.00 51.51 O ATOM 142 CB PRO A 11 86.251 66.327 -20.649 1.00 42.13 C ATOM 143 CG PRO A 11 86.239 67.166 -19.411 1.00 53.00 C ATOM 144 CD PRO A 11 84.865 67.752 -19.319 1.00 1.12 C ATOM 0 HA PRO A 11 85.649 67.451 -22.453 1.00 15.21 H new ATOM 0 HB2 PRO A 11 85.998 65.291 -20.424 1.00 42.13 H new ATOM 0 HB3 PRO A 11 87.239 66.321 -21.110 1.00 42.13 H new ATOM 0 HG2 PRO A 11 86.466 66.565 -18.531 1.00 53.00 H new ATOM 0 HG3 PRO A 11 86.994 67.950 -19.464 1.00 53.00 H new ATOM 0 HD2 PRO A 11 84.179 67.094 -18.786 1.00 1.12 H new ATOM 0 HD3 PRO A 11 84.866 68.706 -18.792 1.00 1.12 H new ATOM 152 N ALA A 12 84.536 65.441 -23.326 1.00 63.13 N ATOM 153 CA ALA A 12 83.713 64.428 -23.949 1.00 14.10 C ATOM 154 C ALA A 12 83.927 63.082 -23.276 1.00 44.02 C ATOM 155 O ALA A 12 85.051 62.575 -23.230 1.00 35.31 O ATOM 156 CB ALA A 12 84.023 64.339 -25.431 1.00 3.04 C ATOM 0 H ALA A 12 85.323 65.754 -23.894 1.00 63.13 H new ATOM 0 HA ALA A 12 82.666 64.707 -23.830 1.00 14.10 H new ATOM 0 HB1 ALA A 12 83.397 63.573 -25.888 1.00 3.04 H new ATOM 0 HB2 ALA A 12 83.823 65.301 -25.903 1.00 3.04 H new ATOM 0 HB3 ALA A 12 85.073 64.079 -25.568 1.00 3.04 H new ATOM 162 N LEU A 13 82.861 62.512 -22.747 1.00 43.34 N ATOM 163 CA LEU A 13 82.949 61.234 -22.067 1.00 11.54 C ATOM 164 C LEU A 13 82.979 60.101 -23.075 1.00 22.23 C ATOM 165 O LEU A 13 82.079 59.972 -23.910 1.00 42.44 O ATOM 166 CB LEU A 13 81.777 61.031 -21.085 1.00 32.23 C ATOM 167 CG LEU A 13 81.747 61.937 -19.841 1.00 61.51 C ATOM 168 CD1 LEU A 13 83.108 61.989 -19.168 1.00 41.11 C ATOM 169 CD2 LEU A 13 81.250 63.335 -20.182 1.00 34.51 C ATOM 0 H LEU A 13 81.924 62.914 -22.775 1.00 43.34 H new ATOM 0 HA LEU A 13 83.875 61.231 -21.492 1.00 11.54 H new ATOM 0 HB2 LEU A 13 80.846 61.176 -21.633 1.00 32.23 H new ATOM 0 HB3 LEU A 13 81.791 59.994 -20.749 1.00 32.23 H new ATOM 0 HG LEU A 13 81.041 61.501 -19.135 1.00 61.51 H new ATOM 0 HD11 LEU A 13 83.056 62.636 -18.293 1.00 41.11 H new ATOM 0 HD12 LEU A 13 83.400 60.985 -18.860 1.00 41.11 H new ATOM 0 HD13 LEU A 13 83.845 62.383 -19.868 1.00 41.11 H new ATOM 0 HD21 LEU A 13 81.242 63.948 -19.281 1.00 34.51 H new ATOM 0 HD22 LEU A 13 81.912 63.786 -20.921 1.00 34.51 H new ATOM 0 HD23 LEU A 13 80.240 63.273 -20.588 1.00 34.51 H new ATOM 181 N THR A 14 84.001 59.280 -22.985 1.00 4.22 N ATOM 182 CA THR A 14 84.164 58.168 -23.892 1.00 34.24 C ATOM 183 C THR A 14 83.300 56.988 -23.447 1.00 72.32 C ATOM 184 O THR A 14 83.397 56.531 -22.306 1.00 15.51 O ATOM 185 CB THR A 14 85.646 57.733 -23.962 1.00 42.04 C ATOM 186 OG1 THR A 14 86.454 58.853 -24.353 1.00 64.34 O ATOM 187 CG2 THR A 14 85.840 56.599 -24.963 1.00 73.15 C ATOM 0 H THR A 14 84.738 59.364 -22.285 1.00 4.22 H new ATOM 0 HA THR A 14 83.846 58.489 -24.884 1.00 34.24 H new ATOM 0 HB THR A 14 85.946 57.378 -22.976 1.00 42.04 H new ATOM 0 HG1 THR A 14 87.394 58.579 -24.396 1.00 64.34 H new ATOM 0 HG21 THR A 14 86.892 56.314 -24.991 1.00 73.15 H new ATOM 0 HG22 THR A 14 85.239 55.741 -24.661 1.00 73.15 H new ATOM 0 HG23 THR A 14 85.528 56.930 -25.953 1.00 73.15 H new ATOM 195 N PRO A 15 82.421 56.506 -24.340 1.00 1.13 N ATOM 196 CA PRO A 15 81.531 55.380 -24.049 1.00 0.31 C ATOM 197 C PRO A 15 82.287 54.057 -23.983 1.00 65.22 C ATOM 198 O PRO A 15 83.497 54.006 -24.230 1.00 72.31 O ATOM 199 CB PRO A 15 80.564 55.381 -25.232 1.00 35.24 C ATOM 200 CG PRO A 15 81.332 55.998 -26.344 1.00 34.12 C ATOM 201 CD PRO A 15 82.228 57.022 -25.710 1.00 74.40 C ATOM 0 HA PRO A 15 81.041 55.482 -23.081 1.00 0.31 H new ATOM 0 HB2 PRO A 15 80.245 54.370 -25.484 1.00 35.24 H new ATOM 0 HB3 PRO A 15 79.663 55.953 -25.007 1.00 35.24 H new ATOM 0 HG2 PRO A 15 81.914 55.248 -26.879 1.00 34.12 H new ATOM 0 HG3 PRO A 15 80.664 56.461 -27.070 1.00 34.12 H new ATOM 0 HD2 PRO A 15 83.175 57.112 -26.242 1.00 74.40 H new ATOM 0 HD3 PRO A 15 81.769 58.011 -25.706 1.00 74.40 H new ATOM 209 N LEU A 16 81.574 52.993 -23.664 1.00 64.22 N ATOM 210 CA LEU A 16 82.176 51.678 -23.555 1.00 2.10 C ATOM 211 C LEU A 16 81.115 50.601 -23.681 1.00 63.04 C ATOM 212 O LEU A 16 79.914 50.889 -23.654 1.00 34.20 O ATOM 213 CB LEU A 16 82.926 51.511 -22.214 1.00 21.53 C ATOM 214 CG LEU A 16 82.057 51.441 -20.941 1.00 41.41 C ATOM 215 CD1 LEU A 16 82.869 50.897 -19.780 1.00 3.34 C ATOM 216 CD2 LEU A 16 81.495 52.811 -20.583 1.00 61.51 C ATOM 0 H LEU A 16 80.572 53.015 -23.475 1.00 64.22 H new ATOM 0 HA LEU A 16 82.896 51.576 -24.367 1.00 2.10 H new ATOM 0 HB2 LEU A 16 83.524 50.601 -22.269 1.00 21.53 H new ATOM 0 HB3 LEU A 16 83.621 52.343 -22.107 1.00 21.53 H new ATOM 0 HG LEU A 16 81.222 50.770 -21.141 1.00 41.41 H new ATOM 0 HD11 LEU A 16 82.244 50.853 -18.888 1.00 3.34 H new ATOM 0 HD12 LEU A 16 83.226 49.896 -20.023 1.00 3.34 H new ATOM 0 HD13 LEU A 16 83.721 51.551 -19.594 1.00 3.34 H new ATOM 0 HD21 LEU A 16 80.887 52.731 -19.682 1.00 61.51 H new ATOM 0 HD22 LEU A 16 82.316 53.506 -20.406 1.00 61.51 H new ATOM 0 HD23 LEU A 16 80.880 53.178 -21.404 1.00 61.51 H new ATOM 228 N VAL A 17 81.559 49.370 -23.811 1.00 61.33 N ATOM 229 CA VAL A 17 80.671 48.236 -23.932 1.00 65.24 C ATOM 230 C VAL A 17 81.348 46.999 -23.341 1.00 34.33 C ATOM 231 O VAL A 17 82.573 46.867 -23.401 1.00 50.14 O ATOM 232 CB VAL A 17 80.282 47.986 -25.421 1.00 41.22 C ATOM 233 CG1 VAL A 17 81.511 47.704 -26.273 1.00 54.15 C ATOM 234 CG2 VAL A 17 79.264 46.861 -25.547 1.00 2.53 C ATOM 0 H VAL A 17 82.549 49.127 -23.836 1.00 61.33 H new ATOM 0 HA VAL A 17 79.754 48.446 -23.382 1.00 65.24 H new ATOM 0 HB VAL A 17 79.818 48.899 -25.794 1.00 41.22 H new ATOM 0 HG11 VAL A 17 81.207 47.534 -27.306 1.00 54.15 H new ATOM 0 HG12 VAL A 17 82.187 48.558 -26.230 1.00 54.15 H new ATOM 0 HG13 VAL A 17 82.021 46.818 -25.894 1.00 54.15 H new ATOM 0 HG21 VAL A 17 79.014 46.712 -26.598 1.00 2.53 H new ATOM 0 HG22 VAL A 17 79.686 45.942 -25.141 1.00 2.53 H new ATOM 0 HG23 VAL A 17 78.362 47.123 -24.993 1.00 2.53 H new ATOM 244 N VAL A 18 80.568 46.110 -22.763 1.00 62.10 N ATOM 245 CA VAL A 18 81.114 44.920 -22.148 1.00 21.03 C ATOM 246 C VAL A 18 80.191 43.718 -22.345 1.00 31.52 C ATOM 247 O VAL A 18 79.061 43.682 -21.850 1.00 3.01 O ATOM 248 CB VAL A 18 81.416 45.141 -20.632 1.00 40.32 C ATOM 249 CG1 VAL A 18 80.177 45.611 -19.876 1.00 64.50 C ATOM 250 CG2 VAL A 18 81.987 43.876 -20.003 1.00 2.32 C ATOM 0 H VAL A 18 79.553 46.190 -22.706 1.00 62.10 H new ATOM 0 HA VAL A 18 82.059 44.707 -22.648 1.00 21.03 H new ATOM 0 HB VAL A 18 82.165 45.929 -20.558 1.00 40.32 H new ATOM 0 HG11 VAL A 18 80.425 45.754 -18.824 1.00 64.50 H new ATOM 0 HG12 VAL A 18 79.829 46.554 -20.298 1.00 64.50 H new ATOM 0 HG13 VAL A 18 79.391 44.861 -19.964 1.00 64.50 H new ATOM 0 HG21 VAL A 18 82.189 44.054 -18.947 1.00 2.32 H new ATOM 0 HG22 VAL A 18 81.267 43.063 -20.102 1.00 2.32 H new ATOM 0 HG23 VAL A 18 82.913 43.604 -20.509 1.00 2.32 H new ATOM 260 N ALA A 19 80.673 42.756 -23.111 1.00 42.42 N ATOM 261 CA ALA A 19 79.941 41.531 -23.370 1.00 52.52 C ATOM 262 C ALA A 19 79.952 40.622 -22.138 1.00 61.53 C ATOM 263 O ALA A 19 80.542 40.963 -21.108 1.00 33.10 O ATOM 264 CB ALA A 19 80.537 40.814 -24.573 1.00 31.54 C ATOM 0 H ALA A 19 81.582 42.803 -23.570 1.00 42.42 H new ATOM 0 HA ALA A 19 78.904 41.784 -23.591 1.00 52.52 H new ATOM 0 HB1 ALA A 19 79.982 39.895 -24.761 1.00 31.54 H new ATOM 0 HB2 ALA A 19 80.476 41.460 -25.449 1.00 31.54 H new ATOM 0 HB3 ALA A 19 81.581 40.572 -24.372 1.00 31.54 H new ATOM 270 N ALA A 20 79.325 39.458 -22.252 1.00 64.03 N ATOM 271 CA ALA A 20 79.255 38.516 -21.144 1.00 51.33 C ATOM 272 C ALA A 20 78.861 37.129 -21.628 1.00 24.25 C ATOM 273 O ALA A 20 77.773 36.937 -22.180 1.00 65.04 O ATOM 274 CB ALA A 20 78.263 39.004 -20.095 1.00 65.04 C ATOM 0 H ALA A 20 78.857 39.144 -23.102 1.00 64.03 H new ATOM 0 HA ALA A 20 80.246 38.452 -20.695 1.00 51.33 H new ATOM 0 HB1 ALA A 20 78.222 38.289 -19.273 1.00 65.04 H new ATOM 0 HB2 ALA A 20 78.582 39.975 -19.716 1.00 65.04 H new ATOM 0 HB3 ALA A 20 77.274 39.097 -20.545 1.00 65.04 H new ATOM 280 N ALA A 21 79.756 36.170 -21.435 1.00 44.40 N ATOM 281 CA ALA A 21 79.504 34.790 -21.824 1.00 11.23 C ATOM 282 C ALA A 21 78.473 34.145 -20.899 1.00 24.14 C ATOM 283 O ALA A 21 78.215 34.647 -19.798 1.00 1.52 O ATOM 284 CB ALA A 21 80.800 33.993 -21.811 1.00 10.21 C ATOM 0 H ALA A 21 80.669 36.325 -21.008 1.00 44.40 H new ATOM 0 HA ALA A 21 79.101 34.788 -22.837 1.00 11.23 H new ATOM 0 HB1 ALA A 21 80.597 32.963 -22.104 1.00 10.21 H new ATOM 0 HB2 ALA A 21 81.507 34.437 -22.512 1.00 10.21 H new ATOM 0 HB3 ALA A 21 81.226 34.008 -20.808 1.00 10.21 H new ATOM 290 N ALA A 22 77.899 33.033 -21.338 1.00 1.43 N ATOM 291 CA ALA A 22 76.888 32.330 -20.561 1.00 21.15 C ATOM 292 C ALA A 22 76.673 30.928 -21.110 1.00 21.20 C ATOM 293 O ALA A 22 77.229 30.570 -22.147 1.00 23.31 O ATOM 294 CB ALA A 22 75.578 33.106 -20.581 1.00 71.23 C ATOM 0 H ALA A 22 78.118 32.597 -22.233 1.00 1.43 H new ATOM 0 HA ALA A 22 77.237 32.250 -19.531 1.00 21.15 H new ATOM 0 HB1 ALA A 22 74.829 32.571 -19.997 1.00 71.23 H new ATOM 0 HB2 ALA A 22 75.735 34.095 -20.151 1.00 71.23 H new ATOM 0 HB3 ALA A 22 75.231 33.208 -21.609 1.00 71.23 H new ATOM 300 N THR A 23 75.862 30.144 -20.424 1.00 12.43 N ATOM 301 CA THR A 23 75.577 28.787 -20.843 1.00 73.22 C ATOM 302 C THR A 23 74.209 28.349 -20.314 1.00 60.14 C ATOM 303 O THR A 23 73.634 29.014 -19.450 1.00 45.43 O ATOM 304 CB THR A 23 76.683 27.804 -20.363 1.00 31.23 C ATOM 305 OG1 THR A 23 76.441 26.489 -20.879 1.00 34.13 O ATOM 306 CG2 THR A 23 76.744 27.748 -18.846 1.00 34.12 C ATOM 0 H THR A 23 75.386 30.428 -19.568 1.00 12.43 H new ATOM 0 HA THR A 23 75.561 28.765 -21.933 1.00 73.22 H new ATOM 0 HB THR A 23 77.638 28.171 -20.738 1.00 31.23 H new ATOM 0 HG1 THR A 23 77.146 25.882 -20.570 1.00 34.13 H new ATOM 0 HG21 THR A 23 77.526 27.053 -18.539 1.00 34.12 H new ATOM 0 HG22 THR A 23 76.966 28.741 -18.454 1.00 34.12 H new ATOM 0 HG23 THR A 23 75.784 27.410 -18.455 1.00 34.12 H new ATOM 314 N SER A 24 73.687 27.261 -20.851 1.00 52.15 N ATOM 315 CA SER A 24 72.388 26.747 -20.448 1.00 74.41 C ATOM 316 C SER A 24 72.456 26.080 -19.070 1.00 72.13 C ATOM 317 O SER A 24 73.549 25.805 -18.550 1.00 22.44 O ATOM 318 CB SER A 24 71.879 25.756 -21.491 1.00 65.54 C ATOM 319 OG SER A 24 71.843 26.354 -22.779 1.00 52.11 O ATOM 0 H SER A 24 74.148 26.710 -21.575 1.00 52.15 H new ATOM 0 HA SER A 24 71.695 27.585 -20.378 1.00 74.41 H new ATOM 0 HB2 SER A 24 72.525 24.878 -21.511 1.00 65.54 H new ATOM 0 HB3 SER A 24 70.882 25.412 -21.217 1.00 65.54 H new ATOM 0 HG SER A 24 71.516 25.702 -23.433 1.00 52.11 H new ATOM 325 N ALA A 25 71.291 25.816 -18.493 1.00 50.23 N ATOM 326 CA ALA A 25 71.190 25.180 -17.188 1.00 30.44 C ATOM 327 C ALA A 25 69.763 24.747 -16.935 1.00 33.52 C ATOM 328 O ALA A 25 68.825 25.475 -17.260 1.00 1.54 O ATOM 329 CB ALA A 25 71.642 26.134 -16.090 1.00 64.43 C ATOM 0 H ALA A 25 70.390 26.037 -18.917 1.00 50.23 H new ATOM 0 HA ALA A 25 71.840 24.305 -17.178 1.00 30.44 H new ATOM 0 HB1 ALA A 25 71.559 25.640 -15.122 1.00 64.43 H new ATOM 0 HB2 ALA A 25 72.679 26.422 -16.263 1.00 64.43 H new ATOM 0 HB3 ALA A 25 71.012 27.023 -16.099 1.00 64.43 H new ATOM 335 N LYS A 26 69.591 23.564 -16.373 1.00 14.31 N ATOM 336 CA LYS A 26 68.262 23.064 -16.075 1.00 33.12 C ATOM 337 C LYS A 26 68.320 21.937 -15.059 1.00 71.41 C ATOM 338 O LYS A 26 69.399 21.534 -14.618 1.00 30.13 O ATOM 339 CB LYS A 26 67.535 22.573 -17.356 1.00 35.22 C ATOM 340 CG LYS A 26 68.009 21.214 -17.896 1.00 71.05 C ATOM 341 CD LYS A 26 69.370 21.302 -18.566 1.00 70.44 C ATOM 342 CE LYS A 26 69.861 19.931 -19.023 1.00 70.14 C ATOM 343 NZ LYS A 26 68.909 19.263 -19.954 1.00 65.13 N ATOM 0 H LYS A 26 70.351 22.935 -16.115 1.00 14.31 H new ATOM 0 HA LYS A 26 67.696 23.895 -15.654 1.00 33.12 H new ATOM 0 HB2 LYS A 26 66.467 22.511 -17.147 1.00 35.22 H new ATOM 0 HB3 LYS A 26 67.664 23.322 -18.138 1.00 35.22 H new ATOM 0 HG2 LYS A 26 68.056 20.496 -17.077 1.00 71.05 H new ATOM 0 HG3 LYS A 26 67.279 20.835 -18.611 1.00 71.05 H new ATOM 0 HD2 LYS A 26 69.311 21.972 -19.423 1.00 70.44 H new ATOM 0 HD3 LYS A 26 70.091 21.734 -17.872 1.00 70.44 H new ATOM 0 HE2 LYS A 26 70.828 20.041 -19.515 1.00 70.14 H new ATOM 0 HE3 LYS A 26 70.017 19.296 -18.151 1.00 70.14 H new ATOM 0 HZ1 LYS A 26 69.371 18.440 -20.391 1.00 65.13 H new ATOM 0 HZ2 LYS A 26 68.070 18.949 -19.426 1.00 65.13 H new ATOM 0 HZ3 LYS A 26 68.621 19.933 -20.696 1.00 65.13 H new ATOM 357 N VAL A 27 67.163 21.442 -14.703 1.00 30.14 N ATOM 358 CA VAL A 27 67.036 20.322 -13.810 1.00 63.43 C ATOM 359 C VAL A 27 65.822 19.515 -14.232 1.00 24.42 C ATOM 360 O VAL A 27 64.757 20.080 -14.512 1.00 25.51 O ATOM 361 CB VAL A 27 66.917 20.763 -12.317 1.00 12.41 C ATOM 362 CG1 VAL A 27 65.682 21.624 -12.078 1.00 54.12 C ATOM 363 CG2 VAL A 27 66.923 19.553 -11.390 1.00 55.43 C ATOM 0 H VAL A 27 66.270 21.812 -15.030 1.00 30.14 H new ATOM 0 HA VAL A 27 67.939 19.715 -13.876 1.00 63.43 H new ATOM 0 HB VAL A 27 67.790 21.374 -12.088 1.00 12.41 H new ATOM 0 HG11 VAL A 27 65.636 21.910 -11.027 1.00 54.12 H new ATOM 0 HG12 VAL A 27 65.738 22.520 -12.696 1.00 54.12 H new ATOM 0 HG13 VAL A 27 64.788 21.058 -12.340 1.00 54.12 H new ATOM 0 HG21 VAL A 27 66.839 19.887 -10.356 1.00 55.43 H new ATOM 0 HG22 VAL A 27 66.080 18.905 -11.632 1.00 55.43 H new ATOM 0 HG23 VAL A 27 67.854 19.001 -11.519 1.00 55.43 H new ATOM 373 N GLU A 28 65.982 18.215 -14.315 1.00 61.53 N ATOM 374 CA GLU A 28 64.917 17.351 -14.790 1.00 62.32 C ATOM 375 C GLU A 28 65.033 15.964 -14.176 1.00 64.22 C ATOM 376 O GLU A 28 64.581 14.975 -14.754 1.00 2.02 O ATOM 377 CB GLU A 28 64.981 17.266 -16.321 1.00 33.25 C ATOM 378 CG GLU A 28 66.353 16.870 -16.854 1.00 51.42 C ATOM 379 CD GLU A 28 66.439 16.933 -18.360 1.00 64.30 C ATOM 380 OE1 GLU A 28 66.103 15.929 -19.020 1.00 11.32 O ATOM 381 OE2 GLU A 28 66.858 17.985 -18.892 1.00 14.45 O ATOM 0 H GLU A 28 66.841 17.727 -14.060 1.00 61.53 H new ATOM 0 HA GLU A 28 63.957 17.770 -14.489 1.00 62.32 H new ATOM 0 HB2 GLU A 28 64.243 16.542 -16.667 1.00 33.25 H new ATOM 0 HB3 GLU A 28 64.702 18.232 -16.742 1.00 33.25 H new ATOM 0 HG2 GLU A 28 67.108 17.528 -16.424 1.00 51.42 H new ATOM 0 HG3 GLU A 28 66.587 15.858 -16.524 1.00 51.42 H new ATOM 388 N VAL A 29 65.617 15.904 -12.989 1.00 0.21 N ATOM 389 CA VAL A 29 65.802 14.645 -12.291 1.00 24.21 C ATOM 390 C VAL A 29 65.334 14.755 -10.848 1.00 52.20 C ATOM 391 O VAL A 29 65.204 15.858 -10.308 1.00 62.30 O ATOM 392 CB VAL A 29 67.280 14.180 -12.315 1.00 75.21 C ATOM 393 CG1 VAL A 29 67.725 13.873 -13.736 1.00 31.25 C ATOM 394 CG2 VAL A 29 68.188 15.226 -11.682 1.00 13.15 C ATOM 0 H VAL A 29 65.972 16.719 -12.488 1.00 0.21 H new ATOM 0 HA VAL A 29 65.200 13.903 -12.816 1.00 24.21 H new ATOM 0 HB VAL A 29 67.356 13.265 -11.728 1.00 75.21 H new ATOM 0 HG11 VAL A 29 68.766 13.548 -13.729 1.00 31.25 H new ATOM 0 HG12 VAL A 29 67.101 13.081 -14.150 1.00 31.25 H new ATOM 0 HG13 VAL A 29 67.628 14.769 -14.349 1.00 31.25 H new ATOM 0 HG21 VAL A 29 69.220 14.877 -11.711 1.00 13.15 H new ATOM 0 HG22 VAL A 29 68.106 16.162 -12.235 1.00 13.15 H new ATOM 0 HG23 VAL A 29 67.889 15.389 -10.647 1.00 13.15 H new ATOM 404 N ASP A 30 65.098 13.613 -10.231 1.00 33.12 N ATOM 405 CA ASP A 30 64.633 13.544 -8.851 1.00 22.24 C ATOM 406 C ASP A 30 64.976 12.181 -8.268 1.00 54.51 C ATOM 407 O ASP A 30 65.702 11.403 -8.892 1.00 42.25 O ATOM 408 CB ASP A 30 63.110 13.794 -8.769 1.00 10.13 C ATOM 409 CG ASP A 30 62.286 12.721 -9.463 1.00 70.15 C ATOM 410 OD1 ASP A 30 62.278 12.681 -10.711 1.00 41.03 O ATOM 411 OD2 ASP A 30 61.642 11.915 -8.766 1.00 73.41 O ATOM 0 H ASP A 30 65.223 12.701 -10.671 1.00 33.12 H new ATOM 0 HA ASP A 30 65.132 14.322 -8.273 1.00 22.24 H new ATOM 0 HB2 ASP A 30 62.814 13.849 -7.721 1.00 10.13 H new ATOM 0 HB3 ASP A 30 62.883 14.762 -9.216 1.00 10.13 H new ATOM 416 N SER A 31 64.462 11.887 -7.092 1.00 74.31 N ATOM 417 CA SER A 31 64.746 10.624 -6.437 1.00 10.32 C ATOM 418 C SER A 31 63.896 9.496 -7.032 1.00 35.32 C ATOM 419 O SER A 31 62.757 9.718 -7.446 1.00 44.51 O ATOM 420 CB SER A 31 64.471 10.745 -4.938 1.00 73.12 C ATOM 421 OG SER A 31 65.160 11.856 -4.385 1.00 54.51 O ATOM 0 H SER A 31 63.844 12.506 -6.568 1.00 74.31 H new ATOM 0 HA SER A 31 65.797 10.383 -6.596 1.00 10.32 H new ATOM 0 HB2 SER A 31 63.400 10.855 -4.768 1.00 73.12 H new ATOM 0 HB3 SER A 31 64.782 9.831 -4.432 1.00 73.12 H new ATOM 0 HG SER A 31 64.968 11.915 -3.426 1.00 54.51 H new ATOM 427 N PRO A 32 64.450 8.273 -7.100 1.00 52.51 N ATOM 428 CA PRO A 32 63.727 7.099 -7.612 1.00 62.42 C ATOM 429 C PRO A 32 62.520 6.760 -6.727 1.00 54.34 C ATOM 430 O PRO A 32 62.413 7.268 -5.605 1.00 52.05 O ATOM 431 CB PRO A 32 64.778 5.977 -7.544 1.00 2.24 C ATOM 432 CG PRO A 32 65.775 6.450 -6.546 1.00 51.11 C ATOM 433 CD PRO A 32 65.821 7.940 -6.689 1.00 20.14 C ATOM 0 HA PRO A 32 63.326 7.256 -8.613 1.00 62.42 H new ATOM 0 HB2 PRO A 32 64.329 5.032 -7.237 1.00 2.24 H new ATOM 0 HB3 PRO A 32 65.241 5.809 -8.516 1.00 2.24 H new ATOM 0 HG2 PRO A 32 65.483 6.163 -5.536 1.00 51.11 H new ATOM 0 HG3 PRO A 32 66.754 6.009 -6.732 1.00 51.11 H new ATOM 0 HD2 PRO A 32 66.092 8.428 -5.752 1.00 20.14 H new ATOM 0 HD3 PRO A 32 66.553 8.252 -7.434 1.00 20.14 H new ATOM 441 N PRO A 33 61.592 5.907 -7.221 1.00 3.01 N ATOM 442 CA PRO A 33 60.391 5.514 -6.467 1.00 4.03 C ATOM 443 C PRO A 33 60.722 5.061 -5.050 1.00 50.13 C ATOM 444 O PRO A 33 61.399 4.051 -4.855 1.00 72.33 O ATOM 445 CB PRO A 33 59.841 4.340 -7.278 1.00 41.33 C ATOM 446 CG PRO A 33 60.292 4.606 -8.667 1.00 64.04 C ATOM 447 CD PRO A 33 61.641 5.263 -8.550 1.00 1.34 C ATOM 0 HA PRO A 33 59.692 6.342 -6.350 1.00 4.03 H new ATOM 0 HB2 PRO A 33 60.226 3.389 -6.911 1.00 41.33 H new ATOM 0 HB3 PRO A 33 58.754 4.289 -7.216 1.00 41.33 H new ATOM 0 HG2 PRO A 33 60.358 3.681 -9.239 1.00 64.04 H new ATOM 0 HG3 PRO A 33 59.587 5.254 -9.188 1.00 64.04 H new ATOM 0 HD2 PRO A 33 62.450 4.535 -8.615 1.00 1.34 H new ATOM 0 HD3 PRO A 33 61.804 5.992 -9.344 1.00 1.34 H new ATOM 455 N ALA A 34 60.266 5.825 -4.071 1.00 34.14 N ATOM 456 CA ALA A 34 60.511 5.505 -2.679 1.00 35.43 C ATOM 457 C ALA A 34 59.673 4.313 -2.248 1.00 44.33 C ATOM 458 O ALA A 34 58.450 4.322 -2.403 1.00 20.31 O ATOM 459 CB ALA A 34 60.211 6.707 -1.800 1.00 54.23 C ATOM 0 H ALA A 34 59.722 6.675 -4.218 1.00 34.14 H new ATOM 0 HA ALA A 34 61.563 5.244 -2.566 1.00 35.43 H new ATOM 0 HB1 ALA A 34 60.400 6.451 -0.757 1.00 54.23 H new ATOM 0 HB2 ALA A 34 60.851 7.540 -2.091 1.00 54.23 H new ATOM 0 HB3 ALA A 34 59.166 6.994 -1.920 1.00 54.23 H new ATOM 465 N PRO A 35 60.318 3.259 -1.725 1.00 31.31 N ATOM 466 CA PRO A 35 59.617 2.069 -1.248 1.00 3.41 C ATOM 467 C PRO A 35 58.645 2.403 -0.121 1.00 2.05 C ATOM 468 O PRO A 35 59.057 2.749 0.990 1.00 73.54 O ATOM 469 CB PRO A 35 60.743 1.162 -0.726 1.00 21.14 C ATOM 470 CG PRO A 35 61.980 1.668 -1.380 1.00 73.12 C ATOM 471 CD PRO A 35 61.777 3.140 -1.566 1.00 73.34 C ATOM 0 HA PRO A 35 59.017 1.607 -2.032 1.00 3.41 H new ATOM 0 HB2 PRO A 35 60.821 1.215 0.360 1.00 21.14 H new ATOM 0 HB3 PRO A 35 60.560 0.118 -0.982 1.00 21.14 H new ATOM 0 HG2 PRO A 35 62.856 1.470 -0.763 1.00 73.12 H new ATOM 0 HG3 PRO A 35 62.146 1.173 -2.337 1.00 73.12 H new ATOM 0 HD2 PRO A 35 62.137 3.708 -0.708 1.00 73.34 H new ATOM 0 HD3 PRO A 35 62.310 3.513 -2.441 1.00 73.34 H new ATOM 479 N VAL A 36 57.362 2.331 -0.419 1.00 51.14 N ATOM 480 CA VAL A 36 56.333 2.611 0.565 1.00 3.44 C ATOM 481 C VAL A 36 56.012 1.363 1.374 1.00 43.33 C ATOM 482 O VAL A 36 56.125 0.236 0.871 1.00 13.23 O ATOM 483 CB VAL A 36 55.041 3.158 -0.092 1.00 73.32 C ATOM 484 CG1 VAL A 36 55.285 4.539 -0.681 1.00 42.51 C ATOM 485 CG2 VAL A 36 54.528 2.204 -1.166 1.00 63.31 C ATOM 0 H VAL A 36 57.005 2.079 -1.341 1.00 51.14 H new ATOM 0 HA VAL A 36 56.725 3.381 1.230 1.00 3.44 H new ATOM 0 HB VAL A 36 54.278 3.240 0.682 1.00 73.32 H new ATOM 0 HG11 VAL A 36 54.366 4.907 -1.138 1.00 42.51 H new ATOM 0 HG12 VAL A 36 55.596 5.222 0.110 1.00 42.51 H new ATOM 0 HG13 VAL A 36 56.068 4.479 -1.437 1.00 42.51 H new ATOM 0 HG21 VAL A 36 53.620 2.612 -1.611 1.00 63.31 H new ATOM 0 HG22 VAL A 36 55.288 2.083 -1.938 1.00 63.31 H new ATOM 0 HG23 VAL A 36 54.309 1.235 -0.717 1.00 63.31 H new ATOM 495 N THR A 37 55.632 1.555 2.617 1.00 73.00 N ATOM 496 CA THR A 37 55.309 0.448 3.486 1.00 32.14 C ATOM 497 C THR A 37 53.843 0.056 3.354 1.00 71.12 C ATOM 498 O THR A 37 53.503 -1.128 3.370 1.00 12.42 O ATOM 499 CB THR A 37 55.621 0.786 4.954 1.00 51.52 C ATOM 500 OG1 THR A 37 54.995 2.025 5.311 1.00 22.40 O ATOM 501 CG2 THR A 37 57.123 0.894 5.173 1.00 23.55 C ATOM 0 H THR A 37 55.539 2.474 3.050 1.00 73.00 H new ATOM 0 HA THR A 37 55.928 -0.395 3.179 1.00 32.14 H new ATOM 0 HB THR A 37 55.232 -0.015 5.582 1.00 51.52 H new ATOM 0 HG1 THR A 37 55.195 2.235 6.247 1.00 22.40 H new ATOM 0 HG21 THR A 37 57.322 1.134 6.218 1.00 23.55 H new ATOM 0 HG22 THR A 37 57.596 -0.055 4.922 1.00 23.55 H new ATOM 0 HG23 THR A 37 57.528 1.681 4.537 1.00 23.55 H new ATOM 509 N HIS A 38 52.979 1.050 3.216 1.00 40.31 N ATOM 510 CA HIS A 38 51.551 0.801 3.090 1.00 72.22 C ATOM 511 C HIS A 38 50.985 1.473 1.851 1.00 12.41 C ATOM 512 O HIS A 38 51.473 2.516 1.421 1.00 0.53 O ATOM 513 CB HIS A 38 50.787 1.255 4.353 1.00 51.24 C ATOM 514 CG HIS A 38 50.853 2.734 4.641 1.00 70.11 C ATOM 515 ND1 HIS A 38 49.771 3.579 4.510 1.00 62.11 N ATOM 516 CD2 HIS A 38 51.874 3.506 5.079 1.00 32.13 C ATOM 517 CE1 HIS A 38 50.127 4.801 4.852 1.00 14.31 C ATOM 518 NE2 HIS A 38 51.397 4.783 5.202 1.00 41.52 N ATOM 0 H HIS A 38 53.241 2.035 3.188 1.00 40.31 H new ATOM 0 HA HIS A 38 51.416 -0.275 2.985 1.00 72.22 H new ATOM 0 HB2 HIS A 38 49.741 0.967 4.250 1.00 51.24 H new ATOM 0 HB3 HIS A 38 51.183 0.715 5.213 1.00 51.24 H new ATOM 0 HD2 HIS A 38 52.880 3.176 5.292 1.00 32.13 H new ATOM 0 HE1 HIS A 38 49.486 5.670 4.846 1.00 14.31 H new ATOM 0 HE2 HIS A 38 51.937 5.590 5.514 1.00 41.52 H new ATOM 527 N GLY A 39 49.961 0.871 1.285 1.00 64.31 N ATOM 528 CA GLY A 39 49.335 1.419 0.112 1.00 31.32 C ATOM 529 C GLY A 39 47.854 1.607 0.315 1.00 75.52 C ATOM 530 O GLY A 39 47.396 2.721 0.576 1.00 34.41 O ATOM 0 H GLY A 39 49.548 0.002 1.622 1.00 64.31 H new ATOM 0 HA2 GLY A 39 49.794 2.377 -0.133 1.00 31.32 H new ATOM 0 HA3 GLY A 39 49.506 0.757 -0.736 1.00 31.32 H new ATOM 534 N ALA A 40 47.107 0.513 0.220 1.00 20.41 N ATOM 535 CA ALA A 40 45.659 0.549 0.394 1.00 72.44 C ATOM 536 C ALA A 40 45.089 -0.858 0.571 1.00 50.21 C ATOM 537 O ALA A 40 43.888 -1.077 0.406 1.00 1.42 O ATOM 538 CB ALA A 40 45.001 1.233 -0.798 1.00 44.31 C ATOM 0 H ALA A 40 47.482 -0.415 0.022 1.00 20.41 H new ATOM 0 HA ALA A 40 45.443 1.120 1.297 1.00 72.44 H new ATOM 0 HB1 ALA A 40 43.921 1.253 -0.655 1.00 44.31 H new ATOM 0 HB2 ALA A 40 45.375 2.253 -0.884 1.00 44.31 H new ATOM 0 HB3 ALA A 40 45.236 0.683 -1.709 1.00 44.31 H new ATOM 544 N ALA A 41 45.952 -1.809 0.918 1.00 3.14 N ATOM 545 CA ALA A 41 45.526 -3.190 1.119 1.00 35.30 C ATOM 546 C ALA A 41 44.761 -3.343 2.430 1.00 12.15 C ATOM 547 O ALA A 41 43.940 -4.247 2.583 1.00 51.21 O ATOM 548 CB ALA A 41 46.723 -4.128 1.089 1.00 10.22 C ATOM 0 H ALA A 41 46.948 -1.649 1.066 1.00 3.14 H new ATOM 0 HA ALA A 41 44.855 -3.457 0.303 1.00 35.30 H new ATOM 0 HB1 ALA A 41 46.386 -5.153 1.241 1.00 10.22 H new ATOM 0 HB2 ALA A 41 47.223 -4.049 0.123 1.00 10.22 H new ATOM 0 HB3 ALA A 41 47.420 -3.854 1.881 1.00 10.22 H new ATOM 554 N MET A 42 45.022 -2.445 3.360 1.00 25.13 N ATOM 555 CA MET A 42 44.380 -2.467 4.664 1.00 55.33 C ATOM 556 C MET A 42 44.354 -1.053 5.236 1.00 10.44 C ATOM 557 O MET A 42 45.105 -0.195 4.770 1.00 44.53 O ATOM 558 CB MET A 42 45.135 -3.419 5.614 1.00 14.33 C ATOM 559 CG MET A 42 46.571 -3.003 5.902 1.00 50.42 C ATOM 560 SD MET A 42 47.420 -4.150 7.002 1.00 5.21 S ATOM 561 CE MET A 42 49.012 -3.347 7.160 1.00 10.42 C ATOM 0 H MET A 42 45.684 -1.679 3.235 1.00 25.13 H new ATOM 0 HA MET A 42 43.358 -2.830 4.559 1.00 55.33 H new ATOM 0 HB2 MET A 42 44.591 -3.481 6.556 1.00 14.33 H new ATOM 0 HB3 MET A 42 45.138 -4.419 5.181 1.00 14.33 H new ATOM 0 HG2 MET A 42 47.120 -2.933 4.963 1.00 50.42 H new ATOM 0 HG3 MET A 42 46.574 -2.008 6.348 1.00 50.42 H new ATOM 0 HE1 MET A 42 49.745 -4.063 7.532 1.00 10.42 H new ATOM 0 HE2 MET A 42 49.330 -2.974 6.186 1.00 10.42 H new ATOM 0 HE3 MET A 42 48.932 -2.514 7.859 1.00 10.42 H new ATOM 571 N PRO A 43 43.478 -0.778 6.236 1.00 14.11 N ATOM 572 CA PRO A 43 43.371 0.552 6.860 1.00 24.21 C ATOM 573 C PRO A 43 44.737 1.144 7.214 1.00 63.10 C ATOM 574 O PRO A 43 45.093 2.232 6.746 1.00 21.03 O ATOM 575 CB PRO A 43 42.564 0.273 8.126 1.00 3.01 C ATOM 576 CG PRO A 43 41.695 -0.876 7.758 1.00 62.54 C ATOM 577 CD PRO A 43 42.510 -1.734 6.825 1.00 3.21 C ATOM 0 HA PRO A 43 42.914 1.283 6.194 1.00 24.21 H new ATOM 0 HB2 PRO A 43 43.213 0.028 8.966 1.00 3.01 H new ATOM 0 HB3 PRO A 43 41.974 1.140 8.421 1.00 3.01 H new ATOM 0 HG2 PRO A 43 41.396 -1.438 8.643 1.00 62.54 H new ATOM 0 HG3 PRO A 43 40.780 -0.534 7.274 1.00 62.54 H new ATOM 0 HD2 PRO A 43 43.015 -2.540 7.358 1.00 3.21 H new ATOM 0 HD3 PRO A 43 41.888 -2.199 6.060 1.00 3.21 H new ATOM 585 N THR A 44 45.503 0.410 8.025 1.00 21.43 N ATOM 586 CA THR A 44 46.841 0.831 8.453 1.00 52.04 C ATOM 587 C THR A 44 46.761 2.127 9.297 1.00 42.40 C ATOM 588 O THR A 44 45.672 2.664 9.523 1.00 64.30 O ATOM 589 CB THR A 44 47.773 1.053 7.225 1.00 62.35 C ATOM 590 OG1 THR A 44 47.417 0.141 6.174 1.00 24.04 O ATOM 591 CG2 THR A 44 49.225 0.812 7.597 1.00 65.02 C ATOM 0 H THR A 44 45.214 -0.492 8.404 1.00 21.43 H new ATOM 0 HA THR A 44 47.261 0.035 9.068 1.00 52.04 H new ATOM 0 HB THR A 44 47.652 2.084 6.893 1.00 62.35 H new ATOM 0 HG1 THR A 44 46.594 0.447 5.740 1.00 24.04 H new ATOM 0 HG21 THR A 44 49.856 0.973 6.723 1.00 65.02 H new ATOM 0 HG22 THR A 44 49.517 1.503 8.388 1.00 65.02 H new ATOM 0 HG23 THR A 44 49.346 -0.213 7.947 1.00 65.02 H new ATOM 599 N LEU A 45 47.898 2.602 9.783 1.00 1.33 N ATOM 600 CA LEU A 45 47.934 3.839 10.540 1.00 14.31 C ATOM 601 C LEU A 45 47.807 5.027 9.589 1.00 64.10 C ATOM 602 O LEU A 45 48.204 4.933 8.421 1.00 11.44 O ATOM 603 CB LEU A 45 49.239 3.935 11.345 1.00 31.42 C ATOM 604 CG LEU A 45 49.404 5.180 12.220 1.00 10.32 C ATOM 605 CD1 LEU A 45 48.319 5.238 13.280 1.00 32.23 C ATOM 606 CD2 LEU A 45 50.779 5.202 12.862 1.00 1.43 C ATOM 0 H LEU A 45 48.804 2.149 9.666 1.00 1.33 H new ATOM 0 HA LEU A 45 47.098 3.853 11.240 1.00 14.31 H new ATOM 0 HB2 LEU A 45 49.313 3.055 11.984 1.00 31.42 H new ATOM 0 HB3 LEU A 45 50.076 3.893 10.647 1.00 31.42 H new ATOM 0 HG LEU A 45 49.307 6.060 11.584 1.00 10.32 H new ATOM 0 HD11 LEU A 45 48.455 6.130 13.891 1.00 32.23 H new ATOM 0 HD12 LEU A 45 47.342 5.273 12.799 1.00 32.23 H new ATOM 0 HD13 LEU A 45 48.381 4.352 13.913 1.00 32.23 H new ATOM 0 HD21 LEU A 45 50.878 6.094 13.480 1.00 1.43 H new ATOM 0 HD22 LEU A 45 50.905 4.315 13.483 1.00 1.43 H new ATOM 0 HD23 LEU A 45 51.543 5.213 12.085 1.00 1.43 H new ATOM 618 N SER A 46 47.240 6.130 10.093 1.00 54.11 N ATOM 619 CA SER A 46 47.016 7.344 9.307 1.00 72.40 C ATOM 620 C SER A 46 45.887 7.108 8.300 1.00 53.01 C ATOM 621 O SER A 46 45.154 6.120 8.414 1.00 3.54 O ATOM 622 CB SER A 46 48.313 7.800 8.598 1.00 2.14 C ATOM 623 OG SER A 46 48.183 9.114 8.061 1.00 44.30 O ATOM 0 H SER A 46 46.924 6.203 11.060 1.00 54.11 H new ATOM 0 HA SER A 46 46.720 8.147 9.982 1.00 72.40 H new ATOM 0 HB2 SER A 46 49.143 7.775 9.305 1.00 2.14 H new ATOM 0 HB3 SER A 46 48.556 7.101 7.797 1.00 2.14 H new ATOM 0 HG SER A 46 47.544 9.626 8.600 1.00 44.30 H new ATOM 629 N SER A 47 45.743 8.023 7.338 1.00 73.42 N ATOM 630 CA SER A 47 44.709 7.940 6.304 1.00 32.34 C ATOM 631 C SER A 47 43.312 8.132 6.908 1.00 75.53 C ATOM 632 O SER A 47 42.830 7.295 7.680 1.00 53.44 O ATOM 633 CB SER A 47 44.800 6.603 5.548 1.00 70.53 C ATOM 634 OG SER A 47 46.116 6.392 5.045 1.00 10.33 O ATOM 0 H SER A 47 46.342 8.844 7.254 1.00 73.42 H new ATOM 0 HA SER A 47 44.880 8.746 5.590 1.00 32.34 H new ATOM 0 HB2 SER A 47 44.525 5.785 6.214 1.00 70.53 H new ATOM 0 HB3 SER A 47 44.086 6.597 4.724 1.00 70.53 H new ATOM 0 HG SER A 47 46.151 5.536 4.570 1.00 10.33 H new ATOM 640 N ALA A 48 42.663 9.223 6.542 1.00 2.52 N ATOM 641 CA ALA A 48 41.350 9.545 7.078 1.00 52.10 C ATOM 642 C ALA A 48 40.624 10.530 6.169 1.00 54.31 C ATOM 643 O ALA A 48 40.984 10.682 4.996 1.00 53.24 O ATOM 644 CB ALA A 48 41.491 10.120 8.485 1.00 31.11 C ATOM 0 H ALA A 48 43.024 9.904 5.874 1.00 2.52 H new ATOM 0 HA ALA A 48 40.758 8.631 7.127 1.00 52.10 H new ATOM 0 HB1 ALA A 48 40.504 10.359 8.881 1.00 31.11 H new ATOM 0 HB2 ALA A 48 41.973 9.386 9.131 1.00 31.11 H new ATOM 0 HB3 ALA A 48 42.097 11.026 8.449 1.00 31.11 H new ATOM 650 N THR A 49 39.604 11.190 6.718 1.00 2.52 N ATOM 651 CA THR A 49 38.783 12.162 5.993 1.00 21.23 C ATOM 652 C THR A 49 37.825 11.471 5.018 1.00 5.10 C ATOM 653 O THR A 49 36.608 11.660 5.098 1.00 52.11 O ATOM 654 CB THR A 49 39.645 13.205 5.257 1.00 50.31 C ATOM 655 OG1 THR A 49 40.581 13.774 6.181 1.00 2.32 O ATOM 656 CG2 THR A 49 38.777 14.310 4.679 1.00 50.22 C ATOM 0 H THR A 49 39.321 11.064 7.690 1.00 2.52 H new ATOM 0 HA THR A 49 38.187 12.689 6.738 1.00 21.23 H new ATOM 0 HB THR A 49 40.171 12.712 4.439 1.00 50.31 H new ATOM 0 HG1 THR A 49 41.134 14.438 5.719 1.00 2.32 H new ATOM 0 HG21 THR A 49 39.407 15.035 4.164 1.00 50.22 H new ATOM 0 HG22 THR A 49 38.065 13.882 3.974 1.00 50.22 H new ATOM 0 HG23 THR A 49 38.236 14.807 5.484 1.00 50.22 H new ATOM 664 N ALA A 50 38.370 10.683 4.103 1.00 13.41 N ATOM 665 CA ALA A 50 37.557 9.929 3.169 1.00 32.41 C ATOM 666 C ALA A 50 36.966 8.701 3.859 1.00 53.33 C ATOM 667 O ALA A 50 37.454 7.580 3.689 1.00 24.14 O ATOM 668 CB ALA A 50 38.372 9.527 1.944 1.00 11.14 C ATOM 0 H ALA A 50 39.375 10.551 3.990 1.00 13.41 H new ATOM 0 HA ALA A 50 36.737 10.563 2.830 1.00 32.41 H new ATOM 0 HB1 ALA A 50 37.742 8.962 1.257 1.00 11.14 H new ATOM 0 HB2 ALA A 50 38.743 10.422 1.444 1.00 11.14 H new ATOM 0 HB3 ALA A 50 39.215 8.909 2.254 1.00 11.14 H new ATOM 674 N GLN A 51 35.971 8.931 4.695 1.00 44.21 N ATOM 675 CA GLN A 51 35.315 7.859 5.421 1.00 23.50 C ATOM 676 C GLN A 51 34.137 7.318 4.627 1.00 75.32 C ATOM 677 O GLN A 51 33.419 8.088 3.984 1.00 22.12 O ATOM 678 CB GLN A 51 34.817 8.359 6.779 1.00 41.30 C ATOM 679 CG GLN A 51 35.886 9.013 7.637 1.00 10.33 C ATOM 680 CD GLN A 51 35.358 9.464 8.986 1.00 54.14 C ATOM 681 OE1 GLN A 51 34.389 8.741 9.515 1.00 63.14 O flip ATOM 682 NE2 GLN A 51 35.829 10.449 9.554 1.00 40.24 N flip ATOM 0 H GLN A 51 35.596 9.860 4.889 1.00 44.21 H new ATOM 0 HA GLN A 51 36.043 7.062 5.573 1.00 23.50 H new ATOM 0 HB2 GLN A 51 34.011 9.075 6.616 1.00 41.30 H new ATOM 0 HB3 GLN A 51 34.391 7.519 7.328 1.00 41.30 H new ATOM 0 HG2 GLN A 51 36.705 8.310 7.788 1.00 10.33 H new ATOM 0 HG3 GLN A 51 36.297 9.872 7.106 1.00 10.33 H new ATOM 0 HE21 GLN A 51 36.578 10.983 9.113 1.00 40.24 H new ATOM 0 HE22 GLN A 51 35.471 10.732 10.466 1.00 40.24 H new ATOM 691 N PRO A 52 33.920 5.990 4.640 1.00 44.51 N ATOM 692 CA PRO A 52 32.759 5.391 3.990 1.00 15.24 C ATOM 693 C PRO A 52 31.479 5.836 4.693 1.00 32.14 C ATOM 694 O PRO A 52 31.177 5.381 5.799 1.00 72.03 O ATOM 695 CB PRO A 52 32.969 3.876 4.169 1.00 51.50 C ATOM 696 CG PRO A 52 34.403 3.719 4.556 1.00 53.32 C ATOM 697 CD PRO A 52 34.785 4.982 5.269 1.00 52.54 C ATOM 0 HA PRO A 52 32.663 5.680 2.943 1.00 15.24 H new ATOM 0 HB2 PRO A 52 32.308 3.476 4.938 1.00 51.50 H new ATOM 0 HB3 PRO A 52 32.749 3.337 3.247 1.00 51.50 H new ATOM 0 HG2 PRO A 52 34.539 2.851 5.201 1.00 53.32 H new ATOM 0 HG3 PRO A 52 35.029 3.564 3.677 1.00 53.32 H new ATOM 0 HD2 PRO A 52 34.607 4.910 6.342 1.00 52.54 H new ATOM 0 HD3 PRO A 52 35.841 5.217 5.137 1.00 52.54 H new ATOM 705 N LEU A 53 30.750 6.730 4.068 1.00 32.32 N ATOM 706 CA LEU A 53 29.556 7.292 4.669 1.00 42.14 C ATOM 707 C LEU A 53 28.315 6.492 4.307 1.00 4.24 C ATOM 708 O LEU A 53 28.181 6.012 3.179 1.00 51.31 O ATOM 709 CB LEU A 53 29.389 8.754 4.250 1.00 41.02 C ATOM 710 CG LEU A 53 30.513 9.697 4.686 1.00 3.52 C ATOM 711 CD1 LEU A 53 30.261 11.104 4.172 1.00 20.41 C ATOM 712 CD2 LEU A 53 30.651 9.697 6.204 1.00 64.11 C ATOM 0 H LEU A 53 30.962 7.088 3.137 1.00 32.32 H new ATOM 0 HA LEU A 53 29.675 7.243 5.751 1.00 42.14 H new ATOM 0 HB2 LEU A 53 29.305 8.795 3.164 1.00 41.02 H new ATOM 0 HB3 LEU A 53 28.449 9.125 4.657 1.00 41.02 H new ATOM 0 HG LEU A 53 31.448 9.339 4.256 1.00 3.52 H new ATOM 0 HD11 LEU A 53 31.071 11.759 4.493 1.00 20.41 H new ATOM 0 HD12 LEU A 53 30.214 11.091 3.083 1.00 20.41 H new ATOM 0 HD13 LEU A 53 29.316 11.473 4.571 1.00 20.41 H new ATOM 0 HD21 LEU A 53 31.455 10.373 6.496 1.00 64.11 H new ATOM 0 HD22 LEU A 53 29.716 10.029 6.654 1.00 64.11 H new ATOM 0 HD23 LEU A 53 30.881 8.689 6.548 1.00 64.11 H new ATOM 724 N PRO A 54 27.397 6.328 5.269 1.00 32.22 N ATOM 725 CA PRO A 54 26.146 5.605 5.054 1.00 24.15 C ATOM 726 C PRO A 54 25.152 6.436 4.248 1.00 65.03 C ATOM 727 O PRO A 54 25.396 7.617 3.967 1.00 45.33 O ATOM 728 CB PRO A 54 25.625 5.380 6.474 1.00 0.42 C ATOM 729 CG PRO A 54 26.171 6.519 7.259 1.00 43.45 C ATOM 730 CD PRO A 54 27.511 6.837 6.653 1.00 70.12 C ATOM 0 HA PRO A 54 26.286 4.684 4.489 1.00 24.15 H new ATOM 0 HB2 PRO A 54 24.535 5.368 6.499 1.00 0.42 H new ATOM 0 HB3 PRO A 54 25.964 4.424 6.874 1.00 0.42 H new ATOM 0 HG2 PRO A 54 25.506 7.381 7.209 1.00 43.45 H new ATOM 0 HG3 PRO A 54 26.272 6.254 8.312 1.00 43.45 H new ATOM 0 HD2 PRO A 54 27.715 7.908 6.671 1.00 70.12 H new ATOM 0 HD3 PRO A 54 28.322 6.349 7.194 1.00 70.12 H new ATOM 738 N VAL A 55 24.041 5.833 3.881 1.00 14.24 N ATOM 739 CA VAL A 55 23.031 6.530 3.107 1.00 42.11 C ATOM 740 C VAL A 55 22.131 7.360 4.014 1.00 20.33 C ATOM 741 O VAL A 55 22.079 7.136 5.229 1.00 31.51 O ATOM 742 CB VAL A 55 22.163 5.557 2.268 1.00 31.12 C ATOM 743 CG1 VAL A 55 23.031 4.742 1.324 1.00 25.24 C ATOM 744 CG2 VAL A 55 21.339 4.643 3.164 1.00 63.15 C ATOM 0 H VAL A 55 23.813 4.864 4.105 1.00 14.24 H new ATOM 0 HA VAL A 55 23.562 7.189 2.420 1.00 42.11 H new ATOM 0 HB VAL A 55 21.472 6.154 1.672 1.00 31.12 H new ATOM 0 HG11 VAL A 55 22.403 4.066 0.745 1.00 25.24 H new ATOM 0 HG12 VAL A 55 23.562 5.412 0.648 1.00 25.24 H new ATOM 0 HG13 VAL A 55 23.752 4.163 1.901 1.00 25.24 H new ATOM 0 HG21 VAL A 55 20.741 3.972 2.548 1.00 63.15 H new ATOM 0 HG22 VAL A 55 22.005 4.057 3.797 1.00 63.15 H new ATOM 0 HG23 VAL A 55 20.680 5.245 3.790 1.00 63.15 H new ATOM 754 N ALA A 56 21.455 8.328 3.428 1.00 34.20 N ATOM 755 CA ALA A 56 20.520 9.174 4.153 1.00 43.11 C ATOM 756 C ALA A 56 19.226 8.410 4.442 1.00 34.44 C ATOM 757 O ALA A 56 19.178 7.179 4.319 1.00 45.01 O ATOM 758 CB ALA A 56 20.231 10.433 3.343 1.00 65.42 C ATOM 0 H ALA A 56 21.536 8.553 2.436 1.00 34.20 H new ATOM 0 HA ALA A 56 20.964 9.463 5.105 1.00 43.11 H new ATOM 0 HB1 ALA A 56 19.530 11.064 3.889 1.00 65.42 H new ATOM 0 HB2 ALA A 56 21.159 10.980 3.177 1.00 65.42 H new ATOM 0 HB3 ALA A 56 19.797 10.156 2.382 1.00 65.42 H new ATOM 764 N SER A 57 18.184 9.127 4.817 1.00 72.21 N ATOM 765 CA SER A 57 16.897 8.513 5.077 1.00 41.15 C ATOM 766 C SER A 57 16.261 8.087 3.746 1.00 63.41 C ATOM 767 O SER A 57 16.751 8.462 2.675 1.00 1.25 O ATOM 768 CB SER A 57 15.990 9.498 5.831 1.00 62.02 C ATOM 769 OG SER A 57 14.761 8.897 6.219 1.00 72.04 O ATOM 0 H SER A 57 18.204 10.138 4.949 1.00 72.21 H new ATOM 0 HA SER A 57 17.028 7.629 5.701 1.00 41.15 H new ATOM 0 HB2 SER A 57 16.510 9.865 6.716 1.00 62.02 H new ATOM 0 HB3 SER A 57 15.788 10.362 5.198 1.00 62.02 H new ATOM 0 HG SER A 57 14.212 9.553 6.697 1.00 72.04 H new ATOM 775 N ALA A 58 15.182 7.325 3.814 1.00 23.20 N ATOM 776 CA ALA A 58 14.534 6.812 2.612 1.00 44.11 C ATOM 777 C ALA A 58 14.014 7.955 1.743 1.00 10.54 C ATOM 778 O ALA A 58 13.325 8.852 2.238 1.00 73.23 O ATOM 779 CB ALA A 58 13.402 5.868 2.984 1.00 0.41 C ATOM 0 H ALA A 58 14.734 7.046 4.687 1.00 23.20 H new ATOM 0 HA ALA A 58 15.275 6.258 2.035 1.00 44.11 H new ATOM 0 HB1 ALA A 58 12.928 5.493 2.077 1.00 0.41 H new ATOM 0 HB2 ALA A 58 13.800 5.031 3.558 1.00 0.41 H new ATOM 0 HB3 ALA A 58 12.665 6.402 3.584 1.00 0.41 H new ATOM 785 N PRO A 59 14.357 7.941 0.437 1.00 31.34 N ATOM 786 CA PRO A 59 13.956 8.989 -0.505 1.00 34.44 C ATOM 787 C PRO A 59 12.454 9.244 -0.493 1.00 54.02 C ATOM 788 O PRO A 59 11.649 8.320 -0.664 1.00 3.22 O ATOM 789 CB PRO A 59 14.409 8.460 -1.878 1.00 22.34 C ATOM 790 CG PRO A 59 14.769 7.028 -1.659 1.00 32.04 C ATOM 791 CD PRO A 59 15.157 6.900 -0.218 1.00 41.14 C ATOM 0 HA PRO A 59 14.405 9.948 -0.246 1.00 34.44 H new ATOM 0 HB2 PRO A 59 13.613 8.555 -2.617 1.00 22.34 H new ATOM 0 HB3 PRO A 59 15.262 9.025 -2.254 1.00 22.34 H new ATOM 0 HG2 PRO A 59 13.927 6.377 -1.893 1.00 32.04 H new ATOM 0 HG3 PRO A 59 15.592 6.731 -2.310 1.00 32.04 H new ATOM 0 HD2 PRO A 59 14.928 5.909 0.174 1.00 41.14 H new ATOM 0 HD3 PRO A 59 16.225 7.061 -0.072 1.00 41.14 H new ATOM 799 N VAL A 60 12.089 10.496 -0.280 1.00 63.22 N ATOM 800 CA VAL A 60 10.697 10.892 -0.229 1.00 4.34 C ATOM 801 C VAL A 60 10.185 11.216 -1.621 1.00 13.12 C ATOM 802 O VAL A 60 10.975 11.426 -2.552 1.00 24.24 O ATOM 803 CB VAL A 60 10.487 12.118 0.696 1.00 75.11 C ATOM 804 CG1 VAL A 60 10.945 11.801 2.106 1.00 35.12 C ATOM 805 CG2 VAL A 60 11.226 13.339 0.159 1.00 43.20 C ATOM 0 H VAL A 60 12.748 11.262 -0.138 1.00 63.22 H new ATOM 0 HA VAL A 60 10.135 10.052 0.180 1.00 4.34 H new ATOM 0 HB VAL A 60 9.422 12.348 0.718 1.00 75.11 H new ATOM 0 HG11 VAL A 60 10.791 12.672 2.743 1.00 35.12 H new ATOM 0 HG12 VAL A 60 10.370 10.961 2.495 1.00 35.12 H new ATOM 0 HG13 VAL A 60 12.004 11.542 2.095 1.00 35.12 H new ATOM 0 HG21 VAL A 60 11.063 14.186 0.826 1.00 43.20 H new ATOM 0 HG22 VAL A 60 12.293 13.123 0.102 1.00 43.20 H new ATOM 0 HG23 VAL A 60 10.852 13.583 -0.835 1.00 43.20 H new ATOM 815 N LEU A 61 8.879 11.261 -1.768 1.00 30.41 N ATOM 816 CA LEU A 61 8.275 11.541 -3.051 1.00 54.12 C ATOM 817 C LEU A 61 8.035 13.035 -3.217 1.00 72.13 C ATOM 818 O LEU A 61 7.110 13.602 -2.625 1.00 24.11 O ATOM 819 CB LEU A 61 6.965 10.760 -3.205 1.00 52.34 C ATOM 820 CG LEU A 61 6.214 10.950 -4.528 1.00 41.50 C ATOM 821 CD1 LEU A 61 7.105 10.607 -5.712 1.00 34.52 C ATOM 822 CD2 LEU A 61 4.959 10.095 -4.545 1.00 62.24 C ATOM 0 H LEU A 61 8.213 11.106 -1.011 1.00 30.41 H new ATOM 0 HA LEU A 61 8.962 11.220 -3.834 1.00 54.12 H new ATOM 0 HB2 LEU A 61 7.183 9.699 -3.084 1.00 52.34 H new ATOM 0 HB3 LEU A 61 6.299 11.044 -2.390 1.00 52.34 H new ATOM 0 HG LEU A 61 5.928 11.998 -4.612 1.00 41.50 H new ATOM 0 HD11 LEU A 61 6.549 10.750 -6.639 1.00 34.52 H new ATOM 0 HD12 LEU A 61 7.980 11.257 -5.709 1.00 34.52 H new ATOM 0 HD13 LEU A 61 7.425 9.568 -5.637 1.00 34.52 H new ATOM 0 HD21 LEU A 61 4.434 10.238 -5.489 1.00 62.24 H new ATOM 0 HD22 LEU A 61 5.232 9.045 -4.437 1.00 62.24 H new ATOM 0 HD23 LEU A 61 4.309 10.387 -3.720 1.00 62.24 H new ATOM 834 N SER A 62 8.880 13.672 -4.003 1.00 43.50 N ATOM 835 CA SER A 62 8.751 15.088 -4.255 1.00 52.31 C ATOM 836 C SER A 62 8.614 15.340 -5.741 1.00 41.02 C ATOM 837 O SER A 62 9.552 15.773 -6.413 1.00 32.53 O ATOM 838 CB SER A 62 9.950 15.842 -3.688 1.00 3.23 C ATOM 839 OG SER A 62 10.223 15.427 -2.355 1.00 22.44 O ATOM 0 H SER A 62 9.665 13.227 -4.478 1.00 43.50 H new ATOM 0 HA SER A 62 7.853 15.454 -3.757 1.00 52.31 H new ATOM 0 HB2 SER A 62 10.825 15.667 -4.314 1.00 3.23 H new ATOM 0 HB3 SER A 62 9.753 16.914 -3.707 1.00 3.23 H new ATOM 0 HG SER A 62 9.678 15.950 -1.731 1.00 22.44 H new ATOM 845 N ALA A 63 7.450 15.033 -6.247 1.00 34.04 N ATOM 846 CA ALA A 63 7.152 15.206 -7.639 1.00 60.51 C ATOM 847 C ALA A 63 5.769 15.811 -7.786 1.00 54.14 C ATOM 848 O ALA A 63 4.936 15.665 -6.883 1.00 62.54 O ATOM 849 CB ALA A 63 7.238 13.866 -8.352 1.00 63.33 C ATOM 0 H ALA A 63 6.678 14.653 -5.699 1.00 34.04 H new ATOM 0 HA ALA A 63 7.877 15.882 -8.092 1.00 60.51 H new ATOM 0 HB1 ALA A 63 7.011 14.001 -9.409 1.00 63.33 H new ATOM 0 HB2 ALA A 63 8.245 13.461 -8.246 1.00 63.33 H new ATOM 0 HB3 ALA A 63 6.520 13.173 -7.913 1.00 63.33 H new ATOM 855 N PRO A 64 5.500 16.520 -8.897 1.00 2.44 N ATOM 856 CA PRO A 64 4.186 17.116 -9.145 1.00 50.33 C ATOM 857 C PRO A 64 3.100 16.048 -9.217 1.00 13.13 C ATOM 858 O PRO A 64 3.097 15.212 -10.126 1.00 62.14 O ATOM 859 CB PRO A 64 4.345 17.806 -10.508 1.00 74.24 C ATOM 860 CG PRO A 64 5.815 17.968 -10.690 1.00 25.33 C ATOM 861 CD PRO A 64 6.448 16.807 -9.987 1.00 31.54 C ATOM 0 HA PRO A 64 3.886 17.799 -8.351 1.00 50.33 H new ATOM 0 HB2 PRO A 64 3.912 17.205 -11.308 1.00 74.24 H new ATOM 0 HB3 PRO A 64 3.837 18.770 -10.524 1.00 74.24 H new ATOM 0 HG2 PRO A 64 6.079 17.975 -11.748 1.00 25.33 H new ATOM 0 HG3 PRO A 64 6.158 18.913 -10.270 1.00 25.33 H new ATOM 0 HD2 PRO A 64 6.570 15.951 -10.651 1.00 31.54 H new ATOM 0 HD3 PRO A 64 7.438 17.058 -9.605 1.00 31.54 H new ATOM 869 N LEU A 65 2.182 16.080 -8.265 1.00 12.25 N ATOM 870 CA LEU A 65 1.119 15.095 -8.198 1.00 14.31 C ATOM 871 C LEU A 65 0.110 15.334 -9.301 1.00 23.22 C ATOM 872 O LEU A 65 -0.683 16.271 -9.242 1.00 63.34 O ATOM 873 CB LEU A 65 0.422 15.108 -6.825 1.00 12.12 C ATOM 874 CG LEU A 65 1.291 14.734 -5.612 1.00 51.43 C ATOM 875 CD1 LEU A 65 2.152 15.904 -5.162 1.00 14.12 C ATOM 876 CD2 LEU A 65 0.426 14.239 -4.468 1.00 63.21 C ATOM 0 H LEU A 65 2.153 16.782 -7.525 1.00 12.25 H new ATOM 0 HA LEU A 65 1.569 14.111 -8.334 1.00 14.31 H new ATOM 0 HB2 LEU A 65 0.014 16.105 -6.658 1.00 12.12 H new ATOM 0 HB3 LEU A 65 -0.423 14.421 -6.865 1.00 12.12 H new ATOM 0 HG LEU A 65 1.959 13.929 -5.919 1.00 51.43 H new ATOM 0 HD11 LEU A 65 2.753 15.604 -4.303 1.00 14.12 H new ATOM 0 HD12 LEU A 65 2.809 16.207 -5.977 1.00 14.12 H new ATOM 0 HD13 LEU A 65 1.512 16.741 -4.883 1.00 14.12 H new ATOM 0 HD21 LEU A 65 1.059 13.979 -3.619 1.00 63.21 H new ATOM 0 HD22 LEU A 65 -0.272 15.023 -4.174 1.00 63.21 H new ATOM 0 HD23 LEU A 65 -0.131 13.358 -4.788 1.00 63.21 H new ATOM 888 N GLY A 66 0.157 14.493 -10.309 1.00 20.03 N ATOM 889 CA GLY A 66 -0.728 14.623 -11.435 1.00 75.01 C ATOM 890 C GLY A 66 -0.020 14.280 -12.715 1.00 22.02 C ATOM 891 O GLY A 66 -0.583 13.621 -13.590 1.00 74.32 O ATOM 0 H GLY A 66 0.805 13.708 -10.368 1.00 20.03 H new ATOM 0 HA2 GLY A 66 -1.589 13.967 -11.304 1.00 75.01 H new ATOM 0 HA3 GLY A 66 -1.109 15.643 -11.487 1.00 75.01 H new ATOM 895 N SER A 67 1.219 14.741 -12.827 1.00 52.15 N ATOM 896 CA SER A 67 2.052 14.447 -13.979 1.00 44.23 C ATOM 897 C SER A 67 2.266 12.937 -14.099 1.00 62.31 C ATOM 898 O SER A 67 2.341 12.241 -13.091 1.00 5.15 O ATOM 899 CB SER A 67 3.398 15.158 -13.842 1.00 14.41 C ATOM 900 OG SER A 67 3.219 16.555 -13.652 1.00 61.40 O ATOM 0 H SER A 67 1.670 15.326 -12.124 1.00 52.15 H new ATOM 0 HA SER A 67 1.552 14.804 -14.879 1.00 44.23 H new ATOM 0 HB2 SER A 67 3.950 14.741 -13.000 1.00 14.41 H new ATOM 0 HB3 SER A 67 3.998 14.983 -14.735 1.00 14.41 H new ATOM 0 HG SER A 67 4.094 16.988 -13.565 1.00 61.40 H new ATOM 906 N HIS A 68 2.383 12.442 -15.323 1.00 34.10 N ATOM 907 CA HIS A 68 2.571 11.009 -15.551 1.00 45.33 C ATOM 908 C HIS A 68 3.875 10.536 -14.898 1.00 22.11 C ATOM 909 O HIS A 68 3.992 9.383 -14.479 1.00 11.22 O ATOM 910 CB HIS A 68 2.578 10.709 -17.055 1.00 13.22 C ATOM 911 CG HIS A 68 2.416 9.257 -17.395 1.00 14.53 C ATOM 912 ND1 HIS A 68 1.213 8.704 -17.767 1.00 71.25 N ATOM 913 CD2 HIS A 68 3.314 8.247 -17.436 1.00 32.01 C ATOM 914 CE1 HIS A 68 1.376 7.423 -18.021 1.00 41.01 C ATOM 915 NE2 HIS A 68 2.642 7.117 -17.829 1.00 43.13 N ATOM 0 H HIS A 68 2.352 13.005 -16.173 1.00 34.10 H new ATOM 0 HA HIS A 68 1.742 10.467 -15.096 1.00 45.33 H new ATOM 0 HB2 HIS A 68 1.775 11.273 -17.530 1.00 13.22 H new ATOM 0 HB3 HIS A 68 3.515 11.068 -17.481 1.00 13.22 H new ATOM 0 HD2 HIS A 68 4.366 8.317 -17.202 1.00 32.01 H new ATOM 0 HE1 HIS A 68 0.602 6.738 -18.334 1.00 41.01 H new ATOM 0 HE2 HIS A 68 3.055 6.193 -17.952 1.00 43.13 H new ATOM 924 N GLU A 69 4.842 11.445 -14.825 1.00 53.31 N ATOM 925 CA GLU A 69 6.126 11.186 -14.174 1.00 43.22 C ATOM 926 C GLU A 69 5.923 10.776 -12.709 1.00 71.04 C ATOM 927 O GLU A 69 6.649 9.921 -12.177 1.00 74.41 O ATOM 928 CB GLU A 69 7.007 12.430 -14.254 1.00 24.20 C ATOM 929 CG GLU A 69 8.375 12.261 -13.621 1.00 33.44 C ATOM 930 CD GLU A 69 9.224 13.495 -13.758 1.00 24.31 C ATOM 931 OE1 GLU A 69 9.168 14.365 -12.866 1.00 54.25 O ATOM 932 OE2 GLU A 69 9.962 13.607 -14.760 1.00 21.01 O ATOM 0 H GLU A 69 4.760 12.384 -15.215 1.00 53.31 H new ATOM 0 HA GLU A 69 6.618 10.363 -14.693 1.00 43.22 H new ATOM 0 HB2 GLU A 69 7.134 12.705 -15.301 1.00 24.20 H new ATOM 0 HB3 GLU A 69 6.493 13.258 -13.767 1.00 24.20 H new ATOM 0 HG2 GLU A 69 8.257 12.020 -12.565 1.00 33.44 H new ATOM 0 HG3 GLU A 69 8.886 11.418 -14.085 1.00 33.44 H new ATOM 939 N TRP A 70 4.929 11.374 -12.067 1.00 21.04 N ATOM 940 CA TRP A 70 4.607 11.052 -10.693 1.00 42.33 C ATOM 941 C TRP A 70 4.056 9.638 -10.618 1.00 4.11 C ATOM 942 O TRP A 70 4.439 8.868 -9.747 1.00 54.52 O ATOM 943 CB TRP A 70 3.574 12.059 -10.166 1.00 21.21 C ATOM 944 CG TRP A 70 3.241 11.913 -8.712 1.00 0.11 C ATOM 945 CD1 TRP A 70 3.839 12.552 -7.670 1.00 64.14 C ATOM 946 CD2 TRP A 70 2.221 11.084 -8.141 1.00 61.24 C ATOM 947 NE1 TRP A 70 3.262 12.171 -6.488 1.00 53.12 N ATOM 948 CE2 TRP A 70 2.268 11.268 -6.750 1.00 55.11 C ATOM 949 CE3 TRP A 70 1.278 10.201 -8.672 1.00 71.12 C ATOM 950 CZ2 TRP A 70 1.409 10.605 -5.883 1.00 62.35 C ATOM 951 CZ3 TRP A 70 0.426 9.545 -7.811 1.00 43.33 C ATOM 952 CH2 TRP A 70 0.496 9.751 -6.432 1.00 1.31 C ATOM 0 H TRP A 70 4.331 12.088 -12.483 1.00 21.04 H new ATOM 0 HA TRP A 70 5.505 11.110 -10.078 1.00 42.33 H new ATOM 0 HB2 TRP A 70 3.949 13.068 -10.339 1.00 21.21 H new ATOM 0 HB3 TRP A 70 2.657 11.956 -10.747 1.00 21.21 H new ATOM 0 HD1 TRP A 70 4.651 13.258 -7.762 1.00 64.14 H new ATOM 0 HE1 TRP A 70 3.530 12.506 -5.563 1.00 53.12 H new ATOM 0 HE3 TRP A 70 1.218 10.036 -9.738 1.00 71.12 H new ATOM 0 HZ2 TRP A 70 1.461 10.759 -4.815 1.00 62.35 H new ATOM 0 HZ3 TRP A 70 -0.308 8.860 -8.209 1.00 43.33 H new ATOM 0 HH2 TRP A 70 -0.188 9.223 -5.784 1.00 1.31 H new ATOM 963 N GLN A 71 3.177 9.299 -11.550 1.00 30.23 N ATOM 964 CA GLN A 71 2.625 7.951 -11.632 1.00 63.40 C ATOM 965 C GLN A 71 3.745 6.929 -11.799 1.00 11.41 C ATOM 966 O GLN A 71 3.753 5.886 -11.138 1.00 13.15 O ATOM 967 CB GLN A 71 1.633 7.828 -12.794 1.00 40.25 C ATOM 968 CG GLN A 71 0.178 8.123 -12.434 1.00 74.13 C ATOM 969 CD GLN A 71 -0.125 9.596 -12.193 1.00 52.21 C ATOM 970 OE1 GLN A 71 0.712 10.358 -11.740 1.00 23.04 O ATOM 971 NE2 GLN A 71 -1.334 9.995 -12.507 1.00 62.12 N ATOM 0 H GLN A 71 2.829 9.940 -12.263 1.00 30.23 H new ATOM 0 HA GLN A 71 2.092 7.752 -10.702 1.00 63.40 H new ATOM 0 HB2 GLN A 71 1.940 8.509 -13.588 1.00 40.25 H new ATOM 0 HB3 GLN A 71 1.694 6.818 -13.199 1.00 40.25 H new ATOM 0 HG2 GLN A 71 -0.463 7.760 -13.237 1.00 74.13 H new ATOM 0 HG3 GLN A 71 -0.083 7.560 -11.538 1.00 74.13 H new ATOM 0 HE21 GLN A 71 -2.009 9.330 -12.884 1.00 62.12 H new ATOM 0 HE22 GLN A 71 -1.600 10.971 -12.374 1.00 62.12 H new ATOM 980 N GLN A 72 4.677 7.230 -12.705 1.00 2.10 N ATOM 981 CA GLN A 72 5.851 6.388 -12.931 1.00 41.32 C ATOM 982 C GLN A 72 6.591 6.123 -11.626 1.00 52.14 C ATOM 983 O GLN A 72 6.909 4.976 -11.299 1.00 2.42 O ATOM 984 CB GLN A 72 6.804 7.058 -13.929 1.00 23.41 C ATOM 985 CG GLN A 72 6.236 7.219 -15.325 1.00 31.34 C ATOM 986 CD GLN A 72 5.905 5.892 -15.973 1.00 31.32 C ATOM 987 OE1 GLN A 72 4.791 5.389 -15.849 1.00 63.43 O ATOM 988 NE2 GLN A 72 6.867 5.321 -16.665 1.00 72.11 N ATOM 0 H GLN A 72 4.639 8.059 -13.299 1.00 2.10 H new ATOM 0 HA GLN A 72 5.506 5.438 -13.339 1.00 41.32 H new ATOM 0 HB2 GLN A 72 7.079 8.041 -13.546 1.00 23.41 H new ATOM 0 HB3 GLN A 72 7.720 6.471 -13.988 1.00 23.41 H new ATOM 0 HG2 GLN A 72 5.336 7.832 -15.279 1.00 31.34 H new ATOM 0 HG3 GLN A 72 6.954 7.754 -15.946 1.00 31.34 H new ATOM 0 HE21 GLN A 72 7.778 5.774 -16.742 1.00 72.11 H new ATOM 0 HE22 GLN A 72 6.702 4.425 -17.124 1.00 72.11 H new ATOM 997 N THR A 73 6.847 7.185 -10.883 1.00 44.54 N ATOM 998 CA THR A 73 7.556 7.084 -9.622 1.00 73.15 C ATOM 999 C THR A 73 6.706 6.344 -8.578 1.00 33.10 C ATOM 1000 O THR A 73 7.205 5.474 -7.855 1.00 71.12 O ATOM 1001 CB THR A 73 7.925 8.485 -9.091 1.00 11.05 C ATOM 1002 OG1 THR A 73 8.519 9.264 -10.153 1.00 55.34 O ATOM 1003 CG2 THR A 73 8.908 8.377 -7.934 1.00 70.14 C ATOM 0 H THR A 73 6.571 8.134 -11.135 1.00 44.54 H new ATOM 0 HA THR A 73 8.471 6.519 -9.798 1.00 73.15 H new ATOM 0 HB THR A 73 7.017 8.973 -8.737 1.00 11.05 H new ATOM 0 HG1 THR A 73 7.817 9.575 -10.763 1.00 55.34 H new ATOM 0 HG21 THR A 73 9.156 9.375 -7.573 1.00 70.14 H new ATOM 0 HG22 THR A 73 8.457 7.801 -7.126 1.00 70.14 H new ATOM 0 HG23 THR A 73 9.816 7.878 -8.273 1.00 70.14 H new ATOM 1011 N PHE A 74 5.425 6.697 -8.514 1.00 45.01 N ATOM 1012 CA PHE A 74 4.485 6.074 -7.592 1.00 54.21 C ATOM 1013 C PHE A 74 4.439 4.561 -7.799 1.00 3.24 C ATOM 1014 O PHE A 74 4.430 3.799 -6.841 1.00 33.24 O ATOM 1015 CB PHE A 74 3.090 6.683 -7.768 1.00 23.03 C ATOM 1016 CG PHE A 74 2.084 6.222 -6.751 1.00 24.05 C ATOM 1017 CD1 PHE A 74 2.182 6.625 -5.429 1.00 51.11 C ATOM 1018 CD2 PHE A 74 1.036 5.391 -7.117 1.00 33.00 C ATOM 1019 CE1 PHE A 74 1.256 6.212 -4.492 1.00 73.14 C ATOM 1020 CE2 PHE A 74 0.107 4.973 -6.183 1.00 31.44 C ATOM 1021 CZ PHE A 74 0.217 5.384 -4.869 1.00 63.23 C ATOM 0 H PHE A 74 5.012 7.422 -9.100 1.00 45.01 H new ATOM 0 HA PHE A 74 4.825 6.264 -6.574 1.00 54.21 H new ATOM 0 HB2 PHE A 74 3.171 7.769 -7.717 1.00 23.03 H new ATOM 0 HB3 PHE A 74 2.722 6.438 -8.764 1.00 23.03 H new ATOM 0 HD1 PHE A 74 2.993 7.271 -5.128 1.00 51.11 H new ATOM 0 HD2 PHE A 74 0.945 5.067 -8.143 1.00 33.00 H new ATOM 0 HE1 PHE A 74 1.344 6.536 -3.466 1.00 73.14 H new ATOM 0 HE2 PHE A 74 -0.704 4.325 -6.480 1.00 31.44 H new ATOM 0 HZ PHE A 74 -0.508 5.058 -4.138 1.00 63.23 H new ATOM 1031 N SER A 75 4.398 4.134 -9.048 1.00 63.41 N ATOM 1032 CA SER A 75 4.398 2.716 -9.360 1.00 64.42 C ATOM 1033 C SER A 75 5.633 2.020 -8.783 1.00 0.22 C ATOM 1034 O SER A 75 5.523 0.958 -8.173 1.00 41.10 O ATOM 1035 CB SER A 75 4.334 2.516 -10.871 1.00 25.03 C ATOM 1036 OG SER A 75 3.207 3.182 -11.418 1.00 74.22 O ATOM 0 H SER A 75 4.364 4.748 -9.862 1.00 63.41 H new ATOM 0 HA SER A 75 3.518 2.266 -8.901 1.00 64.42 H new ATOM 0 HB2 SER A 75 5.246 2.895 -11.332 1.00 25.03 H new ATOM 0 HB3 SER A 75 4.280 1.452 -11.100 1.00 25.03 H new ATOM 0 HG SER A 75 3.375 4.147 -11.437 1.00 74.22 H new ATOM 1042 N GLN A 76 6.800 2.638 -8.967 1.00 5.42 N ATOM 1043 CA GLN A 76 8.062 2.083 -8.470 1.00 32.51 C ATOM 1044 C GLN A 76 8.004 1.783 -6.975 1.00 25.21 C ATOM 1045 O GLN A 76 8.314 0.670 -6.550 1.00 13.32 O ATOM 1046 CB GLN A 76 9.232 3.030 -8.760 1.00 44.34 C ATOM 1047 CG GLN A 76 9.461 3.299 -10.236 1.00 13.05 C ATOM 1048 CD GLN A 76 9.616 2.026 -11.043 1.00 13.30 C ATOM 1049 OE1 GLN A 76 8.638 1.484 -11.556 1.00 21.42 O ATOM 1050 NE2 GLN A 76 10.836 1.543 -11.158 1.00 62.11 N ATOM 0 H GLN A 76 6.899 3.526 -9.458 1.00 5.42 H new ATOM 0 HA GLN A 76 8.222 1.144 -9.000 1.00 32.51 H new ATOM 0 HB2 GLN A 76 9.052 3.978 -8.253 1.00 44.34 H new ATOM 0 HB3 GLN A 76 10.142 2.607 -8.333 1.00 44.34 H new ATOM 0 HG2 GLN A 76 8.624 3.875 -10.631 1.00 13.05 H new ATOM 0 HG3 GLN A 76 10.355 3.912 -10.356 1.00 13.05 H new ATOM 0 HE21 GLN A 76 11.619 2.025 -10.716 1.00 62.11 H new ATOM 0 HE22 GLN A 76 10.998 0.687 -11.689 1.00 62.11 H new ATOM 1059 N GLN A 77 7.598 2.772 -6.184 1.00 42.10 N ATOM 1060 CA GLN A 77 7.534 2.606 -4.731 1.00 44.31 C ATOM 1061 C GLN A 77 6.554 1.498 -4.325 1.00 74.14 C ATOM 1062 O GLN A 77 6.788 0.786 -3.357 1.00 22.41 O ATOM 1063 CB GLN A 77 7.198 3.930 -4.021 1.00 21.04 C ATOM 1064 CG GLN A 77 5.885 4.552 -4.446 1.00 51.24 C ATOM 1065 CD GLN A 77 5.601 5.864 -3.751 1.00 21.31 C ATOM 1066 OE1 GLN A 77 6.003 6.924 -4.220 1.00 40.15 O ATOM 1067 NE2 GLN A 77 4.898 5.803 -2.638 1.00 2.43 N ATOM 0 H GLN A 77 7.310 3.691 -6.519 1.00 42.10 H new ATOM 0 HA GLN A 77 8.528 2.299 -4.405 1.00 44.31 H new ATOM 0 HB2 GLN A 77 7.172 3.755 -2.945 1.00 21.04 H new ATOM 0 HB3 GLN A 77 8.001 4.643 -4.208 1.00 21.04 H new ATOM 0 HG2 GLN A 77 5.898 4.713 -5.524 1.00 51.24 H new ATOM 0 HG3 GLN A 77 5.074 3.854 -4.238 1.00 51.24 H new ATOM 0 HE21 GLN A 77 4.583 4.900 -2.283 1.00 2.43 H new ATOM 0 HE22 GLN A 77 4.669 6.658 -2.132 1.00 2.43 H new ATOM 1076 N VAL A 78 5.482 1.330 -5.096 1.00 65.43 N ATOM 1077 CA VAL A 78 4.475 0.321 -4.780 1.00 42.11 C ATOM 1078 C VAL A 78 4.948 -1.066 -5.210 1.00 3.12 C ATOM 1079 O VAL A 78 4.777 -2.048 -4.477 1.00 22.31 O ATOM 1080 CB VAL A 78 3.111 0.638 -5.447 1.00 11.54 C ATOM 1081 CG1 VAL A 78 2.090 -0.452 -5.145 1.00 62.31 C ATOM 1082 CG2 VAL A 78 2.593 1.991 -4.979 1.00 30.34 C ATOM 0 H VAL A 78 5.289 1.874 -5.937 1.00 65.43 H new ATOM 0 HA VAL A 78 4.335 0.336 -3.699 1.00 42.11 H new ATOM 0 HB VAL A 78 3.262 0.674 -6.526 1.00 11.54 H new ATOM 0 HG11 VAL A 78 1.142 -0.206 -5.624 1.00 62.31 H new ATOM 0 HG12 VAL A 78 2.453 -1.406 -5.527 1.00 62.31 H new ATOM 0 HG13 VAL A 78 1.944 -0.525 -4.067 1.00 62.31 H new ATOM 0 HG21 VAL A 78 1.635 2.199 -5.456 1.00 30.34 H new ATOM 0 HG22 VAL A 78 2.464 1.977 -3.897 1.00 30.34 H new ATOM 0 HG23 VAL A 78 3.309 2.768 -5.249 1.00 30.34 H new ATOM 1092 N MET A 79 5.558 -1.145 -6.386 1.00 72.51 N ATOM 1093 CA MET A 79 6.102 -2.408 -6.873 1.00 0.52 C ATOM 1094 C MET A 79 7.217 -2.873 -5.949 1.00 34.14 C ATOM 1095 O MET A 79 7.386 -4.061 -5.706 1.00 51.42 O ATOM 1096 CB MET A 79 6.625 -2.271 -8.309 1.00 44.14 C ATOM 1097 CG MET A 79 5.539 -1.977 -9.338 1.00 25.11 C ATOM 1098 SD MET A 79 6.186 -1.805 -11.018 1.00 52.33 S ATOM 1099 CE MET A 79 6.814 -3.458 -11.318 1.00 51.44 C ATOM 0 H MET A 79 5.688 -0.355 -7.018 1.00 72.51 H new ATOM 0 HA MET A 79 5.302 -3.149 -6.879 1.00 0.52 H new ATOM 0 HB2 MET A 79 7.367 -1.473 -8.340 1.00 44.14 H new ATOM 0 HB3 MET A 79 7.136 -3.192 -8.588 1.00 44.14 H new ATOM 0 HG2 MET A 79 4.801 -2.779 -9.319 1.00 25.11 H new ATOM 0 HG3 MET A 79 5.020 -1.060 -9.059 1.00 25.11 H new ATOM 0 HE1 MET A 79 6.982 -3.595 -12.386 1.00 51.44 H new ATOM 0 HE2 MET A 79 7.754 -3.593 -10.783 1.00 51.44 H new ATOM 0 HE3 MET A 79 6.088 -4.192 -10.968 1.00 51.44 H new ATOM 1109 N LEU A 80 7.969 -1.916 -5.440 1.00 74.51 N ATOM 1110 CA LEU A 80 9.036 -2.196 -4.495 1.00 41.24 C ATOM 1111 C LEU A 80 8.492 -2.935 -3.264 1.00 2.31 C ATOM 1112 O LEU A 80 9.100 -3.891 -2.791 1.00 5.11 O ATOM 1113 CB LEU A 80 9.732 -0.896 -4.073 1.00 31.51 C ATOM 1114 CG LEU A 80 10.902 -1.046 -3.096 1.00 43.31 C ATOM 1115 CD1 LEU A 80 12.024 -1.867 -3.715 1.00 73.40 C ATOM 1116 CD2 LEU A 80 11.412 0.320 -2.662 1.00 25.33 C ATOM 0 H LEU A 80 7.860 -0.928 -5.667 1.00 74.51 H new ATOM 0 HA LEU A 80 9.767 -2.839 -4.985 1.00 41.24 H new ATOM 0 HB2 LEU A 80 10.096 -0.395 -4.970 1.00 31.51 H new ATOM 0 HB3 LEU A 80 8.989 -0.240 -3.620 1.00 31.51 H new ATOM 0 HG LEU A 80 10.543 -1.576 -2.214 1.00 43.31 H new ATOM 0 HD11 LEU A 80 12.843 -1.959 -3.002 1.00 73.40 H new ATOM 0 HD12 LEU A 80 11.651 -2.859 -3.970 1.00 73.40 H new ATOM 0 HD13 LEU A 80 12.382 -1.371 -4.617 1.00 73.40 H new ATOM 0 HD21 LEU A 80 12.243 0.194 -1.968 1.00 25.33 H new ATOM 0 HD22 LEU A 80 11.750 0.877 -3.536 1.00 25.33 H new ATOM 0 HD23 LEU A 80 10.609 0.869 -2.171 1.00 25.33 H new ATOM 1128 N PHE A 81 7.345 -2.486 -2.755 1.00 63.32 N ATOM 1129 CA PHE A 81 6.717 -3.114 -1.585 1.00 13.34 C ATOM 1130 C PHE A 81 6.481 -4.610 -1.802 1.00 51.24 C ATOM 1131 O PHE A 81 6.960 -5.439 -1.022 1.00 62.30 O ATOM 1132 CB PHE A 81 5.389 -2.426 -1.232 1.00 74.23 C ATOM 1133 CG PHE A 81 5.509 -0.955 -0.934 1.00 72.22 C ATOM 1134 CD1 PHE A 81 6.651 -0.438 -0.336 1.00 3.43 C ATOM 1135 CD2 PHE A 81 4.477 -0.088 -1.256 1.00 20.44 C ATOM 1136 CE1 PHE A 81 6.758 0.912 -0.070 1.00 31.33 C ATOM 1137 CE2 PHE A 81 4.578 1.262 -0.989 1.00 0.51 C ATOM 1138 CZ PHE A 81 5.720 1.763 -0.396 1.00 31.41 C ATOM 0 H PHE A 81 6.829 -1.691 -3.132 1.00 63.32 H new ATOM 0 HA PHE A 81 7.411 -2.994 -0.753 1.00 13.34 H new ATOM 0 HB2 PHE A 81 4.693 -2.561 -2.060 1.00 74.23 H new ATOM 0 HB3 PHE A 81 4.954 -2.925 -0.366 1.00 74.23 H new ATOM 0 HD1 PHE A 81 7.464 -1.100 -0.076 1.00 3.43 H new ATOM 0 HD2 PHE A 81 3.582 -0.474 -1.722 1.00 20.44 H new ATOM 0 HE1 PHE A 81 7.652 1.303 0.393 1.00 31.33 H new ATOM 0 HE2 PHE A 81 3.765 1.926 -1.243 1.00 0.51 H new ATOM 0 HZ PHE A 81 5.802 2.819 -0.187 1.00 31.41 H new ATOM 1148 N THR A 82 5.764 -4.949 -2.871 1.00 31.25 N ATOM 1149 CA THR A 82 5.447 -6.346 -3.166 1.00 54.21 C ATOM 1150 C THR A 82 6.715 -7.171 -3.441 1.00 71.44 C ATOM 1151 O THR A 82 6.761 -8.366 -3.146 1.00 62.13 O ATOM 1152 CB THR A 82 4.426 -6.483 -4.345 1.00 50.00 C ATOM 1153 OG1 THR A 82 4.222 -7.860 -4.685 1.00 33.44 O ATOM 1154 CG2 THR A 82 4.891 -5.728 -5.577 1.00 42.03 C ATOM 0 H THR A 82 5.393 -4.280 -3.545 1.00 31.25 H new ATOM 0 HA THR A 82 4.971 -6.751 -2.273 1.00 54.21 H new ATOM 0 HB THR A 82 3.486 -6.050 -4.004 1.00 50.00 H new ATOM 0 HG1 THR A 82 3.580 -7.923 -5.423 1.00 33.44 H new ATOM 0 HG21 THR A 82 4.157 -5.846 -6.374 1.00 42.03 H new ATOM 0 HG22 THR A 82 4.999 -4.670 -5.336 1.00 42.03 H new ATOM 0 HG23 THR A 82 5.851 -6.125 -5.906 1.00 42.03 H new ATOM 1162 N ARG A 83 7.750 -6.526 -3.978 1.00 42.23 N ATOM 1163 CA ARG A 83 9.008 -7.217 -4.250 1.00 40.32 C ATOM 1164 C ARG A 83 9.748 -7.541 -2.956 1.00 11.21 C ATOM 1165 O ARG A 83 10.335 -8.616 -2.819 1.00 32.50 O ATOM 1166 CB ARG A 83 9.908 -6.399 -5.179 1.00 63.21 C ATOM 1167 CG ARG A 83 9.330 -6.194 -6.567 1.00 61.44 C ATOM 1168 CD ARG A 83 10.349 -5.582 -7.510 1.00 13.15 C ATOM 1169 NE ARG A 83 11.492 -6.470 -7.730 1.00 45.42 N ATOM 1170 CZ ARG A 83 12.480 -6.221 -8.590 1.00 63.21 C ATOM 1171 NH1 ARG A 83 12.471 -5.107 -9.311 1.00 50.13 N ATOM 1172 NH2 ARG A 83 13.478 -7.090 -8.726 1.00 34.21 N ATOM 0 H ARG A 83 7.743 -5.538 -4.231 1.00 42.23 H new ATOM 0 HA ARG A 83 8.759 -8.152 -4.752 1.00 40.32 H new ATOM 0 HB2 ARG A 83 10.093 -5.425 -4.725 1.00 63.21 H new ATOM 0 HB3 ARG A 83 10.873 -6.898 -5.267 1.00 63.21 H new ATOM 0 HG2 ARG A 83 8.992 -7.150 -6.966 1.00 61.44 H new ATOM 0 HG3 ARG A 83 8.455 -5.547 -6.506 1.00 61.44 H new ATOM 0 HD2 ARG A 83 9.873 -5.360 -8.465 1.00 13.15 H new ATOM 0 HD3 ARG A 83 10.699 -4.634 -7.101 1.00 13.15 H new ATOM 0 HE ARG A 83 11.535 -7.335 -7.191 1.00 45.42 H new ATOM 0 HH11 ARG A 83 11.707 -4.439 -9.208 1.00 50.13 H new ATOM 0 HH12 ARG A 83 13.228 -4.919 -9.968 1.00 50.13 H new ATOM 0 HH21 ARG A 83 13.487 -7.947 -8.172 1.00 34.21 H new ATOM 0 HH22 ARG A 83 14.234 -6.900 -9.384 1.00 34.21 H new ATOM 1186 N GLN A 84 9.699 -6.619 -2.000 1.00 24.40 N ATOM 1187 CA GLN A 84 10.374 -6.809 -0.718 1.00 12.33 C ATOM 1188 C GLN A 84 9.634 -7.824 0.137 1.00 5.04 C ATOM 1189 O GLN A 84 10.242 -8.557 0.912 1.00 43.44 O ATOM 1190 CB GLN A 84 10.473 -5.484 0.040 1.00 74.01 C ATOM 1191 CG GLN A 84 11.286 -4.416 -0.667 1.00 53.12 C ATOM 1192 CD GLN A 84 11.308 -3.112 0.102 1.00 11.21 C ATOM 1193 OE1 GLN A 84 10.350 -2.252 -0.167 1.00 64.05 O flip ATOM 1194 NE2 GLN A 84 12.179 -2.886 0.937 1.00 62.13 N flip ATOM 0 H GLN A 84 9.200 -5.734 -2.087 1.00 24.40 H new ATOM 0 HA GLN A 84 11.378 -7.182 -0.923 1.00 12.33 H new ATOM 0 HB2 GLN A 84 9.467 -5.102 0.213 1.00 74.01 H new ATOM 0 HB3 GLN A 84 10.915 -5.671 1.019 1.00 74.01 H new ATOM 0 HG2 GLN A 84 12.307 -4.771 -0.806 1.00 53.12 H new ATOM 0 HG3 GLN A 84 10.871 -4.243 -1.660 1.00 53.12 H new ATOM 0 HE21 GLN A 84 12.905 -3.579 1.117 1.00 62.13 H new ATOM 0 HE22 GLN A 84 12.176 -2.005 1.451 1.00 62.13 H new ATOM 1203 N GLY A 85 8.322 -7.858 -0.004 1.00 53.43 N ATOM 1204 CA GLY A 85 7.525 -8.794 0.759 1.00 31.23 C ATOM 1205 C GLY A 85 6.576 -8.095 1.697 1.00 32.11 C ATOM 1206 O GLY A 85 5.703 -8.724 2.296 1.00 24.45 O ATOM 0 H GLY A 85 7.792 -7.255 -0.633 1.00 53.43 H new ATOM 0 HA2 GLY A 85 6.959 -9.428 0.077 1.00 31.23 H new ATOM 0 HA3 GLY A 85 8.183 -9.449 1.331 1.00 31.23 H new ATOM 1210 N GLN A 86 6.749 -6.794 1.834 1.00 71.31 N ATOM 1211 CA GLN A 86 5.886 -5.999 2.686 1.00 33.21 C ATOM 1212 C GLN A 86 4.595 -5.657 1.947 1.00 12.42 C ATOM 1213 O GLN A 86 4.329 -6.199 0.873 1.00 14.13 O ATOM 1214 CB GLN A 86 6.607 -4.727 3.145 1.00 63.24 C ATOM 1215 CG GLN A 86 7.068 -3.825 2.015 1.00 62.43 C ATOM 1216 CD GLN A 86 7.854 -2.638 2.515 1.00 3.45 C ATOM 1217 OE1 GLN A 86 9.074 -2.699 2.647 1.00 74.32 O ATOM 1218 NE2 GLN A 86 7.164 -1.553 2.797 1.00 54.10 N ATOM 0 H GLN A 86 7.483 -6.264 1.364 1.00 71.31 H new ATOM 0 HA GLN A 86 5.634 -6.580 3.573 1.00 33.21 H new ATOM 0 HB2 GLN A 86 5.941 -4.161 3.796 1.00 63.24 H new ATOM 0 HB3 GLN A 86 7.473 -5.011 3.743 1.00 63.24 H new ATOM 0 HG2 GLN A 86 7.683 -4.399 1.322 1.00 62.43 H new ATOM 0 HG3 GLN A 86 6.201 -3.474 1.456 1.00 62.43 H new ATOM 0 HE21 GLN A 86 6.152 -1.546 2.673 1.00 54.10 H new ATOM 0 HE22 GLN A 86 7.642 -0.720 3.140 1.00 54.10 H new ATOM 1227 N GLN A 87 3.810 -4.747 2.496 1.00 12.23 N ATOM 1228 CA GLN A 87 2.538 -4.389 1.894 1.00 21.43 C ATOM 1229 C GLN A 87 2.035 -3.055 2.439 1.00 4.11 C ATOM 1230 O GLN A 87 1.432 -2.268 1.712 1.00 42.30 O ATOM 1231 CB GLN A 87 1.502 -5.499 2.127 1.00 71.25 C ATOM 1232 CG GLN A 87 1.316 -5.888 3.585 1.00 63.43 C ATOM 1233 CD GLN A 87 0.284 -6.979 3.773 1.00 1.50 C ATOM 1234 OE1 GLN A 87 -0.670 -7.096 3.000 1.00 45.34 O ATOM 1235 NE2 GLN A 87 0.463 -7.785 4.795 1.00 71.05 N ATOM 0 H GLN A 87 4.030 -4.244 3.355 1.00 12.23 H new ATOM 0 HA GLN A 87 2.687 -4.278 0.820 1.00 21.43 H new ATOM 0 HB2 GLN A 87 0.542 -5.174 1.725 1.00 71.25 H new ATOM 0 HB3 GLN A 87 1.801 -6.383 1.563 1.00 71.25 H new ATOM 0 HG2 GLN A 87 2.270 -6.223 3.992 1.00 63.43 H new ATOM 0 HG3 GLN A 87 1.017 -5.009 4.156 1.00 63.43 H new ATOM 0 HE21 GLN A 87 1.265 -7.656 5.412 1.00 71.05 H new ATOM 0 HE22 GLN A 87 -0.200 -8.540 4.971 1.00 71.05 H new ATOM 1244 N SER A 88 2.284 -2.804 3.714 1.00 33.24 N ATOM 1245 CA SER A 88 1.910 -1.547 4.326 1.00 43.21 C ATOM 1246 C SER A 88 3.136 -0.648 4.407 1.00 24.00 C ATOM 1247 O SER A 88 4.233 -1.122 4.726 1.00 23.44 O ATOM 1248 CB SER A 88 1.345 -1.797 5.721 1.00 14.20 C ATOM 1249 OG SER A 88 0.335 -2.791 5.677 1.00 4.34 O ATOM 0 H SER A 88 2.746 -3.460 4.345 1.00 33.24 H new ATOM 0 HA SER A 88 1.144 -1.059 3.724 1.00 43.21 H new ATOM 0 HB2 SER A 88 2.144 -2.112 6.392 1.00 14.20 H new ATOM 0 HB3 SER A 88 0.935 -0.871 6.125 1.00 14.20 H new ATOM 0 HG SER A 88 -0.016 -2.941 6.580 1.00 4.34 H new ATOM 1255 N ALA A 89 2.971 0.629 4.107 1.00 64.25 N ATOM 1256 CA ALA A 89 4.088 1.557 4.144 1.00 52.33 C ATOM 1257 C ALA A 89 3.616 2.995 4.198 1.00 44.54 C ATOM 1258 O ALA A 89 2.697 3.387 3.476 1.00 74.15 O ATOM 1259 CB ALA A 89 4.993 1.350 2.943 1.00 2.30 C ATOM 0 H ALA A 89 2.080 1.045 3.837 1.00 64.25 H new ATOM 0 HA ALA A 89 4.652 1.354 5.054 1.00 52.33 H new ATOM 0 HB1 ALA A 89 5.824 2.054 2.988 1.00 2.30 H new ATOM 0 HB2 ALA A 89 5.380 0.331 2.950 1.00 2.30 H new ATOM 0 HB3 ALA A 89 4.426 1.516 2.027 1.00 2.30 H new ATOM 1265 N GLN A 90 4.232 3.773 5.070 1.00 12.54 N ATOM 1266 CA GLN A 90 3.938 5.185 5.163 1.00 13.01 C ATOM 1267 C GLN A 90 5.133 5.973 4.663 1.00 44.12 C ATOM 1268 O GLN A 90 6.210 5.919 5.254 1.00 73.05 O ATOM 1269 CB GLN A 90 3.609 5.612 6.606 1.00 23.23 C ATOM 1270 CG GLN A 90 2.331 5.014 7.188 1.00 23.33 C ATOM 1271 CD GLN A 90 2.549 3.668 7.855 1.00 64.31 C ATOM 1272 OE1 GLN A 90 2.356 2.599 7.118 1.00 30.31 O flip ATOM 1273 NE2 GLN A 90 2.862 3.598 9.041 1.00 5.44 N flip ATOM 0 H GLN A 90 4.942 3.445 5.725 1.00 12.54 H new ATOM 0 HA GLN A 90 3.060 5.388 4.550 1.00 13.01 H new ATOM 0 HB2 GLN A 90 4.445 5.336 7.249 1.00 23.23 H new ATOM 0 HB3 GLN A 90 3.529 6.699 6.636 1.00 23.23 H new ATOM 0 HG2 GLN A 90 1.911 5.709 7.916 1.00 23.33 H new ATOM 0 HG3 GLN A 90 1.595 4.903 6.392 1.00 23.33 H new ATOM 0 HE21 GLN A 90 3.004 4.451 9.582 1.00 5.44 H new ATOM 0 HE22 GLN A 90 2.980 2.687 9.484 1.00 5.44 H new ATOM 1282 N LEU A 91 4.953 6.685 3.578 1.00 74.22 N ATOM 1283 CA LEU A 91 6.027 7.476 3.015 1.00 24.42 C ATOM 1284 C LEU A 91 5.692 8.947 3.097 1.00 51.21 C ATOM 1285 O LEU A 91 4.522 9.317 3.228 1.00 13.43 O ATOM 1286 CB LEU A 91 6.309 7.068 1.564 1.00 1.02 C ATOM 1287 CG LEU A 91 6.828 5.639 1.360 1.00 31.33 C ATOM 1288 CD1 LEU A 91 7.069 5.363 -0.113 1.00 14.20 C ATOM 1289 CD2 LEU A 91 8.107 5.409 2.159 1.00 71.45 C ATOM 0 H LEU A 91 4.073 6.735 3.064 1.00 74.22 H new ATOM 0 HA LEU A 91 6.929 7.289 3.597 1.00 24.42 H new ATOM 0 HB2 LEU A 91 5.391 7.186 0.988 1.00 1.02 H new ATOM 0 HB3 LEU A 91 7.039 7.762 1.147 1.00 1.02 H new ATOM 0 HG LEU A 91 6.067 4.947 1.722 1.00 31.33 H new ATOM 0 HD11 LEU A 91 7.437 4.344 -0.237 1.00 14.20 H new ATOM 0 HD12 LEU A 91 6.135 5.481 -0.663 1.00 14.20 H new ATOM 0 HD13 LEU A 91 7.808 6.065 -0.499 1.00 14.20 H new ATOM 0 HD21 LEU A 91 8.457 4.389 1.999 1.00 71.45 H new ATOM 0 HD22 LEU A 91 8.873 6.111 1.830 1.00 71.45 H new ATOM 0 HD23 LEU A 91 7.906 5.562 3.219 1.00 71.45 H new ATOM 1301 N ARG A 92 6.711 9.783 3.027 1.00 71.11 N ATOM 1302 CA ARG A 92 6.519 11.216 3.114 1.00 75.52 C ATOM 1303 C ARG A 92 6.183 11.799 1.748 1.00 42.44 C ATOM 1304 O ARG A 92 6.528 11.223 0.711 1.00 33.23 O ATOM 1305 CB ARG A 92 7.752 11.916 3.710 1.00 31.42 C ATOM 1306 CG ARG A 92 7.979 11.661 5.206 1.00 11.51 C ATOM 1307 CD ARG A 92 8.517 10.261 5.485 1.00 64.44 C ATOM 1308 NE ARG A 92 8.739 10.040 6.918 1.00 10.34 N ATOM 1309 CZ ARG A 92 9.544 9.103 7.438 1.00 44.45 C ATOM 1310 NH1 ARG A 92 10.225 8.278 6.643 1.00 63.21 N ATOM 1311 NH2 ARG A 92 9.669 9.000 8.758 1.00 24.02 N ATOM 0 H ARG A 92 7.682 9.492 2.910 1.00 71.11 H new ATOM 0 HA ARG A 92 5.679 11.394 3.785 1.00 75.52 H new ATOM 0 HB2 ARG A 92 8.637 11.591 3.162 1.00 31.42 H new ATOM 0 HB3 ARG A 92 7.655 12.990 3.550 1.00 31.42 H new ATOM 0 HG2 ARG A 92 8.679 12.400 5.595 1.00 11.51 H new ATOM 0 HG3 ARG A 92 7.040 11.799 5.741 1.00 11.51 H new ATOM 0 HD2 ARG A 92 7.814 9.519 5.107 1.00 64.44 H new ATOM 0 HD3 ARG A 92 9.453 10.117 4.945 1.00 64.44 H new ATOM 0 HE ARG A 92 8.242 10.647 7.570 1.00 10.34 H new ATOM 0 HH11 ARG A 92 10.136 8.357 5.630 1.00 63.21 H new ATOM 0 HH12 ARG A 92 10.835 7.568 7.048 1.00 63.21 H new ATOM 0 HH21 ARG A 92 9.153 9.632 9.370 1.00 24.02 H new ATOM 0 HH22 ARG A 92 10.280 8.288 9.158 1.00 24.02 H new ATOM 1325 N LEU A 93 5.544 12.952 1.763 1.00 1.41 N ATOM 1326 CA LEU A 93 5.078 13.598 0.544 1.00 43.41 C ATOM 1327 C LEU A 93 5.281 15.103 0.618 1.00 12.41 C ATOM 1328 O LEU A 93 5.244 15.689 1.699 1.00 61.23 O ATOM 1329 CB LEU A 93 3.586 13.295 0.325 1.00 64.14 C ATOM 1330 CG LEU A 93 3.218 12.504 -0.942 1.00 24.14 C ATOM 1331 CD1 LEU A 93 3.664 13.241 -2.197 1.00 52.13 C ATOM 1332 CD2 LEU A 93 3.807 11.103 -0.899 1.00 63.22 C ATOM 0 H LEU A 93 5.332 13.469 2.616 1.00 1.41 H new ATOM 0 HA LEU A 93 5.658 13.206 -0.291 1.00 43.41 H new ATOM 0 HB2 LEU A 93 3.221 12.740 1.190 1.00 64.14 H new ATOM 0 HB3 LEU A 93 3.047 14.242 0.303 1.00 64.14 H new ATOM 0 HG LEU A 93 2.132 12.413 -0.974 1.00 24.14 H new ATOM 0 HD11 LEU A 93 3.391 12.659 -3.077 1.00 52.13 H new ATOM 0 HD12 LEU A 93 3.176 14.215 -2.240 1.00 52.13 H new ATOM 0 HD13 LEU A 93 4.745 13.378 -2.174 1.00 52.13 H new ATOM 0 HD21 LEU A 93 3.532 10.565 -1.806 1.00 63.22 H new ATOM 0 HD22 LEU A 93 4.893 11.167 -0.830 1.00 63.22 H new ATOM 0 HD23 LEU A 93 3.419 10.572 -0.030 1.00 63.22 H new ATOM 1344 N HIS A 94 5.540 15.712 -0.523 1.00 43.41 N ATOM 1345 CA HIS A 94 5.668 17.160 -0.613 1.00 74.20 C ATOM 1346 C HIS A 94 4.518 17.747 -1.416 1.00 11.43 C ATOM 1347 O HIS A 94 4.186 17.238 -2.489 1.00 52.53 O ATOM 1348 CB HIS A 94 7.006 17.562 -1.237 1.00 43.51 C ATOM 1349 CG HIS A 94 8.125 17.659 -0.250 1.00 63.35 C ATOM 1350 ND1 HIS A 94 9.316 16.991 -0.392 1.00 60.33 N ATOM 1351 CD2 HIS A 94 8.234 18.374 0.892 1.00 13.43 C ATOM 1352 CE1 HIS A 94 10.107 17.285 0.617 1.00 0.21 C ATOM 1353 NE2 HIS A 94 9.476 18.124 1.412 1.00 51.14 N ATOM 0 H HIS A 94 5.667 15.224 -1.410 1.00 43.41 H new ATOM 0 HA HIS A 94 5.633 17.560 0.400 1.00 74.20 H new ATOM 0 HB2 HIS A 94 7.272 16.835 -2.004 1.00 43.51 H new ATOM 0 HB3 HIS A 94 6.889 18.524 -1.736 1.00 43.51 H new ATOM 0 HD2 HIS A 94 7.481 19.022 1.316 1.00 13.43 H new ATOM 0 HE1 HIS A 94 11.106 16.903 0.768 1.00 0.21 H new ATOM 0 HE2 HIS A 94 9.851 18.522 2.273 1.00 51.14 H new ATOM 1362 N PRO A 95 3.876 18.822 -0.910 1.00 51.23 N ATOM 1363 CA PRO A 95 4.225 19.443 0.381 1.00 32.02 C ATOM 1364 C PRO A 95 3.768 18.588 1.563 1.00 52.41 C ATOM 1365 O PRO A 95 2.775 17.860 1.462 1.00 4.21 O ATOM 1366 CB PRO A 95 3.450 20.762 0.352 1.00 51.42 C ATOM 1367 CG PRO A 95 2.274 20.481 -0.518 1.00 12.34 C ATOM 1368 CD PRO A 95 2.752 19.514 -1.566 1.00 70.23 C ATOM 0 HA PRO A 95 5.301 19.565 0.506 1.00 32.02 H new ATOM 0 HB2 PRO A 95 3.141 21.063 1.353 1.00 51.42 H new ATOM 0 HB3 PRO A 95 4.058 21.572 -0.051 1.00 51.42 H new ATOM 0 HG2 PRO A 95 1.454 20.055 0.060 1.00 12.34 H new ATOM 0 HG3 PRO A 95 1.899 21.397 -0.975 1.00 12.34 H new ATOM 0 HD2 PRO A 95 1.966 18.817 -1.857 1.00 70.23 H new ATOM 0 HD3 PRO A 95 3.072 20.030 -2.472 1.00 70.23 H new ATOM 1376 N GLU A 96 4.492 18.670 2.677 1.00 13.13 N ATOM 1377 CA GLU A 96 4.206 17.875 3.877 1.00 43.22 C ATOM 1378 C GLU A 96 2.897 18.265 4.590 1.00 14.21 C ATOM 1379 O GLU A 96 2.744 17.984 5.778 1.00 31.31 O ATOM 1380 CB GLU A 96 5.373 18.011 4.858 1.00 45.55 C ATOM 1381 CG GLU A 96 6.711 17.545 4.303 1.00 71.41 C ATOM 1382 CD GLU A 96 7.874 17.955 5.180 1.00 35.11 C ATOM 1383 OE1 GLU A 96 8.090 17.320 6.230 1.00 12.02 O ATOM 1384 OE2 GLU A 96 8.571 18.929 4.830 1.00 72.33 O ATOM 0 H GLU A 96 5.296 19.290 2.777 1.00 13.13 H new ATOM 0 HA GLU A 96 4.080 16.845 3.544 1.00 43.22 H new ATOM 0 HB2 GLU A 96 5.461 19.055 5.159 1.00 45.55 H new ATOM 0 HB3 GLU A 96 5.146 17.438 5.757 1.00 45.55 H new ATOM 0 HG2 GLU A 96 6.701 16.460 4.202 1.00 71.41 H new ATOM 0 HG3 GLU A 96 6.850 17.957 3.304 1.00 71.41 H new ATOM 1391 N GLU A 97 1.967 18.907 3.886 1.00 13.44 N ATOM 1392 CA GLU A 97 0.678 19.233 4.489 1.00 4.14 C ATOM 1393 C GLU A 97 0.000 17.958 5.000 1.00 72.42 C ATOM 1394 O GLU A 97 -0.380 17.873 6.164 1.00 54.03 O ATOM 1395 CB GLU A 97 -0.241 20.019 3.528 1.00 11.01 C ATOM 1396 CG GLU A 97 -0.648 19.288 2.262 1.00 33.41 C ATOM 1397 CD GLU A 97 -1.704 20.045 1.489 1.00 10.54 C ATOM 1398 OE1 GLU A 97 -2.882 20.037 1.919 1.00 14.42 O ATOM 1399 OE2 GLU A 97 -1.370 20.656 0.462 1.00 42.25 O ATOM 0 H GLU A 97 2.078 19.206 2.917 1.00 13.44 H new ATOM 0 HA GLU A 97 0.865 19.893 5.336 1.00 4.14 H new ATOM 0 HB2 GLU A 97 -1.144 20.302 4.069 1.00 11.01 H new ATOM 0 HB3 GLU A 97 0.264 20.943 3.246 1.00 11.01 H new ATOM 0 HG2 GLU A 97 0.228 19.140 1.631 1.00 33.41 H new ATOM 0 HG3 GLU A 97 -1.026 18.299 2.520 1.00 33.41 H new ATOM 1406 N LEU A 98 -0.152 16.969 4.118 1.00 45.21 N ATOM 1407 CA LEU A 98 -0.684 15.665 4.503 1.00 23.43 C ATOM 1408 C LEU A 98 0.288 14.963 5.446 1.00 52.34 C ATOM 1409 O LEU A 98 -0.101 14.112 6.246 1.00 44.42 O ATOM 1410 CB LEU A 98 -0.898 14.796 3.258 1.00 75.53 C ATOM 1411 CG LEU A 98 -1.569 15.482 2.064 1.00 14.01 C ATOM 1412 CD1 LEU A 98 -1.774 14.496 0.929 1.00 61.44 C ATOM 1413 CD2 LEU A 98 -2.888 16.111 2.472 1.00 42.50 C ATOM 0 H LEU A 98 0.087 17.049 3.130 1.00 45.21 H new ATOM 0 HA LEU A 98 -1.638 15.813 5.009 1.00 23.43 H new ATOM 0 HB2 LEU A 98 0.071 14.415 2.935 1.00 75.53 H new ATOM 0 HB3 LEU A 98 -1.501 13.933 3.541 1.00 75.53 H new ATOM 0 HG LEU A 98 -0.910 16.277 1.715 1.00 14.01 H new ATOM 0 HD11 LEU A 98 -2.252 15.001 0.090 1.00 61.44 H new ATOM 0 HD12 LEU A 98 -0.809 14.100 0.612 1.00 61.44 H new ATOM 0 HD13 LEU A 98 -2.409 13.677 1.268 1.00 61.44 H new ATOM 0 HD21 LEU A 98 -3.345 16.592 1.607 1.00 42.50 H new ATOM 0 HD22 LEU A 98 -3.557 15.339 2.853 1.00 42.50 H new ATOM 0 HD23 LEU A 98 -2.712 16.855 3.249 1.00 42.50 H new ATOM 1425 N GLY A 99 1.552 15.334 5.331 1.00 55.21 N ATOM 1426 CA GLY A 99 2.607 14.772 6.149 1.00 31.23 C ATOM 1427 C GLY A 99 3.073 13.414 5.676 1.00 32.43 C ATOM 1428 O GLY A 99 4.275 13.167 5.579 1.00 3.11 O ATOM 0 H GLY A 99 1.874 16.036 4.665 1.00 55.21 H new ATOM 0 HA2 GLY A 99 3.455 15.457 6.156 1.00 31.23 H new ATOM 0 HA3 GLY A 99 2.255 14.689 7.177 1.00 31.23 H new ATOM 1432 N GLN A 100 2.137 12.543 5.356 1.00 52.55 N ATOM 1433 CA GLN A 100 2.461 11.211 4.899 1.00 11.45 C ATOM 1434 C GLN A 100 1.286 10.586 4.165 1.00 32.05 C ATOM 1435 O GLN A 100 0.207 11.180 4.075 1.00 74.43 O ATOM 1436 CB GLN A 100 2.932 10.319 6.059 1.00 30.02 C ATOM 1437 CG GLN A 100 2.069 10.399 7.307 1.00 42.51 C ATOM 1438 CD GLN A 100 2.571 9.488 8.411 1.00 72.25 C ATOM 1439 OE1 GLN A 100 3.762 9.191 8.496 1.00 42.14 O ATOM 1440 NE2 GLN A 100 1.676 9.064 9.270 1.00 14.02 N ATOM 0 H GLN A 100 1.137 12.739 5.406 1.00 52.55 H new ATOM 0 HA GLN A 100 3.289 11.294 4.195 1.00 11.45 H new ATOM 0 HB2 GLN A 100 2.959 9.284 5.717 1.00 30.02 H new ATOM 0 HB3 GLN A 100 3.954 10.595 6.321 1.00 30.02 H new ATOM 0 HG2 GLN A 100 2.050 11.427 7.668 1.00 42.51 H new ATOM 0 HG3 GLN A 100 1.043 10.130 7.055 1.00 42.51 H new ATOM 0 HE21 GLN A 100 0.698 9.334 9.163 1.00 14.02 H new ATOM 0 HE22 GLN A 100 1.957 8.464 10.045 1.00 14.02 H new ATOM 1449 N VAL A 101 1.502 9.386 3.667 1.00 5.00 N ATOM 1450 CA VAL A 101 0.483 8.635 2.953 1.00 10.43 C ATOM 1451 C VAL A 101 0.478 7.198 3.456 1.00 72.31 C ATOM 1452 O VAL A 101 1.539 6.591 3.623 1.00 22.54 O ATOM 1453 CB VAL A 101 0.728 8.642 1.415 1.00 51.12 C ATOM 1454 CG1 VAL A 101 -0.339 7.829 0.690 1.00 1.24 C ATOM 1455 CG2 VAL A 101 0.759 10.067 0.879 1.00 52.30 C ATOM 0 H VAL A 101 2.395 8.899 3.745 1.00 5.00 H new ATOM 0 HA VAL A 101 -0.480 9.111 3.140 1.00 10.43 H new ATOM 0 HB VAL A 101 1.698 8.181 1.229 1.00 51.12 H new ATOM 0 HG11 VAL A 101 -0.146 7.849 -0.383 1.00 1.24 H new ATOM 0 HG12 VAL A 101 -0.314 6.798 1.044 1.00 1.24 H new ATOM 0 HG13 VAL A 101 -1.321 8.257 0.890 1.00 1.24 H new ATOM 0 HG21 VAL A 101 0.931 10.047 -0.197 1.00 52.30 H new ATOM 0 HG22 VAL A 101 -0.194 10.554 1.085 1.00 52.30 H new ATOM 0 HG23 VAL A 101 1.562 10.621 1.365 1.00 52.30 H new ATOM 1465 N HIS A 102 -0.702 6.663 3.720 1.00 20.24 N ATOM 1466 CA HIS A 102 -0.822 5.302 4.213 1.00 13.51 C ATOM 1467 C HIS A 102 -1.274 4.377 3.106 1.00 42.22 C ATOM 1468 O HIS A 102 -2.454 4.350 2.753 1.00 40.12 O ATOM 1469 CB HIS A 102 -1.823 5.217 5.374 1.00 72.13 C ATOM 1470 CG HIS A 102 -1.366 5.846 6.655 1.00 61.35 C ATOM 1471 ND1 HIS A 102 -1.312 5.159 7.845 1.00 64.25 N ATOM 1472 CD2 HIS A 102 -0.977 7.110 6.941 1.00 41.40 C ATOM 1473 CE1 HIS A 102 -0.914 5.966 8.802 1.00 33.13 C ATOM 1474 NE2 HIS A 102 -0.704 7.159 8.284 1.00 4.53 N ATOM 0 H HIS A 102 -1.590 7.150 3.601 1.00 20.24 H new ATOM 0 HA HIS A 102 0.161 4.996 4.570 1.00 13.51 H new ATOM 0 HB2 HIS A 102 -2.754 5.692 5.066 1.00 72.13 H new ATOM 0 HB3 HIS A 102 -2.048 4.167 5.563 1.00 72.13 H new ATOM 0 HD1 HIS A 102 -1.545 4.173 7.966 1.00 64.25 H new ATOM 0 HD2 HIS A 102 -0.896 7.929 6.241 1.00 41.40 H new ATOM 0 HE1 HIS A 102 -0.781 5.697 9.839 1.00 33.13 H new ATOM 1483 N ILE A 103 -0.344 3.643 2.541 1.00 2.33 N ATOM 1484 CA ILE A 103 -0.666 2.676 1.516 1.00 33.11 C ATOM 1485 C ILE A 103 -0.771 1.289 2.127 1.00 11.41 C ATOM 1486 O ILE A 103 0.209 0.763 2.662 1.00 54.12 O ATOM 1487 CB ILE A 103 0.414 2.662 0.408 1.00 51.24 C ATOM 1488 CG1 ILE A 103 0.610 4.074 -0.157 1.00 12.43 C ATOM 1489 CG2 ILE A 103 0.030 1.688 -0.704 1.00 20.32 C ATOM 1490 CD1 ILE A 103 1.779 4.196 -1.109 1.00 61.22 C ATOM 0 H ILE A 103 0.647 3.697 2.775 1.00 2.33 H new ATOM 0 HA ILE A 103 -1.621 2.960 1.073 1.00 33.11 H new ATOM 0 HB ILE A 103 1.355 2.327 0.844 1.00 51.24 H new ATOM 0 HG12 ILE A 103 -0.300 4.377 -0.674 1.00 12.43 H new ATOM 0 HG13 ILE A 103 0.754 4.769 0.670 1.00 12.43 H new ATOM 0 HG21 ILE A 103 0.802 1.692 -1.474 1.00 20.32 H new ATOM 0 HG22 ILE A 103 -0.065 0.684 -0.291 1.00 20.32 H new ATOM 0 HG23 ILE A 103 -0.921 1.992 -1.142 1.00 20.32 H new ATOM 0 HD11 ILE A 103 1.852 5.223 -1.466 1.00 61.22 H new ATOM 0 HD12 ILE A 103 2.699 3.925 -0.592 1.00 61.22 H new ATOM 0 HD13 ILE A 103 1.629 3.527 -1.957 1.00 61.22 H new ATOM 1502 N SER A 104 -1.953 0.716 2.085 1.00 33.15 N ATOM 1503 CA SER A 104 -2.156 -0.613 2.608 1.00 42.30 C ATOM 1504 C SER A 104 -2.673 -1.535 1.514 1.00 13.24 C ATOM 1505 O SER A 104 -3.883 -1.687 1.330 1.00 31.23 O ATOM 1506 CB SER A 104 -3.118 -0.595 3.811 1.00 2.51 C ATOM 1507 OG SER A 104 -3.221 -1.881 4.416 1.00 22.32 O ATOM 0 H SER A 104 -2.788 1.151 1.693 1.00 33.15 H new ATOM 0 HA SER A 104 -1.197 -0.994 2.958 1.00 42.30 H new ATOM 0 HB2 SER A 104 -2.768 0.128 4.548 1.00 2.51 H new ATOM 0 HB3 SER A 104 -4.104 -0.265 3.485 1.00 2.51 H new ATOM 0 HG SER A 104 -3.706 -1.806 5.264 1.00 22.32 H new ATOM 1513 N LEU A 105 -1.756 -2.094 0.747 1.00 10.30 N ATOM 1514 CA LEU A 105 -2.111 -3.031 -0.293 1.00 71.15 C ATOM 1515 C LEU A 105 -2.155 -4.444 0.263 1.00 25.31 C ATOM 1516 O LEU A 105 -1.144 -4.984 0.706 1.00 34.04 O ATOM 1517 CB LEU A 105 -1.086 -2.947 -1.432 1.00 41.53 C ATOM 1518 CG LEU A 105 -1.328 -3.869 -2.630 1.00 40.42 C ATOM 1519 CD1 LEU A 105 -2.589 -3.467 -3.370 1.00 21.40 C ATOM 1520 CD2 LEU A 105 -0.129 -3.854 -3.566 1.00 42.00 C ATOM 0 H LEU A 105 -0.756 -1.912 0.828 1.00 10.30 H new ATOM 0 HA LEU A 105 -3.099 -2.778 -0.677 1.00 71.15 H new ATOM 0 HB2 LEU A 105 -1.058 -1.918 -1.792 1.00 41.53 H new ATOM 0 HB3 LEU A 105 -0.100 -3.169 -1.023 1.00 41.53 H new ATOM 0 HG LEU A 105 -1.461 -4.885 -2.258 1.00 40.42 H new ATOM 0 HD11 LEU A 105 -2.742 -4.135 -4.218 1.00 21.40 H new ATOM 0 HD12 LEU A 105 -3.443 -3.534 -2.696 1.00 21.40 H new ATOM 0 HD13 LEU A 105 -2.489 -2.443 -3.729 1.00 21.40 H new ATOM 0 HD21 LEU A 105 -0.319 -4.515 -4.412 1.00 42.00 H new ATOM 0 HD22 LEU A 105 0.037 -2.840 -3.929 1.00 42.00 H new ATOM 0 HD23 LEU A 105 0.756 -4.197 -3.029 1.00 42.00 H new ATOM 1532 N LYS A 106 -3.329 -5.022 0.247 1.00 3.24 N ATOM 1533 CA LYS A 106 -3.546 -6.368 0.737 1.00 62.21 C ATOM 1534 C LYS A 106 -3.599 -7.333 -0.431 1.00 24.34 C ATOM 1535 O LYS A 106 -3.904 -6.932 -1.546 1.00 71.24 O ATOM 1536 CB LYS A 106 -4.815 -6.440 1.583 1.00 12.01 C ATOM 1537 CG LYS A 106 -4.681 -5.729 2.921 1.00 55.14 C ATOM 1538 CD LYS A 106 -5.962 -5.804 3.730 1.00 2.33 C ATOM 1539 CE LYS A 106 -5.763 -5.251 5.136 1.00 64.12 C ATOM 1540 NZ LYS A 106 -5.273 -3.844 5.129 1.00 24.01 N ATOM 0 H LYS A 106 -4.172 -4.571 -0.109 1.00 3.24 H new ATOM 0 HA LYS A 106 -2.714 -6.653 1.381 1.00 62.21 H new ATOM 0 HB2 LYS A 106 -5.642 -6.000 1.025 1.00 12.01 H new ATOM 0 HB3 LYS A 106 -5.069 -7.485 1.758 1.00 12.01 H new ATOM 0 HG2 LYS A 106 -3.865 -6.176 3.490 1.00 55.14 H new ATOM 0 HG3 LYS A 106 -4.418 -4.685 2.753 1.00 55.14 H new ATOM 0 HD2 LYS A 106 -6.747 -5.243 3.224 1.00 2.33 H new ATOM 0 HD3 LYS A 106 -6.297 -6.839 3.788 1.00 2.33 H new ATOM 0 HE2 LYS A 106 -6.706 -5.302 5.680 1.00 64.12 H new ATOM 0 HE3 LYS A 106 -5.051 -5.878 5.673 1.00 64.12 H new ATOM 0 HZ1 LYS A 106 -5.314 -3.457 6.094 1.00 24.01 H new ATOM 0 HZ2 LYS A 106 -4.291 -3.820 4.788 1.00 24.01 H new ATOM 0 HZ3 LYS A 106 -5.872 -3.271 4.500 1.00 24.01 H new ATOM 1554 N LEU A 107 -3.314 -8.596 -0.184 1.00 13.23 N ATOM 1555 CA LEU A 107 -3.206 -9.559 -1.261 1.00 74.12 C ATOM 1556 C LEU A 107 -3.974 -10.832 -0.930 1.00 34.02 C ATOM 1557 O LEU A 107 -3.894 -11.348 0.186 1.00 22.44 O ATOM 1558 CB LEU A 107 -1.736 -9.884 -1.546 1.00 53.34 C ATOM 1559 CG LEU A 107 -1.471 -10.846 -2.710 1.00 15.45 C ATOM 1560 CD1 LEU A 107 -1.954 -10.251 -4.026 1.00 23.25 C ATOM 1561 CD2 LEU A 107 0.009 -11.189 -2.789 1.00 45.21 C ATOM 0 H LEU A 107 -3.154 -8.978 0.748 1.00 13.23 H new ATOM 0 HA LEU A 107 -3.645 -9.117 -2.155 1.00 74.12 H new ATOM 0 HB2 LEU A 107 -1.211 -8.950 -1.746 1.00 53.34 H new ATOM 0 HB3 LEU A 107 -1.297 -10.309 -0.643 1.00 53.34 H new ATOM 0 HG LEU A 107 -2.030 -11.764 -2.528 1.00 15.45 H new ATOM 0 HD11 LEU A 107 -1.755 -10.952 -4.837 1.00 23.25 H new ATOM 0 HD12 LEU A 107 -3.025 -10.059 -3.967 1.00 23.25 H new ATOM 0 HD13 LEU A 107 -1.428 -9.316 -4.217 1.00 23.25 H new ATOM 0 HD21 LEU A 107 0.180 -11.873 -3.620 1.00 45.21 H new ATOM 0 HD22 LEU A 107 0.586 -10.277 -2.944 1.00 45.21 H new ATOM 0 HD23 LEU A 107 0.323 -11.663 -1.859 1.00 45.21 H new ATOM 1573 N ASP A 108 -4.716 -11.324 -1.899 1.00 13.04 N ATOM 1574 CA ASP A 108 -5.471 -12.556 -1.752 1.00 24.33 C ATOM 1575 C ASP A 108 -5.538 -13.260 -3.086 1.00 13.21 C ATOM 1576 O ASP A 108 -5.841 -12.634 -4.095 1.00 51.13 O ATOM 1577 CB ASP A 108 -6.883 -12.272 -1.229 1.00 65.12 C ATOM 1578 CG ASP A 108 -7.725 -13.526 -1.114 1.00 41.01 C ATOM 1579 OD1 ASP A 108 -7.576 -14.257 -0.114 1.00 30.22 O ATOM 1580 OD2 ASP A 108 -8.541 -13.790 -2.024 1.00 0.21 O ATOM 0 H ASP A 108 -4.815 -10.883 -2.813 1.00 13.04 H new ATOM 0 HA ASP A 108 -4.968 -13.196 -1.027 1.00 24.33 H new ATOM 0 HB2 ASP A 108 -6.815 -11.794 -0.252 1.00 65.12 H new ATOM 0 HB3 ASP A 108 -7.378 -11.566 -1.896 1.00 65.12 H new ATOM 1585 N ASP A 109 -5.279 -14.567 -3.082 1.00 75.41 N ATOM 1586 CA ASP A 109 -5.209 -15.381 -4.307 1.00 3.43 C ATOM 1587 C ASP A 109 -4.320 -14.736 -5.387 1.00 23.11 C ATOM 1588 O ASP A 109 -3.109 -14.952 -5.407 1.00 32.34 O ATOM 1589 CB ASP A 109 -6.610 -15.690 -4.850 1.00 4.55 C ATOM 1590 CG ASP A 109 -6.581 -16.632 -6.033 1.00 21.40 C ATOM 1591 OD1 ASP A 109 -6.139 -17.783 -5.872 1.00 32.24 O ATOM 1592 OD2 ASP A 109 -6.997 -16.227 -7.126 1.00 10.12 O ATOM 0 H ASP A 109 -5.110 -15.099 -2.228 1.00 75.41 H new ATOM 0 HA ASP A 109 -4.738 -16.325 -4.033 1.00 3.43 H new ATOM 0 HB2 ASP A 109 -7.215 -16.128 -4.056 1.00 4.55 H new ATOM 0 HB3 ASP A 109 -7.095 -14.759 -5.143 1.00 4.55 H new ATOM 1597 N ASN A 110 -4.917 -13.933 -6.260 1.00 61.33 N ATOM 1598 CA ASN A 110 -4.170 -13.253 -7.312 1.00 70.25 C ATOM 1599 C ASN A 110 -4.704 -11.835 -7.492 1.00 21.23 C ATOM 1600 O ASN A 110 -4.429 -11.166 -8.493 1.00 64.13 O ATOM 1601 CB ASN A 110 -4.283 -14.035 -8.640 1.00 32.24 C ATOM 1602 CG ASN A 110 -5.586 -13.772 -9.390 1.00 50.34 C ATOM 1603 OD1 ASN A 110 -5.645 -12.918 -10.274 1.00 1.52 O ATOM 1604 ND2 ASN A 110 -6.630 -14.487 -9.042 1.00 33.14 N ATOM 0 H ASN A 110 -5.918 -13.736 -6.260 1.00 61.33 H new ATOM 0 HA ASN A 110 -3.120 -13.205 -7.024 1.00 70.25 H new ATOM 0 HB2 ASN A 110 -3.443 -13.769 -9.282 1.00 32.24 H new ATOM 0 HB3 ASN A 110 -4.201 -15.102 -8.433 1.00 32.24 H new ATOM 0 HD21 ASN A 110 -7.525 -14.343 -9.509 1.00 33.14 H new ATOM 0 HD22 ASN A 110 -6.546 -15.187 -8.305 1.00 33.14 H new ATOM 1611 N GLN A 111 -5.395 -11.354 -6.475 1.00 65.04 N ATOM 1612 CA GLN A 111 -6.025 -10.055 -6.529 1.00 72.04 C ATOM 1613 C GLN A 111 -5.673 -9.264 -5.283 1.00 42.00 C ATOM 1614 O GLN A 111 -5.640 -9.806 -4.173 1.00 34.41 O ATOM 1615 CB GLN A 111 -7.553 -10.186 -6.723 1.00 24.33 C ATOM 1616 CG GLN A 111 -8.280 -10.994 -5.652 1.00 61.34 C ATOM 1617 CD GLN A 111 -8.734 -10.149 -4.478 1.00 72.15 C ATOM 1618 OE1 GLN A 111 -9.040 -8.963 -4.627 1.00 13.23 O ATOM 1619 NE2 GLN A 111 -8.790 -10.748 -3.312 1.00 75.42 N ATOM 0 H GLN A 111 -5.533 -11.852 -5.595 1.00 65.04 H new ATOM 0 HA GLN A 111 -5.647 -9.509 -7.394 1.00 72.04 H new ATOM 0 HB2 GLN A 111 -7.985 -9.186 -6.756 1.00 24.33 H new ATOM 0 HB3 GLN A 111 -7.741 -10.647 -7.693 1.00 24.33 H new ATOM 0 HG2 GLN A 111 -9.147 -11.481 -6.098 1.00 61.34 H new ATOM 0 HG3 GLN A 111 -7.621 -11.784 -5.291 1.00 61.34 H new ATOM 0 HE21 GLN A 111 -8.528 -11.731 -3.230 1.00 75.42 H new ATOM 0 HE22 GLN A 111 -9.095 -10.231 -2.487 1.00 75.42 H new ATOM 1628 N ALA A 112 -5.374 -8.004 -5.463 1.00 13.11 N ATOM 1629 CA ALA A 112 -4.949 -7.177 -4.368 1.00 31.40 C ATOM 1630 C ALA A 112 -5.934 -6.057 -4.075 1.00 11.01 C ATOM 1631 O ALA A 112 -6.531 -5.473 -4.990 1.00 1.21 O ATOM 1632 CB ALA A 112 -3.573 -6.610 -4.663 1.00 51.15 C ATOM 0 H ALA A 112 -5.418 -7.527 -6.364 1.00 13.11 H new ATOM 0 HA ALA A 112 -4.906 -7.802 -3.476 1.00 31.40 H new ATOM 0 HB1 ALA A 112 -3.252 -5.983 -3.831 1.00 51.15 H new ATOM 0 HB2 ALA A 112 -2.864 -7.427 -4.796 1.00 51.15 H new ATOM 0 HB3 ALA A 112 -3.613 -6.012 -5.574 1.00 51.15 H new ATOM 1638 N GLN A 113 -6.118 -5.788 -2.794 1.00 14.31 N ATOM 1639 CA GLN A 113 -6.950 -4.696 -2.342 1.00 50.43 C ATOM 1640 C GLN A 113 -6.082 -3.485 -2.049 1.00 55.11 C ATOM 1641 O GLN A 113 -5.256 -3.507 -1.135 1.00 75.40 O ATOM 1642 CB GLN A 113 -7.732 -5.084 -1.085 1.00 22.21 C ATOM 1643 CG GLN A 113 -8.593 -3.953 -0.535 1.00 11.30 C ATOM 1644 CD GLN A 113 -9.232 -4.286 0.796 1.00 14.44 C ATOM 1645 OE1 GLN A 113 -8.684 -5.045 1.594 1.00 0.35 O ATOM 1646 NE2 GLN A 113 -10.390 -3.718 1.047 1.00 2.32 N ATOM 0 H GLN A 113 -5.691 -6.325 -2.039 1.00 14.31 H new ATOM 0 HA GLN A 113 -7.665 -4.458 -3.130 1.00 50.43 H new ATOM 0 HB2 GLN A 113 -8.369 -5.939 -1.312 1.00 22.21 H new ATOM 0 HB3 GLN A 113 -7.031 -5.405 -0.314 1.00 22.21 H new ATOM 0 HG2 GLN A 113 -7.980 -3.059 -0.423 1.00 11.30 H new ATOM 0 HG3 GLN A 113 -9.374 -3.715 -1.257 1.00 11.30 H new ATOM 0 HE21 GLN A 113 -10.812 -3.094 0.359 1.00 2.32 H new ATOM 0 HE22 GLN A 113 -10.867 -3.901 1.930 1.00 2.32 H new ATOM 1655 N LEU A 114 -6.263 -2.444 -2.824 1.00 33.34 N ATOM 1656 CA LEU A 114 -5.485 -1.238 -2.667 1.00 60.42 C ATOM 1657 C LEU A 114 -6.237 -0.230 -1.803 1.00 12.21 C ATOM 1658 O LEU A 114 -7.236 0.357 -2.231 1.00 23.41 O ATOM 1659 CB LEU A 114 -5.141 -0.660 -4.062 1.00 72.24 C ATOM 1660 CG LEU A 114 -4.196 0.560 -4.122 1.00 3.05 C ATOM 1661 CD1 LEU A 114 -4.938 1.846 -3.833 1.00 63.54 C ATOM 1662 CD2 LEU A 114 -3.022 0.394 -3.164 1.00 45.52 C ATOM 0 H LEU A 114 -6.949 -2.408 -3.578 1.00 33.34 H new ATOM 0 HA LEU A 114 -4.550 -1.467 -2.155 1.00 60.42 H new ATOM 0 HB2 LEU A 114 -4.695 -1.459 -4.655 1.00 72.24 H new ATOM 0 HB3 LEU A 114 -6.076 -0.384 -4.550 1.00 72.24 H new ATOM 0 HG LEU A 114 -3.803 0.618 -5.137 1.00 3.05 H new ATOM 0 HD11 LEU A 114 -4.244 2.685 -3.883 1.00 63.54 H new ATOM 0 HD12 LEU A 114 -5.728 1.984 -4.571 1.00 63.54 H new ATOM 0 HD13 LEU A 114 -5.377 1.797 -2.836 1.00 63.54 H new ATOM 0 HD21 LEU A 114 -2.374 1.268 -3.228 1.00 45.52 H new ATOM 0 HD22 LEU A 114 -3.395 0.293 -2.145 1.00 45.52 H new ATOM 0 HD23 LEU A 114 -2.456 -0.498 -3.433 1.00 45.52 H new ATOM 1674 N GLN A 115 -5.780 -0.067 -0.577 1.00 21.23 N ATOM 1675 CA GLN A 115 -6.369 0.889 0.339 1.00 54.41 C ATOM 1676 C GLN A 115 -5.487 2.118 0.459 1.00 53.41 C ATOM 1677 O GLN A 115 -4.283 2.004 0.718 1.00 12.44 O ATOM 1678 CB GLN A 115 -6.566 0.264 1.717 1.00 52.33 C ATOM 1679 CG GLN A 115 -7.532 -0.902 1.739 1.00 12.21 C ATOM 1680 CD GLN A 115 -7.664 -1.506 3.117 1.00 20.20 C ATOM 1681 OE1 GLN A 115 -6.933 -2.426 3.478 1.00 32.41 O ATOM 1682 NE2 GLN A 115 -8.590 -0.991 3.900 1.00 22.34 N ATOM 0 H GLN A 115 -4.995 -0.590 -0.190 1.00 21.23 H new ATOM 0 HA GLN A 115 -7.341 1.183 -0.057 1.00 54.41 H new ATOM 0 HB2 GLN A 115 -5.600 -0.073 2.092 1.00 52.33 H new ATOM 0 HB3 GLN A 115 -6.925 1.031 2.403 1.00 52.33 H new ATOM 0 HG2 GLN A 115 -8.511 -0.568 1.395 1.00 12.21 H new ATOM 0 HG3 GLN A 115 -7.193 -1.666 1.040 1.00 12.21 H new ATOM 0 HE21 GLN A 115 -9.176 -0.228 3.563 1.00 22.34 H new ATOM 0 HE22 GLN A 115 -8.720 -1.356 4.844 1.00 22.34 H new ATOM 1691 N MET A 116 -6.077 3.282 0.273 1.00 23.34 N ATOM 1692 CA MET A 116 -5.355 4.536 0.397 1.00 4.20 C ATOM 1693 C MET A 116 -6.197 5.557 1.126 1.00 42.20 C ATOM 1694 O MET A 116 -7.425 5.592 0.979 1.00 5.44 O ATOM 1695 CB MET A 116 -4.923 5.093 -0.963 1.00 45.53 C ATOM 1696 CG MET A 116 -3.815 4.303 -1.633 1.00 13.24 C ATOM 1697 SD MET A 116 -3.155 5.123 -3.099 1.00 44.12 S ATOM 1698 CE MET A 116 -4.651 5.405 -4.048 1.00 5.51 C ATOM 0 H MET A 116 -7.063 3.387 0.033 1.00 23.34 H new ATOM 0 HA MET A 116 -4.452 4.330 0.971 1.00 4.20 H new ATOM 0 HB2 MET A 116 -5.789 5.117 -1.625 1.00 45.53 H new ATOM 0 HB3 MET A 116 -4.592 6.123 -0.833 1.00 45.53 H new ATOM 0 HG2 MET A 116 -3.008 4.142 -0.919 1.00 13.24 H new ATOM 0 HG3 MET A 116 -4.194 3.320 -1.913 1.00 13.24 H new ATOM 0 HE1 MET A 116 -4.418 5.373 -5.112 1.00 5.51 H new ATOM 0 HE2 MET A 116 -5.382 4.632 -3.813 1.00 5.51 H new ATOM 0 HE3 MET A 116 -5.063 6.382 -3.796 1.00 5.51 H new ATOM 1708 N VAL A 117 -5.545 6.370 1.916 1.00 12.11 N ATOM 1709 CA VAL A 117 -6.212 7.404 2.659 1.00 3.24 C ATOM 1710 C VAL A 117 -5.639 8.769 2.311 1.00 71.53 C ATOM 1711 O VAL A 117 -4.441 9.011 2.461 1.00 74.54 O ATOM 1712 CB VAL A 117 -6.130 7.144 4.188 1.00 14.12 C ATOM 1713 CG1 VAL A 117 -6.338 8.425 4.976 1.00 34.40 C ATOM 1714 CG2 VAL A 117 -7.172 6.110 4.597 1.00 52.43 C ATOM 0 H VAL A 117 -4.536 6.333 2.062 1.00 12.11 H new ATOM 0 HA VAL A 117 -7.265 7.391 2.378 1.00 3.24 H new ATOM 0 HB VAL A 117 -5.133 6.765 4.413 1.00 14.12 H new ATOM 0 HG11 VAL A 117 -6.275 8.210 6.043 1.00 34.40 H new ATOM 0 HG12 VAL A 117 -5.568 9.148 4.705 1.00 34.40 H new ATOM 0 HG13 VAL A 117 -7.320 8.838 4.747 1.00 34.40 H new ATOM 0 HG21 VAL A 117 -7.108 5.934 5.671 1.00 52.43 H new ATOM 0 HG22 VAL A 117 -8.167 6.479 4.349 1.00 52.43 H new ATOM 0 HG23 VAL A 117 -6.987 5.177 4.064 1.00 52.43 H new ATOM 1724 N SER A 118 -6.497 9.642 1.832 1.00 4.54 N ATOM 1725 CA SER A 118 -6.111 10.979 1.456 1.00 35.04 C ATOM 1726 C SER A 118 -7.344 11.880 1.451 1.00 44.33 C ATOM 1727 O SER A 118 -8.446 11.420 1.128 1.00 1.33 O ATOM 1728 CB SER A 118 -5.467 10.960 0.061 1.00 15.23 C ATOM 1729 OG SER A 118 -6.341 10.370 -0.891 1.00 61.34 O ATOM 0 H SER A 118 -7.487 9.441 1.693 1.00 4.54 H new ATOM 0 HA SER A 118 -5.387 11.365 2.174 1.00 35.04 H new ATOM 0 HB2 SER A 118 -5.222 11.977 -0.245 1.00 15.23 H new ATOM 0 HB3 SER A 118 -4.531 10.403 0.096 1.00 15.23 H new ATOM 0 HG SER A 118 -5.912 10.369 -1.772 1.00 61.34 H new ATOM 1735 N PRO A 119 -7.185 13.162 1.812 1.00 13.43 N ATOM 1736 CA PRO A 119 -8.296 14.128 1.840 1.00 61.41 C ATOM 1737 C PRO A 119 -8.814 14.419 0.435 1.00 51.21 C ATOM 1738 O PRO A 119 -8.213 13.991 -0.554 1.00 70.35 O ATOM 1739 CB PRO A 119 -7.653 15.383 2.436 1.00 3.51 C ATOM 1740 CG PRO A 119 -6.209 15.248 2.125 1.00 14.31 C ATOM 1741 CD PRO A 119 -5.909 13.782 2.207 1.00 11.12 C ATOM 0 HA PRO A 119 -9.154 13.764 2.406 1.00 61.41 H new ATOM 0 HB2 PRO A 119 -8.070 16.289 1.996 1.00 3.51 H new ATOM 0 HB3 PRO A 119 -7.823 15.443 3.511 1.00 3.51 H new ATOM 0 HG2 PRO A 119 -5.985 15.638 1.132 1.00 14.31 H new ATOM 0 HG3 PRO A 119 -5.602 15.812 2.834 1.00 14.31 H new ATOM 0 HD2 PRO A 119 -5.097 13.498 1.537 1.00 11.12 H new ATOM 0 HD3 PRO A 119 -5.611 13.486 3.213 1.00 11.12 H new ATOM 1749 N HIS A 120 -9.909 15.161 0.325 1.00 54.31 N ATOM 1750 CA HIS A 120 -10.446 15.463 -0.987 1.00 24.43 C ATOM 1751 C HIS A 120 -9.835 16.749 -1.515 1.00 14.44 C ATOM 1752 O HIS A 120 -10.057 17.835 -0.974 1.00 33.52 O ATOM 1753 CB HIS A 120 -12.001 15.508 -1.000 1.00 71.24 C ATOM 1754 CG HIS A 120 -12.645 16.634 -0.221 1.00 53.22 C ATOM 1755 ND1 HIS A 120 -13.114 17.787 -0.815 1.00 14.20 N ATOM 1756 CD2 HIS A 120 -12.931 16.755 1.095 1.00 63.31 C ATOM 1757 CE1 HIS A 120 -13.655 18.565 0.099 1.00 24.32 C ATOM 1758 NE2 HIS A 120 -13.559 17.965 1.266 1.00 75.23 N ATOM 0 H HIS A 120 -10.429 15.554 1.110 1.00 54.31 H new ATOM 0 HA HIS A 120 -10.169 14.649 -1.657 1.00 24.43 H new ATOM 0 HB2 HIS A 120 -12.333 15.575 -2.036 1.00 71.24 H new ATOM 0 HB3 HIS A 120 -12.374 14.562 -0.606 1.00 71.24 H new ATOM 0 HD2 HIS A 120 -12.707 16.035 1.868 1.00 63.31 H new ATOM 0 HE1 HIS A 120 -14.102 19.532 -0.079 1.00 24.32 H new ATOM 0 HE2 HIS A 120 -13.896 18.338 2.154 1.00 75.23 H new ATOM 1767 N SER A 121 -9.055 16.607 -2.561 1.00 24.21 N ATOM 1768 CA SER A 121 -8.336 17.705 -3.157 1.00 31.51 C ATOM 1769 C SER A 121 -7.693 17.219 -4.448 1.00 15.11 C ATOM 1770 O SER A 121 -7.970 16.101 -4.901 1.00 73.43 O ATOM 1771 CB SER A 121 -7.259 18.225 -2.176 1.00 23.44 C ATOM 1772 OG SER A 121 -6.572 19.353 -2.699 1.00 60.11 O ATOM 0 H SER A 121 -8.901 15.713 -3.027 1.00 24.21 H new ATOM 0 HA SER A 121 -9.019 18.526 -3.377 1.00 31.51 H new ATOM 0 HB2 SER A 121 -7.728 18.492 -1.229 1.00 23.44 H new ATOM 0 HB3 SER A 121 -6.544 17.429 -1.965 1.00 23.44 H new ATOM 0 HG SER A 121 -5.901 19.656 -2.053 1.00 60.11 H new ATOM 1778 N HIS A 122 -6.823 18.034 -5.023 1.00 34.35 N ATOM 1779 CA HIS A 122 -6.150 17.680 -6.260 1.00 74.00 C ATOM 1780 C HIS A 122 -5.269 16.462 -6.083 1.00 62.34 C ATOM 1781 O HIS A 122 -5.024 15.724 -7.040 1.00 34.30 O ATOM 1782 CB HIS A 122 -5.345 18.851 -6.818 1.00 43.51 C ATOM 1783 CG HIS A 122 -6.184 19.840 -7.562 1.00 63.22 C ATOM 1784 ND1 HIS A 122 -6.640 19.618 -8.841 1.00 51.41 N ATOM 1785 CD2 HIS A 122 -6.660 21.054 -7.203 1.00 23.12 C ATOM 1786 CE1 HIS A 122 -7.355 20.644 -9.237 1.00 34.23 C ATOM 1787 NE2 HIS A 122 -7.385 21.529 -8.264 1.00 53.31 N ATOM 0 H HIS A 122 -6.566 18.948 -4.650 1.00 34.35 H new ATOM 0 HA HIS A 122 -6.926 17.432 -6.985 1.00 74.00 H new ATOM 0 HB2 HIS A 122 -4.838 19.359 -5.998 1.00 43.51 H new ATOM 0 HB3 HIS A 122 -4.571 18.468 -7.483 1.00 43.51 H new ATOM 0 HD2 HIS A 122 -6.499 21.554 -6.259 1.00 23.12 H new ATOM 0 HE1 HIS A 122 -7.837 20.745 -10.198 1.00 34.23 H new ATOM 0 HE2 HIS A 122 -7.870 22.426 -8.295 1.00 53.31 H new ATOM 1796 N VAL A 123 -4.782 16.244 -4.861 1.00 73.45 N ATOM 1797 CA VAL A 123 -3.986 15.073 -4.554 1.00 50.43 C ATOM 1798 C VAL A 123 -4.807 13.804 -4.747 1.00 13.53 C ATOM 1799 O VAL A 123 -4.353 12.857 -5.375 1.00 44.34 O ATOM 1800 CB VAL A 123 -3.481 15.125 -3.088 1.00 63.52 C ATOM 1801 CG1 VAL A 123 -2.689 13.876 -2.733 1.00 63.02 C ATOM 1802 CG2 VAL A 123 -2.650 16.376 -2.851 1.00 55.31 C ATOM 0 H VAL A 123 -4.930 16.871 -4.070 1.00 73.45 H new ATOM 0 HA VAL A 123 -3.133 15.063 -5.232 1.00 50.43 H new ATOM 0 HB VAL A 123 -4.353 15.163 -2.435 1.00 63.52 H new ATOM 0 HG11 VAL A 123 -2.349 13.942 -1.700 1.00 63.02 H new ATOM 0 HG12 VAL A 123 -3.323 12.997 -2.850 1.00 63.02 H new ATOM 0 HG13 VAL A 123 -1.827 13.792 -3.394 1.00 63.02 H new ATOM 0 HG21 VAL A 123 -2.305 16.393 -1.817 1.00 55.31 H new ATOM 0 HG22 VAL A 123 -1.790 16.373 -3.520 1.00 55.31 H new ATOM 0 HG23 VAL A 123 -3.258 17.259 -3.046 1.00 55.31 H new ATOM 1812 N ARG A 124 -6.033 13.815 -4.233 1.00 4.55 N ATOM 1813 CA ARG A 124 -6.903 12.652 -4.316 1.00 3.14 C ATOM 1814 C ARG A 124 -7.221 12.338 -5.770 1.00 24.14 C ATOM 1815 O ARG A 124 -7.286 11.176 -6.164 1.00 15.41 O ATOM 1816 CB ARG A 124 -8.194 12.890 -3.546 1.00 3.54 C ATOM 1817 CG ARG A 124 -9.024 11.636 -3.368 1.00 52.44 C ATOM 1818 CD ARG A 124 -10.440 11.956 -2.932 1.00 13.01 C ATOM 1819 NE ARG A 124 -11.232 10.745 -2.722 1.00 5.44 N ATOM 1820 CZ ARG A 124 -11.580 9.876 -3.685 1.00 22.35 C ATOM 1821 NH1 ARG A 124 -11.230 10.090 -4.950 1.00 11.22 N ATOM 1822 NH2 ARG A 124 -12.287 8.801 -3.375 1.00 74.43 N ATOM 0 H ARG A 124 -6.444 14.617 -3.755 1.00 4.55 H new ATOM 0 HA ARG A 124 -6.383 11.804 -3.871 1.00 3.14 H new ATOM 0 HB2 ARG A 124 -7.954 13.301 -2.565 1.00 3.54 H new ATOM 0 HB3 ARG A 124 -8.788 13.640 -4.069 1.00 3.54 H new ATOM 0 HG2 ARG A 124 -9.049 11.080 -4.305 1.00 52.44 H new ATOM 0 HG3 ARG A 124 -8.553 10.990 -2.627 1.00 52.44 H new ATOM 0 HD2 ARG A 124 -10.414 12.537 -2.010 1.00 13.01 H new ATOM 0 HD3 ARG A 124 -10.921 12.578 -3.687 1.00 13.01 H new ATOM 0 HE ARG A 124 -11.544 10.545 -1.772 1.00 5.44 H new ATOM 0 HH11 ARG A 124 -10.692 10.921 -5.197 1.00 11.22 H new ATOM 0 HH12 ARG A 124 -11.500 9.423 -5.673 1.00 11.22 H new ATOM 0 HH21 ARG A 124 -12.565 8.635 -2.408 1.00 74.43 H new ATOM 0 HH22 ARG A 124 -12.553 8.138 -4.103 1.00 74.43 H new ATOM 1836 N ALA A 125 -7.419 13.392 -6.558 1.00 4.14 N ATOM 1837 CA ALA A 125 -7.681 13.258 -7.984 1.00 21.14 C ATOM 1838 C ALA A 125 -6.553 12.482 -8.652 1.00 74.50 C ATOM 1839 O ALA A 125 -6.788 11.506 -9.364 1.00 13.52 O ATOM 1840 CB ALA A 125 -7.817 14.643 -8.612 1.00 60.24 C ATOM 0 H ALA A 125 -7.402 14.356 -6.226 1.00 4.14 H new ATOM 0 HA ALA A 125 -8.612 12.710 -8.129 1.00 21.14 H new ATOM 0 HB1 ALA A 125 -8.013 14.541 -9.679 1.00 60.24 H new ATOM 0 HB2 ALA A 125 -8.642 15.177 -8.141 1.00 60.24 H new ATOM 0 HB3 ALA A 125 -6.893 15.202 -8.465 1.00 60.24 H new ATOM 1846 N ALA A 126 -5.330 12.917 -8.390 1.00 52.15 N ATOM 1847 CA ALA A 126 -4.148 12.276 -8.946 1.00 2.10 C ATOM 1848 C ALA A 126 -3.966 10.862 -8.412 1.00 14.43 C ATOM 1849 O ALA A 126 -3.612 9.962 -9.161 1.00 0.25 O ATOM 1850 CB ALA A 126 -2.914 13.113 -8.659 1.00 63.54 C ATOM 0 H ALA A 126 -5.129 13.718 -7.791 1.00 52.15 H new ATOM 0 HA ALA A 126 -4.288 12.202 -10.024 1.00 2.10 H new ATOM 0 HB1 ALA A 126 -2.036 12.623 -9.080 1.00 63.54 H new ATOM 0 HB2 ALA A 126 -3.030 14.099 -9.109 1.00 63.54 H new ATOM 0 HB3 ALA A 126 -2.789 13.219 -7.581 1.00 63.54 H new ATOM 1856 N LEU A 127 -4.221 10.666 -7.127 1.00 60.12 N ATOM 1857 CA LEU A 127 -4.095 9.337 -6.526 1.00 74.41 C ATOM 1858 C LEU A 127 -5.095 8.362 -7.131 1.00 50.21 C ATOM 1859 O LEU A 127 -4.766 7.206 -7.396 1.00 35.44 O ATOM 1860 CB LEU A 127 -4.268 9.397 -4.998 1.00 65.55 C ATOM 1861 CG LEU A 127 -2.981 9.524 -4.165 1.00 54.03 C ATOM 1862 CD1 LEU A 127 -2.119 8.283 -4.315 1.00 45.41 C ATOM 1863 CD2 LEU A 127 -2.195 10.762 -4.553 1.00 14.51 C ATOM 0 H LEU A 127 -4.514 11.399 -6.482 1.00 60.12 H new ATOM 0 HA LEU A 127 -3.089 8.977 -6.743 1.00 74.41 H new ATOM 0 HB2 LEU A 127 -4.913 10.243 -4.761 1.00 65.55 H new ATOM 0 HB3 LEU A 127 -4.793 8.497 -4.679 1.00 65.55 H new ATOM 0 HG LEU A 127 -3.272 9.622 -3.119 1.00 54.03 H new ATOM 0 HD11 LEU A 127 -1.214 8.394 -3.718 1.00 45.41 H new ATOM 0 HD12 LEU A 127 -2.675 7.410 -3.972 1.00 45.41 H new ATOM 0 HD13 LEU A 127 -1.848 8.152 -5.363 1.00 45.41 H new ATOM 0 HD21 LEU A 127 -1.291 10.824 -3.947 1.00 14.51 H new ATOM 0 HD22 LEU A 127 -1.922 10.704 -5.607 1.00 14.51 H new ATOM 0 HD23 LEU A 127 -2.806 11.649 -4.385 1.00 14.51 H new ATOM 1875 N GLU A 128 -6.307 8.831 -7.356 1.00 72.13 N ATOM 1876 CA GLU A 128 -7.340 8.004 -7.943 1.00 21.10 C ATOM 1877 C GLU A 128 -7.019 7.717 -9.406 1.00 43.41 C ATOM 1878 O GLU A 128 -7.140 6.578 -9.871 1.00 5.24 O ATOM 1879 CB GLU A 128 -8.703 8.679 -7.802 1.00 52.12 C ATOM 1880 CG GLU A 128 -9.864 7.819 -8.250 1.00 51.01 C ATOM 1881 CD GLU A 128 -11.193 8.369 -7.797 1.00 32.35 C ATOM 1882 OE1 GLU A 128 -11.617 8.041 -6.667 1.00 71.05 O ATOM 1883 OE2 GLU A 128 -11.821 9.119 -8.557 1.00 62.12 O ATOM 0 H GLU A 128 -6.600 9.784 -7.140 1.00 72.13 H new ATOM 0 HA GLU A 128 -7.377 7.053 -7.411 1.00 21.10 H new ATOM 0 HB2 GLU A 128 -8.852 8.959 -6.759 1.00 52.12 H new ATOM 0 HB3 GLU A 128 -8.702 9.602 -8.383 1.00 52.12 H new ATOM 0 HG2 GLU A 128 -9.857 7.741 -9.337 1.00 51.01 H new ATOM 0 HG3 GLU A 128 -9.738 6.810 -7.858 1.00 51.01 H new ATOM 1890 N ALA A 129 -6.625 8.755 -10.130 1.00 25.12 N ATOM 1891 CA ALA A 129 -6.217 8.628 -11.523 1.00 73.23 C ATOM 1892 C ALA A 129 -5.004 7.716 -11.682 1.00 74.32 C ATOM 1893 O ALA A 129 -4.798 7.132 -12.743 1.00 54.40 O ATOM 1894 CB ALA A 129 -5.901 9.997 -12.087 1.00 43.22 C ATOM 0 H ALA A 129 -6.579 9.708 -9.769 1.00 25.12 H new ATOM 0 HA ALA A 129 -7.045 8.178 -12.071 1.00 73.23 H new ATOM 0 HB1 ALA A 129 -5.596 9.900 -13.129 1.00 43.22 H new ATOM 0 HB2 ALA A 129 -6.787 10.629 -12.026 1.00 43.22 H new ATOM 0 HB3 ALA A 129 -5.092 10.449 -11.513 1.00 43.22 H new ATOM 1900 N ALA A 130 -4.210 7.598 -10.637 1.00 62.52 N ATOM 1901 CA ALA A 130 -3.007 6.787 -10.681 1.00 23.41 C ATOM 1902 C ALA A 130 -3.307 5.285 -10.624 1.00 40.14 C ATOM 1903 O ALA A 130 -2.440 4.464 -10.923 1.00 4.44 O ATOM 1904 CB ALA A 130 -2.060 7.187 -9.561 1.00 10.30 C ATOM 0 H ALA A 130 -4.377 8.056 -9.741 1.00 62.52 H new ATOM 0 HA ALA A 130 -2.527 6.976 -11.641 1.00 23.41 H new ATOM 0 HB1 ALA A 130 -1.162 6.571 -9.606 1.00 10.30 H new ATOM 0 HB2 ALA A 130 -1.786 8.236 -9.673 1.00 10.30 H new ATOM 0 HB3 ALA A 130 -2.552 7.042 -8.599 1.00 10.30 H new ATOM 1910 N LEU A 131 -4.540 4.930 -10.273 1.00 42.13 N ATOM 1911 CA LEU A 131 -4.925 3.520 -10.132 1.00 31.23 C ATOM 1912 C LEU A 131 -4.821 2.736 -11.462 1.00 42.40 C ATOM 1913 O LEU A 131 -4.155 1.699 -11.510 1.00 24.41 O ATOM 1914 CB LEU A 131 -6.330 3.384 -9.530 1.00 63.23 C ATOM 1915 CG LEU A 131 -6.503 3.938 -8.115 1.00 73.51 C ATOM 1916 CD1 LEU A 131 -7.935 3.756 -7.647 1.00 2.10 C ATOM 1917 CD2 LEU A 131 -5.538 3.267 -7.153 1.00 44.52 C ATOM 0 H LEU A 131 -5.291 5.593 -10.081 1.00 42.13 H new ATOM 0 HA LEU A 131 -4.208 3.074 -9.443 1.00 31.23 H new ATOM 0 HB2 LEU A 131 -7.037 3.890 -10.187 1.00 63.23 H new ATOM 0 HB3 LEU A 131 -6.601 2.328 -9.522 1.00 63.23 H new ATOM 0 HG LEU A 131 -6.278 5.004 -8.134 1.00 73.51 H new ATOM 0 HD11 LEU A 131 -8.042 4.155 -6.638 1.00 2.10 H new ATOM 0 HD12 LEU A 131 -8.608 4.287 -8.320 1.00 2.10 H new ATOM 0 HD13 LEU A 131 -8.185 2.695 -7.646 1.00 2.10 H new ATOM 0 HD21 LEU A 131 -5.678 3.676 -6.152 1.00 44.52 H new ATOM 0 HD22 LEU A 131 -5.728 2.194 -7.136 1.00 44.52 H new ATOM 0 HD23 LEU A 131 -4.514 3.449 -7.479 1.00 44.52 H new ATOM 1929 N PRO A 132 -5.473 3.209 -12.567 1.00 24.32 N ATOM 1930 CA PRO A 132 -5.407 2.525 -13.868 1.00 41.03 C ATOM 1931 C PRO A 132 -3.974 2.412 -14.398 1.00 3.44 C ATOM 1932 O PRO A 132 -3.661 1.513 -15.181 1.00 33.04 O ATOM 1933 CB PRO A 132 -6.257 3.407 -14.798 1.00 2.45 C ATOM 1934 CG PRO A 132 -6.364 4.716 -14.100 1.00 42.52 C ATOM 1935 CD PRO A 132 -6.330 4.407 -12.635 1.00 35.30 C ATOM 0 HA PRO A 132 -5.767 1.498 -13.797 1.00 41.03 H new ATOM 0 HB2 PRO A 132 -5.786 3.518 -15.775 1.00 2.45 H new ATOM 0 HB3 PRO A 132 -7.241 2.969 -14.967 1.00 2.45 H new ATOM 0 HG2 PRO A 132 -5.542 5.375 -14.379 1.00 42.52 H new ATOM 0 HG3 PRO A 132 -7.288 5.227 -14.369 1.00 42.52 H new ATOM 0 HD2 PRO A 132 -5.915 5.233 -12.058 1.00 35.30 H new ATOM 0 HD3 PRO A 132 -7.327 4.212 -12.241 1.00 35.30 H new ATOM 1943 N MET A 133 -3.111 3.316 -13.961 1.00 74.04 N ATOM 1944 CA MET A 133 -1.721 3.301 -14.382 1.00 12.44 C ATOM 1945 C MET A 133 -0.948 2.279 -13.550 1.00 73.31 C ATOM 1946 O MET A 133 -0.099 1.554 -14.054 1.00 61.41 O ATOM 1947 CB MET A 133 -1.099 4.693 -14.228 1.00 73.32 C ATOM 1948 CG MET A 133 -0.236 5.124 -15.411 1.00 54.53 C ATOM 1949 SD MET A 133 1.166 4.026 -15.721 1.00 2.12 S ATOM 1950 CE MET A 133 2.145 4.290 -14.244 1.00 43.45 C ATOM 0 H MET A 133 -3.350 4.069 -13.315 1.00 74.04 H new ATOM 0 HA MET A 133 -1.670 3.020 -15.434 1.00 12.44 H new ATOM 0 HB2 MET A 133 -1.897 5.422 -14.089 1.00 73.32 H new ATOM 0 HB3 MET A 133 -0.491 4.710 -13.323 1.00 73.32 H new ATOM 0 HG2 MET A 133 -0.857 5.169 -16.306 1.00 54.53 H new ATOM 0 HG3 MET A 133 0.136 6.133 -15.230 1.00 54.53 H new ATOM 0 HE1 MET A 133 2.857 3.473 -14.129 1.00 43.45 H new ATOM 0 HE2 MET A 133 2.685 5.233 -14.329 1.00 43.45 H new ATOM 0 HE3 MET A 133 1.489 4.325 -13.374 1.00 43.45 H new ATOM 1960 N LEU A 134 -1.277 2.229 -12.268 1.00 64.31 N ATOM 1961 CA LEU A 134 -0.616 1.344 -11.315 1.00 54.43 C ATOM 1962 C LEU A 134 -0.952 -0.123 -11.597 1.00 34.35 C ATOM 1963 O LEU A 134 -0.072 -0.987 -11.584 1.00 54.04 O ATOM 1964 CB LEU A 134 -1.049 1.715 -9.892 1.00 24.15 C ATOM 1965 CG LEU A 134 -0.340 0.983 -8.754 1.00 4.41 C ATOM 1966 CD1 LEU A 134 1.124 1.380 -8.695 1.00 60.34 C ATOM 1967 CD2 LEU A 134 -1.028 1.267 -7.428 1.00 64.20 C ATOM 0 H LEU A 134 -2.013 2.803 -11.856 1.00 64.31 H new ATOM 0 HA LEU A 134 0.462 1.468 -11.418 1.00 54.43 H new ATOM 0 HB2 LEU A 134 -0.897 2.786 -9.757 1.00 24.15 H new ATOM 0 HB3 LEU A 134 -2.120 1.531 -9.802 1.00 24.15 H new ATOM 0 HG LEU A 134 -0.395 -0.089 -8.946 1.00 4.41 H new ATOM 0 HD11 LEU A 134 1.612 0.849 -7.878 1.00 60.34 H new ATOM 0 HD12 LEU A 134 1.609 1.123 -9.637 1.00 60.34 H new ATOM 0 HD13 LEU A 134 1.203 2.454 -8.528 1.00 60.34 H new ATOM 0 HD21 LEU A 134 -0.510 0.738 -6.628 1.00 64.20 H new ATOM 0 HD22 LEU A 134 -1.005 2.338 -7.228 1.00 64.20 H new ATOM 0 HD23 LEU A 134 -2.063 0.929 -7.475 1.00 64.20 H new ATOM 1979 N ARG A 135 -2.232 -0.387 -11.849 1.00 72.41 N ATOM 1980 CA ARG A 135 -2.720 -1.748 -12.110 1.00 74.21 C ATOM 1981 C ARG A 135 -1.942 -2.446 -13.232 1.00 2.32 C ATOM 1982 O ARG A 135 -1.685 -3.640 -13.150 1.00 11.23 O ATOM 1983 CB ARG A 135 -4.223 -1.743 -12.432 1.00 1.43 C ATOM 1984 CG ARG A 135 -4.571 -1.075 -13.748 1.00 43.31 C ATOM 1985 CD ARG A 135 -6.063 -1.092 -14.016 1.00 43.32 C ATOM 1986 NE ARG A 135 -6.383 -0.510 -15.323 1.00 61.31 N ATOM 1987 CZ ARG A 135 -7.610 -0.162 -15.717 1.00 61.23 C ATOM 1988 NH1 ARG A 135 -8.643 -0.311 -14.898 1.00 23.34 N ATOM 1989 NH2 ARG A 135 -7.800 0.341 -16.930 1.00 62.20 N ATOM 0 H ARG A 135 -2.959 0.328 -11.879 1.00 72.41 H new ATOM 0 HA ARG A 135 -2.554 -2.317 -11.195 1.00 74.21 H new ATOM 0 HB2 ARG A 135 -4.583 -2.772 -12.452 1.00 1.43 H new ATOM 0 HB3 ARG A 135 -4.755 -1.235 -11.627 1.00 1.43 H new ATOM 0 HG2 ARG A 135 -4.216 -0.044 -13.736 1.00 43.31 H new ATOM 0 HG3 ARG A 135 -4.051 -1.582 -14.561 1.00 43.31 H new ATOM 0 HD2 ARG A 135 -6.429 -2.118 -13.974 1.00 43.32 H new ATOM 0 HD3 ARG A 135 -6.580 -0.537 -13.233 1.00 43.32 H new ATOM 0 HE ARG A 135 -5.615 -0.361 -15.977 1.00 61.31 H new ATOM 0 HH11 ARG A 135 -8.501 -0.693 -13.963 1.00 23.34 H new ATOM 0 HH12 ARG A 135 -9.579 -0.044 -15.203 1.00 23.34 H new ATOM 0 HH21 ARG A 135 -7.008 0.462 -17.562 1.00 62.20 H new ATOM 0 HH22 ARG A 135 -8.738 0.607 -17.231 1.00 62.20 H new ATOM 2003 N THR A 136 -1.551 -1.704 -14.263 1.00 33.42 N ATOM 2004 CA THR A 136 -0.845 -2.307 -15.378 1.00 54.25 C ATOM 2005 C THR A 136 0.605 -2.645 -14.996 1.00 4.50 C ATOM 2006 O THR A 136 1.172 -3.623 -15.485 1.00 73.24 O ATOM 2007 CB THR A 136 -0.896 -1.417 -16.660 1.00 20.24 C ATOM 2008 OG1 THR A 136 -0.443 -2.159 -17.796 1.00 23.33 O ATOM 2009 CG2 THR A 136 -0.046 -0.168 -16.513 1.00 62.44 C ATOM 0 H THR A 136 -1.710 -0.700 -14.346 1.00 33.42 H new ATOM 0 HA THR A 136 -1.360 -3.237 -15.616 1.00 54.25 H new ATOM 0 HB THR A 136 -1.933 -1.114 -16.801 1.00 20.24 H new ATOM 0 HG1 THR A 136 -0.481 -1.591 -18.594 1.00 23.33 H new ATOM 0 HG21 THR A 136 -0.108 0.424 -17.426 1.00 62.44 H new ATOM 0 HG22 THR A 136 -0.409 0.423 -15.672 1.00 62.44 H new ATOM 0 HG23 THR A 136 0.991 -0.453 -16.335 1.00 62.44 H new ATOM 2017 N GLN A 137 1.189 -1.850 -14.102 1.00 20.55 N ATOM 2018 CA GLN A 137 2.552 -2.094 -13.646 1.00 54.24 C ATOM 2019 C GLN A 137 2.594 -3.337 -12.766 1.00 73.11 C ATOM 2020 O GLN A 137 3.439 -4.216 -12.942 1.00 64.02 O ATOM 2021 CB GLN A 137 3.077 -0.889 -12.858 1.00 34.35 C ATOM 2022 CG GLN A 137 2.885 0.450 -13.556 1.00 12.34 C ATOM 2023 CD GLN A 137 3.530 0.508 -14.926 1.00 61.21 C ATOM 2024 OE1 GLN A 137 4.532 -0.156 -15.187 1.00 12.01 O ATOM 2025 NE2 GLN A 137 2.959 1.301 -15.807 1.00 31.24 N ATOM 0 H GLN A 137 0.741 -1.036 -13.682 1.00 20.55 H new ATOM 0 HA GLN A 137 3.185 -2.249 -14.520 1.00 54.24 H new ATOM 0 HB2 GLN A 137 2.575 -0.856 -11.891 1.00 34.35 H new ATOM 0 HB3 GLN A 137 4.139 -1.034 -12.661 1.00 34.35 H new ATOM 0 HG2 GLN A 137 1.818 0.651 -13.655 1.00 12.34 H new ATOM 0 HG3 GLN A 137 3.302 1.241 -12.932 1.00 12.34 H new ATOM 0 HE21 GLN A 137 2.129 1.835 -15.550 1.00 31.24 H new ATOM 0 HE22 GLN A 137 3.347 1.382 -16.747 1.00 31.24 H new ATOM 2034 N LEU A 138 1.658 -3.409 -11.831 1.00 55.31 N ATOM 2035 CA LEU A 138 1.569 -4.535 -10.909 1.00 53.00 C ATOM 2036 C LEU A 138 1.150 -5.807 -11.634 1.00 63.44 C ATOM 2037 O LEU A 138 1.480 -6.916 -11.206 1.00 52.32 O ATOM 2038 CB LEU A 138 0.589 -4.223 -9.766 1.00 23.45 C ATOM 2039 CG LEU A 138 1.167 -3.478 -8.549 1.00 14.30 C ATOM 2040 CD1 LEU A 138 2.216 -4.325 -7.847 1.00 4.21 C ATOM 2041 CD2 LEU A 138 1.754 -2.137 -8.957 1.00 14.35 C ATOM 0 H LEU A 138 0.943 -2.695 -11.689 1.00 55.31 H new ATOM 0 HA LEU A 138 2.560 -4.698 -10.484 1.00 53.00 H new ATOM 0 HB2 LEU A 138 -0.230 -3.629 -10.172 1.00 23.45 H new ATOM 0 HB3 LEU A 138 0.160 -5.163 -9.418 1.00 23.45 H new ATOM 0 HG LEU A 138 0.349 -3.293 -7.852 1.00 14.30 H new ATOM 0 HD11 LEU A 138 2.611 -3.779 -6.990 1.00 4.21 H new ATOM 0 HD12 LEU A 138 1.763 -5.256 -7.507 1.00 4.21 H new ATOM 0 HD13 LEU A 138 3.027 -4.548 -8.540 1.00 4.21 H new ATOM 0 HD21 LEU A 138 2.155 -1.633 -8.078 1.00 14.35 H new ATOM 0 HD22 LEU A 138 2.553 -2.295 -9.681 1.00 14.35 H new ATOM 0 HD23 LEU A 138 0.975 -1.520 -9.405 1.00 14.35 H new ATOM 2053 N ALA A 139 0.436 -5.643 -12.740 1.00 3.40 N ATOM 2054 CA ALA A 139 -0.019 -6.768 -13.541 1.00 44.23 C ATOM 2055 C ALA A 139 1.162 -7.585 -14.058 1.00 11.45 C ATOM 2056 O ALA A 139 1.084 -8.808 -14.163 1.00 64.30 O ATOM 2057 CB ALA A 139 -0.877 -6.278 -14.697 1.00 12.22 C ATOM 0 H ALA A 139 0.158 -4.732 -13.104 1.00 3.40 H new ATOM 0 HA ALA A 139 -0.623 -7.417 -12.907 1.00 44.23 H new ATOM 0 HB1 ALA A 139 -1.211 -7.130 -15.289 1.00 12.22 H new ATOM 0 HB2 ALA A 139 -1.744 -5.745 -14.306 1.00 12.22 H new ATOM 0 HB3 ALA A 139 -0.292 -5.607 -15.326 1.00 12.22 H new ATOM 2063 N GLU A 140 2.263 -6.902 -14.351 1.00 2.30 N ATOM 2064 CA GLU A 140 3.469 -7.565 -14.850 1.00 10.21 C ATOM 2065 C GLU A 140 4.093 -8.462 -13.781 1.00 0.41 C ATOM 2066 O GLU A 140 4.833 -9.392 -14.093 1.00 51.44 O ATOM 2067 CB GLU A 140 4.504 -6.549 -15.321 1.00 1.00 C ATOM 2068 CG GLU A 140 4.058 -5.689 -16.482 1.00 51.11 C ATOM 2069 CD GLU A 140 5.195 -4.868 -17.040 1.00 35.51 C ATOM 2070 OE1 GLU A 140 5.534 -3.834 -16.440 1.00 61.32 O ATOM 2071 OE2 GLU A 140 5.770 -5.263 -18.072 1.00 42.40 O ATOM 0 H GLU A 140 2.348 -5.890 -14.253 1.00 2.30 H new ATOM 0 HA GLU A 140 3.165 -8.181 -15.696 1.00 10.21 H new ATOM 0 HB2 GLU A 140 4.764 -5.901 -14.484 1.00 1.00 H new ATOM 0 HB3 GLU A 140 5.412 -7.080 -15.607 1.00 1.00 H new ATOM 0 HG2 GLU A 140 3.648 -6.323 -17.268 1.00 51.11 H new ATOM 0 HG3 GLU A 140 3.256 -5.026 -16.156 1.00 51.11 H new ATOM 2078 N SER A 141 3.789 -8.179 -12.530 1.00 60.50 N ATOM 2079 CA SER A 141 4.334 -8.942 -11.422 1.00 31.53 C ATOM 2080 C SER A 141 3.341 -9.991 -10.919 1.00 4.25 C ATOM 2081 O SER A 141 3.613 -10.708 -9.953 1.00 70.22 O ATOM 2082 CB SER A 141 4.735 -8.000 -10.290 1.00 32.32 C ATOM 2083 OG SER A 141 5.809 -7.156 -10.689 1.00 35.54 O ATOM 0 H SER A 141 3.164 -7.422 -12.253 1.00 60.50 H new ATOM 0 HA SER A 141 5.217 -9.472 -11.778 1.00 31.53 H new ATOM 0 HB2 SER A 141 3.879 -7.392 -9.997 1.00 32.32 H new ATOM 0 HB3 SER A 141 5.029 -8.580 -9.415 1.00 32.32 H new ATOM 0 HG SER A 141 6.049 -6.560 -9.949 1.00 35.54 H new ATOM 2089 N GLY A 142 2.200 -10.085 -11.581 1.00 61.23 N ATOM 2090 CA GLY A 142 1.201 -11.057 -11.186 1.00 33.34 C ATOM 2091 C GLY A 142 0.307 -10.541 -10.079 1.00 41.12 C ATOM 2092 O GLY A 142 0.043 -11.243 -9.099 1.00 35.21 O ATOM 0 H GLY A 142 1.947 -9.508 -12.383 1.00 61.23 H new ATOM 0 HA2 GLY A 142 0.591 -11.320 -12.050 1.00 33.34 H new ATOM 0 HA3 GLY A 142 1.696 -11.970 -10.855 1.00 33.34 H new ATOM 2096 N ILE A 143 -0.153 -9.317 -10.233 1.00 34.32 N ATOM 2097 CA ILE A 143 -1.032 -8.689 -9.265 1.00 12.13 C ATOM 2098 C ILE A 143 -2.178 -8.003 -10.001 1.00 33.11 C ATOM 2099 O ILE A 143 -1.958 -7.315 -10.994 1.00 11.40 O ATOM 2100 CB ILE A 143 -0.291 -7.643 -8.354 1.00 2.42 C ATOM 2101 CG1 ILE A 143 0.623 -8.330 -7.321 1.00 73.32 C ATOM 2102 CG2 ILE A 143 -1.281 -6.726 -7.642 1.00 64.52 C ATOM 2103 CD1 ILE A 143 1.994 -8.690 -7.843 1.00 20.13 C ATOM 0 H ILE A 143 0.072 -8.727 -11.034 1.00 34.32 H new ATOM 0 HA ILE A 143 -1.407 -9.474 -8.608 1.00 12.13 H new ATOM 0 HB ILE A 143 0.332 -7.040 -9.014 1.00 2.42 H new ATOM 0 HG12 ILE A 143 0.737 -7.672 -6.460 1.00 73.32 H new ATOM 0 HG13 ILE A 143 0.133 -9.237 -6.966 1.00 73.32 H new ATOM 0 HG21 ILE A 143 -0.736 -6.015 -7.021 1.00 64.52 H new ATOM 0 HG22 ILE A 143 -1.871 -6.184 -8.381 1.00 64.52 H new ATOM 0 HG23 ILE A 143 -1.944 -7.323 -7.015 1.00 64.52 H new ATOM 0 HD11 ILE A 143 2.571 -9.169 -7.051 1.00 20.13 H new ATOM 0 HD12 ILE A 143 1.894 -9.375 -8.685 1.00 20.13 H new ATOM 0 HD13 ILE A 143 2.508 -7.786 -8.170 1.00 20.13 H new ATOM 2115 N GLN A 144 -3.389 -8.203 -9.523 1.00 44.42 N ATOM 2116 CA GLN A 144 -4.553 -7.588 -10.131 1.00 53.21 C ATOM 2117 C GLN A 144 -5.375 -6.879 -9.080 1.00 42.03 C ATOM 2118 O GLN A 144 -5.872 -7.502 -8.144 1.00 62.42 O ATOM 2119 CB GLN A 144 -5.414 -8.621 -10.862 1.00 10.13 C ATOM 2120 CG GLN A 144 -4.751 -9.224 -12.086 1.00 52.14 C ATOM 2121 CD GLN A 144 -5.697 -10.088 -12.891 1.00 54.25 C ATOM 2122 OE1 GLN A 144 -6.384 -9.601 -13.793 1.00 71.24 O ATOM 2123 NE2 GLN A 144 -5.745 -11.366 -12.578 1.00 63.03 N ATOM 0 H GLN A 144 -3.594 -8.788 -8.713 1.00 44.42 H new ATOM 0 HA GLN A 144 -4.203 -6.862 -10.865 1.00 53.21 H new ATOM 0 HB2 GLN A 144 -5.669 -9.422 -10.168 1.00 10.13 H new ATOM 0 HB3 GLN A 144 -6.350 -8.150 -11.163 1.00 10.13 H new ATOM 0 HG2 GLN A 144 -4.367 -8.424 -12.719 1.00 52.14 H new ATOM 0 HG3 GLN A 144 -3.895 -9.822 -11.774 1.00 52.14 H new ATOM 0 HE21 GLN A 144 -5.160 -11.729 -11.825 1.00 63.03 H new ATOM 0 HE22 GLN A 144 -6.367 -11.993 -13.088 1.00 63.03 H new ATOM 2132 N LEU A 145 -5.505 -5.577 -9.224 1.00 61.02 N ATOM 2133 CA LEU A 145 -6.262 -4.782 -8.279 1.00 41.23 C ATOM 2134 C LEU A 145 -7.750 -5.057 -8.418 1.00 44.00 C ATOM 2135 O LEU A 145 -8.387 -4.644 -9.393 1.00 0.22 O ATOM 2136 CB LEU A 145 -5.973 -3.288 -8.465 1.00 10.22 C ATOM 2137 CG LEU A 145 -4.518 -2.857 -8.247 1.00 64.15 C ATOM 2138 CD1 LEU A 145 -4.365 -1.360 -8.459 1.00 74.34 C ATOM 2139 CD2 LEU A 145 -4.046 -3.250 -6.855 1.00 40.02 C ATOM 0 H LEU A 145 -5.094 -5.044 -9.990 1.00 61.02 H new ATOM 0 HA LEU A 145 -5.951 -5.066 -7.274 1.00 41.23 H new ATOM 0 HB2 LEU A 145 -6.269 -3.003 -9.475 1.00 10.22 H new ATOM 0 HB3 LEU A 145 -6.605 -2.727 -7.777 1.00 10.22 H new ATOM 0 HG LEU A 145 -3.896 -3.372 -8.979 1.00 64.15 H new ATOM 0 HD11 LEU A 145 -3.325 -1.074 -8.300 1.00 74.34 H new ATOM 0 HD12 LEU A 145 -4.659 -1.105 -9.477 1.00 74.34 H new ATOM 0 HD13 LEU A 145 -5.000 -0.826 -7.753 1.00 74.34 H new ATOM 0 HD21 LEU A 145 -3.011 -2.936 -6.719 1.00 40.02 H new ATOM 0 HD22 LEU A 145 -4.674 -2.765 -6.108 1.00 40.02 H new ATOM 0 HD23 LEU A 145 -4.115 -4.332 -6.739 1.00 40.02 H new ATOM 2151 N GLY A 146 -8.287 -5.782 -7.462 1.00 65.15 N ATOM 2152 CA GLY A 146 -9.692 -6.091 -7.474 1.00 35.24 C ATOM 2153 C GLY A 146 -10.467 -5.094 -6.663 1.00 34.11 C ATOM 2154 O GLY A 146 -11.389 -4.452 -7.158 1.00 61.11 O ATOM 0 H GLY A 146 -7.771 -6.166 -6.670 1.00 65.15 H new ATOM 0 HA2 GLY A 146 -10.059 -6.094 -8.500 1.00 35.24 H new ATOM 0 HA3 GLY A 146 -9.851 -7.093 -7.075 1.00 35.24 H new ATOM 2158 N GLN A 147 -10.089 -4.960 -5.414 1.00 11.53 N ATOM 2159 CA GLN A 147 -10.725 -4.022 -4.522 1.00 51.50 C ATOM 2160 C GLN A 147 -9.830 -2.810 -4.310 1.00 42.14 C ATOM 2161 O GLN A 147 -8.614 -2.941 -4.193 1.00 44.30 O ATOM 2162 CB GLN A 147 -11.042 -4.695 -3.191 1.00 43.50 C ATOM 2163 CG GLN A 147 -11.993 -5.871 -3.322 1.00 2.11 C ATOM 2164 CD GLN A 147 -12.196 -6.604 -2.016 1.00 35.44 C ATOM 2165 OE1 GLN A 147 -13.089 -6.275 -1.237 1.00 23.23 O ATOM 2166 NE2 GLN A 147 -11.376 -7.602 -1.771 1.00 44.22 N ATOM 0 H GLN A 147 -9.333 -5.497 -4.989 1.00 11.53 H new ATOM 0 HA GLN A 147 -11.660 -3.686 -4.970 1.00 51.50 H new ATOM 0 HB2 GLN A 147 -10.113 -5.037 -2.735 1.00 43.50 H new ATOM 0 HB3 GLN A 147 -11.477 -3.959 -2.515 1.00 43.50 H new ATOM 0 HG2 GLN A 147 -12.956 -5.515 -3.688 1.00 2.11 H new ATOM 0 HG3 GLN A 147 -11.605 -6.565 -4.067 1.00 2.11 H new ATOM 0 HE21 GLN A 147 -10.649 -7.842 -2.445 1.00 44.22 H new ATOM 0 HE22 GLN A 147 -11.467 -8.137 -0.907 1.00 44.22 H new ATOM 2175 N SER A 148 -10.420 -1.641 -4.295 1.00 43.23 N ATOM 2176 CA SER A 148 -9.684 -0.413 -4.071 1.00 14.21 C ATOM 2177 C SER A 148 -10.531 0.551 -3.264 1.00 51.01 C ATOM 2178 O SER A 148 -11.751 0.596 -3.426 1.00 61.33 O ATOM 2179 CB SER A 148 -9.289 0.216 -5.409 1.00 0.04 C ATOM 2180 OG SER A 148 -8.528 -0.696 -6.188 1.00 44.42 O ATOM 0 H SER A 148 -11.421 -1.509 -4.437 1.00 43.23 H new ATOM 0 HA SER A 148 -8.775 -0.637 -3.513 1.00 14.21 H new ATOM 0 HB2 SER A 148 -10.184 0.510 -5.956 1.00 0.04 H new ATOM 0 HB3 SER A 148 -8.710 1.123 -5.233 1.00 0.04 H new ATOM 0 HG SER A 148 -8.286 -0.276 -7.040 1.00 44.42 H new ATOM 2186 N SER A 149 -9.904 1.294 -2.376 1.00 63.03 N ATOM 2187 CA SER A 149 -10.617 2.247 -1.552 1.00 54.53 C ATOM 2188 C SER A 149 -9.773 3.490 -1.320 1.00 14.34 C ATOM 2189 O SER A 149 -8.573 3.393 -1.055 1.00 33.41 O ATOM 2190 CB SER A 149 -10.977 1.608 -0.209 1.00 65.03 C ATOM 2191 OG SER A 149 -11.660 0.379 -0.398 1.00 24.13 O ATOM 0 H SER A 149 -8.899 1.256 -2.206 1.00 63.03 H new ATOM 0 HA SER A 149 -11.531 2.537 -2.071 1.00 54.53 H new ATOM 0 HB2 SER A 149 -10.070 1.439 0.372 1.00 65.03 H new ATOM 0 HB3 SER A 149 -11.602 2.291 0.367 1.00 65.03 H new ATOM 0 HG SER A 149 -11.878 -0.011 0.474 1.00 24.13 H new ATOM 2197 N ILE A 150 -10.402 4.648 -1.418 1.00 21.32 N ATOM 2198 CA ILE A 150 -9.726 5.916 -1.206 1.00 64.14 C ATOM 2199 C ILE A 150 -10.597 6.807 -0.335 1.00 24.01 C ATOM 2200 O ILE A 150 -11.569 7.400 -0.812 1.00 72.42 O ATOM 2201 CB ILE A 150 -9.417 6.651 -2.539 1.00 14.33 C ATOM 2202 CG1 ILE A 150 -8.589 5.758 -3.470 1.00 75.21 C ATOM 2203 CG2 ILE A 150 -8.675 7.960 -2.263 1.00 45.14 C ATOM 2204 CD1 ILE A 150 -8.297 6.385 -4.817 1.00 21.32 C ATOM 0 H ILE A 150 -11.392 4.736 -1.646 1.00 21.32 H new ATOM 0 HA ILE A 150 -8.775 5.705 -0.717 1.00 64.14 H new ATOM 0 HB ILE A 150 -10.362 6.880 -3.032 1.00 14.33 H new ATOM 0 HG12 ILE A 150 -7.646 5.515 -2.981 1.00 75.21 H new ATOM 0 HG13 ILE A 150 -9.120 4.819 -3.624 1.00 75.21 H new ATOM 0 HG21 ILE A 150 -8.465 8.465 -3.206 1.00 45.14 H new ATOM 0 HG22 ILE A 150 -9.293 8.603 -1.637 1.00 45.14 H new ATOM 0 HG23 ILE A 150 -7.738 7.746 -1.749 1.00 45.14 H new ATOM 0 HD11 ILE A 150 -7.708 5.694 -5.420 1.00 21.32 H new ATOM 0 HD12 ILE A 150 -9.235 6.603 -5.328 1.00 21.32 H new ATOM 0 HD13 ILE A 150 -7.738 7.310 -4.674 1.00 21.32 H new ATOM 2216 N SER A 151 -10.277 6.867 0.934 1.00 61.01 N ATOM 2217 CA SER A 151 -11.049 7.659 1.871 1.00 21.53 C ATOM 2218 C SER A 151 -10.201 8.738 2.522 1.00 64.33 C ATOM 2219 O SER A 151 -8.983 8.612 2.617 1.00 35.35 O ATOM 2220 CB SER A 151 -11.658 6.757 2.942 1.00 54.15 C ATOM 2221 OG SER A 151 -12.536 5.802 2.366 1.00 14.04 O ATOM 0 H SER A 151 -9.484 6.376 1.347 1.00 61.01 H new ATOM 0 HA SER A 151 -11.846 8.151 1.314 1.00 21.53 H new ATOM 0 HB2 SER A 151 -10.864 6.245 3.485 1.00 54.15 H new ATOM 0 HB3 SER A 151 -12.200 7.363 3.667 1.00 54.15 H new ATOM 0 HG SER A 151 -12.912 5.235 3.072 1.00 14.04 H new ATOM 2227 N SER A 152 -10.853 9.789 2.973 1.00 72.25 N ATOM 2228 CA SER A 152 -10.192 10.881 3.648 1.00 0.43 C ATOM 2229 C SER A 152 -10.093 10.579 5.141 1.00 32.01 C ATOM 2230 O SER A 152 -10.623 11.318 5.979 1.00 41.34 O ATOM 2231 CB SER A 152 -10.972 12.173 3.398 1.00 63.01 C ATOM 2232 OG SER A 152 -12.372 11.943 3.509 1.00 54.25 O ATOM 0 H SER A 152 -11.862 9.908 2.880 1.00 72.25 H new ATOM 0 HA SER A 152 -9.181 11.004 3.259 1.00 0.43 H new ATOM 0 HB2 SER A 152 -10.665 12.934 4.116 1.00 63.01 H new ATOM 0 HB3 SER A 152 -10.739 12.558 2.405 1.00 63.01 H new ATOM 0 HG SER A 152 -12.859 12.660 3.051 1.00 54.25 H new ATOM 2238 N GLU A 153 -9.406 9.474 5.455 1.00 74.23 N ATOM 2239 CA GLU A 153 -9.266 8.966 6.825 1.00 13.35 C ATOM 2240 C GLU A 153 -10.602 8.426 7.305 1.00 12.12 C ATOM 2241 O GLU A 153 -10.866 7.224 7.224 1.00 24.50 O ATOM 2242 CB GLU A 153 -8.738 10.045 7.789 1.00 23.34 C ATOM 2243 CG GLU A 153 -7.374 10.598 7.421 1.00 43.31 C ATOM 2244 CD GLU A 153 -6.954 11.725 8.326 1.00 41.22 C ATOM 2245 OE1 GLU A 153 -7.295 12.889 8.030 1.00 25.34 O ATOM 2246 OE2 GLU A 153 -6.293 11.461 9.345 1.00 33.40 O ATOM 0 H GLU A 153 -8.927 8.902 4.759 1.00 74.23 H new ATOM 0 HA GLU A 153 -8.530 8.162 6.815 1.00 13.35 H new ATOM 0 HB2 GLU A 153 -9.453 10.867 7.823 1.00 23.34 H new ATOM 0 HB3 GLU A 153 -8.688 9.625 8.794 1.00 23.34 H new ATOM 0 HG2 GLU A 153 -6.634 9.799 7.471 1.00 43.31 H new ATOM 0 HG3 GLU A 153 -7.393 10.950 6.390 1.00 43.31 H new ATOM 2253 N SER A 154 -11.442 9.318 7.782 1.00 52.14 N ATOM 2254 CA SER A 154 -12.778 8.979 8.217 1.00 53.45 C ATOM 2255 C SER A 154 -13.659 10.228 8.149 1.00 64.02 C ATOM 2256 O SER A 154 -14.668 10.342 8.855 1.00 5.23 O ATOM 2257 CB SER A 154 -12.754 8.420 9.646 1.00 51.24 C ATOM 2258 OG SER A 154 -11.954 7.249 9.727 1.00 24.43 O ATOM 0 H SER A 154 -11.214 10.308 7.879 1.00 52.14 H new ATOM 0 HA SER A 154 -13.186 8.210 7.561 1.00 53.45 H new ATOM 0 HB2 SER A 154 -12.366 9.176 10.328 1.00 51.24 H new ATOM 0 HB3 SER A 154 -13.770 8.192 9.967 1.00 51.24 H new ATOM 0 HG SER A 154 -11.606 7.028 8.838 1.00 24.43 H new ATOM 2264 N PHE A 155 -13.271 11.152 7.275 1.00 40.11 N ATOM 2265 CA PHE A 155 -13.963 12.421 7.119 1.00 13.54 C ATOM 2266 C PHE A 155 -15.233 12.270 6.290 1.00 74.31 C ATOM 2267 O PHE A 155 -15.180 11.990 5.087 1.00 55.45 O ATOM 2268 CB PHE A 155 -13.026 13.459 6.475 1.00 1.32 C ATOM 2269 CG PHE A 155 -13.700 14.749 6.082 1.00 72.41 C ATOM 2270 CD1 PHE A 155 -14.004 15.704 7.033 1.00 61.33 C ATOM 2271 CD2 PHE A 155 -14.034 14.998 4.758 1.00 12.03 C ATOM 2272 CE1 PHE A 155 -14.627 16.884 6.678 1.00 42.41 C ATOM 2273 CE2 PHE A 155 -14.657 16.175 4.396 1.00 3.01 C ATOM 2274 CZ PHE A 155 -14.954 17.119 5.357 1.00 45.31 C ATOM 0 H PHE A 155 -12.468 11.039 6.656 1.00 40.11 H new ATOM 0 HA PHE A 155 -14.255 12.766 8.111 1.00 13.54 H new ATOM 0 HB2 PHE A 155 -12.219 13.683 7.172 1.00 1.32 H new ATOM 0 HB3 PHE A 155 -12.569 13.018 5.589 1.00 1.32 H new ATOM 0 HD1 PHE A 155 -13.751 15.525 8.068 1.00 61.33 H new ATOM 0 HD2 PHE A 155 -13.804 14.262 4.002 1.00 12.03 H new ATOM 0 HE1 PHE A 155 -14.858 17.622 7.432 1.00 42.41 H new ATOM 0 HE2 PHE A 155 -14.912 16.357 3.362 1.00 3.01 H new ATOM 0 HZ PHE A 155 -15.442 18.041 5.077 1.00 45.31 H new ATOM 2284 N ALA A 156 -16.366 12.422 6.943 1.00 73.23 N ATOM 2285 CA ALA A 156 -17.642 12.388 6.267 1.00 43.12 C ATOM 2286 C ALA A 156 -18.028 13.790 5.808 1.00 20.14 C ATOM 2287 O ALA A 156 -18.519 14.599 6.599 1.00 41.41 O ATOM 2288 CB ALA A 156 -18.712 11.801 7.174 1.00 14.25 C ATOM 0 H ALA A 156 -16.427 12.571 7.950 1.00 73.23 H new ATOM 0 HA ALA A 156 -17.558 11.748 5.389 1.00 43.12 H new ATOM 0 HB1 ALA A 156 -19.666 11.784 6.647 1.00 14.25 H new ATOM 0 HB2 ALA A 156 -18.434 10.785 7.455 1.00 14.25 H new ATOM 0 HB3 ALA A 156 -18.804 12.413 8.071 1.00 14.25 H new ATOM 2294 N GLY A 157 -17.773 14.086 4.548 1.00 63.13 N ATOM 2295 CA GLY A 157 -18.099 15.394 4.023 1.00 42.41 C ATOM 2296 C GLY A 157 -19.405 15.386 3.274 1.00 44.41 C ATOM 2297 O GLY A 157 -19.640 14.506 2.451 1.00 24.23 O ATOM 0 H GLY A 157 -17.346 13.446 3.878 1.00 63.13 H new ATOM 0 HA2 GLY A 157 -18.154 16.111 4.842 1.00 42.41 H new ATOM 0 HA3 GLY A 157 -17.301 15.729 3.360 1.00 42.41 H new ATOM 2301 N GLN A 158 -20.248 16.374 3.543 1.00 23.13 N ATOM 2302 CA GLN A 158 -21.565 16.478 2.911 1.00 32.15 C ATOM 2303 C GLN A 158 -22.016 17.929 2.870 1.00 31.14 C ATOM 2304 O GLN A 158 -22.388 18.498 3.898 1.00 54.41 O ATOM 2305 CB GLN A 158 -22.626 15.670 3.689 1.00 0.21 C ATOM 2306 CG GLN A 158 -22.460 14.159 3.654 1.00 13.12 C ATOM 2307 CD GLN A 158 -22.616 13.579 2.264 1.00 43.44 C ATOM 2308 OE1 GLN A 158 -23.332 14.125 1.421 1.00 31.35 O ATOM 2309 NE2 GLN A 158 -21.958 12.466 2.021 1.00 23.01 N ATOM 0 H GLN A 158 -20.043 17.125 4.202 1.00 23.13 H new ATOM 0 HA GLN A 158 -21.471 16.078 1.902 1.00 32.15 H new ATOM 0 HB2 GLN A 158 -22.612 15.995 4.729 1.00 0.21 H new ATOM 0 HB3 GLN A 158 -23.610 15.918 3.290 1.00 0.21 H new ATOM 0 HG2 GLN A 158 -21.475 13.898 4.042 1.00 13.12 H new ATOM 0 HG3 GLN A 158 -23.195 13.703 4.317 1.00 13.12 H new ATOM 0 HE21 GLN A 158 -21.377 12.048 2.748 1.00 23.01 H new ATOM 0 HE22 GLN A 158 -22.029 12.021 1.106 1.00 23.01 H new ATOM 2318 N GLN A 159 -21.964 18.532 1.699 1.00 22.40 N ATOM 2319 CA GLN A 159 -22.442 19.894 1.537 1.00 12.41 C ATOM 2320 C GLN A 159 -23.962 19.888 1.484 1.00 4.11 C ATOM 2321 O GLN A 159 -24.563 19.048 0.808 1.00 63.14 O ATOM 2322 CB GLN A 159 -21.850 20.543 0.278 1.00 61.03 C ATOM 2323 CG GLN A 159 -22.094 19.762 -1.001 1.00 75.33 C ATOM 2324 CD GLN A 159 -21.508 20.439 -2.221 1.00 65.20 C ATOM 2325 OE1 GLN A 159 -21.423 21.668 -2.285 1.00 71.40 O ATOM 2326 NE2 GLN A 159 -21.097 19.650 -3.193 1.00 55.25 N ATOM 0 H GLN A 159 -21.598 18.104 0.848 1.00 22.40 H new ATOM 0 HA GLN A 159 -22.115 20.489 2.390 1.00 12.41 H new ATOM 0 HB2 GLN A 159 -22.271 21.542 0.166 1.00 61.03 H new ATOM 0 HB3 GLN A 159 -20.776 20.664 0.417 1.00 61.03 H new ATOM 0 HG2 GLN A 159 -21.663 18.766 -0.901 1.00 75.33 H new ATOM 0 HG3 GLN A 159 -23.167 19.632 -1.143 1.00 75.33 H new ATOM 0 HE21 GLN A 159 -21.185 18.638 -3.100 1.00 55.25 H new ATOM 0 HE22 GLN A 159 -20.690 20.051 -4.038 1.00 55.25 H new ATOM 2335 N GLN A 160 -24.582 20.807 2.196 1.00 24.23 N ATOM 2336 CA GLN A 160 -26.034 20.849 2.289 1.00 24.10 C ATOM 2337 C GLN A 160 -26.533 22.283 2.277 1.00 63.54 C ATOM 2338 O GLN A 160 -25.813 23.207 2.671 1.00 4.23 O ATOM 2339 CB GLN A 160 -26.493 20.159 3.579 1.00 12.31 C ATOM 2340 CG GLN A 160 -26.224 18.663 3.613 1.00 43.54 C ATOM 2341 CD GLN A 160 -26.303 18.089 5.011 1.00 21.31 C ATOM 2342 OE1 GLN A 160 -25.988 18.763 5.992 1.00 30.12 O ATOM 2343 NE2 GLN A 160 -26.723 16.849 5.115 1.00 71.23 N ATOM 0 H GLN A 160 -24.104 21.539 2.722 1.00 24.23 H new ATOM 0 HA GLN A 160 -26.448 20.327 1.426 1.00 24.10 H new ATOM 0 HB2 GLN A 160 -25.992 20.627 4.426 1.00 12.31 H new ATOM 0 HB3 GLN A 160 -27.562 20.328 3.708 1.00 12.31 H new ATOM 0 HG2 GLN A 160 -26.945 18.153 2.974 1.00 43.54 H new ATOM 0 HG3 GLN A 160 -25.235 18.466 3.199 1.00 43.54 H new ATOM 0 HE21 GLN A 160 -26.975 16.324 4.278 1.00 71.23 H new ATOM 0 HE22 GLN A 160 -26.798 16.411 6.033 1.00 71.23 H new ATOM 2352 N SER A 161 -27.757 22.464 1.821 1.00 3.53 N ATOM 2353 CA SER A 161 -28.367 23.778 1.759 1.00 22.12 C ATOM 2354 C SER A 161 -29.863 23.694 2.057 1.00 70.14 C ATOM 2355 O SER A 161 -30.374 24.423 2.906 1.00 63.10 O ATOM 2356 CB SER A 161 -28.134 24.408 0.385 1.00 41.11 C ATOM 2357 OG SER A 161 -26.750 24.453 0.073 1.00 34.14 O ATOM 0 H SER A 161 -28.354 21.709 1.485 1.00 3.53 H new ATOM 0 HA SER A 161 -27.901 24.408 2.517 1.00 22.12 H new ATOM 0 HB2 SER A 161 -28.663 23.835 -0.376 1.00 41.11 H new ATOM 0 HB3 SER A 161 -28.547 25.417 0.369 1.00 41.11 H new ATOM 0 HG SER A 161 -26.627 24.858 -0.811 1.00 34.14 H new ATOM 2363 N SER A 162 -30.557 22.789 1.351 1.00 61.32 N ATOM 2364 CA SER A 162 -32.001 22.591 1.521 1.00 52.13 C ATOM 2365 C SER A 162 -32.772 23.832 1.056 1.00 64.54 C ATOM 2366 O SER A 162 -33.849 24.146 1.565 1.00 31.03 O ATOM 2367 CB SER A 162 -32.325 22.262 2.986 1.00 32.13 C ATOM 2368 OG SER A 162 -31.481 21.219 3.461 1.00 63.14 O ATOM 0 H SER A 162 -30.135 22.178 0.651 1.00 61.32 H new ATOM 0 HA SER A 162 -32.313 21.748 0.904 1.00 52.13 H new ATOM 0 HB2 SER A 162 -32.195 23.152 3.602 1.00 32.13 H new ATOM 0 HB3 SER A 162 -33.369 21.962 3.075 1.00 32.13 H new ATOM 0 HG SER A 162 -31.699 21.022 4.396 1.00 63.14 H new ATOM 2374 N SER A 163 -32.211 24.521 0.078 1.00 51.42 N ATOM 2375 CA SER A 163 -32.816 25.721 -0.455 1.00 62.23 C ATOM 2376 C SER A 163 -33.834 25.377 -1.543 1.00 14.22 C ATOM 2377 O SER A 163 -33.649 24.420 -2.300 1.00 25.40 O ATOM 2378 CB SER A 163 -31.732 26.639 -1.017 1.00 12.25 C ATOM 2379 OG SER A 163 -30.712 26.871 -0.053 1.00 24.31 O ATOM 0 H SER A 163 -31.329 24.264 -0.364 1.00 51.42 H new ATOM 0 HA SER A 163 -33.340 26.236 0.350 1.00 62.23 H new ATOM 0 HB2 SER A 163 -31.298 26.191 -1.911 1.00 12.25 H new ATOM 0 HB3 SER A 163 -32.175 27.588 -1.319 1.00 12.25 H new ATOM 0 HG SER A 163 -30.028 27.460 -0.435 1.00 24.31 H new ATOM 2385 N GLN A 164 -34.891 26.170 -1.623 1.00 4.51 N ATOM 2386 CA GLN A 164 -35.956 25.969 -2.600 1.00 73.14 C ATOM 2387 C GLN A 164 -36.516 27.319 -3.017 1.00 1.23 C ATOM 2388 O GLN A 164 -35.944 28.363 -2.673 1.00 42.42 O ATOM 2389 CB GLN A 164 -37.086 25.113 -2.011 1.00 64.11 C ATOM 2390 CG GLN A 164 -36.696 23.683 -1.679 1.00 30.41 C ATOM 2391 CD GLN A 164 -37.850 22.888 -1.105 1.00 24.45 C ATOM 2392 OE1 GLN A 164 -38.729 23.437 -0.441 1.00 13.24 O ATOM 2393 NE2 GLN A 164 -37.859 21.597 -1.356 1.00 43.54 N ATOM 0 H GLN A 164 -35.037 26.974 -1.012 1.00 4.51 H new ATOM 0 HA GLN A 164 -35.541 25.450 -3.464 1.00 73.14 H new ATOM 0 HB2 GLN A 164 -37.452 25.594 -1.104 1.00 64.11 H new ATOM 0 HB3 GLN A 164 -37.915 25.094 -2.719 1.00 64.11 H new ATOM 0 HG2 GLN A 164 -36.332 23.190 -2.580 1.00 30.41 H new ATOM 0 HG3 GLN A 164 -35.873 23.690 -0.965 1.00 30.41 H new ATOM 0 HE21 GLN A 164 -37.111 21.180 -1.911 1.00 43.54 H new ATOM 0 HE22 GLN A 164 -38.614 21.013 -0.996 1.00 43.54 H new ATOM 2402 N GLN A 165 -37.623 27.307 -3.741 1.00 65.14 N ATOM 2403 CA GLN A 165 -38.240 28.537 -4.206 1.00 23.11 C ATOM 2404 C GLN A 165 -39.699 28.318 -4.567 1.00 71.34 C ATOM 2405 O GLN A 165 -40.024 27.559 -5.487 1.00 74.04 O ATOM 2406 CB GLN A 165 -37.491 29.090 -5.420 1.00 61.45 C ATOM 2407 CG GLN A 165 -38.076 30.391 -5.961 1.00 72.51 C ATOM 2408 CD GLN A 165 -37.340 30.909 -7.181 1.00 22.22 C ATOM 2409 OE1 GLN A 165 -36.047 30.642 -7.253 1.00 11.23 O flip ATOM 2410 NE2 GLN A 165 -37.930 31.561 -8.050 1.00 44.21 N flip ATOM 0 H GLN A 165 -38.113 26.457 -4.020 1.00 65.14 H new ATOM 0 HA GLN A 165 -38.187 29.259 -3.391 1.00 23.11 H new ATOM 0 HB2 GLN A 165 -36.449 29.256 -5.148 1.00 61.45 H new ATOM 0 HB3 GLN A 165 -37.498 28.341 -6.212 1.00 61.45 H new ATOM 0 HG2 GLN A 165 -39.124 30.234 -6.215 1.00 72.51 H new ATOM 0 HG3 GLN A 165 -38.048 31.149 -5.178 1.00 72.51 H new ATOM 0 HE21 GLN A 165 -38.929 31.746 -7.958 1.00 44.21 H new ATOM 0 HE22 GLN A 165 -37.418 31.914 -8.859 1.00 44.21 H new ATOM 2419 N GLN A 166 -40.573 28.975 -3.845 1.00 14.35 N ATOM 2420 CA GLN A 166 -41.987 28.913 -4.123 1.00 51.24 C ATOM 2421 C GLN A 166 -42.378 30.161 -4.911 1.00 31.32 C ATOM 2422 O GLN A 166 -41.604 31.121 -4.972 1.00 1.25 O ATOM 2423 CB GLN A 166 -42.782 28.816 -2.811 1.00 63.01 C ATOM 2424 CG GLN A 166 -44.271 28.573 -3.003 1.00 43.34 C ATOM 2425 CD GLN A 166 -45.020 28.463 -1.696 1.00 33.34 C ATOM 2426 OE1 GLN A 166 -45.173 27.377 -1.143 1.00 62.13 O ATOM 2427 NE2 GLN A 166 -45.497 29.581 -1.197 1.00 54.31 N ATOM 0 H GLN A 166 -40.326 29.566 -3.051 1.00 14.35 H new ATOM 0 HA GLN A 166 -42.217 28.026 -4.713 1.00 51.24 H new ATOM 0 HB2 GLN A 166 -42.368 28.009 -2.207 1.00 63.01 H new ATOM 0 HB3 GLN A 166 -42.645 29.739 -2.247 1.00 63.01 H new ATOM 0 HG2 GLN A 166 -44.694 29.387 -3.592 1.00 43.34 H new ATOM 0 HG3 GLN A 166 -44.414 27.657 -3.576 1.00 43.34 H new ATOM 0 HE21 GLN A 166 -45.348 30.463 -1.688 1.00 54.31 H new ATOM 0 HE22 GLN A 166 -46.016 29.567 -0.319 1.00 54.31 H new ATOM 2436 N SER A 167 -43.552 30.161 -5.510 1.00 43.14 N ATOM 2437 CA SER A 167 -44.001 31.297 -6.295 1.00 41.13 C ATOM 2438 C SER A 167 -45.515 31.307 -6.413 1.00 63.15 C ATOM 2439 O SER A 167 -46.115 30.407 -6.999 1.00 24.55 O ATOM 2440 CB SER A 167 -43.367 31.271 -7.698 1.00 22.44 C ATOM 2441 OG SER A 167 -41.949 31.345 -7.625 1.00 42.41 O ATOM 0 H SER A 167 -44.214 29.386 -5.469 1.00 43.14 H new ATOM 0 HA SER A 167 -43.685 32.205 -5.782 1.00 41.13 H new ATOM 0 HB2 SER A 167 -43.660 30.357 -8.215 1.00 22.44 H new ATOM 0 HB3 SER A 167 -43.747 32.106 -8.287 1.00 22.44 H new ATOM 0 HG SER A 167 -41.681 31.612 -6.721 1.00 42.41 H new ATOM 2447 N SER A 168 -46.123 32.316 -5.820 1.00 15.11 N ATOM 2448 CA SER A 168 -47.557 32.492 -5.853 1.00 22.01 C ATOM 2449 C SER A 168 -47.921 33.924 -5.495 1.00 12.04 C ATOM 2450 O SER A 168 -47.433 34.466 -4.501 1.00 5.34 O ATOM 2451 CB SER A 168 -48.238 31.506 -4.898 1.00 50.20 C ATOM 2452 OG SER A 168 -47.526 31.404 -3.670 1.00 30.24 O ATOM 0 H SER A 168 -45.630 33.041 -5.299 1.00 15.11 H new ATOM 0 HA SER A 168 -47.911 32.289 -6.864 1.00 22.01 H new ATOM 0 HB2 SER A 168 -49.260 31.831 -4.703 1.00 50.20 H new ATOM 0 HB3 SER A 168 -48.300 30.524 -5.368 1.00 50.20 H new ATOM 0 HG SER A 168 -47.983 30.770 -3.079 1.00 30.24 H new ATOM 2458 N ARG A 169 -48.741 34.542 -6.318 1.00 21.33 N ATOM 2459 CA ARG A 169 -49.175 35.903 -6.079 1.00 1.33 C ATOM 2460 C ARG A 169 -50.428 35.912 -5.222 1.00 21.12 C ATOM 2461 O ARG A 169 -51.534 35.774 -5.784 1.00 0.00 O ATOM 2462 CB ARG A 169 -49.435 36.628 -7.399 1.00 35.51 C ATOM 2463 CG ARG A 169 -48.209 36.756 -8.288 1.00 70.13 C ATOM 2464 CD ARG A 169 -48.522 37.552 -9.539 1.00 41.33 C ATOM 2465 NE ARG A 169 -49.004 38.892 -9.213 1.00 12.32 N ATOM 2466 CZ ARG A 169 -50.002 39.512 -9.840 1.00 61.25 C ATOM 2467 NH1 ARG A 169 -50.623 38.926 -10.861 1.00 34.13 N ATOM 2468 NH2 ARG A 169 -50.371 40.721 -9.449 1.00 1.42 N ATOM 2469 OXT ARG A 169 -50.305 36.037 -3.991 1.00 0.00 O ATOM 0 H ARG A 169 -49.123 34.120 -7.165 1.00 21.33 H new ATOM 0 HA ARG A 169 -48.380 36.428 -5.549 1.00 1.33 H new ATOM 0 HB2 ARG A 169 -50.213 36.096 -7.946 1.00 35.51 H new ATOM 0 HB3 ARG A 169 -49.821 37.625 -7.184 1.00 35.51 H new ATOM 0 HG2 ARG A 169 -47.405 37.242 -7.736 1.00 70.13 H new ATOM 0 HG3 ARG A 169 -47.851 35.764 -8.564 1.00 70.13 H new ATOM 0 HD2 ARG A 169 -47.628 37.626 -10.158 1.00 41.33 H new ATOM 0 HD3 ARG A 169 -49.274 37.027 -10.127 1.00 41.33 H new ATOM 0 HE ARG A 169 -48.543 39.388 -8.450 1.00 12.32 H new ATOM 0 HH11 ARG A 169 -50.335 37.997 -11.167 1.00 34.13 H new ATOM 0 HH12 ARG A 169 -51.387 39.406 -11.337 1.00 34.13 H new ATOM 0 HH21 ARG A 169 -49.892 41.174 -8.671 1.00 1.42 H new ATOM 0 HH22 ARG A 169 -51.135 41.200 -9.926 1.00 1.42 H new TER 2483 ARG A 169