USER MOD reduce.3.24.130724 H: found=0, std=0, add=917, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 920 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: B 108 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: B 114 HIS : no HD1:sc= 0.0741 K(o=0.074,f=-2) USER MOD Set 2.1: B 104 THR OG1 : rot -102:sc= 1.17 USER MOD Set 2.2: B 107 SER OG : rot 160:sc= 0.985 USER MOD Set 3.1: B 45 TYR OH : rot -134:sc= 1.93 USER MOD Set 3.2: B 68 ASN : amide:sc= -0.0993! K(o=1.8!,f=0.26) USER MOD Set 4.1: B 53 ASN : amide:sc= -0.0572 K(o=0.57,f=-1.2) USER MOD Set 4.2: B 54 SER OG : rot 47:sc= 0.626 USER MOD Set 5.1: B 41 HIS : no HD1:sc= -0.024 K(o=-0.45,f=-0.96) USER MOD Set 5.2: B 90 GLN : amide:sc= -0.016 K(o=-0.45,f=-1.3) USER MOD Set 5.3: B 91 TYR OH : rot 30:sc= -0.411 USER MOD Single : A 1 GLY N :NH3+ -99:sc= 0.045 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 GLN : amide:sc= -0.906 K(o=-0.91,f=0) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= -0.0914 K(o=-0.091,f=-2.3!) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 SER OG : rot 91:sc= -0.169 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : B 31 MET CE :methyl 163:sc= -0.0875 (180deg=-0.521) USER MOD Single : B 34 SER OG : rot -52:sc= 0.553 USER MOD Single : B 35 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 38 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 40 SER OG : rot 138:sc= 0.665 USER MOD Single : B 43 SER OG : rot 180:sc= 0 USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 52 LYS NZ :NH3+ -149:sc= 2.32 (180deg=0.751) USER MOD Single : B 59 LYS NZ :NH3+ 170:sc=-0.000767 (180deg=-0.097) USER MOD Single : B 62 THR OG1 : rot 180:sc= 0 USER MOD Single : B 66 HIS : no HD1:sc=-0.00547 X(o=-0.0055,f=0) USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD Single : B 70 TYR OH : rot 180:sc= 0 USER MOD Single : B 71 THR OG1 : rot 180:sc= 0 USER MOD Single : B 73 LYS NZ :NH3+ 171:sc= 0.325 (180deg=0.17) USER MOD Single : B 76 LYS NZ :NH3+ -163:sc= -0.0423 (180deg=-0.3) USER MOD Single : B 81 TYR OH : rot 180:sc= 0.934 USER MOD Single : B 84 GLN : amide:sc= 1.33 K(o=1.3,f=-9.1!) USER MOD Single : B 87 SER OG : rot 42:sc= -0.713 USER MOD Single : B 89 GLN : amide:sc= 1.14 K(o=1.1,f=-2.4!) USER MOD Single : B 93 HIS : no HE2:sc= 1.06 K(o=1.1,f=-5.3!) USER MOD Single : B 94 GLN : amide:sc= -0.0119 K(o=-0.012,f=-1) USER MOD Single : B 97 THR OG1 : rot -170:sc= 1.26 USER MOD Single : B 102 THR OG1 : rot 34:sc= 0.983 USER MOD Single : B 103 THR OG1 : rot 116:sc= 1.3 USER MOD Single : B 105 SER OG : rot 180:sc= 0 USER MOD Single : B 106 THR OG1 : rot 59:sc= 0.0156 USER MOD Single : B 111 SER OG : rot 180:sc= 0 USER MOD Single : B 113 SER OG : rot 180:sc= 0 USER MOD Single : B 115 HIS : no HE2:sc= -0.0608 K(o=-0.061,f=-0.57) USER MOD Single : B 116 HIS : no HD1:sc= -0.0236 X(o=-0.024,f=-0.00011) USER MOD Single : B 117 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 118 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 119 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -3.626 28.774 13.808 1.00 0.00 N ATOM 2 CA GLY A 1 -4.670 27.776 13.480 1.00 0.00 C ATOM 3 C GLY A 1 -4.425 26.455 14.171 1.00 0.00 C ATOM 4 O GLY A 1 -3.292 26.147 14.550 1.00 0.00 O ATOM 0 H1 GLY A 1 -3.975 29.410 14.553 1.00 0.00 H new ATOM 0 H2 GLY A 1 -2.771 28.285 14.143 1.00 0.00 H new ATOM 0 H3 GLY A 1 -3.397 29.329 12.959 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -5.646 28.163 13.772 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -4.698 27.622 12.401 1.00 0.00 H new ATOM 10 N SER A 2 -5.480 25.675 14.343 1.00 0.00 N ATOM 11 CA SER A 2 -5.373 24.388 15.004 1.00 0.00 C ATOM 12 C SER A 2 -5.269 23.263 13.977 1.00 0.00 C ATOM 13 O SER A 2 -4.380 22.416 14.063 1.00 0.00 O ATOM 14 CB SER A 2 -6.578 24.165 15.923 1.00 0.00 C ATOM 15 OG SER A 2 -6.427 22.990 16.701 1.00 0.00 O ATOM 0 H SER A 2 -6.422 25.913 14.032 1.00 0.00 H new ATOM 0 HA SER A 2 -4.466 24.383 15.609 1.00 0.00 H new ATOM 0 HB2 SER A 2 -6.699 25.025 16.581 1.00 0.00 H new ATOM 0 HB3 SER A 2 -7.485 24.092 15.324 1.00 0.00 H new ATOM 0 HG SER A 2 -7.211 22.877 17.278 1.00 0.00 H new ATOM 21 N GLN A 3 -6.161 23.269 12.995 1.00 0.00 N ATOM 22 CA GLN A 3 -6.195 22.206 12.000 1.00 0.00 C ATOM 23 C GLN A 3 -5.108 22.411 10.956 1.00 0.00 C ATOM 24 O GLN A 3 -5.258 23.209 10.031 1.00 0.00 O ATOM 25 CB GLN A 3 -7.564 22.134 11.323 1.00 0.00 C ATOM 26 CG GLN A 3 -7.679 20.990 10.327 1.00 0.00 C ATOM 27 CD GLN A 3 -9.039 20.910 9.663 1.00 0.00 C ATOM 28 OE1 GLN A 3 -9.505 19.824 9.320 1.00 0.00 O ATOM 29 NE2 GLN A 3 -9.680 22.048 9.463 1.00 0.00 N ATOM 0 H GLN A 3 -6.867 23.994 12.867 1.00 0.00 H new ATOM 0 HA GLN A 3 -6.013 21.262 12.515 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -8.334 22.022 12.086 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -7.758 23.076 10.809 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -6.914 21.107 9.560 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -7.476 20.049 10.839 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -9.261 22.929 9.762 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -10.594 22.046 9.010 1.00 0.00 H new ATOM 38 N THR A 4 -4.008 21.701 11.119 1.00 0.00 N ATOM 39 CA THR A 4 -2.913 21.764 10.172 1.00 0.00 C ATOM 40 C THR A 4 -2.564 20.365 9.680 1.00 0.00 C ATOM 41 O THR A 4 -1.839 19.622 10.348 1.00 0.00 O ATOM 42 CB THR A 4 -1.670 22.415 10.808 1.00 0.00 C ATOM 43 OG1 THR A 4 -2.050 23.628 11.474 1.00 0.00 O ATOM 44 CG2 THR A 4 -0.617 22.725 9.754 1.00 0.00 C ATOM 0 H THR A 4 -3.849 21.070 11.904 1.00 0.00 H new ATOM 0 HA THR A 4 -3.231 22.376 9.328 1.00 0.00 H new ATOM 0 HB THR A 4 -1.245 21.714 11.526 1.00 0.00 H new ATOM 0 HG1 THR A 4 -1.259 24.040 11.880 1.00 0.00 H new ATOM 0 HG21 THR A 4 0.250 23.184 10.230 1.00 0.00 H new ATOM 0 HG22 THR A 4 -0.314 21.802 9.260 1.00 0.00 H new ATOM 0 HG23 THR A 4 -1.032 23.412 9.016 1.00 0.00 H new ATOM 52 N THR A 5 -3.097 20.000 8.527 1.00 0.00 N ATOM 53 CA THR A 5 -2.848 18.686 7.966 1.00 0.00 C ATOM 54 C THR A 5 -1.441 18.621 7.377 1.00 0.00 C ATOM 55 O THR A 5 -0.914 19.619 6.877 1.00 0.00 O ATOM 56 CB THR A 5 -3.898 18.313 6.896 1.00 0.00 C ATOM 57 OG1 THR A 5 -3.637 17.004 6.378 1.00 0.00 O ATOM 58 CG2 THR A 5 -3.908 19.321 5.760 1.00 0.00 C ATOM 0 H THR A 5 -3.704 20.595 7.963 1.00 0.00 H new ATOM 0 HA THR A 5 -2.930 17.959 8.774 1.00 0.00 H new ATOM 0 HB THR A 5 -4.878 18.323 7.374 1.00 0.00 H new ATOM 0 HG1 THR A 5 -4.310 16.779 5.702 1.00 0.00 H new ATOM 0 HG21 THR A 5 -4.657 19.031 5.023 1.00 0.00 H new ATOM 0 HG22 THR A 5 -4.148 20.309 6.152 1.00 0.00 H new ATOM 0 HG23 THR A 5 -2.926 19.347 5.288 1.00 0.00 H new ATOM 66 N ALA A 6 -0.833 17.450 7.462 1.00 0.00 N ATOM 67 CA ALA A 6 0.537 17.261 7.015 1.00 0.00 C ATOM 68 C ALA A 6 0.773 15.850 6.462 1.00 0.00 C ATOM 69 O ALA A 6 1.377 15.713 5.397 1.00 0.00 O ATOM 70 CB ALA A 6 1.522 17.576 8.135 1.00 0.00 C ATOM 0 H ALA A 6 -1.271 16.610 7.840 1.00 0.00 H new ATOM 0 HA ALA A 6 0.708 17.961 6.197 1.00 0.00 H new ATOM 0 HB1 ALA A 6 2.540 17.427 7.776 1.00 0.00 H new ATOM 0 HB2 ALA A 6 1.396 18.612 8.450 1.00 0.00 H new ATOM 0 HB3 ALA A 6 1.335 16.914 8.981 1.00 0.00 H new ATOM 76 N PRO A 7 0.325 14.773 7.158 1.00 0.00 N ATOM 77 CA PRO A 7 0.508 13.402 6.665 1.00 0.00 C ATOM 78 C PRO A 7 -0.203 13.157 5.336 1.00 0.00 C ATOM 79 O PRO A 7 -1.430 13.045 5.281 1.00 0.00 O ATOM 80 CB PRO A 7 -0.104 12.524 7.764 1.00 0.00 C ATOM 81 CG PRO A 7 -0.135 13.389 8.975 1.00 0.00 C ATOM 82 CD PRO A 7 -0.364 14.780 8.466 1.00 0.00 C ATOM 0 HA PRO A 7 1.559 13.189 6.472 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -1.105 12.191 7.491 1.00 0.00 H new ATOM 0 HB3 PRO A 7 0.495 11.629 7.933 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -0.930 13.084 9.655 1.00 0.00 H new ATOM 0 HG3 PRO A 7 0.801 13.323 9.529 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -1.426 15.002 8.362 1.00 0.00 H new ATOM 0 HD3 PRO A 7 0.054 15.530 9.138 1.00 0.00 H new ATOM 90 N ASP A 8 0.579 13.072 4.268 1.00 0.00 N ATOM 91 CA ASP A 8 0.044 12.813 2.935 1.00 0.00 C ATOM 92 C ASP A 8 0.191 11.338 2.589 1.00 0.00 C ATOM 93 O ASP A 8 0.097 10.938 1.431 1.00 0.00 O ATOM 94 CB ASP A 8 0.746 13.686 1.883 1.00 0.00 C ATOM 95 CG ASP A 8 2.238 13.423 1.785 1.00 0.00 C ATOM 96 OD1 ASP A 8 2.948 13.612 2.798 1.00 0.00 O ATOM 97 OD2 ASP A 8 2.713 13.060 0.687 1.00 0.00 O ATOM 0 H ASP A 8 1.593 13.179 4.298 1.00 0.00 H new ATOM 0 HA ASP A 8 -1.015 13.070 2.933 1.00 0.00 H new ATOM 0 HB2 ASP A 8 0.288 13.509 0.910 1.00 0.00 H new ATOM 0 HB3 ASP A 8 0.584 14.736 2.126 1.00 0.00 H new ATOM 102 N ALA A 9 0.426 10.534 3.617 1.00 0.00 N ATOM 103 CA ALA A 9 0.507 9.093 3.465 1.00 0.00 C ATOM 104 C ALA A 9 -0.832 8.454 3.817 1.00 0.00 C ATOM 105 O ALA A 9 -1.462 8.841 4.806 1.00 0.00 O ATOM 106 CB ALA A 9 1.606 8.531 4.352 1.00 0.00 C ATOM 0 H ALA A 9 0.565 10.862 4.573 1.00 0.00 H new ATOM 0 HA ALA A 9 0.745 8.862 2.427 1.00 0.00 H new ATOM 0 HB1 ALA A 9 1.656 7.449 4.228 1.00 0.00 H new ATOM 0 HB2 ALA A 9 2.562 8.973 4.071 1.00 0.00 H new ATOM 0 HB3 ALA A 9 1.389 8.767 5.394 1.00 0.00 H new ATOM 112 N PRO A 10 -1.300 7.493 3.006 1.00 0.00 N ATOM 113 CA PRO A 10 -2.536 6.756 3.283 1.00 0.00 C ATOM 114 C PRO A 10 -2.419 5.934 4.561 1.00 0.00 C ATOM 115 O PRO A 10 -1.500 5.125 4.701 1.00 0.00 O ATOM 116 CB PRO A 10 -2.698 5.829 2.070 1.00 0.00 C ATOM 117 CG PRO A 10 -1.805 6.393 1.020 1.00 0.00 C ATOM 118 CD PRO A 10 -0.672 7.052 1.752 1.00 0.00 C ATOM 0 HA PRO A 10 -3.385 7.423 3.430 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -2.416 4.805 2.317 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -3.734 5.802 1.732 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -1.438 5.609 0.357 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -2.339 7.112 0.398 1.00 0.00 H new ATOM 0 HD2 PRO A 10 0.149 6.358 1.934 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -0.262 7.891 1.189 1.00 0.00 H new ATOM 126 N PRO A 11 -3.330 6.161 5.522 1.00 0.00 N ATOM 127 CA PRO A 11 -3.376 5.399 6.776 1.00 0.00 C ATOM 128 C PRO A 11 -3.403 3.891 6.542 1.00 0.00 C ATOM 129 O PRO A 11 -3.873 3.424 5.501 1.00 0.00 O ATOM 130 CB PRO A 11 -4.682 5.862 7.419 1.00 0.00 C ATOM 131 CG PRO A 11 -4.896 7.230 6.878 1.00 0.00 C ATOM 132 CD PRO A 11 -4.375 7.196 5.469 1.00 0.00 C ATOM 0 HA PRO A 11 -2.493 5.573 7.391 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -5.508 5.199 7.162 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -4.608 5.872 8.506 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -5.952 7.498 6.899 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -4.367 7.974 7.473 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -5.159 6.941 4.756 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -3.970 8.162 5.166 1.00 0.00 H new ATOM 140 N ASP A 12 -2.895 3.153 7.530 1.00 0.00 N ATOM 141 CA ASP A 12 -2.759 1.695 7.464 1.00 0.00 C ATOM 142 C ASP A 12 -4.013 1.030 6.905 1.00 0.00 C ATOM 143 O ASP A 12 -5.091 1.121 7.497 1.00 0.00 O ATOM 144 CB ASP A 12 -2.453 1.131 8.857 1.00 0.00 C ATOM 145 CG ASP A 12 -1.118 1.602 9.404 1.00 0.00 C ATOM 146 OD1 ASP A 12 -0.178 0.784 9.491 1.00 0.00 O ATOM 147 OD2 ASP A 12 -0.998 2.797 9.753 1.00 0.00 O ATOM 0 H ASP A 12 -2.563 3.553 8.407 1.00 0.00 H new ATOM 0 HA ASP A 12 -1.934 1.475 6.787 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -3.246 1.425 9.545 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -2.458 0.042 8.812 1.00 0.00 H new ATOM 152 N PRO A 13 -3.886 0.374 5.736 1.00 0.00 N ATOM 153 CA PRO A 13 -5.002 -0.304 5.068 1.00 0.00 C ATOM 154 C PRO A 13 -5.586 -1.439 5.904 1.00 0.00 C ATOM 155 O PRO A 13 -4.873 -2.109 6.652 1.00 0.00 O ATOM 156 CB PRO A 13 -4.378 -0.868 3.785 1.00 0.00 C ATOM 157 CG PRO A 13 -3.125 -0.087 3.587 1.00 0.00 C ATOM 158 CD PRO A 13 -2.639 0.257 4.963 1.00 0.00 C ATOM 0 HA PRO A 13 -5.831 0.382 4.892 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -4.167 -1.933 3.884 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -5.052 -0.754 2.936 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -2.382 -0.671 3.044 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -3.313 0.813 3.002 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -1.986 -0.517 5.366 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -2.071 1.188 4.969 1.00 0.00 H new ATOM 166 N THR A 14 -6.884 -1.649 5.764 1.00 0.00 N ATOM 167 CA THR A 14 -7.573 -2.710 6.477 1.00 0.00 C ATOM 168 C THR A 14 -8.022 -3.791 5.498 1.00 0.00 C ATOM 169 O THR A 14 -8.496 -3.485 4.399 1.00 0.00 O ATOM 170 CB THR A 14 -8.805 -2.167 7.223 1.00 0.00 C ATOM 171 OG1 THR A 14 -8.491 -0.911 7.843 1.00 0.00 O ATOM 172 CG2 THR A 14 -9.276 -3.150 8.284 1.00 0.00 C ATOM 0 H THR A 14 -7.486 -1.093 5.157 1.00 0.00 H new ATOM 0 HA THR A 14 -6.878 -3.130 7.203 1.00 0.00 H new ATOM 0 HB THR A 14 -9.605 -2.027 6.496 1.00 0.00 H new ATOM 0 HG1 THR A 14 -9.281 -0.572 8.314 1.00 0.00 H new ATOM 0 HG21 THR A 14 -10.147 -2.742 8.796 1.00 0.00 H new ATOM 0 HG22 THR A 14 -9.542 -4.096 7.811 1.00 0.00 H new ATOM 0 HG23 THR A 14 -8.476 -3.317 9.005 1.00 0.00 H new ATOM 180 N VAL A 15 -7.867 -5.044 5.890 1.00 0.00 N ATOM 181 CA VAL A 15 -8.256 -6.159 5.047 1.00 0.00 C ATOM 182 C VAL A 15 -9.592 -6.737 5.504 1.00 0.00 C ATOM 183 O VAL A 15 -9.732 -7.173 6.647 1.00 0.00 O ATOM 184 CB VAL A 15 -7.180 -7.267 5.052 1.00 0.00 C ATOM 185 CG1 VAL A 15 -7.661 -8.496 4.298 1.00 0.00 C ATOM 186 CG2 VAL A 15 -5.880 -6.749 4.453 1.00 0.00 C ATOM 0 H VAL A 15 -7.473 -5.314 6.791 1.00 0.00 H new ATOM 0 HA VAL A 15 -8.359 -5.782 4.030 1.00 0.00 H new ATOM 0 HB VAL A 15 -6.996 -7.556 6.087 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -6.885 -9.261 4.316 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -8.563 -8.883 4.771 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -7.880 -8.226 3.265 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -5.133 -7.542 4.464 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -6.055 -6.430 3.426 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -5.521 -5.904 5.040 1.00 0.00 H new ATOM 196 N ASP A 16 -10.567 -6.729 4.607 1.00 0.00 N ATOM 197 CA ASP A 16 -11.898 -7.243 4.907 1.00 0.00 C ATOM 198 C ASP A 16 -12.314 -8.298 3.895 1.00 0.00 C ATOM 199 O ASP A 16 -11.678 -8.443 2.849 1.00 0.00 O ATOM 200 CB ASP A 16 -12.933 -6.115 4.915 1.00 0.00 C ATOM 201 CG ASP A 16 -12.912 -5.298 6.190 1.00 0.00 C ATOM 202 OD1 ASP A 16 -12.306 -4.206 6.200 1.00 0.00 O ATOM 203 OD2 ASP A 16 -13.525 -5.734 7.188 1.00 0.00 O ATOM 0 H ASP A 16 -10.461 -6.370 3.658 1.00 0.00 H new ATOM 0 HA ASP A 16 -11.856 -7.695 5.898 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -12.750 -5.457 4.066 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -13.927 -6.541 4.780 1.00 0.00 H new ATOM 208 N GLN A 17 -13.387 -9.019 4.224 1.00 0.00 N ATOM 209 CA GLN A 17 -13.974 -10.035 3.347 1.00 0.00 C ATOM 210 C GLN A 17 -12.912 -10.975 2.782 1.00 0.00 C ATOM 211 O GLN A 17 -12.591 -10.931 1.592 1.00 0.00 O ATOM 212 CB GLN A 17 -14.766 -9.374 2.212 1.00 0.00 C ATOM 213 CG GLN A 17 -15.844 -8.418 2.699 1.00 0.00 C ATOM 214 CD GLN A 17 -16.731 -7.900 1.581 1.00 0.00 C ATOM 215 OE1 GLN A 17 -16.309 -7.786 0.429 1.00 0.00 O ATOM 216 NE2 GLN A 17 -17.968 -7.573 1.919 1.00 0.00 N ATOM 0 H GLN A 17 -13.877 -8.914 5.112 1.00 0.00 H new ATOM 0 HA GLN A 17 -14.657 -10.634 3.949 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -14.076 -8.831 1.566 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -15.229 -10.150 1.603 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -16.462 -8.924 3.440 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -15.372 -7.573 3.201 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -18.279 -7.682 2.884 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -18.611 -7.212 1.214 1.00 0.00 H new ATOM 225 N VAL A 18 -12.365 -11.820 3.642 1.00 0.00 N ATOM 226 CA VAL A 18 -11.355 -12.779 3.225 1.00 0.00 C ATOM 227 C VAL A 18 -12.004 -14.063 2.704 1.00 0.00 C ATOM 228 O VAL A 18 -12.773 -14.720 3.405 1.00 0.00 O ATOM 229 CB VAL A 18 -10.363 -13.100 4.374 1.00 0.00 C ATOM 230 CG1 VAL A 18 -11.093 -13.542 5.634 1.00 0.00 C ATOM 231 CG2 VAL A 18 -9.356 -14.158 3.944 1.00 0.00 C ATOM 0 H VAL A 18 -12.604 -11.861 4.633 1.00 0.00 H new ATOM 0 HA VAL A 18 -10.788 -12.322 2.413 1.00 0.00 H new ATOM 0 HB VAL A 18 -9.823 -12.182 4.604 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -10.367 -13.759 6.418 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -11.760 -12.746 5.966 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -11.676 -14.438 5.421 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -8.672 -14.365 4.767 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -9.883 -15.072 3.671 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -8.791 -13.795 3.085 1.00 0.00 H new ATOM 241 N ASP A 19 -11.709 -14.393 1.455 1.00 0.00 N ATOM 242 CA ASP A 19 -12.214 -15.611 0.833 1.00 0.00 C ATOM 243 C ASP A 19 -11.157 -16.702 0.905 1.00 0.00 C ATOM 244 O ASP A 19 -10.251 -16.647 1.738 1.00 0.00 O ATOM 245 CB ASP A 19 -12.572 -15.372 -0.637 1.00 0.00 C ATOM 246 CG ASP A 19 -13.613 -14.295 -0.844 1.00 0.00 C ATOM 247 OD1 ASP A 19 -14.789 -14.520 -0.487 1.00 0.00 O ATOM 248 OD2 ASP A 19 -13.266 -13.231 -1.397 1.00 0.00 O ATOM 0 H ASP A 19 -11.116 -13.829 0.846 1.00 0.00 H new ATOM 0 HA ASP A 19 -13.111 -15.915 1.372 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -11.668 -15.100 -1.182 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -12.936 -16.304 -1.069 1.00 0.00 H new ATOM 253 N ASP A 20 -11.269 -17.684 0.019 1.00 0.00 N ATOM 254 CA ASP A 20 -10.302 -18.772 -0.043 1.00 0.00 C ATOM 255 C ASP A 20 -8.953 -18.252 -0.512 1.00 0.00 C ATOM 256 O ASP A 20 -7.924 -18.523 0.106 1.00 0.00 O ATOM 257 CB ASP A 20 -10.781 -19.875 -0.988 1.00 0.00 C ATOM 258 CG ASP A 20 -12.137 -20.426 -0.607 1.00 0.00 C ATOM 259 OD1 ASP A 20 -13.117 -20.150 -1.328 1.00 0.00 O ATOM 260 OD2 ASP A 20 -12.240 -21.129 0.417 1.00 0.00 O ATOM 0 H ASP A 20 -12.021 -17.749 -0.667 1.00 0.00 H new ATOM 0 HA ASP A 20 -10.201 -19.189 0.959 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -10.826 -19.482 -2.004 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -10.052 -20.686 -0.991 1.00 0.00 H new ATOM 265 N THR A 21 -8.966 -17.487 -1.600 1.00 0.00 N ATOM 266 CA THR A 21 -7.737 -16.967 -2.182 1.00 0.00 C ATOM 267 C THR A 21 -7.859 -15.490 -2.559 1.00 0.00 C ATOM 268 O THR A 21 -7.116 -14.997 -3.407 1.00 0.00 O ATOM 269 CB THR A 21 -7.324 -17.773 -3.435 1.00 0.00 C ATOM 270 OG1 THR A 21 -8.440 -17.917 -4.328 1.00 0.00 O ATOM 271 CG2 THR A 21 -6.793 -19.147 -3.057 1.00 0.00 C ATOM 0 H THR A 21 -9.815 -17.215 -2.095 1.00 0.00 H new ATOM 0 HA THR A 21 -6.970 -17.069 -1.414 1.00 0.00 H new ATOM 0 HB THR A 21 -6.529 -17.221 -3.936 1.00 0.00 H new ATOM 0 HG1 THR A 21 -8.164 -18.428 -5.117 1.00 0.00 H new ATOM 0 HG21 THR A 21 -6.511 -19.689 -3.960 1.00 0.00 H new ATOM 0 HG22 THR A 21 -5.920 -19.035 -2.413 1.00 0.00 H new ATOM 0 HG23 THR A 21 -7.566 -19.703 -2.527 1.00 0.00 H new ATOM 279 N SER A 22 -8.785 -14.778 -1.928 1.00 0.00 N ATOM 280 CA SER A 22 -8.994 -13.370 -2.244 1.00 0.00 C ATOM 281 C SER A 22 -9.367 -12.566 -1.005 1.00 0.00 C ATOM 282 O SER A 22 -10.013 -13.079 -0.095 1.00 0.00 O ATOM 283 CB SER A 22 -10.075 -13.226 -3.322 1.00 0.00 C ATOM 284 OG SER A 22 -11.216 -14.010 -3.016 1.00 0.00 O ATOM 0 H SER A 22 -9.398 -15.148 -1.201 1.00 0.00 H new ATOM 0 HA SER A 22 -8.055 -12.969 -2.625 1.00 0.00 H new ATOM 0 HB2 SER A 22 -10.364 -12.179 -3.412 1.00 0.00 H new ATOM 0 HB3 SER A 22 -9.671 -13.530 -4.288 1.00 0.00 H new ATOM 0 HG SER A 22 -11.849 -13.476 -2.493 1.00 0.00 H new ATOM 290 N ILE A 23 -8.938 -11.312 -0.972 1.00 0.00 N ATOM 291 CA ILE A 23 -9.259 -10.406 0.128 1.00 0.00 C ATOM 292 C ILE A 23 -9.658 -9.045 -0.419 1.00 0.00 C ATOM 293 O ILE A 23 -9.331 -8.713 -1.558 1.00 0.00 O ATOM 294 CB ILE A 23 -8.060 -10.176 1.073 1.00 0.00 C ATOM 295 CG1 ILE A 23 -6.936 -9.454 0.322 1.00 0.00 C ATOM 296 CG2 ILE A 23 -7.566 -11.492 1.658 1.00 0.00 C ATOM 297 CD1 ILE A 23 -5.949 -8.743 1.218 1.00 0.00 C ATOM 0 H ILE A 23 -8.361 -10.893 -1.701 1.00 0.00 H new ATOM 0 HA ILE A 23 -10.072 -10.876 0.682 1.00 0.00 H new ATOM 0 HB ILE A 23 -8.385 -9.549 1.903 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -6.398 -10.179 -0.289 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -7.378 -8.728 -0.360 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -6.721 -11.302 2.320 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -8.370 -11.964 2.223 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -7.252 -12.154 0.851 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -5.187 -8.259 0.608 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -6.471 -7.992 1.810 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -5.476 -9.465 1.883 1.00 0.00 H new ATOM 309 N VAL A 24 -10.348 -8.260 0.387 1.00 0.00 N ATOM 310 CA VAL A 24 -10.622 -6.877 0.041 1.00 0.00 C ATOM 311 C VAL A 24 -9.750 -5.959 0.888 1.00 0.00 C ATOM 312 O VAL A 24 -9.992 -5.779 2.083 1.00 0.00 O ATOM 313 CB VAL A 24 -12.107 -6.512 0.250 1.00 0.00 C ATOM 314 CG1 VAL A 24 -12.375 -5.072 -0.162 1.00 0.00 C ATOM 315 CG2 VAL A 24 -13.005 -7.463 -0.524 1.00 0.00 C ATOM 0 H VAL A 24 -10.729 -8.556 1.286 1.00 0.00 H new ATOM 0 HA VAL A 24 -10.393 -6.748 -1.017 1.00 0.00 H new ATOM 0 HB VAL A 24 -12.333 -6.610 1.312 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -13.428 -4.839 -0.005 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -11.761 -4.401 0.439 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -12.128 -4.943 -1.216 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -14.048 -7.190 -0.364 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -12.772 -7.399 -1.587 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -12.840 -8.483 -0.177 1.00 0.00 H new ATOM 325 N VAL A 25 -8.728 -5.392 0.272 1.00 0.00 N ATOM 326 CA VAL A 25 -7.822 -4.491 0.964 1.00 0.00 C ATOM 327 C VAL A 25 -8.177 -3.044 0.634 1.00 0.00 C ATOM 328 O VAL A 25 -8.198 -2.643 -0.532 1.00 0.00 O ATOM 329 CB VAL A 25 -6.337 -4.799 0.621 1.00 0.00 C ATOM 330 CG1 VAL A 25 -6.132 -4.958 -0.874 1.00 0.00 C ATOM 331 CG2 VAL A 25 -5.406 -3.729 1.169 1.00 0.00 C ATOM 0 H VAL A 25 -8.503 -5.540 -0.712 1.00 0.00 H new ATOM 0 HA VAL A 25 -7.938 -4.644 2.037 1.00 0.00 H new ATOM 0 HB VAL A 25 -6.090 -5.746 1.101 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -5.083 -5.172 -1.077 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -6.748 -5.780 -1.240 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -6.418 -4.036 -1.381 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -4.376 -3.976 0.911 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -5.667 -2.763 0.736 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -5.507 -3.680 2.253 1.00 0.00 H new ATOM 341 N ARG A 26 -8.506 -2.280 1.664 1.00 0.00 N ATOM 342 CA ARG A 26 -8.923 -0.896 1.490 1.00 0.00 C ATOM 343 C ARG A 26 -8.082 0.020 2.365 1.00 0.00 C ATOM 344 O ARG A 26 -7.551 -0.411 3.384 1.00 0.00 O ATOM 345 CB ARG A 26 -10.399 -0.729 1.848 1.00 0.00 C ATOM 346 CG ARG A 26 -11.325 -1.678 1.108 1.00 0.00 C ATOM 347 CD ARG A 26 -12.779 -1.436 1.475 1.00 0.00 C ATOM 348 NE ARG A 26 -13.210 -0.084 1.125 1.00 0.00 N ATOM 349 CZ ARG A 26 -14.480 0.315 1.105 1.00 0.00 C ATOM 350 NH1 ARG A 26 -15.452 -0.534 1.420 1.00 0.00 N ATOM 351 NH2 ARG A 26 -14.773 1.567 0.775 1.00 0.00 N ATOM 0 H ARG A 26 -8.492 -2.596 2.634 1.00 0.00 H new ATOM 0 HA ARG A 26 -8.781 -0.627 0.443 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -10.522 -0.881 2.920 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -10.700 0.297 1.635 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -11.194 -1.552 0.033 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -11.056 -2.708 1.343 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -13.409 -2.162 0.962 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -12.915 -1.595 2.545 1.00 0.00 H new ATOM 0 HE ARG A 26 -12.492 0.598 0.880 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -15.226 -1.495 1.678 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -16.424 -0.225 1.404 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -14.026 2.220 0.538 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -15.745 1.876 0.759 1.00 0.00 H new ATOM 365 N TRP A 27 -7.972 1.277 1.967 1.00 0.00 N ATOM 366 CA TRP A 27 -7.182 2.249 2.710 1.00 0.00 C ATOM 367 C TRP A 27 -7.859 3.615 2.685 1.00 0.00 C ATOM 368 O TRP A 27 -8.768 3.851 1.887 1.00 0.00 O ATOM 369 CB TRP A 27 -5.759 2.332 2.138 1.00 0.00 C ATOM 370 CG TRP A 27 -5.706 2.523 0.650 1.00 0.00 C ATOM 371 CD1 TRP A 27 -5.632 3.708 -0.023 1.00 0.00 C ATOM 372 CD2 TRP A 27 -5.711 1.494 -0.351 1.00 0.00 C ATOM 373 NE1 TRP A 27 -5.603 3.480 -1.377 1.00 0.00 N ATOM 374 CE2 TRP A 27 -5.647 2.130 -1.603 1.00 0.00 C ATOM 375 CE3 TRP A 27 -5.766 0.096 -0.307 1.00 0.00 C ATOM 376 CZ2 TRP A 27 -5.639 1.418 -2.800 1.00 0.00 C ATOM 377 CZ3 TRP A 27 -5.756 -0.608 -1.495 1.00 0.00 C ATOM 378 CH2 TRP A 27 -5.693 0.052 -2.728 1.00 0.00 C ATOM 0 H TRP A 27 -8.421 1.650 1.131 1.00 0.00 H new ATOM 0 HA TRP A 27 -7.113 1.923 3.748 1.00 0.00 H new ATOM 0 HB2 TRP A 27 -5.234 3.157 2.618 1.00 0.00 H new ATOM 0 HB3 TRP A 27 -5.222 1.419 2.396 1.00 0.00 H new ATOM 0 HD1 TRP A 27 -5.601 4.683 0.441 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -5.556 4.200 -2.098 1.00 0.00 H new ATOM 0 HE3 TRP A 27 -5.815 -0.423 0.639 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -5.592 1.926 -3.752 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -5.798 -1.687 -1.472 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -5.687 -0.527 -3.639 1.00 0.00 H new ATOM 389 N SER A 28 -7.423 4.502 3.564 1.00 0.00 N ATOM 390 CA SER A 28 -8.030 5.818 3.690 1.00 0.00 C ATOM 391 C SER A 28 -7.274 6.859 2.870 1.00 0.00 C ATOM 392 O SER A 28 -6.066 6.747 2.669 1.00 0.00 O ATOM 393 CB SER A 28 -8.060 6.231 5.160 1.00 0.00 C ATOM 394 OG SER A 28 -8.787 5.295 5.935 1.00 0.00 O ATOM 0 H SER A 28 -6.647 4.334 4.204 1.00 0.00 H new ATOM 0 HA SER A 28 -9.048 5.763 3.304 1.00 0.00 H new ATOM 0 HB2 SER A 28 -7.041 6.310 5.540 1.00 0.00 H new ATOM 0 HB3 SER A 28 -8.513 7.218 5.255 1.00 0.00 H new ATOM 0 HG SER A 28 -8.791 5.580 6.873 1.00 0.00 H new ATOM 400 N ARG A 29 -8.005 7.861 2.390 1.00 0.00 N ATOM 401 CA ARG A 29 -7.414 8.967 1.649 1.00 0.00 C ATOM 402 C ARG A 29 -6.673 9.894 2.601 1.00 0.00 C ATOM 403 O ARG A 29 -7.156 10.164 3.702 1.00 0.00 O ATOM 404 CB ARG A 29 -8.498 9.757 0.905 1.00 0.00 C ATOM 405 CG ARG A 29 -9.081 9.032 -0.297 1.00 0.00 C ATOM 406 CD ARG A 29 -8.110 9.021 -1.469 1.00 0.00 C ATOM 407 NE ARG A 29 -7.902 10.359 -2.013 1.00 0.00 N ATOM 408 CZ ARG A 29 -7.426 10.610 -3.231 1.00 0.00 C ATOM 409 NH1 ARG A 29 -6.994 9.622 -4.007 1.00 0.00 N ATOM 410 NH2 ARG A 29 -7.358 11.858 -3.661 1.00 0.00 N ATOM 0 H ARG A 29 -9.016 7.928 2.503 1.00 0.00 H new ATOM 0 HA ARG A 29 -6.713 8.558 0.921 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -9.304 9.991 1.601 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -8.077 10.707 0.574 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -9.329 8.008 -0.020 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -10.011 9.515 -0.598 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -7.155 8.608 -1.146 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -8.492 8.366 -2.252 1.00 0.00 H new ATOM 0 HE ARG A 29 -8.137 11.155 -1.421 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -7.025 8.659 -3.672 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -6.631 9.826 -4.938 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -7.669 12.622 -3.061 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -6.994 12.057 -4.593 1.00 0.00 H new ATOM 424 N PRO A 30 -5.485 10.376 2.209 1.00 0.00 N ATOM 425 CA PRO A 30 -4.721 11.329 3.012 1.00 0.00 C ATOM 426 C PRO A 30 -5.361 12.716 3.007 1.00 0.00 C ATOM 427 O PRO A 30 -4.872 13.592 2.269 1.00 0.00 O ATOM 428 CB PRO A 30 -3.343 11.376 2.332 1.00 0.00 C ATOM 429 CG PRO A 30 -3.343 10.268 1.330 1.00 0.00 C ATOM 430 CD PRO A 30 -4.779 10.024 0.971 1.00 0.00 C ATOM 431 OXT PRO A 30 -6.366 12.918 3.722 1.00 0.00 O ATOM 0 HA PRO A 30 -4.673 11.028 4.058 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -3.178 12.339 1.849 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -2.543 11.244 3.061 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -2.763 10.541 0.448 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -2.888 9.369 1.745 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -5.098 10.644 0.133 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -4.955 8.987 0.686 1.00 0.00 H new TER 439 PRO A 30 ATOM 440 N MET B 31 -1.083 30.860 -7.639 1.00 0.00 N ATOM 441 CA MET B 31 -1.872 30.463 -6.449 1.00 0.00 C ATOM 442 C MET B 31 -3.292 30.105 -6.861 1.00 0.00 C ATOM 443 O MET B 31 -3.906 30.828 -7.646 1.00 0.00 O ATOM 444 CB MET B 31 -1.908 31.599 -5.424 1.00 0.00 C ATOM 445 CG MET B 31 -0.542 31.978 -4.877 1.00 0.00 C ATOM 446 SD MET B 31 -0.618 33.325 -3.678 1.00 0.00 S ATOM 447 CE MET B 31 -1.566 32.567 -2.360 1.00 0.00 C ATOM 0 HA MET B 31 -1.396 29.594 -5.996 1.00 0.00 H new ATOM 0 HB2 MET B 31 -2.360 32.477 -5.885 1.00 0.00 H new ATOM 0 HB3 MET B 31 -2.552 31.307 -4.595 1.00 0.00 H new ATOM 0 HG2 MET B 31 -0.089 31.105 -4.408 1.00 0.00 H new ATOM 0 HG3 MET B 31 0.107 32.269 -5.703 1.00 0.00 H new ATOM 0 HE1 MET B 31 -1.443 33.145 -1.444 1.00 0.00 H new ATOM 0 HE2 MET B 31 -2.620 32.545 -2.636 1.00 0.00 H new ATOM 0 HE3 MET B 31 -1.212 31.549 -2.196 1.00 0.00 H new ATOM 459 N ARG B 32 -3.801 28.988 -6.336 1.00 0.00 N ATOM 460 CA ARG B 32 -5.150 28.512 -6.656 1.00 0.00 C ATOM 461 C ARG B 32 -5.353 28.420 -8.167 1.00 0.00 C ATOM 462 O ARG B 32 -6.392 28.809 -8.695 1.00 0.00 O ATOM 463 CB ARG B 32 -6.214 29.421 -6.024 1.00 0.00 C ATOM 464 CG ARG B 32 -6.200 29.414 -4.502 1.00 0.00 C ATOM 465 CD ARG B 32 -6.511 28.033 -3.945 1.00 0.00 C ATOM 466 NE ARG B 32 -6.454 28.001 -2.483 1.00 0.00 N ATOM 467 CZ ARG B 32 -6.508 26.881 -1.759 1.00 0.00 C ATOM 468 NH1 ARG B 32 -6.645 25.704 -2.357 1.00 0.00 N ATOM 469 NH2 ARG B 32 -6.438 26.943 -0.436 1.00 0.00 N ATOM 0 H ARG B 32 -3.295 28.391 -5.682 1.00 0.00 H new ATOM 0 HA ARG B 32 -5.260 27.512 -6.236 1.00 0.00 H new ATOM 0 HB2 ARG B 32 -6.062 30.442 -6.375 1.00 0.00 H new ATOM 0 HB3 ARG B 32 -7.199 29.108 -6.371 1.00 0.00 H new ATOM 0 HG2 ARG B 32 -5.223 29.739 -4.145 1.00 0.00 H new ATOM 0 HG3 ARG B 32 -6.931 30.131 -4.128 1.00 0.00 H new ATOM 0 HD2 ARG B 32 -7.503 27.725 -4.275 1.00 0.00 H new ATOM 0 HD3 ARG B 32 -5.802 27.311 -4.350 1.00 0.00 H new ATOM 0 HE ARG B 32 -6.368 28.888 -1.987 1.00 0.00 H new ATOM 0 HH11 ARG B 32 -6.709 25.653 -3.374 1.00 0.00 H new ATOM 0 HH12 ARG B 32 -6.686 24.851 -1.800 1.00 0.00 H new ATOM 0 HH21 ARG B 32 -6.343 27.846 0.028 1.00 0.00 H new ATOM 0 HH22 ARG B 32 -6.479 26.087 0.118 1.00 0.00 H new ATOM 483 N GLY B 33 -4.342 27.907 -8.849 1.00 0.00 N ATOM 484 CA GLY B 33 -4.385 27.799 -10.291 1.00 0.00 C ATOM 485 C GLY B 33 -3.548 26.640 -10.779 1.00 0.00 C ATOM 486 O GLY B 33 -2.653 26.814 -11.606 1.00 0.00 O ATOM 0 H GLY B 33 -3.483 27.560 -8.423 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -5.417 27.668 -10.618 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -4.024 28.725 -10.738 1.00 0.00 H new ATOM 490 N SER B 34 -3.839 25.458 -10.260 1.00 0.00 N ATOM 491 CA SER B 34 -3.067 24.270 -10.576 1.00 0.00 C ATOM 492 C SER B 34 -4.000 23.091 -10.834 1.00 0.00 C ATOM 493 O SER B 34 -3.731 21.965 -10.409 1.00 0.00 O ATOM 494 CB SER B 34 -2.105 23.958 -9.422 1.00 0.00 C ATOM 495 OG SER B 34 -1.249 22.871 -9.734 1.00 0.00 O ATOM 0 H SER B 34 -4.611 25.297 -9.613 1.00 0.00 H new ATOM 0 HA SER B 34 -2.484 24.448 -11.480 1.00 0.00 H new ATOM 0 HB2 SER B 34 -1.506 24.841 -9.198 1.00 0.00 H new ATOM 0 HB3 SER B 34 -2.677 23.725 -8.524 1.00 0.00 H new ATOM 0 HG SER B 34 -1.786 22.106 -10.030 1.00 0.00 H new ATOM 501 N ASN B 35 -5.101 23.367 -11.532 1.00 0.00 N ATOM 502 CA ASN B 35 -6.111 22.355 -11.838 1.00 0.00 C ATOM 503 C ASN B 35 -6.631 21.725 -10.555 1.00 0.00 C ATOM 504 O ASN B 35 -6.486 20.520 -10.348 1.00 0.00 O ATOM 505 CB ASN B 35 -5.541 21.269 -12.758 1.00 0.00 C ATOM 506 CG ASN B 35 -5.142 21.800 -14.119 1.00 0.00 C ATOM 507 OD1 ASN B 35 -4.009 22.238 -14.321 1.00 0.00 O ATOM 508 ND2 ASN B 35 -6.065 21.762 -15.062 1.00 0.00 N ATOM 0 H ASN B 35 -5.317 24.294 -11.900 1.00 0.00 H new ATOM 0 HA ASN B 35 -6.935 22.847 -12.355 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -4.672 20.815 -12.281 1.00 0.00 H new ATOM 0 HB3 ASN B 35 -6.283 20.481 -12.884 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -5.851 22.103 -15.999 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -6.992 21.391 -14.854 1.00 0.00 H new ATOM 515 N ALA B 36 -7.231 22.555 -9.705 1.00 0.00 N ATOM 516 CA ALA B 36 -7.670 22.133 -8.377 1.00 0.00 C ATOM 517 C ALA B 36 -6.472 21.661 -7.555 1.00 0.00 C ATOM 518 O ALA B 36 -6.153 20.468 -7.531 1.00 0.00 O ATOM 519 CB ALA B 36 -8.739 21.046 -8.467 1.00 0.00 C ATOM 0 H ALA B 36 -7.426 23.534 -9.916 1.00 0.00 H new ATOM 0 HA ALA B 36 -8.120 22.989 -7.874 1.00 0.00 H new ATOM 0 HB1 ALA B 36 -9.045 20.753 -7.463 1.00 0.00 H new ATOM 0 HB2 ALA B 36 -9.602 21.428 -9.012 1.00 0.00 H new ATOM 0 HB3 ALA B 36 -8.334 20.180 -8.990 1.00 0.00 H new ATOM 525 N PRO B 37 -5.780 22.601 -6.888 1.00 0.00 N ATOM 526 CA PRO B 37 -4.563 22.306 -6.119 1.00 0.00 C ATOM 527 C PRO B 37 -4.821 21.415 -4.904 1.00 0.00 C ATOM 528 O PRO B 37 -5.003 21.899 -3.785 1.00 0.00 O ATOM 529 CB PRO B 37 -4.068 23.687 -5.678 1.00 0.00 C ATOM 530 CG PRO B 37 -5.275 24.558 -5.716 1.00 0.00 C ATOM 531 CD PRO B 37 -6.131 24.031 -6.831 1.00 0.00 C ATOM 0 HA PRO B 37 -3.842 21.750 -6.718 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -3.638 23.651 -4.677 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -3.291 24.060 -6.345 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -5.809 24.527 -4.766 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -5.000 25.598 -5.893 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -7.192 24.176 -6.626 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -5.917 24.535 -7.774 1.00 0.00 H new ATOM 539 N GLN B 38 -4.847 20.114 -5.137 1.00 0.00 N ATOM 540 CA GLN B 38 -4.994 19.147 -4.066 1.00 0.00 C ATOM 541 C GLN B 38 -3.664 18.462 -3.799 1.00 0.00 C ATOM 542 O GLN B 38 -3.144 17.742 -4.654 1.00 0.00 O ATOM 543 CB GLN B 38 -6.050 18.098 -4.420 1.00 0.00 C ATOM 544 CG GLN B 38 -7.459 18.652 -4.508 1.00 0.00 C ATOM 545 CD GLN B 38 -8.488 17.571 -4.767 1.00 0.00 C ATOM 546 OE1 GLN B 38 -9.039 16.979 -3.836 1.00 0.00 O ATOM 547 NE2 GLN B 38 -8.750 17.300 -6.033 1.00 0.00 N ATOM 0 H GLN B 38 -4.767 19.702 -6.067 1.00 0.00 H new ATOM 0 HA GLN B 38 -5.317 19.677 -3.170 1.00 0.00 H new ATOM 0 HB2 GLN B 38 -5.789 17.641 -5.375 1.00 0.00 H new ATOM 0 HB3 GLN B 38 -6.027 17.306 -3.671 1.00 0.00 H new ATOM 0 HG2 GLN B 38 -7.703 19.167 -3.579 1.00 0.00 H new ATOM 0 HG3 GLN B 38 -7.506 19.394 -5.305 1.00 0.00 H new ATOM 0 HE21 GLN B 38 -8.272 17.813 -6.774 1.00 0.00 H new ATOM 0 HE22 GLN B 38 -9.430 16.578 -6.270 1.00 0.00 H new ATOM 556 N PRO B 39 -3.081 18.706 -2.615 1.00 0.00 N ATOM 557 CA PRO B 39 -1.858 18.028 -2.182 1.00 0.00 C ATOM 558 C PRO B 39 -2.036 16.517 -2.200 1.00 0.00 C ATOM 559 O PRO B 39 -1.130 15.770 -2.567 1.00 0.00 O ATOM 560 CB PRO B 39 -1.653 18.524 -0.748 1.00 0.00 C ATOM 561 CG PRO B 39 -2.400 19.808 -0.671 1.00 0.00 C ATOM 562 CD PRO B 39 -3.563 19.673 -1.612 1.00 0.00 C ATOM 0 HA PRO B 39 -1.010 18.241 -2.833 1.00 0.00 H new ATOM 0 HB2 PRO B 39 -2.032 17.803 -0.024 1.00 0.00 H new ATOM 0 HB3 PRO B 39 -0.595 18.670 -0.529 1.00 0.00 H new ATOM 0 HG2 PRO B 39 -2.742 19.999 0.346 1.00 0.00 H new ATOM 0 HG3 PRO B 39 -1.764 20.646 -0.956 1.00 0.00 H new ATOM 0 HD2 PRO B 39 -4.454 19.310 -1.100 1.00 0.00 H new ATOM 0 HD3 PRO B 39 -3.824 20.628 -2.068 1.00 0.00 H new ATOM 570 N SER B 40 -3.231 16.085 -1.827 1.00 0.00 N ATOM 571 CA SER B 40 -3.584 14.680 -1.836 1.00 0.00 C ATOM 572 C SER B 40 -4.115 14.296 -3.219 1.00 0.00 C ATOM 573 O SER B 40 -5.271 13.896 -3.372 1.00 0.00 O ATOM 574 CB SER B 40 -4.638 14.419 -0.754 1.00 0.00 C ATOM 575 OG SER B 40 -4.815 13.039 -0.499 1.00 0.00 O ATOM 0 H SER B 40 -3.980 16.700 -1.510 1.00 0.00 H new ATOM 0 HA SER B 40 -2.706 14.071 -1.623 1.00 0.00 H new ATOM 0 HB2 SER B 40 -4.342 14.921 0.167 1.00 0.00 H new ATOM 0 HB3 SER B 40 -5.588 14.854 -1.063 1.00 0.00 H new ATOM 0 HG SER B 40 -4.890 12.892 0.467 1.00 0.00 H new ATOM 581 N HIS B 41 -3.273 14.451 -4.231 1.00 0.00 N ATOM 582 CA HIS B 41 -3.651 14.105 -5.593 1.00 0.00 C ATOM 583 C HIS B 41 -2.867 12.883 -6.045 1.00 0.00 C ATOM 584 O HIS B 41 -1.784 12.999 -6.626 1.00 0.00 O ATOM 585 CB HIS B 41 -3.407 15.284 -6.542 1.00 0.00 C ATOM 586 CG HIS B 41 -4.105 15.157 -7.865 1.00 0.00 C ATOM 587 ND1 HIS B 41 -3.481 15.366 -9.080 1.00 0.00 N ATOM 588 CD2 HIS B 41 -5.395 14.863 -8.159 1.00 0.00 C ATOM 589 CE1 HIS B 41 -4.358 15.207 -10.055 1.00 0.00 C ATOM 590 NE2 HIS B 41 -5.522 14.901 -9.523 1.00 0.00 N ATOM 0 H HIS B 41 -2.325 14.814 -4.134 1.00 0.00 H new ATOM 0 HA HIS B 41 -4.716 13.873 -5.615 1.00 0.00 H new ATOM 0 HB2 HIS B 41 -3.736 16.203 -6.056 1.00 0.00 H new ATOM 0 HB3 HIS B 41 -2.335 15.381 -6.716 1.00 0.00 H new ATOM 0 HD2 HIS B 41 -6.178 14.640 -7.449 1.00 0.00 H new ATOM 0 HE1 HIS B 41 -4.154 15.311 -11.111 1.00 0.00 H new ATOM 0 HE2 HIS B 41 -6.381 14.721 -10.043 1.00 0.00 H new ATOM 599 N ILE B 42 -3.415 11.716 -5.752 1.00 0.00 N ATOM 600 CA ILE B 42 -2.784 10.456 -6.101 1.00 0.00 C ATOM 601 C ILE B 42 -3.193 10.045 -7.511 1.00 0.00 C ATOM 602 O ILE B 42 -4.372 10.092 -7.863 1.00 0.00 O ATOM 603 CB ILE B 42 -3.162 9.320 -5.110 1.00 0.00 C ATOM 604 CG1 ILE B 42 -2.644 9.607 -3.692 1.00 0.00 C ATOM 605 CG2 ILE B 42 -2.615 7.986 -5.594 1.00 0.00 C ATOM 606 CD1 ILE B 42 -3.443 10.645 -2.929 1.00 0.00 C ATOM 0 H ILE B 42 -4.307 11.616 -5.267 1.00 0.00 H new ATOM 0 HA ILE B 42 -1.706 10.607 -6.048 1.00 0.00 H new ATOM 0 HB ILE B 42 -4.250 9.273 -5.072 1.00 0.00 H new ATOM 0 HG12 ILE B 42 -2.644 8.677 -3.124 1.00 0.00 H new ATOM 0 HG13 ILE B 42 -1.608 9.940 -3.758 1.00 0.00 H new ATOM 0 HG21 ILE B 42 -2.889 7.202 -4.888 1.00 0.00 H new ATOM 0 HG22 ILE B 42 -3.034 7.755 -6.573 1.00 0.00 H new ATOM 0 HG23 ILE B 42 -1.529 8.043 -5.668 1.00 0.00 H new ATOM 0 HD11 ILE B 42 -3.007 10.784 -1.940 1.00 0.00 H new ATOM 0 HD12 ILE B 42 -3.423 11.590 -3.471 1.00 0.00 H new ATOM 0 HD13 ILE B 42 -4.474 10.307 -2.827 1.00 0.00 H new ATOM 618 N SER B 43 -2.214 9.663 -8.316 1.00 0.00 N ATOM 619 CA SER B 43 -2.471 9.233 -9.679 1.00 0.00 C ATOM 620 C SER B 43 -2.756 7.734 -9.717 1.00 0.00 C ATOM 621 O SER B 43 -3.615 7.274 -10.472 1.00 0.00 O ATOM 622 CB SER B 43 -1.277 9.576 -10.574 1.00 0.00 C ATOM 623 OG SER B 43 -1.524 9.239 -11.931 1.00 0.00 O ATOM 0 H SER B 43 -1.231 9.642 -8.046 1.00 0.00 H new ATOM 0 HA SER B 43 -3.349 9.759 -10.054 1.00 0.00 H new ATOM 0 HB2 SER B 43 -1.059 10.641 -10.497 1.00 0.00 H new ATOM 0 HB3 SER B 43 -0.393 9.044 -10.222 1.00 0.00 H new ATOM 0 HG SER B 43 -0.742 9.473 -12.474 1.00 0.00 H new ATOM 629 N LYS B 44 -2.043 6.980 -8.888 1.00 0.00 N ATOM 630 CA LYS B 44 -2.202 5.534 -8.844 1.00 0.00 C ATOM 631 C LYS B 44 -1.642 4.965 -7.546 1.00 0.00 C ATOM 632 O LYS B 44 -0.735 5.543 -6.941 1.00 0.00 O ATOM 633 CB LYS B 44 -1.500 4.885 -10.042 1.00 0.00 C ATOM 634 CG LYS B 44 0.004 5.114 -10.073 1.00 0.00 C ATOM 635 CD LYS B 44 0.626 4.558 -11.341 1.00 0.00 C ATOM 636 CE LYS B 44 2.136 4.735 -11.343 1.00 0.00 C ATOM 637 NZ LYS B 44 2.761 4.160 -12.562 1.00 0.00 N ATOM 0 H LYS B 44 -1.349 7.348 -8.237 1.00 0.00 H new ATOM 0 HA LYS B 44 -3.268 5.310 -8.890 1.00 0.00 H new ATOM 0 HB2 LYS B 44 -1.694 3.813 -10.027 1.00 0.00 H new ATOM 0 HB3 LYS B 44 -1.936 5.275 -10.962 1.00 0.00 H new ATOM 0 HG2 LYS B 44 0.212 6.182 -10.003 1.00 0.00 H new ATOM 0 HG3 LYS B 44 0.463 4.642 -9.204 1.00 0.00 H new ATOM 0 HD2 LYS B 44 0.382 3.500 -11.434 1.00 0.00 H new ATOM 0 HD3 LYS B 44 0.198 5.061 -12.208 1.00 0.00 H new ATOM 0 HE2 LYS B 44 2.377 5.796 -11.278 1.00 0.00 H new ATOM 0 HE3 LYS B 44 2.558 4.257 -10.459 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 3.791 4.302 -12.524 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 2.553 3.142 -12.612 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 2.377 4.633 -13.405 1.00 0.00 H new ATOM 651 N TYR B 45 -2.203 3.848 -7.120 1.00 0.00 N ATOM 652 CA TYR B 45 -1.701 3.119 -5.969 1.00 0.00 C ATOM 653 C TYR B 45 -1.081 1.815 -6.439 1.00 0.00 C ATOM 654 O TYR B 45 -1.630 1.147 -7.313 1.00 0.00 O ATOM 655 CB TYR B 45 -2.822 2.791 -4.982 1.00 0.00 C ATOM 656 CG TYR B 45 -3.637 3.972 -4.511 1.00 0.00 C ATOM 657 CD1 TYR B 45 -3.136 4.862 -3.570 1.00 0.00 C ATOM 658 CD2 TYR B 45 -4.926 4.175 -4.985 1.00 0.00 C ATOM 659 CE1 TYR B 45 -3.898 5.922 -3.115 1.00 0.00 C ATOM 660 CE2 TYR B 45 -5.691 5.234 -4.541 1.00 0.00 C ATOM 661 CZ TYR B 45 -5.175 6.103 -3.607 1.00 0.00 C ATOM 662 OH TYR B 45 -5.947 7.144 -3.150 1.00 0.00 O ATOM 0 H TYR B 45 -3.018 3.421 -7.561 1.00 0.00 H new ATOM 0 HA TYR B 45 -0.964 3.746 -5.467 1.00 0.00 H new ATOM 0 HB2 TYR B 45 -3.494 2.070 -5.448 1.00 0.00 H new ATOM 0 HB3 TYR B 45 -2.385 2.302 -4.111 1.00 0.00 H new ATOM 0 HD1 TYR B 45 -2.135 4.724 -3.188 1.00 0.00 H new ATOM 0 HD2 TYR B 45 -5.337 3.492 -5.714 1.00 0.00 H new ATOM 0 HE1 TYR B 45 -3.497 6.604 -2.380 1.00 0.00 H new ATOM 0 HE2 TYR B 45 -6.690 5.380 -4.925 1.00 0.00 H new ATOM 0 HH TYR B 45 -6.850 6.819 -2.950 1.00 0.00 H new ATOM 672 N ILE B 46 0.055 1.459 -5.874 1.00 0.00 N ATOM 673 CA ILE B 46 0.687 0.191 -6.197 1.00 0.00 C ATOM 674 C ILE B 46 0.610 -0.745 -4.996 1.00 0.00 C ATOM 675 O ILE B 46 1.196 -0.477 -3.946 1.00 0.00 O ATOM 676 CB ILE B 46 2.161 0.361 -6.655 1.00 0.00 C ATOM 677 CG1 ILE B 46 2.241 1.048 -8.028 1.00 0.00 C ATOM 678 CG2 ILE B 46 2.871 -0.985 -6.711 1.00 0.00 C ATOM 679 CD1 ILE B 46 1.939 2.532 -8.008 1.00 0.00 C ATOM 0 H ILE B 46 0.559 2.025 -5.192 1.00 0.00 H new ATOM 0 HA ILE B 46 0.142 -0.241 -7.037 1.00 0.00 H new ATOM 0 HB ILE B 46 2.660 0.993 -5.920 1.00 0.00 H new ATOM 0 HG12 ILE B 46 3.241 0.899 -8.437 1.00 0.00 H new ATOM 0 HG13 ILE B 46 1.543 0.557 -8.707 1.00 0.00 H new ATOM 0 HG21 ILE B 46 3.902 -0.839 -7.034 1.00 0.00 H new ATOM 0 HG22 ILE B 46 2.862 -1.442 -5.722 1.00 0.00 H new ATOM 0 HG23 ILE B 46 2.358 -1.638 -7.417 1.00 0.00 H new ATOM 0 HD11 ILE B 46 2.019 2.933 -9.018 1.00 0.00 H new ATOM 0 HD12 ILE B 46 0.928 2.693 -7.633 1.00 0.00 H new ATOM 0 HD13 ILE B 46 2.652 3.040 -7.359 1.00 0.00 H new ATOM 691 N LEU B 47 -0.151 -1.818 -5.152 1.00 0.00 N ATOM 692 CA LEU B 47 -0.312 -2.812 -4.101 1.00 0.00 C ATOM 693 C LEU B 47 0.647 -3.962 -4.376 1.00 0.00 C ATOM 694 O LEU B 47 0.603 -4.569 -5.447 1.00 0.00 O ATOM 695 CB LEU B 47 -1.770 -3.320 -4.080 1.00 0.00 C ATOM 696 CG LEU B 47 -2.300 -3.924 -2.758 1.00 0.00 C ATOM 697 CD1 LEU B 47 -1.432 -5.067 -2.261 1.00 0.00 C ATOM 698 CD2 LEU B 47 -2.434 -2.856 -1.685 1.00 0.00 C ATOM 0 H LEU B 47 -0.671 -2.024 -6.005 1.00 0.00 H new ATOM 0 HA LEU B 47 -0.089 -2.373 -3.129 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -2.419 -2.488 -4.353 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -1.874 -4.075 -4.859 1.00 0.00 H new ATOM 0 HG LEU B 47 -3.288 -4.331 -2.972 1.00 0.00 H new ATOM 0 HD11 LEU B 47 -1.844 -5.459 -1.331 1.00 0.00 H new ATOM 0 HD12 LEU B 47 -1.409 -5.859 -3.010 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -0.419 -4.705 -2.085 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -2.808 -3.308 -0.767 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -1.460 -2.405 -1.497 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -3.130 -2.088 -2.021 1.00 0.00 H new ATOM 710 N ARG B 48 1.529 -4.239 -3.429 1.00 0.00 N ATOM 711 CA ARG B 48 2.491 -5.319 -3.589 1.00 0.00 C ATOM 712 C ARG B 48 2.434 -6.257 -2.394 1.00 0.00 C ATOM 713 O ARG B 48 2.405 -5.807 -1.246 1.00 0.00 O ATOM 714 CB ARG B 48 3.904 -4.755 -3.766 1.00 0.00 C ATOM 715 CG ARG B 48 3.981 -3.706 -4.860 1.00 0.00 C ATOM 716 CD ARG B 48 5.406 -3.410 -5.291 1.00 0.00 C ATOM 717 NE ARG B 48 6.184 -2.718 -4.275 1.00 0.00 N ATOM 718 CZ ARG B 48 7.412 -2.247 -4.491 1.00 0.00 C ATOM 719 NH1 ARG B 48 7.972 -2.376 -5.691 1.00 0.00 N ATOM 720 NH2 ARG B 48 8.067 -1.630 -3.517 1.00 0.00 N ATOM 0 H ARG B 48 1.599 -3.734 -2.545 1.00 0.00 H new ATOM 0 HA ARG B 48 2.234 -5.885 -4.484 1.00 0.00 H new ATOM 0 HB2 ARG B 48 4.237 -4.318 -2.825 1.00 0.00 H new ATOM 0 HB3 ARG B 48 4.590 -5.569 -4.000 1.00 0.00 H new ATOM 0 HG2 ARG B 48 3.408 -4.045 -5.723 1.00 0.00 H new ATOM 0 HG3 ARG B 48 3.514 -2.786 -4.509 1.00 0.00 H new ATOM 0 HD2 ARG B 48 5.903 -4.346 -5.544 1.00 0.00 H new ATOM 0 HD3 ARG B 48 5.386 -2.805 -6.197 1.00 0.00 H new ATOM 0 HE ARG B 48 5.769 -2.587 -3.352 1.00 0.00 H new ATOM 0 HH11 ARG B 48 7.462 -2.835 -6.445 1.00 0.00 H new ATOM 0 HH12 ARG B 48 8.912 -2.016 -5.857 1.00 0.00 H new ATOM 0 HH21 ARG B 48 7.631 -1.516 -2.602 1.00 0.00 H new ATOM 0 HH22 ARG B 48 9.007 -1.270 -3.683 1.00 0.00 H new ATOM 734 N TRP B 49 2.398 -7.556 -2.665 1.00 0.00 N ATOM 735 CA TRP B 49 2.307 -8.549 -1.605 1.00 0.00 C ATOM 736 C TRP B 49 3.328 -9.665 -1.796 1.00 0.00 C ATOM 737 O TRP B 49 3.688 -10.018 -2.925 1.00 0.00 O ATOM 738 CB TRP B 49 0.885 -9.124 -1.511 1.00 0.00 C ATOM 739 CG TRP B 49 0.386 -9.792 -2.763 1.00 0.00 C ATOM 740 CD1 TRP B 49 0.338 -11.133 -3.012 1.00 0.00 C ATOM 741 CD2 TRP B 49 -0.151 -9.150 -3.926 1.00 0.00 C ATOM 742 NE1 TRP B 49 -0.205 -11.364 -4.254 1.00 0.00 N ATOM 743 CE2 TRP B 49 -0.508 -10.161 -4.836 1.00 0.00 C ATOM 744 CE3 TRP B 49 -0.365 -7.817 -4.285 1.00 0.00 C ATOM 745 CZ2 TRP B 49 -1.069 -9.879 -6.079 1.00 0.00 C ATOM 746 CZ3 TRP B 49 -0.920 -7.539 -5.518 1.00 0.00 C ATOM 747 CH2 TRP B 49 -1.267 -8.564 -6.402 1.00 0.00 C ATOM 0 H TRP B 49 2.430 -7.944 -3.608 1.00 0.00 H new ATOM 0 HA TRP B 49 2.536 -8.046 -0.665 1.00 0.00 H new ATOM 0 HB2 TRP B 49 0.854 -9.846 -0.695 1.00 0.00 H new ATOM 0 HB3 TRP B 49 0.200 -8.318 -1.249 1.00 0.00 H new ATOM 0 HD1 TRP B 49 0.677 -11.901 -2.333 1.00 0.00 H new ATOM 0 HE1 TRP B 49 -0.357 -12.281 -4.674 1.00 0.00 H new ATOM 0 HE3 TRP B 49 -0.101 -7.017 -3.609 1.00 0.00 H new ATOM 0 HZ2 TRP B 49 -1.338 -10.670 -6.764 1.00 0.00 H new ATOM 0 HZ3 TRP B 49 -1.089 -6.511 -5.804 1.00 0.00 H new ATOM 0 HH2 TRP B 49 -1.700 -8.313 -7.359 1.00 0.00 H new ATOM 758 N ARG B 50 3.799 -10.200 -0.679 1.00 0.00 N ATOM 759 CA ARG B 50 4.793 -11.267 -0.676 1.00 0.00 C ATOM 760 C ARG B 50 4.531 -12.219 0.490 1.00 0.00 C ATOM 761 O ARG B 50 4.270 -11.772 1.602 1.00 0.00 O ATOM 762 CB ARG B 50 6.195 -10.667 -0.542 1.00 0.00 C ATOM 763 CG ARG B 50 7.314 -11.692 -0.624 1.00 0.00 C ATOM 764 CD ARG B 50 8.668 -11.060 -0.354 1.00 0.00 C ATOM 765 NE ARG B 50 8.817 -10.639 1.037 1.00 0.00 N ATOM 766 CZ ARG B 50 9.926 -10.090 1.535 1.00 0.00 C ATOM 767 NH1 ARG B 50 10.983 -9.899 0.756 1.00 0.00 N ATOM 768 NH2 ARG B 50 9.983 -9.748 2.815 1.00 0.00 N ATOM 0 H ARG B 50 3.503 -9.907 0.252 1.00 0.00 H new ATOM 0 HA ARG B 50 4.724 -11.820 -1.613 1.00 0.00 H new ATOM 0 HB2 ARG B 50 6.338 -9.924 -1.327 1.00 0.00 H new ATOM 0 HB3 ARG B 50 6.265 -10.142 0.411 1.00 0.00 H new ATOM 0 HG2 ARG B 50 7.133 -12.489 0.097 1.00 0.00 H new ATOM 0 HG3 ARG B 50 7.316 -12.152 -1.612 1.00 0.00 H new ATOM 0 HD2 ARG B 50 9.455 -11.773 -0.602 1.00 0.00 H new ATOM 0 HD3 ARG B 50 8.801 -10.198 -1.008 1.00 0.00 H new ATOM 0 HE ARG B 50 8.025 -10.773 1.666 1.00 0.00 H new ATOM 0 HH11 ARG B 50 10.949 -10.172 -0.226 1.00 0.00 H new ATOM 0 HH12 ARG B 50 11.830 -9.479 1.139 1.00 0.00 H new ATOM 0 HH21 ARG B 50 9.178 -9.905 3.421 1.00 0.00 H new ATOM 0 HH22 ARG B 50 10.832 -9.328 3.193 1.00 0.00 H new ATOM 782 N PRO B 51 4.573 -13.542 0.253 1.00 0.00 N ATOM 783 CA PRO B 51 4.394 -14.538 1.315 1.00 0.00 C ATOM 784 C PRO B 51 5.451 -14.401 2.408 1.00 0.00 C ATOM 785 O PRO B 51 6.634 -14.247 2.125 1.00 0.00 O ATOM 786 CB PRO B 51 4.558 -15.881 0.593 1.00 0.00 C ATOM 787 CG PRO B 51 4.340 -15.583 -0.851 1.00 0.00 C ATOM 788 CD PRO B 51 4.798 -14.169 -1.062 1.00 0.00 C ATOM 0 HA PRO B 51 3.432 -14.426 1.815 1.00 0.00 H new ATOM 0 HB2 PRO B 51 5.550 -16.300 0.762 1.00 0.00 H new ATOM 0 HB3 PRO B 51 3.837 -16.613 0.956 1.00 0.00 H new ATOM 0 HG2 PRO B 51 4.903 -16.272 -1.480 1.00 0.00 H new ATOM 0 HG3 PRO B 51 3.289 -15.695 -1.117 1.00 0.00 H new ATOM 0 HD2 PRO B 51 5.847 -14.125 -1.355 1.00 0.00 H new ATOM 0 HD3 PRO B 51 4.227 -13.674 -1.847 1.00 0.00 H new ATOM 796 N LYS B 52 5.011 -14.464 3.658 1.00 0.00 N ATOM 797 CA LYS B 52 5.902 -14.329 4.808 1.00 0.00 C ATOM 798 C LYS B 52 6.933 -15.450 4.847 1.00 0.00 C ATOM 799 O LYS B 52 8.051 -15.258 5.321 1.00 0.00 O ATOM 800 CB LYS B 52 5.093 -14.357 6.101 1.00 0.00 C ATOM 801 CG LYS B 52 4.179 -13.165 6.299 1.00 0.00 C ATOM 802 CD LYS B 52 4.841 -12.051 7.088 1.00 0.00 C ATOM 803 CE LYS B 52 3.799 -11.052 7.562 1.00 0.00 C ATOM 804 NZ LYS B 52 4.386 -9.956 8.369 1.00 0.00 N ATOM 0 H LYS B 52 4.032 -14.609 3.905 1.00 0.00 H new ATOM 0 HA LYS B 52 6.423 -13.377 4.711 1.00 0.00 H new ATOM 0 HB2 LYS B 52 4.492 -15.266 6.118 1.00 0.00 H new ATOM 0 HB3 LYS B 52 5.782 -14.414 6.944 1.00 0.00 H new ATOM 0 HG2 LYS B 52 3.870 -12.783 5.326 1.00 0.00 H new ATOM 0 HG3 LYS B 52 3.276 -13.486 6.817 1.00 0.00 H new ATOM 0 HD2 LYS B 52 5.372 -12.468 7.944 1.00 0.00 H new ATOM 0 HD3 LYS B 52 5.582 -11.547 6.468 1.00 0.00 H new ATOM 0 HE2 LYS B 52 3.288 -10.628 6.698 1.00 0.00 H new ATOM 0 HE3 LYS B 52 3.046 -11.572 8.155 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 3.691 -9.631 9.071 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 5.236 -10.302 8.858 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 4.643 -9.165 7.745 1.00 0.00 H new ATOM 818 N ASN B 53 6.541 -16.625 4.370 1.00 0.00 N ATOM 819 CA ASN B 53 7.414 -17.795 4.407 1.00 0.00 C ATOM 820 C ASN B 53 8.224 -17.935 3.118 1.00 0.00 C ATOM 821 O ASN B 53 9.184 -18.703 3.062 1.00 0.00 O ATOM 822 CB ASN B 53 6.601 -19.073 4.651 1.00 0.00 C ATOM 823 CG ASN B 53 5.808 -19.520 3.435 1.00 0.00 C ATOM 824 OD1 ASN B 53 6.303 -20.285 2.609 1.00 0.00 O ATOM 825 ND2 ASN B 53 4.572 -19.064 3.323 1.00 0.00 N ATOM 0 H ASN B 53 5.626 -16.794 3.953 1.00 0.00 H new ATOM 0 HA ASN B 53 8.110 -17.651 5.233 1.00 0.00 H new ATOM 0 HB2 ASN B 53 7.277 -19.874 4.950 1.00 0.00 H new ATOM 0 HB3 ASN B 53 5.916 -18.907 5.482 1.00 0.00 H new ATOM 0 HD21 ASN B 53 3.994 -19.346 2.531 1.00 0.00 H new ATOM 0 HD22 ASN B 53 4.196 -18.431 4.029 1.00 0.00 H new ATOM 832 N SER B 54 7.834 -17.207 2.082 1.00 0.00 N ATOM 833 CA SER B 54 8.512 -17.305 0.796 1.00 0.00 C ATOM 834 C SER B 54 8.898 -15.928 0.280 1.00 0.00 C ATOM 835 O SER B 54 8.038 -15.097 -0.002 1.00 0.00 O ATOM 836 CB SER B 54 7.624 -17.999 -0.233 1.00 0.00 C ATOM 837 OG SER B 54 7.197 -19.272 0.225 1.00 0.00 O ATOM 0 H SER B 54 7.057 -16.546 2.105 1.00 0.00 H new ATOM 0 HA SER B 54 9.416 -17.896 0.945 1.00 0.00 H new ATOM 0 HB2 SER B 54 6.755 -17.376 -0.444 1.00 0.00 H new ATOM 0 HB3 SER B 54 8.170 -18.112 -1.170 1.00 0.00 H new ATOM 0 HG SER B 54 6.877 -19.197 1.148 1.00 0.00 H new ATOM 843 N VAL B 55 10.195 -15.708 0.138 1.00 0.00 N ATOM 844 CA VAL B 55 10.700 -14.427 -0.307 1.00 0.00 C ATOM 845 C VAL B 55 10.372 -14.208 -1.783 1.00 0.00 C ATOM 846 O VAL B 55 9.992 -13.102 -2.171 1.00 0.00 O ATOM 847 CB VAL B 55 12.221 -14.301 -0.052 1.00 0.00 C ATOM 848 CG1 VAL B 55 13.009 -15.368 -0.798 1.00 0.00 C ATOM 849 CG2 VAL B 55 12.704 -12.916 -0.424 1.00 0.00 C ATOM 0 H VAL B 55 10.916 -16.405 0.326 1.00 0.00 H new ATOM 0 HA VAL B 55 10.206 -13.649 0.275 1.00 0.00 H new ATOM 0 HB VAL B 55 12.394 -14.458 1.013 1.00 0.00 H new ATOM 0 HG11 VAL B 55 14.072 -15.245 -0.593 1.00 0.00 H new ATOM 0 HG12 VAL B 55 12.687 -16.356 -0.467 1.00 0.00 H new ATOM 0 HG13 VAL B 55 12.832 -15.269 -1.869 1.00 0.00 H new ATOM 0 HG21 VAL B 55 13.776 -12.843 -0.239 1.00 0.00 H new ATOM 0 HG22 VAL B 55 12.504 -12.732 -1.480 1.00 0.00 H new ATOM 0 HG23 VAL B 55 12.180 -12.174 0.179 1.00 0.00 H new ATOM 859 N GLY B 56 10.520 -15.276 -2.581 1.00 0.00 N ATOM 860 CA GLY B 56 10.124 -15.277 -3.986 1.00 0.00 C ATOM 861 C GLY B 56 10.307 -13.944 -4.684 1.00 0.00 C ATOM 862 O GLY B 56 11.433 -13.495 -4.909 1.00 0.00 O ATOM 0 H GLY B 56 10.918 -16.160 -2.265 1.00 0.00 H new ATOM 0 HA2 GLY B 56 10.703 -16.034 -4.515 1.00 0.00 H new ATOM 0 HA3 GLY B 56 9.077 -15.571 -4.057 1.00 0.00 H new ATOM 866 N ARG B 57 9.190 -13.313 -5.010 1.00 0.00 N ATOM 867 CA ARG B 57 9.193 -12.015 -5.661 1.00 0.00 C ATOM 868 C ARG B 57 7.894 -11.282 -5.343 1.00 0.00 C ATOM 869 O ARG B 57 6.879 -11.908 -5.037 1.00 0.00 O ATOM 870 CB ARG B 57 9.371 -12.156 -7.184 1.00 0.00 C ATOM 871 CG ARG B 57 8.265 -12.927 -7.899 1.00 0.00 C ATOM 872 CD ARG B 57 8.358 -14.429 -7.663 1.00 0.00 C ATOM 873 NE ARG B 57 9.630 -14.982 -8.128 1.00 0.00 N ATOM 874 CZ ARG B 57 10.081 -16.189 -7.794 1.00 0.00 C ATOM 875 NH1 ARG B 57 9.372 -16.968 -6.986 1.00 0.00 N ATOM 876 NH2 ARG B 57 11.243 -16.616 -8.272 1.00 0.00 N ATOM 0 H ARG B 57 8.258 -13.686 -4.831 1.00 0.00 H new ATOM 0 HA ARG B 57 10.036 -11.438 -5.281 1.00 0.00 H new ATOM 0 HB2 ARG B 57 9.437 -11.159 -7.620 1.00 0.00 H new ATOM 0 HB3 ARG B 57 10.322 -12.652 -7.378 1.00 0.00 H new ATOM 0 HG2 ARG B 57 7.295 -12.567 -7.556 1.00 0.00 H new ATOM 0 HG3 ARG B 57 8.319 -12.726 -8.969 1.00 0.00 H new ATOM 0 HD2 ARG B 57 8.240 -14.636 -6.599 1.00 0.00 H new ATOM 0 HD3 ARG B 57 7.537 -14.928 -8.178 1.00 0.00 H new ATOM 0 HE ARG B 57 10.205 -14.409 -8.745 1.00 0.00 H new ATOM 0 HH11 ARG B 57 8.478 -16.642 -6.619 1.00 0.00 H new ATOM 0 HH12 ARG B 57 9.721 -17.892 -6.733 1.00 0.00 H new ATOM 0 HH21 ARG B 57 11.789 -16.020 -8.894 1.00 0.00 H new ATOM 0 HH22 ARG B 57 11.590 -17.541 -8.017 1.00 0.00 H new ATOM 890 N TRP B 58 7.934 -9.959 -5.399 1.00 0.00 N ATOM 891 CA TRP B 58 6.762 -9.149 -5.099 1.00 0.00 C ATOM 892 C TRP B 58 5.843 -9.058 -6.311 1.00 0.00 C ATOM 893 O TRP B 58 6.298 -8.820 -7.432 1.00 0.00 O ATOM 894 CB TRP B 58 7.175 -7.740 -4.661 1.00 0.00 C ATOM 895 CG TRP B 58 7.820 -7.689 -3.310 1.00 0.00 C ATOM 896 CD1 TRP B 58 9.140 -7.883 -3.018 1.00 0.00 C ATOM 897 CD2 TRP B 58 7.171 -7.416 -2.062 1.00 0.00 C ATOM 898 NE1 TRP B 58 9.349 -7.751 -1.666 1.00 0.00 N ATOM 899 CE2 TRP B 58 8.156 -7.464 -1.059 1.00 0.00 C ATOM 900 CE3 TRP B 58 5.853 -7.136 -1.696 1.00 0.00 C ATOM 901 CZ2 TRP B 58 7.862 -7.244 0.285 1.00 0.00 C ATOM 902 CZ3 TRP B 58 5.562 -6.918 -0.362 1.00 0.00 C ATOM 903 CH2 TRP B 58 6.563 -6.973 0.613 1.00 0.00 C ATOM 0 H TRP B 58 8.765 -9.423 -5.649 1.00 0.00 H new ATOM 0 HA TRP B 58 6.224 -9.631 -4.283 1.00 0.00 H new ATOM 0 HB2 TRP B 58 7.865 -7.329 -5.398 1.00 0.00 H new ATOM 0 HB3 TRP B 58 6.294 -7.099 -4.656 1.00 0.00 H new ATOM 0 HD1 TRP B 58 9.908 -8.107 -3.744 1.00 0.00 H new ATOM 0 HE1 TRP B 58 10.247 -7.851 -1.192 1.00 0.00 H new ATOM 0 HE3 TRP B 58 5.074 -7.090 -2.442 1.00 0.00 H new ATOM 0 HZ2 TRP B 58 8.633 -7.286 1.040 1.00 0.00 H new ATOM 0 HZ3 TRP B 58 4.545 -6.702 -0.068 1.00 0.00 H new ATOM 0 HH2 TRP B 58 6.304 -6.798 1.647 1.00 0.00 H new ATOM 914 N LYS B 59 4.556 -9.269 -6.085 1.00 0.00 N ATOM 915 CA LYS B 59 3.559 -9.085 -7.128 1.00 0.00 C ATOM 916 C LYS B 59 3.016 -7.668 -7.044 1.00 0.00 C ATOM 917 O LYS B 59 2.650 -7.209 -5.964 1.00 0.00 O ATOM 918 CB LYS B 59 2.421 -10.096 -6.979 1.00 0.00 C ATOM 919 CG LYS B 59 2.876 -11.544 -7.052 1.00 0.00 C ATOM 920 CD LYS B 59 1.704 -12.501 -6.904 1.00 0.00 C ATOM 921 CE LYS B 59 2.153 -13.953 -6.927 1.00 0.00 C ATOM 922 NZ LYS B 59 2.970 -14.306 -5.736 1.00 0.00 N ATOM 0 H LYS B 59 4.177 -9.568 -5.187 1.00 0.00 H new ATOM 0 HA LYS B 59 4.024 -9.247 -8.100 1.00 0.00 H new ATOM 0 HB2 LYS B 59 1.921 -9.929 -6.025 1.00 0.00 H new ATOM 0 HB3 LYS B 59 1.683 -9.917 -7.761 1.00 0.00 H new ATOM 0 HG2 LYS B 59 3.376 -11.723 -8.004 1.00 0.00 H new ATOM 0 HG3 LYS B 59 3.607 -11.737 -6.267 1.00 0.00 H new ATOM 0 HD2 LYS B 59 1.184 -12.296 -5.968 1.00 0.00 H new ATOM 0 HD3 LYS B 59 0.990 -12.329 -7.710 1.00 0.00 H new ATOM 0 HE2 LYS B 59 1.278 -14.602 -6.971 1.00 0.00 H new ATOM 0 HE3 LYS B 59 2.733 -14.138 -7.831 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 3.111 -15.336 -5.705 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 3.893 -13.831 -5.795 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 2.477 -13.998 -4.873 1.00 0.00 H new ATOM 936 N GLU B 60 2.978 -6.974 -8.171 1.00 0.00 N ATOM 937 CA GLU B 60 2.616 -5.564 -8.176 1.00 0.00 C ATOM 938 C GLU B 60 1.314 -5.333 -8.934 1.00 0.00 C ATOM 939 O GLU B 60 1.185 -5.721 -10.095 1.00 0.00 O ATOM 940 CB GLU B 60 3.740 -4.740 -8.807 1.00 0.00 C ATOM 941 CG GLU B 60 5.117 -5.079 -8.257 1.00 0.00 C ATOM 942 CD GLU B 60 6.207 -4.178 -8.795 1.00 0.00 C ATOM 943 OE1 GLU B 60 6.598 -4.344 -9.969 1.00 0.00 O ATOM 944 OE2 GLU B 60 6.692 -3.310 -8.039 1.00 0.00 O ATOM 0 H GLU B 60 3.192 -7.361 -9.090 1.00 0.00 H new ATOM 0 HA GLU B 60 2.469 -5.247 -7.144 1.00 0.00 H new ATOM 0 HB2 GLU B 60 3.738 -4.901 -9.885 1.00 0.00 H new ATOM 0 HB3 GLU B 60 3.541 -3.681 -8.642 1.00 0.00 H new ATOM 0 HG2 GLU B 60 5.096 -5.005 -7.170 1.00 0.00 H new ATOM 0 HG3 GLU B 60 5.355 -6.114 -8.502 1.00 0.00 H new ATOM 951 N ALA B 61 0.352 -4.715 -8.272 1.00 0.00 N ATOM 952 CA ALA B 61 -0.911 -4.368 -8.905 1.00 0.00 C ATOM 953 C ALA B 61 -1.128 -2.862 -8.859 1.00 0.00 C ATOM 954 O ALA B 61 -0.859 -2.223 -7.841 1.00 0.00 O ATOM 955 CB ALA B 61 -2.062 -5.094 -8.225 1.00 0.00 C ATOM 0 H ALA B 61 0.421 -4.441 -7.292 1.00 0.00 H new ATOM 0 HA ALA B 61 -0.876 -4.681 -9.949 1.00 0.00 H new ATOM 0 HB1 ALA B 61 -3.000 -4.824 -8.710 1.00 0.00 H new ATOM 0 HB2 ALA B 61 -1.910 -6.171 -8.303 1.00 0.00 H new ATOM 0 HB3 ALA B 61 -2.102 -4.809 -7.174 1.00 0.00 H new ATOM 961 N THR B 62 -1.604 -2.299 -9.958 1.00 0.00 N ATOM 962 CA THR B 62 -1.829 -0.865 -10.038 1.00 0.00 C ATOM 963 C THR B 62 -3.313 -0.535 -9.913 1.00 0.00 C ATOM 964 O THR B 62 -4.139 -1.008 -10.698 1.00 0.00 O ATOM 965 CB THR B 62 -1.282 -0.294 -11.359 1.00 0.00 C ATOM 966 OG1 THR B 62 0.093 -0.672 -11.517 1.00 0.00 O ATOM 967 CG2 THR B 62 -1.400 1.221 -11.386 1.00 0.00 C ATOM 0 H THR B 62 -1.842 -2.813 -10.806 1.00 0.00 H new ATOM 0 HA THR B 62 -1.295 -0.405 -9.207 1.00 0.00 H new ATOM 0 HB THR B 62 -1.873 -0.701 -12.180 1.00 0.00 H new ATOM 0 HG1 THR B 62 0.437 -0.309 -12.359 1.00 0.00 H new ATOM 0 HG21 THR B 62 -1.007 1.600 -12.329 1.00 0.00 H new ATOM 0 HG22 THR B 62 -2.448 1.506 -11.289 1.00 0.00 H new ATOM 0 HG23 THR B 62 -0.830 1.645 -10.559 1.00 0.00 H new ATOM 975 N ILE B 63 -3.642 0.264 -8.912 1.00 0.00 N ATOM 976 CA ILE B 63 -5.013 0.685 -8.666 1.00 0.00 C ATOM 977 C ILE B 63 -5.143 2.179 -8.945 1.00 0.00 C ATOM 978 O ILE B 63 -4.331 2.969 -8.464 1.00 0.00 O ATOM 979 CB ILE B 63 -5.444 0.406 -7.199 1.00 0.00 C ATOM 980 CG1 ILE B 63 -5.368 -1.090 -6.866 1.00 0.00 C ATOM 981 CG2 ILE B 63 -6.853 0.923 -6.940 1.00 0.00 C ATOM 982 CD1 ILE B 63 -3.979 -1.579 -6.513 1.00 0.00 C ATOM 0 H ILE B 63 -2.967 0.640 -8.246 1.00 0.00 H new ATOM 0 HA ILE B 63 -5.662 0.113 -9.329 1.00 0.00 H new ATOM 0 HB ILE B 63 -4.747 0.937 -6.551 1.00 0.00 H new ATOM 0 HG12 ILE B 63 -6.037 -1.299 -6.032 1.00 0.00 H new ATOM 0 HG13 ILE B 63 -5.735 -1.660 -7.720 1.00 0.00 H new ATOM 0 HG21 ILE B 63 -7.132 0.716 -5.907 1.00 0.00 H new ATOM 0 HG22 ILE B 63 -6.884 1.998 -7.116 1.00 0.00 H new ATOM 0 HG23 ILE B 63 -7.552 0.425 -7.612 1.00 0.00 H new ATOM 0 HD11 ILE B 63 -4.014 -2.646 -6.292 1.00 0.00 H new ATOM 0 HD12 ILE B 63 -3.307 -1.405 -7.354 1.00 0.00 H new ATOM 0 HD13 ILE B 63 -3.614 -1.039 -5.639 1.00 0.00 H new ATOM 994 N PRO B 64 -6.147 2.584 -9.745 1.00 0.00 N ATOM 995 CA PRO B 64 -6.425 4.000 -10.013 1.00 0.00 C ATOM 996 C PRO B 64 -6.460 4.826 -8.729 1.00 0.00 C ATOM 997 O PRO B 64 -7.053 4.407 -7.728 1.00 0.00 O ATOM 998 CB PRO B 64 -7.805 3.967 -10.668 1.00 0.00 C ATOM 999 CG PRO B 64 -7.876 2.634 -11.328 1.00 0.00 C ATOM 1000 CD PRO B 64 -7.074 1.693 -10.467 1.00 0.00 C ATOM 0 HA PRO B 64 -5.658 4.464 -10.633 1.00 0.00 H new ATOM 0 HB2 PRO B 64 -8.597 4.086 -9.929 1.00 0.00 H new ATOM 0 HB3 PRO B 64 -7.920 4.774 -11.391 1.00 0.00 H new ATOM 0 HG2 PRO B 64 -8.909 2.297 -11.414 1.00 0.00 H new ATOM 0 HG3 PRO B 64 -7.470 2.678 -12.339 1.00 0.00 H new ATOM 0 HD2 PRO B 64 -7.712 1.137 -9.780 1.00 0.00 H new ATOM 0 HD3 PRO B 64 -6.537 0.959 -11.068 1.00 0.00 H new ATOM 1008 N GLY B 65 -5.837 6.002 -8.764 1.00 0.00 N ATOM 1009 CA GLY B 65 -5.668 6.810 -7.565 1.00 0.00 C ATOM 1010 C GLY B 65 -6.940 7.501 -7.104 1.00 0.00 C ATOM 1011 O GLY B 65 -6.938 8.700 -6.837 1.00 0.00 O ATOM 0 H GLY B 65 -5.442 6.414 -9.610 1.00 0.00 H new ATOM 0 HA2 GLY B 65 -5.299 6.175 -6.760 1.00 0.00 H new ATOM 0 HA3 GLY B 65 -4.904 7.564 -7.752 1.00 0.00 H new ATOM 1015 N HIS B 66 -8.020 6.738 -6.997 1.00 0.00 N ATOM 1016 CA HIS B 66 -9.302 7.265 -6.548 1.00 0.00 C ATOM 1017 C HIS B 66 -10.279 6.130 -6.241 1.00 0.00 C ATOM 1018 O HIS B 66 -11.487 6.278 -6.411 1.00 0.00 O ATOM 1019 CB HIS B 66 -9.901 8.219 -7.598 1.00 0.00 C ATOM 1020 CG HIS B 66 -9.938 7.657 -8.987 1.00 0.00 C ATOM 1021 ND1 HIS B 66 -9.086 8.072 -9.987 1.00 0.00 N ATOM 1022 CD2 HIS B 66 -10.723 6.704 -9.539 1.00 0.00 C ATOM 1023 CE1 HIS B 66 -9.346 7.400 -11.091 1.00 0.00 C ATOM 1024 NE2 HIS B 66 -10.334 6.563 -10.845 1.00 0.00 N ATOM 0 H HIS B 66 -8.033 5.742 -7.218 1.00 0.00 H new ATOM 0 HA HIS B 66 -9.130 7.828 -5.631 1.00 0.00 H new ATOM 0 HB2 HIS B 66 -10.915 8.482 -7.297 1.00 0.00 H new ATOM 0 HB3 HIS B 66 -9.321 9.142 -7.607 1.00 0.00 H new ATOM 0 HD2 HIS B 66 -11.510 6.156 -9.043 1.00 0.00 H new ATOM 0 HE1 HIS B 66 -8.836 7.516 -12.036 1.00 0.00 H new ATOM 0 HE2 HIS B 66 -10.743 5.915 -11.518 1.00 0.00 H new ATOM 1033 N LEU B 67 -9.749 4.993 -5.804 1.00 0.00 N ATOM 1034 CA LEU B 67 -10.588 3.848 -5.453 1.00 0.00 C ATOM 1035 C LEU B 67 -10.433 3.500 -3.981 1.00 0.00 C ATOM 1036 O LEU B 67 -11.418 3.386 -3.255 1.00 0.00 O ATOM 1037 CB LEU B 67 -10.242 2.623 -6.306 1.00 0.00 C ATOM 1038 CG LEU B 67 -10.508 2.762 -7.806 1.00 0.00 C ATOM 1039 CD1 LEU B 67 -10.260 1.441 -8.513 1.00 0.00 C ATOM 1040 CD2 LEU B 67 -11.929 3.240 -8.058 1.00 0.00 C ATOM 0 H LEU B 67 -8.748 4.838 -5.684 1.00 0.00 H new ATOM 0 HA LEU B 67 -11.623 4.129 -5.650 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -9.187 2.390 -6.163 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -10.810 1.771 -5.932 1.00 0.00 H new ATOM 0 HG LEU B 67 -9.820 3.506 -8.208 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -10.454 1.557 -9.579 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -9.224 1.137 -8.363 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -10.924 0.679 -8.104 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -12.097 3.332 -9.131 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -12.634 2.521 -7.641 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -12.076 4.210 -7.583 1.00 0.00 H new ATOM 1052 N ASN B 68 -9.185 3.321 -3.557 1.00 0.00 N ATOM 1053 CA ASN B 68 -8.866 2.990 -2.167 1.00 0.00 C ATOM 1054 C ASN B 68 -9.435 1.637 -1.767 1.00 0.00 C ATOM 1055 O ASN B 68 -9.722 1.396 -0.593 1.00 0.00 O ATOM 1056 CB ASN B 68 -9.367 4.070 -1.204 1.00 0.00 C ATOM 1057 CG ASN B 68 -8.510 5.317 -1.225 1.00 0.00 C ATOM 1058 OD1 ASN B 68 -7.989 5.720 -2.265 1.00 0.00 O ATOM 1059 ND2 ASN B 68 -8.338 5.924 -0.067 1.00 0.00 N ATOM 0 H ASN B 68 -8.368 3.400 -4.162 1.00 0.00 H new ATOM 0 HA ASN B 68 -7.779 2.940 -2.099 1.00 0.00 H new ATOM 0 HB2 ASN B 68 -10.392 4.335 -1.463 1.00 0.00 H new ATOM 0 HB3 ASN B 68 -9.388 3.666 -0.192 1.00 0.00 H new ATOM 0 HD21 ASN B 68 -7.756 6.759 -0.011 1.00 0.00 H new ATOM 0 HD22 ASN B 68 -8.787 5.558 0.772 1.00 0.00 H new ATOM 1066 N SER B 69 -9.590 0.758 -2.743 1.00 0.00 N ATOM 1067 CA SER B 69 -10.096 -0.579 -2.501 1.00 0.00 C ATOM 1068 C SER B 69 -9.642 -1.520 -3.612 1.00 0.00 C ATOM 1069 O SER B 69 -9.717 -1.176 -4.793 1.00 0.00 O ATOM 1070 CB SER B 69 -11.625 -0.551 -2.409 1.00 0.00 C ATOM 1071 OG SER B 69 -12.192 0.172 -3.492 1.00 0.00 O ATOM 0 H SER B 69 -9.369 0.951 -3.720 1.00 0.00 H new ATOM 0 HA SER B 69 -9.698 -0.945 -1.555 1.00 0.00 H new ATOM 0 HB2 SER B 69 -12.010 -1.571 -2.408 1.00 0.00 H new ATOM 0 HB3 SER B 69 -11.927 -0.095 -1.466 1.00 0.00 H new ATOM 0 HG SER B 69 -13.169 0.173 -3.409 1.00 0.00 H new ATOM 1077 N TYR B 70 -9.144 -2.687 -3.231 1.00 0.00 N ATOM 1078 CA TYR B 70 -8.692 -3.676 -4.198 1.00 0.00 C ATOM 1079 C TYR B 70 -8.923 -5.086 -3.669 1.00 0.00 C ATOM 1080 O TYR B 70 -8.740 -5.350 -2.484 1.00 0.00 O ATOM 1081 CB TYR B 70 -7.208 -3.465 -4.514 1.00 0.00 C ATOM 1082 CG TYR B 70 -6.639 -4.454 -5.512 1.00 0.00 C ATOM 1083 CD1 TYR B 70 -5.588 -5.292 -5.162 1.00 0.00 C ATOM 1084 CD2 TYR B 70 -7.154 -4.552 -6.801 1.00 0.00 C ATOM 1085 CE1 TYR B 70 -5.065 -6.198 -6.066 1.00 0.00 C ATOM 1086 CE2 TYR B 70 -6.636 -5.457 -7.710 1.00 0.00 C ATOM 1087 CZ TYR B 70 -5.592 -6.277 -7.337 1.00 0.00 C ATOM 1088 OH TYR B 70 -5.072 -7.181 -8.238 1.00 0.00 O ATOM 0 H TYR B 70 -9.043 -2.973 -2.257 1.00 0.00 H new ATOM 0 HA TYR B 70 -9.269 -3.553 -5.115 1.00 0.00 H new ATOM 0 HB2 TYR B 70 -7.070 -2.455 -4.901 1.00 0.00 H new ATOM 0 HB3 TYR B 70 -6.638 -3.532 -3.588 1.00 0.00 H new ATOM 0 HD1 TYR B 70 -5.172 -5.235 -4.167 1.00 0.00 H new ATOM 0 HD2 TYR B 70 -7.971 -3.911 -7.097 1.00 0.00 H new ATOM 0 HE1 TYR B 70 -4.247 -6.841 -5.777 1.00 0.00 H new ATOM 0 HE2 TYR B 70 -7.047 -5.521 -8.707 1.00 0.00 H new ATOM 0 HH TYR B 70 -5.555 -7.111 -9.088 1.00 0.00 H new ATOM 1098 N THR B 71 -9.346 -5.982 -4.543 1.00 0.00 N ATOM 1099 CA THR B 71 -9.538 -7.370 -4.171 1.00 0.00 C ATOM 1100 C THR B 71 -8.403 -8.229 -4.720 1.00 0.00 C ATOM 1101 O THR B 71 -8.408 -8.604 -5.895 1.00 0.00 O ATOM 1102 CB THR B 71 -10.887 -7.895 -4.693 1.00 0.00 C ATOM 1103 OG1 THR B 71 -11.930 -6.983 -4.326 1.00 0.00 O ATOM 1104 CG2 THR B 71 -11.195 -9.277 -4.130 1.00 0.00 C ATOM 0 H THR B 71 -9.563 -5.771 -5.517 1.00 0.00 H new ATOM 0 HA THR B 71 -9.538 -7.431 -3.083 1.00 0.00 H new ATOM 0 HB THR B 71 -10.827 -7.974 -5.778 1.00 0.00 H new ATOM 0 HG1 THR B 71 -12.789 -7.317 -4.660 1.00 0.00 H new ATOM 0 HG21 THR B 71 -12.154 -9.622 -4.516 1.00 0.00 H new ATOM 0 HG22 THR B 71 -10.412 -9.974 -4.428 1.00 0.00 H new ATOM 0 HG23 THR B 71 -11.240 -9.225 -3.042 1.00 0.00 H new ATOM 1112 N ILE B 72 -7.431 -8.527 -3.864 1.00 0.00 N ATOM 1113 CA ILE B 72 -6.279 -9.333 -4.253 1.00 0.00 C ATOM 1114 C ILE B 72 -6.709 -10.777 -4.467 1.00 0.00 C ATOM 1115 O ILE B 72 -7.378 -11.357 -3.613 1.00 0.00 O ATOM 1116 CB ILE B 72 -5.165 -9.299 -3.182 1.00 0.00 C ATOM 1117 CG1 ILE B 72 -4.822 -7.856 -2.796 1.00 0.00 C ATOM 1118 CG2 ILE B 72 -3.924 -10.021 -3.690 1.00 0.00 C ATOM 1119 CD1 ILE B 72 -3.803 -7.748 -1.681 1.00 0.00 C ATOM 0 H ILE B 72 -7.419 -8.221 -2.891 1.00 0.00 H new ATOM 0 HA ILE B 72 -5.883 -8.911 -5.176 1.00 0.00 H new ATOM 0 HB ILE B 72 -5.530 -9.811 -2.292 1.00 0.00 H new ATOM 0 HG12 ILE B 72 -4.442 -7.335 -3.675 1.00 0.00 H new ATOM 0 HG13 ILE B 72 -5.735 -7.344 -2.492 1.00 0.00 H new ATOM 0 HG21 ILE B 72 -3.147 -9.990 -2.926 1.00 0.00 H new ATOM 0 HG22 ILE B 72 -4.172 -11.059 -3.913 1.00 0.00 H new ATOM 0 HG23 ILE B 72 -3.563 -9.532 -4.595 1.00 0.00 H new ATOM 0 HD11 ILE B 72 -3.611 -6.697 -1.464 1.00 0.00 H new ATOM 0 HD12 ILE B 72 -4.188 -8.239 -0.787 1.00 0.00 H new ATOM 0 HD13 ILE B 72 -2.875 -8.230 -1.988 1.00 0.00 H new ATOM 1131 N LYS B 73 -6.343 -11.349 -5.605 1.00 0.00 N ATOM 1132 CA LYS B 73 -6.738 -12.712 -5.931 1.00 0.00 C ATOM 1133 C LYS B 73 -5.514 -13.577 -6.203 1.00 0.00 C ATOM 1134 O LYS B 73 -4.685 -13.250 -7.053 1.00 0.00 O ATOM 1135 CB LYS B 73 -7.665 -12.714 -7.149 1.00 0.00 C ATOM 1136 CG LYS B 73 -8.876 -11.812 -6.987 1.00 0.00 C ATOM 1137 CD LYS B 73 -9.752 -11.820 -8.226 1.00 0.00 C ATOM 1138 CE LYS B 73 -10.848 -10.771 -8.139 1.00 0.00 C ATOM 1139 NZ LYS B 73 -10.299 -9.387 -8.120 1.00 0.00 N ATOM 0 H LYS B 73 -5.774 -10.891 -6.317 1.00 0.00 H new ATOM 0 HA LYS B 73 -7.272 -13.129 -5.077 1.00 0.00 H new ATOM 0 HB2 LYS B 73 -7.101 -12.398 -8.026 1.00 0.00 H new ATOM 0 HB3 LYS B 73 -8.003 -13.733 -7.337 1.00 0.00 H new ATOM 0 HG2 LYS B 73 -9.460 -12.138 -6.126 1.00 0.00 H new ATOM 0 HG3 LYS B 73 -8.546 -10.794 -6.781 1.00 0.00 H new ATOM 0 HD2 LYS B 73 -9.139 -11.635 -9.108 1.00 0.00 H new ATOM 0 HD3 LYS B 73 -10.200 -12.806 -8.350 1.00 0.00 H new ATOM 0 HE2 LYS B 73 -11.523 -10.881 -8.988 1.00 0.00 H new ATOM 0 HE3 LYS B 73 -11.439 -10.939 -7.238 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 -11.077 -8.704 -8.214 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 -9.801 -9.223 -7.222 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 -9.635 -9.266 -8.911 1.00 0.00 H new ATOM 1153 N GLY B 74 -5.406 -14.677 -5.477 1.00 0.00 N ATOM 1154 CA GLY B 74 -4.280 -15.573 -5.645 1.00 0.00 C ATOM 1155 C GLY B 74 -3.559 -15.837 -4.341 1.00 0.00 C ATOM 1156 O GLY B 74 -2.533 -16.520 -4.314 1.00 0.00 O ATOM 0 H GLY B 74 -6.081 -14.968 -4.770 1.00 0.00 H new ATOM 0 HA2 GLY B 74 -4.629 -16.517 -6.063 1.00 0.00 H new ATOM 0 HA3 GLY B 74 -3.582 -15.145 -6.364 1.00 0.00 H new ATOM 1160 N LEU B 75 -4.100 -15.300 -3.258 1.00 0.00 N ATOM 1161 CA LEU B 75 -3.513 -15.471 -1.939 1.00 0.00 C ATOM 1162 C LEU B 75 -3.774 -16.881 -1.428 1.00 0.00 C ATOM 1163 O LEU B 75 -4.918 -17.311 -1.337 1.00 0.00 O ATOM 1164 CB LEU B 75 -4.097 -14.445 -0.968 1.00 0.00 C ATOM 1165 CG LEU B 75 -3.865 -12.978 -1.343 1.00 0.00 C ATOM 1166 CD1 LEU B 75 -4.611 -12.070 -0.385 1.00 0.00 C ATOM 1167 CD2 LEU B 75 -2.381 -12.649 -1.339 1.00 0.00 C ATOM 0 H LEU B 75 -4.951 -14.738 -3.268 1.00 0.00 H new ATOM 0 HA LEU B 75 -2.436 -15.316 -2.011 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -5.170 -14.616 -0.888 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -3.671 -14.621 0.020 1.00 0.00 H new ATOM 0 HG LEU B 75 -4.246 -12.815 -2.351 1.00 0.00 H new ATOM 0 HD11 LEU B 75 -4.439 -11.030 -0.661 1.00 0.00 H new ATOM 0 HD12 LEU B 75 -5.678 -12.287 -0.435 1.00 0.00 H new ATOM 0 HD13 LEU B 75 -4.253 -12.240 0.630 1.00 0.00 H new ATOM 0 HD21 LEU B 75 -2.240 -11.602 -1.608 1.00 0.00 H new ATOM 0 HD22 LEU B 75 -1.972 -12.826 -0.344 1.00 0.00 H new ATOM 0 HD23 LEU B 75 -1.866 -13.282 -2.062 1.00 0.00 H new ATOM 1179 N LYS B 76 -2.710 -17.598 -1.106 1.00 0.00 N ATOM 1180 CA LYS B 76 -2.824 -18.989 -0.690 1.00 0.00 C ATOM 1181 C LYS B 76 -3.396 -19.097 0.721 1.00 0.00 C ATOM 1182 O LYS B 76 -2.938 -18.417 1.643 1.00 0.00 O ATOM 1183 CB LYS B 76 -1.459 -19.674 -0.752 1.00 0.00 C ATOM 1184 CG LYS B 76 -0.857 -19.709 -2.147 1.00 0.00 C ATOM 1185 CD LYS B 76 0.459 -20.468 -2.163 1.00 0.00 C ATOM 1186 CE LYS B 76 1.019 -20.588 -3.572 1.00 0.00 C ATOM 1187 NZ LYS B 76 0.090 -21.309 -4.485 1.00 0.00 N ATOM 0 H LYS B 76 -1.755 -17.240 -1.124 1.00 0.00 H new ATOM 0 HA LYS B 76 -3.508 -19.489 -1.376 1.00 0.00 H new ATOM 0 HB2 LYS B 76 -0.772 -19.157 -0.082 1.00 0.00 H new ATOM 0 HB3 LYS B 76 -1.557 -20.695 -0.382 1.00 0.00 H new ATOM 0 HG2 LYS B 76 -1.559 -20.179 -2.836 1.00 0.00 H new ATOM 0 HG3 LYS B 76 -0.696 -18.691 -2.501 1.00 0.00 H new ATOM 0 HD2 LYS B 76 1.182 -19.958 -1.526 1.00 0.00 H new ATOM 0 HD3 LYS B 76 0.311 -21.463 -1.744 1.00 0.00 H new ATOM 0 HE2 LYS B 76 1.216 -19.592 -3.969 1.00 0.00 H new ATOM 0 HE3 LYS B 76 1.974 -21.113 -3.539 1.00 0.00 H new ATOM 0 HZ1 LYS B 76 0.608 -21.621 -5.331 1.00 0.00 H new ATOM 0 HZ2 LYS B 76 -0.305 -22.137 -3.995 1.00 0.00 H new ATOM 0 HZ3 LYS B 76 -0.683 -20.673 -4.767 1.00 0.00 H new ATOM 1201 N PRO B 77 -4.411 -19.954 0.905 1.00 0.00 N ATOM 1202 CA PRO B 77 -5.042 -20.166 2.208 1.00 0.00 C ATOM 1203 C PRO B 77 -4.086 -20.815 3.205 1.00 0.00 C ATOM 1204 O PRO B 77 -3.578 -21.918 2.980 1.00 0.00 O ATOM 1205 CB PRO B 77 -6.220 -21.094 1.898 1.00 0.00 C ATOM 1206 CG PRO B 77 -5.849 -21.772 0.626 1.00 0.00 C ATOM 1207 CD PRO B 77 -5.026 -20.783 -0.147 1.00 0.00 C ATOM 0 HA PRO B 77 -5.347 -19.229 2.673 1.00 0.00 H new ATOM 0 HB2 PRO B 77 -6.376 -21.816 2.700 1.00 0.00 H new ATOM 0 HB3 PRO B 77 -7.148 -20.532 1.790 1.00 0.00 H new ATOM 0 HG2 PRO B 77 -5.283 -22.683 0.820 1.00 0.00 H new ATOM 0 HG3 PRO B 77 -6.738 -22.063 0.065 1.00 0.00 H new ATOM 0 HD2 PRO B 77 -4.273 -21.279 -0.760 1.00 0.00 H new ATOM 0 HD3 PRO B 77 -5.642 -20.186 -0.820 1.00 0.00 H new ATOM 1215 N GLY B 78 -3.838 -20.119 4.304 1.00 0.00 N ATOM 1216 CA GLY B 78 -2.916 -20.614 5.304 1.00 0.00 C ATOM 1217 C GLY B 78 -1.608 -19.852 5.291 1.00 0.00 C ATOM 1218 O GLY B 78 -0.847 -19.889 6.257 1.00 0.00 O ATOM 0 H GLY B 78 -4.261 -19.217 4.522 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -3.373 -20.534 6.290 1.00 0.00 H new ATOM 0 HA3 GLY B 78 -2.722 -21.672 5.127 1.00 0.00 H new ATOM 1222 N VAL B 79 -1.355 -19.142 4.201 1.00 0.00 N ATOM 1223 CA VAL B 79 -0.125 -18.380 4.053 1.00 0.00 C ATOM 1224 C VAL B 79 -0.322 -16.947 4.536 1.00 0.00 C ATOM 1225 O VAL B 79 -1.319 -16.298 4.213 1.00 0.00 O ATOM 1226 CB VAL B 79 0.354 -18.364 2.581 1.00 0.00 C ATOM 1227 CG1 VAL B 79 1.620 -17.542 2.424 1.00 0.00 C ATOM 1228 CG2 VAL B 79 0.598 -19.773 2.079 1.00 0.00 C ATOM 0 H VAL B 79 -1.988 -19.078 3.404 1.00 0.00 H new ATOM 0 HA VAL B 79 0.636 -18.867 4.662 1.00 0.00 H new ATOM 0 HB VAL B 79 -0.436 -17.905 1.986 1.00 0.00 H new ATOM 0 HG11 VAL B 79 1.932 -17.550 1.380 1.00 0.00 H new ATOM 0 HG12 VAL B 79 1.429 -16.516 2.738 1.00 0.00 H new ATOM 0 HG13 VAL B 79 2.410 -17.969 3.042 1.00 0.00 H new ATOM 0 HG21 VAL B 79 0.934 -19.737 1.043 1.00 0.00 H new ATOM 0 HG22 VAL B 79 1.363 -20.250 2.692 1.00 0.00 H new ATOM 0 HG23 VAL B 79 -0.327 -20.347 2.141 1.00 0.00 H new ATOM 1238 N VAL B 80 0.619 -16.469 5.336 1.00 0.00 N ATOM 1239 CA VAL B 80 0.613 -15.089 5.789 1.00 0.00 C ATOM 1240 C VAL B 80 1.381 -14.242 4.776 1.00 0.00 C ATOM 1241 O VAL B 80 2.337 -14.723 4.162 1.00 0.00 O ATOM 1242 CB VAL B 80 1.248 -14.953 7.194 1.00 0.00 C ATOM 1243 CG1 VAL B 80 1.032 -13.557 7.762 1.00 0.00 C ATOM 1244 CG2 VAL B 80 0.686 -16.004 8.139 1.00 0.00 C ATOM 0 H VAL B 80 1.401 -17.022 5.686 1.00 0.00 H new ATOM 0 HA VAL B 80 -0.418 -14.743 5.865 1.00 0.00 H new ATOM 0 HB VAL B 80 2.321 -15.114 7.093 1.00 0.00 H new ATOM 0 HG11 VAL B 80 1.489 -13.491 8.749 1.00 0.00 H new ATOM 0 HG12 VAL B 80 1.489 -12.821 7.101 1.00 0.00 H new ATOM 0 HG13 VAL B 80 -0.037 -13.358 7.843 1.00 0.00 H new ATOM 0 HG21 VAL B 80 1.144 -15.892 9.122 1.00 0.00 H new ATOM 0 HG22 VAL B 80 -0.393 -15.876 8.225 1.00 0.00 H new ATOM 0 HG23 VAL B 80 0.903 -16.998 7.748 1.00 0.00 H new ATOM 1254 N TYR B 81 0.967 -12.999 4.579 1.00 0.00 N ATOM 1255 CA TYR B 81 1.558 -12.169 3.542 1.00 0.00 C ATOM 1256 C TYR B 81 2.033 -10.820 4.072 1.00 0.00 C ATOM 1257 O TYR B 81 1.560 -10.324 5.096 1.00 0.00 O ATOM 1258 CB TYR B 81 0.557 -11.940 2.408 1.00 0.00 C ATOM 1259 CG TYR B 81 0.364 -13.126 1.490 1.00 0.00 C ATOM 1260 CD1 TYR B 81 -0.587 -14.102 1.762 1.00 0.00 C ATOM 1261 CD2 TYR B 81 1.131 -13.261 0.342 1.00 0.00 C ATOM 1262 CE1 TYR B 81 -0.763 -15.181 0.912 1.00 0.00 C ATOM 1263 CE2 TYR B 81 0.962 -14.334 -0.509 1.00 0.00 C ATOM 1264 CZ TYR B 81 0.014 -15.290 -0.221 1.00 0.00 C ATOM 1265 OH TYR B 81 -0.157 -16.361 -1.073 1.00 0.00 O ATOM 0 H TYR B 81 0.230 -12.546 5.119 1.00 0.00 H new ATOM 0 HA TYR B 81 2.430 -12.708 3.170 1.00 0.00 H new ATOM 0 HB2 TYR B 81 -0.407 -11.671 2.840 1.00 0.00 H new ATOM 0 HB3 TYR B 81 0.889 -11.088 1.815 1.00 0.00 H new ATOM 0 HD1 TYR B 81 -1.198 -14.018 2.649 1.00 0.00 H new ATOM 0 HD2 TYR B 81 1.874 -12.512 0.110 1.00 0.00 H new ATOM 0 HE1 TYR B 81 -1.505 -15.933 1.136 1.00 0.00 H new ATOM 0 HE2 TYR B 81 1.570 -14.423 -1.397 1.00 0.00 H new ATOM 0 HH TYR B 81 0.469 -16.285 -1.823 1.00 0.00 H new ATOM 1275 N GLU B 82 2.985 -10.250 3.349 1.00 0.00 N ATOM 1276 CA GLU B 82 3.452 -8.889 3.567 1.00 0.00 C ATOM 1277 C GLU B 82 2.842 -7.988 2.508 1.00 0.00 C ATOM 1278 O GLU B 82 3.029 -8.225 1.316 1.00 0.00 O ATOM 1279 CB GLU B 82 4.976 -8.827 3.446 1.00 0.00 C ATOM 1280 CG GLU B 82 5.720 -9.555 4.546 1.00 0.00 C ATOM 1281 CD GLU B 82 5.948 -8.688 5.764 1.00 0.00 C ATOM 1282 OE1 GLU B 82 4.961 -8.251 6.391 1.00 0.00 O ATOM 1283 OE2 GLU B 82 7.123 -8.458 6.118 1.00 0.00 O ATOM 0 H GLU B 82 3.462 -10.726 2.583 1.00 0.00 H new ATOM 0 HA GLU B 82 3.157 -8.564 4.565 1.00 0.00 H new ATOM 0 HB2 GLU B 82 5.270 -9.249 2.485 1.00 0.00 H new ATOM 0 HB3 GLU B 82 5.286 -7.782 3.444 1.00 0.00 H new ATOM 0 HG2 GLU B 82 5.156 -10.442 4.836 1.00 0.00 H new ATOM 0 HG3 GLU B 82 6.681 -9.899 4.164 1.00 0.00 H new ATOM 1290 N GLY B 83 2.105 -6.977 2.932 1.00 0.00 N ATOM 1291 CA GLY B 83 1.466 -6.090 1.983 1.00 0.00 C ATOM 1292 C GLY B 83 1.927 -4.662 2.132 1.00 0.00 C ATOM 1293 O GLY B 83 2.219 -4.209 3.239 1.00 0.00 O ATOM 0 H GLY B 83 1.937 -6.753 3.913 1.00 0.00 H new ATOM 0 HA2 GLY B 83 1.676 -6.433 0.970 1.00 0.00 H new ATOM 0 HA3 GLY B 83 0.385 -6.136 2.117 1.00 0.00 H new ATOM 1297 N GLN B 84 1.995 -3.951 1.021 1.00 0.00 N ATOM 1298 CA GLN B 84 2.376 -2.549 1.032 1.00 0.00 C ATOM 1299 C GLN B 84 1.570 -1.761 0.010 1.00 0.00 C ATOM 1300 O GLN B 84 1.369 -2.210 -1.122 1.00 0.00 O ATOM 1301 CB GLN B 84 3.875 -2.396 0.762 1.00 0.00 C ATOM 1302 CG GLN B 84 4.356 -3.135 -0.474 1.00 0.00 C ATOM 1303 CD GLN B 84 5.816 -2.876 -0.774 1.00 0.00 C ATOM 1304 OE1 GLN B 84 6.153 -1.956 -1.515 1.00 0.00 O ATOM 1305 NE2 GLN B 84 6.694 -3.680 -0.196 1.00 0.00 N ATOM 0 H GLN B 84 1.790 -4.324 0.094 1.00 0.00 H new ATOM 0 HA GLN B 84 2.159 -2.147 2.022 1.00 0.00 H new ATOM 0 HB2 GLN B 84 4.108 -1.337 0.654 1.00 0.00 H new ATOM 0 HB3 GLN B 84 4.429 -2.758 1.628 1.00 0.00 H new ATOM 0 HG2 GLN B 84 4.201 -4.205 -0.336 1.00 0.00 H new ATOM 0 HG3 GLN B 84 3.754 -2.833 -1.331 1.00 0.00 H new ATOM 0 HE21 GLN B 84 6.373 -4.433 0.413 1.00 0.00 H new ATOM 0 HE22 GLN B 84 7.692 -3.547 -0.359 1.00 0.00 H new ATOM 1314 N LEU B 85 1.092 -0.598 0.428 1.00 0.00 N ATOM 1315 CA LEU B 85 0.344 0.290 -0.445 1.00 0.00 C ATOM 1316 C LEU B 85 1.194 1.512 -0.771 1.00 0.00 C ATOM 1317 O LEU B 85 1.573 2.271 0.121 1.00 0.00 O ATOM 1318 CB LEU B 85 -0.977 0.699 0.230 1.00 0.00 C ATOM 1319 CG LEU B 85 -2.000 1.435 -0.653 1.00 0.00 C ATOM 1320 CD1 LEU B 85 -1.635 2.902 -0.828 1.00 0.00 C ATOM 1321 CD2 LEU B 85 -2.121 0.755 -2.008 1.00 0.00 C ATOM 0 H LEU B 85 1.212 -0.246 1.378 1.00 0.00 H new ATOM 0 HA LEU B 85 0.103 -0.224 -1.375 1.00 0.00 H new ATOM 0 HB2 LEU B 85 -1.451 -0.200 0.625 1.00 0.00 H new ATOM 0 HB3 LEU B 85 -0.742 1.336 1.083 1.00 0.00 H new ATOM 0 HG LEU B 85 -2.965 1.390 -0.148 1.00 0.00 H new ATOM 0 HD11 LEU B 85 -2.380 3.390 -1.457 1.00 0.00 H new ATOM 0 HD12 LEU B 85 -1.608 3.389 0.147 1.00 0.00 H new ATOM 0 HD13 LEU B 85 -0.655 2.979 -1.299 1.00 0.00 H new ATOM 0 HD21 LEU B 85 -2.849 1.289 -2.619 1.00 0.00 H new ATOM 0 HD22 LEU B 85 -1.152 0.763 -2.507 1.00 0.00 H new ATOM 0 HD23 LEU B 85 -2.449 -0.275 -1.870 1.00 0.00 H new ATOM 1333 N ILE B 86 1.504 1.682 -2.045 1.00 0.00 N ATOM 1334 CA ILE B 86 2.336 2.788 -2.495 1.00 0.00 C ATOM 1335 C ILE B 86 1.491 3.834 -3.214 1.00 0.00 C ATOM 1336 O ILE B 86 0.919 3.557 -4.269 1.00 0.00 O ATOM 1337 CB ILE B 86 3.432 2.288 -3.454 1.00 0.00 C ATOM 1338 CG1 ILE B 86 4.077 1.014 -2.895 1.00 0.00 C ATOM 1339 CG2 ILE B 86 4.482 3.372 -3.676 1.00 0.00 C ATOM 1340 CD1 ILE B 86 4.869 0.233 -3.916 1.00 0.00 C ATOM 0 H ILE B 86 1.190 1.063 -2.792 1.00 0.00 H new ATOM 0 HA ILE B 86 2.800 3.235 -1.616 1.00 0.00 H new ATOM 0 HB ILE B 86 2.978 2.054 -4.417 1.00 0.00 H new ATOM 0 HG12 ILE B 86 4.734 1.283 -2.068 1.00 0.00 H new ATOM 0 HG13 ILE B 86 3.297 0.372 -2.486 1.00 0.00 H new ATOM 0 HG21 ILE B 86 5.249 3.002 -4.356 1.00 0.00 H new ATOM 0 HG22 ILE B 86 4.009 4.254 -4.108 1.00 0.00 H new ATOM 0 HG23 ILE B 86 4.939 3.636 -2.723 1.00 0.00 H new ATOM 0 HD11 ILE B 86 5.294 -0.654 -3.446 1.00 0.00 H new ATOM 0 HD12 ILE B 86 4.213 -0.069 -4.732 1.00 0.00 H new ATOM 0 HD13 ILE B 86 5.672 0.857 -4.308 1.00 0.00 H new ATOM 1352 N SER B 87 1.402 5.024 -2.643 1.00 0.00 N ATOM 1353 CA SER B 87 0.629 6.098 -3.246 1.00 0.00 C ATOM 1354 C SER B 87 1.516 7.004 -4.096 1.00 0.00 C ATOM 1355 O SER B 87 2.427 7.660 -3.586 1.00 0.00 O ATOM 1356 CB SER B 87 -0.074 6.907 -2.156 1.00 0.00 C ATOM 1357 OG SER B 87 0.833 7.285 -1.133 1.00 0.00 O ATOM 0 H SER B 87 1.855 5.271 -1.763 1.00 0.00 H new ATOM 0 HA SER B 87 -0.121 5.656 -3.902 1.00 0.00 H new ATOM 0 HB2 SER B 87 -0.524 7.798 -2.594 1.00 0.00 H new ATOM 0 HB3 SER B 87 -0.885 6.318 -1.728 1.00 0.00 H new ATOM 0 HG SER B 87 1.677 7.577 -1.536 1.00 0.00 H new ATOM 1363 N ILE B 88 1.261 7.021 -5.397 1.00 0.00 N ATOM 1364 CA ILE B 88 1.996 7.893 -6.300 1.00 0.00 C ATOM 1365 C ILE B 88 1.261 9.215 -6.465 1.00 0.00 C ATOM 1366 O ILE B 88 0.250 9.297 -7.167 1.00 0.00 O ATOM 1367 CB ILE B 88 2.200 7.253 -7.689 1.00 0.00 C ATOM 1368 CG1 ILE B 88 2.855 5.874 -7.558 1.00 0.00 C ATOM 1369 CG2 ILE B 88 3.040 8.165 -8.576 1.00 0.00 C ATOM 1370 CD1 ILE B 88 4.191 5.888 -6.849 1.00 0.00 C ATOM 0 H ILE B 88 0.553 6.442 -5.849 1.00 0.00 H new ATOM 0 HA ILE B 88 2.977 8.060 -5.855 1.00 0.00 H new ATOM 0 HB ILE B 88 1.223 7.123 -8.155 1.00 0.00 H new ATOM 0 HG12 ILE B 88 2.177 5.212 -7.019 1.00 0.00 H new ATOM 0 HG13 ILE B 88 2.989 5.452 -8.554 1.00 0.00 H new ATOM 0 HG21 ILE B 88 3.175 7.699 -9.552 1.00 0.00 H new ATOM 0 HG22 ILE B 88 2.533 9.122 -8.697 1.00 0.00 H new ATOM 0 HG23 ILE B 88 4.014 8.326 -8.113 1.00 0.00 H new ATOM 0 HD11 ILE B 88 4.587 4.874 -6.798 1.00 0.00 H new ATOM 0 HD12 ILE B 88 4.887 6.522 -7.398 1.00 0.00 H new ATOM 0 HD13 ILE B 88 4.063 6.278 -5.839 1.00 0.00 H new ATOM 1382 N GLN B 89 1.759 10.242 -5.801 1.00 0.00 N ATOM 1383 CA GLN B 89 1.155 11.560 -5.866 1.00 0.00 C ATOM 1384 C GLN B 89 1.791 12.390 -6.971 1.00 0.00 C ATOM 1385 O GLN B 89 2.892 12.090 -7.434 1.00 0.00 O ATOM 1386 CB GLN B 89 1.298 12.260 -4.519 1.00 0.00 C ATOM 1387 CG GLN B 89 0.524 11.571 -3.412 1.00 0.00 C ATOM 1388 CD GLN B 89 0.808 12.161 -2.051 1.00 0.00 C ATOM 1389 OE1 GLN B 89 0.145 13.100 -1.619 1.00 0.00 O ATOM 1390 NE2 GLN B 89 1.797 11.611 -1.368 1.00 0.00 N ATOM 0 H GLN B 89 2.586 10.187 -5.207 1.00 0.00 H new ATOM 0 HA GLN B 89 0.095 11.450 -6.096 1.00 0.00 H new ATOM 0 HB2 GLN B 89 2.353 12.302 -4.247 1.00 0.00 H new ATOM 0 HB3 GLN B 89 0.952 13.289 -4.611 1.00 0.00 H new ATOM 0 HG2 GLN B 89 -0.543 11.644 -3.620 1.00 0.00 H new ATOM 0 HG3 GLN B 89 0.775 10.510 -3.404 1.00 0.00 H new ATOM 0 HE21 GLN B 89 2.321 10.832 -1.767 1.00 0.00 H new ATOM 0 HE22 GLN B 89 2.036 11.965 -0.442 1.00 0.00 H new ATOM 1399 N GLN B 90 1.084 13.441 -7.376 1.00 0.00 N ATOM 1400 CA GLN B 90 1.472 14.261 -8.524 1.00 0.00 C ATOM 1401 C GLN B 90 2.784 15.008 -8.288 1.00 0.00 C ATOM 1402 O GLN B 90 3.353 15.575 -9.215 1.00 0.00 O ATOM 1403 CB GLN B 90 0.367 15.266 -8.846 1.00 0.00 C ATOM 1404 CG GLN B 90 0.199 16.352 -7.793 1.00 0.00 C ATOM 1405 CD GLN B 90 -0.887 17.345 -8.151 1.00 0.00 C ATOM 1406 OE1 GLN B 90 -1.169 17.576 -9.325 1.00 0.00 O ATOM 1407 NE2 GLN B 90 -1.500 17.942 -7.143 1.00 0.00 N ATOM 0 H GLN B 90 0.226 13.750 -6.919 1.00 0.00 H new ATOM 0 HA GLN B 90 1.622 13.584 -9.365 1.00 0.00 H new ATOM 0 HB2 GLN B 90 0.583 15.734 -9.806 1.00 0.00 H new ATOM 0 HB3 GLN B 90 -0.576 14.731 -8.957 1.00 0.00 H new ATOM 0 HG2 GLN B 90 -0.037 15.890 -6.834 1.00 0.00 H new ATOM 0 HG3 GLN B 90 1.144 16.881 -7.668 1.00 0.00 H new ATOM 0 HE21 GLN B 90 -1.236 17.722 -6.183 1.00 0.00 H new ATOM 0 HE22 GLN B 90 -2.237 18.623 -7.326 1.00 0.00 H new ATOM 1416 N TYR B 91 3.248 15.022 -7.046 1.00 0.00 N ATOM 1417 CA TYR B 91 4.497 15.693 -6.709 1.00 0.00 C ATOM 1418 C TYR B 91 5.655 14.709 -6.785 1.00 0.00 C ATOM 1419 O TYR B 91 6.814 15.074 -6.592 1.00 0.00 O ATOM 1420 CB TYR B 91 4.415 16.296 -5.304 1.00 0.00 C ATOM 1421 CG TYR B 91 3.211 17.183 -5.098 1.00 0.00 C ATOM 1422 CD1 TYR B 91 3.223 18.513 -5.498 1.00 0.00 C ATOM 1423 CD2 TYR B 91 2.059 16.686 -4.506 1.00 0.00 C ATOM 1424 CE1 TYR B 91 2.116 19.321 -5.315 1.00 0.00 C ATOM 1425 CE2 TYR B 91 0.952 17.485 -4.318 1.00 0.00 C ATOM 1426 CZ TYR B 91 0.983 18.802 -4.723 1.00 0.00 C ATOM 1427 OH TYR B 91 -0.124 19.599 -4.538 1.00 0.00 O ATOM 0 H TYR B 91 2.780 14.578 -6.256 1.00 0.00 H new ATOM 0 HA TYR B 91 4.665 16.497 -7.426 1.00 0.00 H new ATOM 0 HB2 TYR B 91 4.391 15.489 -4.572 1.00 0.00 H new ATOM 0 HB3 TYR B 91 5.319 16.874 -5.112 1.00 0.00 H new ATOM 0 HD1 TYR B 91 4.110 18.922 -5.959 1.00 0.00 H new ATOM 0 HD2 TYR B 91 2.029 15.655 -4.187 1.00 0.00 H new ATOM 0 HE1 TYR B 91 2.138 20.353 -5.634 1.00 0.00 H new ATOM 0 HE2 TYR B 91 0.064 17.081 -3.855 1.00 0.00 H new ATOM 0 HH TYR B 91 -0.159 20.279 -5.243 1.00 0.00 H new ATOM 1437 N GLY B 92 5.328 13.454 -7.062 1.00 0.00 N ATOM 1438 CA GLY B 92 6.332 12.414 -7.119 1.00 0.00 C ATOM 1439 C GLY B 92 6.690 11.893 -5.745 1.00 0.00 C ATOM 1440 O GLY B 92 7.643 11.130 -5.590 1.00 0.00 O ATOM 0 H GLY B 92 4.377 13.137 -7.249 1.00 0.00 H new ATOM 0 HA2 GLY B 92 5.967 11.592 -7.734 1.00 0.00 H new ATOM 0 HA3 GLY B 92 7.228 12.802 -7.604 1.00 0.00 H new ATOM 1444 N HIS B 93 5.932 12.313 -4.741 1.00 0.00 N ATOM 1445 CA HIS B 93 6.148 11.837 -3.388 1.00 0.00 C ATOM 1446 C HIS B 93 5.482 10.477 -3.240 1.00 0.00 C ATOM 1447 O HIS B 93 4.263 10.360 -3.378 1.00 0.00 O ATOM 1448 CB HIS B 93 5.574 12.843 -2.380 1.00 0.00 C ATOM 1449 CG HIS B 93 6.071 12.669 -0.973 1.00 0.00 C ATOM 1450 ND1 HIS B 93 5.244 12.687 0.129 1.00 0.00 N ATOM 1451 CD2 HIS B 93 7.328 12.509 -0.490 1.00 0.00 C ATOM 1452 CE1 HIS B 93 5.966 12.547 1.223 1.00 0.00 C ATOM 1453 NE2 HIS B 93 7.233 12.437 0.877 1.00 0.00 N ATOM 0 H HIS B 93 5.166 12.979 -4.840 1.00 0.00 H new ATOM 0 HA HIS B 93 7.215 11.738 -3.189 1.00 0.00 H new ATOM 0 HB2 HIS B 93 5.816 13.852 -2.715 1.00 0.00 H new ATOM 0 HB3 HIS B 93 4.487 12.759 -2.381 1.00 0.00 H new ATOM 0 HD1 HIS B 93 4.230 12.792 0.102 1.00 0.00 H new ATOM 0 HD2 HIS B 93 8.235 12.449 -1.073 1.00 0.00 H new ATOM 0 HE1 HIS B 93 5.584 12.526 2.233 1.00 0.00 H new ATOM 1462 N GLN B 94 6.282 9.455 -2.971 1.00 0.00 N ATOM 1463 CA GLN B 94 5.771 8.097 -2.896 1.00 0.00 C ATOM 1464 C GLN B 94 5.716 7.636 -1.451 1.00 0.00 C ATOM 1465 O GLN B 94 6.746 7.545 -0.782 1.00 0.00 O ATOM 1466 CB GLN B 94 6.668 7.150 -3.695 1.00 0.00 C ATOM 1467 CG GLN B 94 6.895 7.576 -5.136 1.00 0.00 C ATOM 1468 CD GLN B 94 7.930 6.716 -5.837 1.00 0.00 C ATOM 1469 OE1 GLN B 94 8.853 6.197 -5.208 1.00 0.00 O ATOM 1470 NE2 GLN B 94 7.789 6.563 -7.143 1.00 0.00 N ATOM 0 H GLN B 94 7.284 9.541 -2.802 1.00 0.00 H new ATOM 0 HA GLN B 94 4.766 8.084 -3.317 1.00 0.00 H new ATOM 0 HB2 GLN B 94 7.633 7.073 -3.194 1.00 0.00 H new ATOM 0 HB3 GLN B 94 6.224 6.154 -3.688 1.00 0.00 H new ATOM 0 HG2 GLN B 94 5.952 7.522 -5.681 1.00 0.00 H new ATOM 0 HG3 GLN B 94 7.217 8.617 -5.158 1.00 0.00 H new ATOM 0 HE21 GLN B 94 7.010 7.010 -7.628 1.00 0.00 H new ATOM 0 HE22 GLN B 94 8.459 5.998 -7.666 1.00 0.00 H new ATOM 1479 N GLU B 95 4.526 7.316 -0.988 1.00 0.00 N ATOM 1480 CA GLU B 95 4.342 6.861 0.376 1.00 0.00 C ATOM 1481 C GLU B 95 3.962 5.392 0.386 1.00 0.00 C ATOM 1482 O GLU B 95 3.002 4.987 -0.271 1.00 0.00 O ATOM 1483 CB GLU B 95 3.275 7.702 1.076 1.00 0.00 C ATOM 1484 CG GLU B 95 3.676 9.160 1.249 1.00 0.00 C ATOM 1485 CD GLU B 95 4.916 9.324 2.108 1.00 0.00 C ATOM 1486 OE1 GLU B 95 6.022 9.481 1.550 1.00 0.00 O ATOM 1487 OE2 GLU B 95 4.791 9.299 3.349 1.00 0.00 O ATOM 0 H GLU B 95 3.668 7.362 -1.538 1.00 0.00 H new ATOM 0 HA GLU B 95 5.279 6.980 0.919 1.00 0.00 H new ATOM 0 HB2 GLU B 95 2.349 7.652 0.503 1.00 0.00 H new ATOM 0 HB3 GLU B 95 3.067 7.271 2.055 1.00 0.00 H new ATOM 0 HG2 GLU B 95 3.856 9.603 0.269 1.00 0.00 H new ATOM 0 HG3 GLU B 95 2.850 9.709 1.700 1.00 0.00 H new ATOM 1494 N VAL B 96 4.729 4.596 1.110 1.00 0.00 N ATOM 1495 CA VAL B 96 4.496 3.166 1.168 1.00 0.00 C ATOM 1496 C VAL B 96 4.011 2.767 2.554 1.00 0.00 C ATOM 1497 O VAL B 96 4.784 2.753 3.515 1.00 0.00 O ATOM 1498 CB VAL B 96 5.775 2.370 0.827 1.00 0.00 C ATOM 1499 CG1 VAL B 96 5.483 0.877 0.768 1.00 0.00 C ATOM 1500 CG2 VAL B 96 6.379 2.854 -0.483 1.00 0.00 C ATOM 0 H VAL B 96 5.520 4.918 1.667 1.00 0.00 H new ATOM 0 HA VAL B 96 3.733 2.928 0.427 1.00 0.00 H new ATOM 0 HB VAL B 96 6.503 2.542 1.620 1.00 0.00 H new ATOM 0 HG11 VAL B 96 6.398 0.337 0.526 1.00 0.00 H new ATOM 0 HG12 VAL B 96 5.108 0.541 1.735 1.00 0.00 H new ATOM 0 HG13 VAL B 96 4.734 0.683 0.001 1.00 0.00 H new ATOM 0 HG21 VAL B 96 7.279 2.279 -0.703 1.00 0.00 H new ATOM 0 HG22 VAL B 96 5.657 2.720 -1.288 1.00 0.00 H new ATOM 0 HG23 VAL B 96 6.635 3.910 -0.397 1.00 0.00 H new ATOM 1510 N THR B 97 2.732 2.449 2.651 1.00 0.00 N ATOM 1511 CA THR B 97 2.145 2.020 3.905 1.00 0.00 C ATOM 1512 C THR B 97 2.029 0.500 3.935 1.00 0.00 C ATOM 1513 O THR B 97 1.265 -0.092 3.172 1.00 0.00 O ATOM 1514 CB THR B 97 0.759 2.653 4.116 1.00 0.00 C ATOM 1515 OG1 THR B 97 0.837 4.070 3.907 1.00 0.00 O ATOM 1516 CG2 THR B 97 0.247 2.377 5.520 1.00 0.00 C ATOM 0 H THR B 97 2.077 2.481 1.869 1.00 0.00 H new ATOM 0 HA THR B 97 2.798 2.350 4.713 1.00 0.00 H new ATOM 0 HB THR B 97 0.067 2.211 3.399 1.00 0.00 H new ATOM 0 HG1 THR B 97 -0.004 4.489 4.186 1.00 0.00 H new ATOM 0 HG21 THR B 97 -0.734 2.834 5.646 1.00 0.00 H new ATOM 0 HG22 THR B 97 0.168 1.301 5.674 1.00 0.00 H new ATOM 0 HG23 THR B 97 0.939 2.798 6.249 1.00 0.00 H new ATOM 1524 N ARG B 98 2.808 -0.125 4.801 1.00 0.00 N ATOM 1525 CA ARG B 98 2.847 -1.575 4.888 1.00 0.00 C ATOM 1526 C ARG B 98 1.830 -2.085 5.899 1.00 0.00 C ATOM 1527 O ARG B 98 1.556 -1.424 6.902 1.00 0.00 O ATOM 1528 CB ARG B 98 4.249 -2.033 5.276 1.00 0.00 C ATOM 1529 CG ARG B 98 5.320 -1.559 4.310 1.00 0.00 C ATOM 1530 CD ARG B 98 6.711 -1.837 4.842 1.00 0.00 C ATOM 1531 NE ARG B 98 6.985 -1.087 6.069 1.00 0.00 N ATOM 1532 CZ ARG B 98 8.151 -1.117 6.714 1.00 0.00 C ATOM 1533 NH1 ARG B 98 9.151 -1.860 6.255 1.00 0.00 N ATOM 1534 NH2 ARG B 98 8.319 -0.398 7.815 1.00 0.00 N ATOM 0 H ARG B 98 3.426 0.352 5.458 1.00 0.00 H new ATOM 0 HA ARG B 98 2.592 -1.987 3.912 1.00 0.00 H new ATOM 0 HB2 ARG B 98 4.481 -1.665 6.275 1.00 0.00 H new ATOM 0 HB3 ARG B 98 4.268 -3.122 5.325 1.00 0.00 H new ATOM 0 HG2 ARG B 98 5.191 -2.057 3.349 1.00 0.00 H new ATOM 0 HG3 ARG B 98 5.204 -0.490 4.133 1.00 0.00 H new ATOM 0 HD2 ARG B 98 6.819 -2.904 5.037 1.00 0.00 H new ATOM 0 HD3 ARG B 98 7.449 -1.575 4.084 1.00 0.00 H new ATOM 0 HE ARG B 98 6.239 -0.507 6.453 1.00 0.00 H new ATOM 0 HH11 ARG B 98 9.029 -2.411 5.405 1.00 0.00 H new ATOM 0 HH12 ARG B 98 10.042 -1.880 6.752 1.00 0.00 H new ATOM 0 HH21 ARG B 98 7.556 0.179 8.169 1.00 0.00 H new ATOM 0 HH22 ARG B 98 9.212 -0.421 8.308 1.00 0.00 H new ATOM 1548 N PHE B 99 1.278 -3.255 5.630 1.00 0.00 N ATOM 1549 CA PHE B 99 0.279 -3.851 6.502 1.00 0.00 C ATOM 1550 C PHE B 99 0.458 -5.364 6.560 1.00 0.00 C ATOM 1551 O PHE B 99 1.062 -5.966 5.666 1.00 0.00 O ATOM 1552 CB PHE B 99 -1.138 -3.488 6.031 1.00 0.00 C ATOM 1553 CG PHE B 99 -1.425 -3.828 4.590 1.00 0.00 C ATOM 1554 CD1 PHE B 99 -2.068 -5.008 4.255 1.00 0.00 C ATOM 1555 CD2 PHE B 99 -1.058 -2.960 3.572 1.00 0.00 C ATOM 1556 CE1 PHE B 99 -2.339 -5.316 2.936 1.00 0.00 C ATOM 1557 CE2 PHE B 99 -1.324 -3.265 2.251 1.00 0.00 C ATOM 1558 CZ PHE B 99 -1.965 -4.445 1.933 1.00 0.00 C ATOM 0 H PHE B 99 1.506 -3.815 4.809 1.00 0.00 H new ATOM 0 HA PHE B 99 0.415 -3.450 7.507 1.00 0.00 H new ATOM 0 HB2 PHE B 99 -1.861 -4.004 6.664 1.00 0.00 H new ATOM 0 HB3 PHE B 99 -1.293 -2.419 6.177 1.00 0.00 H new ATOM 0 HD1 PHE B 99 -2.361 -5.696 5.034 1.00 0.00 H new ATOM 0 HD2 PHE B 99 -0.558 -2.034 3.815 1.00 0.00 H new ATOM 0 HE1 PHE B 99 -2.844 -6.239 2.690 1.00 0.00 H new ATOM 0 HE2 PHE B 99 -1.031 -2.581 1.468 1.00 0.00 H new ATOM 0 HZ PHE B 99 -2.174 -4.686 0.901 1.00 0.00 H new ATOM 1568 N ASP B 100 -0.059 -5.968 7.617 1.00 0.00 N ATOM 1569 CA ASP B 100 0.072 -7.401 7.835 1.00 0.00 C ATOM 1570 C ASP B 100 -1.273 -8.077 7.620 1.00 0.00 C ATOM 1571 O ASP B 100 -2.289 -7.631 8.155 1.00 0.00 O ATOM 1572 CB ASP B 100 0.575 -7.667 9.257 1.00 0.00 C ATOM 1573 CG ASP B 100 0.832 -9.135 9.534 1.00 0.00 C ATOM 1574 OD1 ASP B 100 -0.132 -9.876 9.825 1.00 0.00 O ATOM 1575 OD2 ASP B 100 2.006 -9.551 9.482 1.00 0.00 O ATOM 0 H ASP B 100 -0.580 -5.482 8.347 1.00 0.00 H new ATOM 0 HA ASP B 100 0.792 -7.809 7.125 1.00 0.00 H new ATOM 0 HB2 ASP B 100 1.495 -7.106 9.421 1.00 0.00 H new ATOM 0 HB3 ASP B 100 -0.158 -7.292 9.971 1.00 0.00 H new ATOM 1580 N PHE B 101 -1.286 -9.146 6.837 1.00 0.00 N ATOM 1581 CA PHE B 101 -2.528 -9.844 6.538 1.00 0.00 C ATOM 1582 C PHE B 101 -2.260 -11.293 6.160 1.00 0.00 C ATOM 1583 O PHE B 101 -1.117 -11.680 5.910 1.00 0.00 O ATOM 1584 CB PHE B 101 -3.285 -9.137 5.405 1.00 0.00 C ATOM 1585 CG PHE B 101 -2.600 -9.205 4.064 1.00 0.00 C ATOM 1586 CD1 PHE B 101 -3.136 -9.970 3.039 1.00 0.00 C ATOM 1587 CD2 PHE B 101 -1.431 -8.501 3.825 1.00 0.00 C ATOM 1588 CE1 PHE B 101 -2.518 -10.029 1.804 1.00 0.00 C ATOM 1589 CE2 PHE B 101 -0.810 -8.561 2.592 1.00 0.00 C ATOM 1590 CZ PHE B 101 -1.354 -9.324 1.581 1.00 0.00 C ATOM 0 H PHE B 101 -0.456 -9.547 6.400 1.00 0.00 H new ATOM 0 HA PHE B 101 -3.145 -9.830 7.437 1.00 0.00 H new ATOM 0 HB2 PHE B 101 -4.277 -9.579 5.316 1.00 0.00 H new ATOM 0 HB3 PHE B 101 -3.425 -8.090 5.675 1.00 0.00 H new ATOM 0 HD1 PHE B 101 -4.046 -10.526 3.208 1.00 0.00 H new ATOM 0 HD2 PHE B 101 -1.000 -7.899 4.611 1.00 0.00 H new ATOM 0 HE1 PHE B 101 -2.947 -10.627 1.014 1.00 0.00 H new ATOM 0 HE2 PHE B 101 0.103 -8.010 2.420 1.00 0.00 H new ATOM 0 HZ PHE B 101 -0.870 -9.370 0.617 1.00 0.00 H new ATOM 1600 N THR B 102 -3.319 -12.086 6.115 1.00 0.00 N ATOM 1601 CA THR B 102 -3.206 -13.488 5.765 1.00 0.00 C ATOM 1602 C THR B 102 -4.549 -14.031 5.288 1.00 0.00 C ATOM 1603 O THR B 102 -5.606 -13.601 5.751 1.00 0.00 O ATOM 1604 CB THR B 102 -2.712 -14.330 6.966 1.00 0.00 C ATOM 1605 OG1 THR B 102 -2.521 -15.694 6.572 1.00 0.00 O ATOM 1606 CG2 THR B 102 -3.698 -14.275 8.127 1.00 0.00 C ATOM 0 H THR B 102 -4.270 -11.778 6.318 1.00 0.00 H new ATOM 0 HA THR B 102 -2.475 -13.565 4.960 1.00 0.00 H new ATOM 0 HB THR B 102 -1.763 -13.906 7.296 1.00 0.00 H new ATOM 0 HG1 THR B 102 -2.210 -15.726 5.643 1.00 0.00 H new ATOM 0 HG21 THR B 102 -3.321 -14.877 8.954 1.00 0.00 H new ATOM 0 HG22 THR B 102 -3.817 -13.242 8.455 1.00 0.00 H new ATOM 0 HG23 THR B 102 -4.663 -14.667 7.804 1.00 0.00 H new ATOM 1614 N THR B 103 -4.501 -14.949 4.341 1.00 0.00 N ATOM 1615 CA THR B 103 -5.684 -15.666 3.917 1.00 0.00 C ATOM 1616 C THR B 103 -5.972 -16.799 4.896 1.00 0.00 C ATOM 1617 O THR B 103 -5.405 -17.890 4.789 1.00 0.00 O ATOM 1618 CB THR B 103 -5.494 -16.224 2.501 1.00 0.00 C ATOM 1619 OG1 THR B 103 -4.142 -15.990 2.074 1.00 0.00 O ATOM 1620 CG2 THR B 103 -6.465 -15.573 1.528 1.00 0.00 C ATOM 0 H THR B 103 -3.648 -15.215 3.849 1.00 0.00 H new ATOM 0 HA THR B 103 -6.530 -14.979 3.904 1.00 0.00 H new ATOM 0 HB THR B 103 -5.694 -17.295 2.516 1.00 0.00 H new ATOM 0 HG1 THR B 103 -3.686 -16.848 1.947 1.00 0.00 H new ATOM 0 HG21 THR B 103 -6.311 -15.985 0.530 1.00 0.00 H new ATOM 0 HG22 THR B 103 -7.488 -15.770 1.848 1.00 0.00 H new ATOM 0 HG23 THR B 103 -6.292 -14.497 1.507 1.00 0.00 H new ATOM 1628 N THR B 104 -6.814 -16.516 5.876 1.00 0.00 N ATOM 1629 CA THR B 104 -7.128 -17.478 6.918 1.00 0.00 C ATOM 1630 C THR B 104 -8.421 -18.226 6.596 1.00 0.00 C ATOM 1631 O THR B 104 -9.405 -17.632 6.149 1.00 0.00 O ATOM 1632 CB THR B 104 -7.230 -16.785 8.299 1.00 0.00 C ATOM 1633 OG1 THR B 104 -7.566 -17.735 9.319 1.00 0.00 O ATOM 1634 CG2 THR B 104 -8.259 -15.661 8.279 1.00 0.00 C ATOM 0 H THR B 104 -7.295 -15.622 5.971 1.00 0.00 H new ATOM 0 HA THR B 104 -6.315 -18.203 6.960 1.00 0.00 H new ATOM 0 HB THR B 104 -6.254 -16.354 8.523 1.00 0.00 H new ATOM 0 HG1 THR B 104 -8.517 -17.653 9.542 1.00 0.00 H new ATOM 0 HG21 THR B 104 -8.307 -15.194 9.263 1.00 0.00 H new ATOM 0 HG22 THR B 104 -7.970 -14.916 7.538 1.00 0.00 H new ATOM 0 HG23 THR B 104 -9.237 -16.068 8.022 1.00 0.00 H new ATOM 1642 N SER B 105 -8.397 -19.533 6.804 1.00 0.00 N ATOM 1643 CA SER B 105 -9.539 -20.381 6.521 1.00 0.00 C ATOM 1644 C SER B 105 -10.151 -20.914 7.813 1.00 0.00 C ATOM 1645 O SER B 105 -11.341 -20.728 8.082 1.00 0.00 O ATOM 1646 CB SER B 105 -9.098 -21.533 5.616 1.00 0.00 C ATOM 1647 OG SER B 105 -7.899 -22.123 6.098 1.00 0.00 O ATOM 0 H SER B 105 -7.587 -20.032 7.172 1.00 0.00 H new ATOM 0 HA SER B 105 -10.303 -19.795 6.011 1.00 0.00 H new ATOM 0 HB2 SER B 105 -9.885 -22.285 5.568 1.00 0.00 H new ATOM 0 HB3 SER B 105 -8.946 -21.166 4.601 1.00 0.00 H new ATOM 0 HG SER B 105 -7.635 -22.858 5.506 1.00 0.00 H new ATOM 1653 N THR B 106 -9.331 -21.570 8.619 1.00 0.00 N ATOM 1654 CA THR B 106 -9.784 -22.124 9.882 1.00 0.00 C ATOM 1655 C THR B 106 -9.744 -21.076 10.989 1.00 0.00 C ATOM 1656 O THR B 106 -8.940 -21.155 11.919 1.00 0.00 O ATOM 1657 CB THR B 106 -8.944 -23.353 10.283 1.00 0.00 C ATOM 1658 OG1 THR B 106 -7.547 -23.085 10.094 1.00 0.00 O ATOM 1659 CG2 THR B 106 -9.347 -24.571 9.464 1.00 0.00 C ATOM 0 H THR B 106 -8.344 -21.731 8.418 1.00 0.00 H new ATOM 0 HA THR B 106 -10.818 -22.442 9.746 1.00 0.00 H new ATOM 0 HB THR B 106 -9.130 -23.561 11.337 1.00 0.00 H new ATOM 0 HG1 THR B 106 -7.286 -22.312 10.636 1.00 0.00 H new ATOM 0 HG21 THR B 106 -8.742 -25.427 9.763 1.00 0.00 H new ATOM 0 HG22 THR B 106 -10.400 -24.793 9.636 1.00 0.00 H new ATOM 0 HG23 THR B 106 -9.188 -24.366 8.405 1.00 0.00 H new ATOM 1667 N SER B 107 -10.610 -20.082 10.872 1.00 0.00 N ATOM 1668 CA SER B 107 -10.702 -19.024 11.863 1.00 0.00 C ATOM 1669 C SER B 107 -11.793 -19.350 12.882 1.00 0.00 C ATOM 1670 O SER B 107 -12.858 -18.730 12.885 1.00 0.00 O ATOM 1671 CB SER B 107 -11.014 -17.696 11.177 1.00 0.00 C ATOM 1672 OG SER B 107 -10.262 -17.543 9.983 1.00 0.00 O ATOM 0 H SER B 107 -11.263 -19.987 10.094 1.00 0.00 H new ATOM 0 HA SER B 107 -9.747 -18.944 12.382 1.00 0.00 H new ATOM 0 HB2 SER B 107 -12.078 -17.644 10.948 1.00 0.00 H new ATOM 0 HB3 SER B 107 -10.793 -16.873 11.856 1.00 0.00 H new ATOM 0 HG SER B 107 -10.691 -16.874 9.410 1.00 0.00 H new ATOM 1678 N THR B 108 -11.536 -20.329 13.736 1.00 0.00 N ATOM 1679 CA THR B 108 -12.512 -20.730 14.736 1.00 0.00 C ATOM 1680 C THR B 108 -11.841 -20.952 16.102 1.00 0.00 C ATOM 1681 O THR B 108 -11.627 -22.084 16.541 1.00 0.00 O ATOM 1682 CB THR B 108 -13.295 -21.990 14.274 1.00 0.00 C ATOM 1683 OG1 THR B 108 -14.182 -22.448 15.301 1.00 0.00 O ATOM 1684 CG2 THR B 108 -12.357 -23.117 13.857 1.00 0.00 C ATOM 0 H THR B 108 -10.664 -20.858 13.757 1.00 0.00 H new ATOM 0 HA THR B 108 -13.232 -19.920 14.852 1.00 0.00 H new ATOM 0 HB THR B 108 -13.882 -21.698 13.403 1.00 0.00 H new ATOM 0 HG1 THR B 108 -14.665 -23.241 14.987 1.00 0.00 H new ATOM 0 HG21 THR B 108 -12.943 -23.980 13.541 1.00 0.00 H new ATOM 0 HG22 THR B 108 -11.730 -22.782 13.031 1.00 0.00 H new ATOM 0 HG23 THR B 108 -11.726 -23.396 14.701 1.00 0.00 H new ATOM 1692 N PRO B 109 -11.484 -19.854 16.790 1.00 0.00 N ATOM 1693 CA PRO B 109 -10.866 -19.909 18.115 1.00 0.00 C ATOM 1694 C PRO B 109 -11.867 -20.326 19.189 1.00 0.00 C ATOM 1695 O PRO B 109 -13.080 -20.264 18.980 1.00 0.00 O ATOM 1696 CB PRO B 109 -10.382 -18.469 18.359 1.00 0.00 C ATOM 1697 CG PRO B 109 -10.537 -17.766 17.052 1.00 0.00 C ATOM 1698 CD PRO B 109 -11.649 -18.471 16.337 1.00 0.00 C ATOM 0 HA PRO B 109 -10.063 -20.645 18.161 1.00 0.00 H new ATOM 0 HB2 PRO B 109 -10.971 -17.984 19.137 1.00 0.00 H new ATOM 0 HB3 PRO B 109 -9.344 -18.455 18.691 1.00 0.00 H new ATOM 0 HG2 PRO B 109 -10.774 -16.713 17.201 1.00 0.00 H new ATOM 0 HG3 PRO B 109 -9.613 -17.807 16.475 1.00 0.00 H new ATOM 0 HD2 PRO B 109 -12.625 -18.069 16.607 1.00 0.00 H new ATOM 0 HD3 PRO B 109 -11.556 -18.384 15.254 1.00 0.00 H new ATOM 1706 N GLY B 110 -11.359 -20.743 20.338 1.00 0.00 N ATOM 1707 CA GLY B 110 -12.221 -21.227 21.397 1.00 0.00 C ATOM 1708 C GLY B 110 -12.353 -22.731 21.343 1.00 0.00 C ATOM 1709 O GLY B 110 -13.439 -23.282 21.532 1.00 0.00 O ATOM 0 H GLY B 110 -10.363 -20.755 20.557 1.00 0.00 H new ATOM 0 HA2 GLY B 110 -11.817 -20.928 22.364 1.00 0.00 H new ATOM 0 HA3 GLY B 110 -13.206 -20.768 21.307 1.00 0.00 H new ATOM 1713 N SER B 111 -11.232 -23.390 21.088 1.00 0.00 N ATOM 1714 CA SER B 111 -11.196 -24.829 20.874 1.00 0.00 C ATOM 1715 C SER B 111 -11.692 -25.597 22.101 1.00 0.00 C ATOM 1716 O SER B 111 -12.205 -26.708 21.979 1.00 0.00 O ATOM 1717 CB SER B 111 -9.768 -25.256 20.513 1.00 0.00 C ATOM 1718 OG SER B 111 -9.718 -26.604 20.081 1.00 0.00 O ATOM 0 H SER B 111 -10.319 -22.940 21.024 1.00 0.00 H new ATOM 0 HA SER B 111 -11.868 -25.070 20.050 1.00 0.00 H new ATOM 0 HB2 SER B 111 -9.382 -24.607 19.727 1.00 0.00 H new ATOM 0 HB3 SER B 111 -9.120 -25.127 21.380 1.00 0.00 H new ATOM 0 HG SER B 111 -8.794 -26.842 19.858 1.00 0.00 H new ATOM 1724 N ARG B 112 -11.554 -24.997 23.279 1.00 0.00 N ATOM 1725 CA ARG B 112 -11.988 -25.641 24.513 1.00 0.00 C ATOM 1726 C ARG B 112 -13.508 -25.733 24.579 1.00 0.00 C ATOM 1727 O ARG B 112 -14.061 -26.752 24.995 1.00 0.00 O ATOM 1728 CB ARG B 112 -11.471 -24.882 25.735 1.00 0.00 C ATOM 1729 CG ARG B 112 -9.966 -24.956 25.922 1.00 0.00 C ATOM 1730 CD ARG B 112 -9.511 -26.373 26.225 1.00 0.00 C ATOM 1731 NE ARG B 112 -8.096 -26.426 26.587 1.00 0.00 N ATOM 1732 CZ ARG B 112 -7.456 -27.544 26.930 1.00 0.00 C ATOM 1733 NH1 ARG B 112 -8.094 -28.706 26.927 1.00 0.00 N ATOM 1734 NH2 ARG B 112 -6.175 -27.501 27.270 1.00 0.00 N ATOM 0 H ARG B 112 -11.147 -24.070 23.405 1.00 0.00 H new ATOM 0 HA ARG B 112 -11.573 -26.649 24.517 1.00 0.00 H new ATOM 0 HB2 ARG B 112 -11.764 -23.836 25.650 1.00 0.00 H new ATOM 0 HB3 ARG B 112 -11.957 -25.278 26.627 1.00 0.00 H new ATOM 0 HG2 ARG B 112 -9.468 -24.598 25.021 1.00 0.00 H new ATOM 0 HG3 ARG B 112 -9.667 -24.295 26.735 1.00 0.00 H new ATOM 0 HD2 ARG B 112 -10.110 -26.780 27.040 1.00 0.00 H new ATOM 0 HD3 ARG B 112 -9.687 -27.005 25.354 1.00 0.00 H new ATOM 0 HE ARG B 112 -7.566 -25.555 26.577 1.00 0.00 H new ATOM 0 HH11 ARG B 112 -9.078 -28.747 26.662 1.00 0.00 H new ATOM 0 HH12 ARG B 112 -7.601 -29.559 27.190 1.00 0.00 H new ATOM 0 HH21 ARG B 112 -5.677 -26.611 27.270 1.00 0.00 H new ATOM 0 HH22 ARG B 112 -5.688 -28.358 27.532 1.00 0.00 H new ATOM 1748 N SER B 113 -14.180 -24.673 24.158 1.00 0.00 N ATOM 1749 CA SER B 113 -15.630 -24.613 24.244 1.00 0.00 C ATOM 1750 C SER B 113 -16.290 -25.218 23.008 1.00 0.00 C ATOM 1751 O SER B 113 -17.445 -25.641 23.057 1.00 0.00 O ATOM 1752 CB SER B 113 -16.077 -23.167 24.442 1.00 0.00 C ATOM 1753 OG SER B 113 -15.450 -22.603 25.583 1.00 0.00 O ATOM 0 H SER B 113 -13.745 -23.844 23.754 1.00 0.00 H new ATOM 0 HA SER B 113 -15.946 -25.205 25.103 1.00 0.00 H new ATOM 0 HB2 SER B 113 -15.830 -22.580 23.557 1.00 0.00 H new ATOM 0 HB3 SER B 113 -17.160 -23.128 24.559 1.00 0.00 H new ATOM 0 HG SER B 113 -15.746 -21.676 25.694 1.00 0.00 H new ATOM 1759 N HIS B 114 -15.555 -25.264 21.901 1.00 0.00 N ATOM 1760 CA HIS B 114 -16.071 -25.869 20.679 1.00 0.00 C ATOM 1761 C HIS B 114 -16.118 -27.383 20.816 1.00 0.00 C ATOM 1762 O HIS B 114 -15.102 -28.065 20.674 1.00 0.00 O ATOM 1763 CB HIS B 114 -15.227 -25.481 19.459 1.00 0.00 C ATOM 1764 CG HIS B 114 -15.387 -24.054 19.031 1.00 0.00 C ATOM 1765 ND1 HIS B 114 -16.600 -23.401 19.013 1.00 0.00 N ATOM 1766 CD2 HIS B 114 -14.474 -23.150 18.610 1.00 0.00 C ATOM 1767 CE1 HIS B 114 -16.423 -22.161 18.598 1.00 0.00 C ATOM 1768 NE2 HIS B 114 -15.141 -21.981 18.348 1.00 0.00 N ATOM 0 H HIS B 114 -14.608 -24.893 21.825 1.00 0.00 H new ATOM 0 HA HIS B 114 -17.081 -25.490 20.526 1.00 0.00 H new ATOM 0 HB2 HIS B 114 -14.177 -25.666 19.684 1.00 0.00 H new ATOM 0 HB3 HIS B 114 -15.493 -26.131 18.625 1.00 0.00 H new ATOM 0 HD2 HIS B 114 -13.413 -23.318 18.500 1.00 0.00 H new ATOM 0 HE1 HIS B 114 -17.198 -21.418 18.482 1.00 0.00 H new ATOM 0 HE2 HIS B 114 -14.716 -21.116 18.015 1.00 0.00 H new ATOM 1777 N HIS B 115 -17.305 -27.902 21.091 1.00 0.00 N ATOM 1778 CA HIS B 115 -17.497 -29.333 21.260 1.00 0.00 C ATOM 1779 C HIS B 115 -17.924 -29.959 19.935 1.00 0.00 C ATOM 1780 O HIS B 115 -19.062 -30.404 19.778 1.00 0.00 O ATOM 1781 CB HIS B 115 -18.548 -29.606 22.347 1.00 0.00 C ATOM 1782 CG HIS B 115 -18.646 -31.047 22.755 1.00 0.00 C ATOM 1783 ND1 HIS B 115 -19.509 -31.946 22.161 1.00 0.00 N ATOM 1784 CD2 HIS B 115 -17.979 -31.745 23.705 1.00 0.00 C ATOM 1785 CE1 HIS B 115 -19.364 -33.129 22.725 1.00 0.00 C ATOM 1786 NE2 HIS B 115 -18.444 -33.035 23.663 1.00 0.00 N ATOM 0 H HIS B 115 -18.155 -27.349 21.202 1.00 0.00 H new ATOM 0 HA HIS B 115 -16.555 -29.782 21.574 1.00 0.00 H new ATOM 0 HB2 HIS B 115 -18.311 -29.006 23.226 1.00 0.00 H new ATOM 0 HB3 HIS B 115 -19.522 -29.274 21.987 1.00 0.00 H new ATOM 0 HD1 HIS B 115 -20.157 -31.729 21.404 1.00 0.00 H new ATOM 0 HD2 HIS B 115 -17.222 -31.358 24.371 1.00 0.00 H new ATOM 0 HE1 HIS B 115 -19.908 -34.024 22.462 1.00 0.00 H new ATOM 1795 N HIS B 116 -17.011 -29.967 18.976 1.00 0.00 N ATOM 1796 CA HIS B 116 -17.271 -30.589 17.687 1.00 0.00 C ATOM 1797 C HIS B 116 -16.621 -31.964 17.635 1.00 0.00 C ATOM 1798 O HIS B 116 -17.263 -32.971 17.944 1.00 0.00 O ATOM 1799 CB HIS B 116 -16.751 -29.728 16.527 1.00 0.00 C ATOM 1800 CG HIS B 116 -17.554 -28.492 16.253 1.00 0.00 C ATOM 1801 ND1 HIS B 116 -18.317 -28.331 15.118 1.00 0.00 N ATOM 1802 CD2 HIS B 116 -17.678 -27.338 16.950 1.00 0.00 C ATOM 1803 CE1 HIS B 116 -18.871 -27.134 15.128 1.00 0.00 C ATOM 1804 NE2 HIS B 116 -18.501 -26.507 16.228 1.00 0.00 N ATOM 0 H HIS B 116 -16.084 -29.550 19.066 1.00 0.00 H new ATOM 0 HA HIS B 116 -18.351 -30.686 17.577 1.00 0.00 H new ATOM 0 HB2 HIS B 116 -15.723 -29.436 16.742 1.00 0.00 H new ATOM 0 HB3 HIS B 116 -16.727 -30.337 15.623 1.00 0.00 H new ATOM 0 HD2 HIS B 116 -17.215 -27.112 17.899 1.00 0.00 H new ATOM 0 HE1 HIS B 116 -19.520 -26.734 14.363 1.00 0.00 H new ATOM 0 HE2 HIS B 116 -18.779 -25.563 16.498 1.00 0.00 H new ATOM 1813 N HIS B 117 -15.334 -31.985 17.276 1.00 0.00 N ATOM 1814 CA HIS B 117 -14.560 -33.223 17.158 1.00 0.00 C ATOM 1815 C HIS B 117 -15.293 -34.248 16.303 1.00 0.00 C ATOM 1816 O HIS B 117 -15.246 -35.449 16.573 1.00 0.00 O ATOM 1817 CB HIS B 117 -14.251 -33.817 18.537 1.00 0.00 C ATOM 1818 CG HIS B 117 -13.438 -32.919 19.414 1.00 0.00 C ATOM 1819 ND1 HIS B 117 -13.820 -32.566 20.689 1.00 0.00 N ATOM 1820 CD2 HIS B 117 -12.250 -32.309 19.199 1.00 0.00 C ATOM 1821 CE1 HIS B 117 -12.906 -31.778 21.218 1.00 0.00 C ATOM 1822 NE2 HIS B 117 -11.940 -31.605 20.335 1.00 0.00 N ATOM 0 H HIS B 117 -14.800 -31.144 17.059 1.00 0.00 H new ATOM 0 HA HIS B 117 -13.618 -32.972 16.670 1.00 0.00 H new ATOM 0 HB2 HIS B 117 -15.189 -34.049 19.041 1.00 0.00 H new ATOM 0 HB3 HIS B 117 -13.719 -34.759 18.405 1.00 0.00 H new ATOM 0 HD2 HIS B 117 -11.655 -32.366 18.299 1.00 0.00 H new ATOM 0 HE1 HIS B 117 -12.941 -31.346 22.207 1.00 0.00 H new ATOM 0 HE2 HIS B 117 -11.102 -31.041 20.474 1.00 0.00 H new ATOM 1831 N HIS B 118 -15.969 -33.769 15.273 1.00 0.00 N ATOM 1832 CA HIS B 118 -16.770 -34.630 14.424 1.00 0.00 C ATOM 1833 C HIS B 118 -16.181 -34.682 13.024 1.00 0.00 C ATOM 1834 O HIS B 118 -15.772 -33.659 12.475 1.00 0.00 O ATOM 1835 CB HIS B 118 -18.218 -34.130 14.378 1.00 0.00 C ATOM 1836 CG HIS B 118 -19.145 -35.036 13.624 1.00 0.00 C ATOM 1837 ND1 HIS B 118 -19.585 -34.771 12.346 1.00 0.00 N ATOM 1838 CD2 HIS B 118 -19.712 -36.214 13.977 1.00 0.00 C ATOM 1839 CE1 HIS B 118 -20.381 -35.743 11.945 1.00 0.00 C ATOM 1840 NE2 HIS B 118 -20.474 -36.631 12.916 1.00 0.00 N ATOM 0 H HIS B 118 -15.978 -32.785 15.005 1.00 0.00 H new ATOM 0 HA HIS B 118 -16.764 -35.637 14.840 1.00 0.00 H new ATOM 0 HB2 HIS B 118 -18.586 -34.015 15.398 1.00 0.00 H new ATOM 0 HB3 HIS B 118 -18.237 -33.142 13.919 1.00 0.00 H new ATOM 0 HD2 HIS B 118 -19.587 -36.729 14.918 1.00 0.00 H new ATOM 0 HE1 HIS B 118 -20.873 -35.802 10.985 1.00 0.00 H new ATOM 0 HE2 HIS B 118 -21.024 -37.489 12.883 1.00 0.00 H new ATOM 1849 N HIS B 119 -16.126 -35.876 12.461 1.00 0.00 N ATOM 1850 CA HIS B 119 -15.598 -36.059 11.120 1.00 0.00 C ATOM 1851 C HIS B 119 -16.691 -35.799 10.090 1.00 0.00 C ATOM 1852 O HIS B 119 -16.751 -34.672 9.556 1.00 0.00 O ATOM 1853 CB HIS B 119 -15.028 -37.473 10.967 1.00 0.00 C ATOM 1854 CG HIS B 119 -14.411 -37.737 9.629 1.00 0.00 C ATOM 1855 ND1 HIS B 119 -14.963 -38.595 8.704 1.00 0.00 N ATOM 1856 CD2 HIS B 119 -13.270 -37.269 9.070 1.00 0.00 C ATOM 1857 CE1 HIS B 119 -14.190 -38.643 7.636 1.00 0.00 C ATOM 1858 NE2 HIS B 119 -13.157 -37.846 7.831 1.00 0.00 N ATOM 1859 OXT HIS B 119 -17.499 -36.713 9.836 1.00 0.00 O ATOM 0 H HIS B 119 -16.441 -36.735 12.912 1.00 0.00 H new ATOM 0 HA HIS B 119 -14.791 -35.346 10.952 1.00 0.00 H new ATOM 0 HB2 HIS B 119 -14.278 -37.637 11.741 1.00 0.00 H new ATOM 0 HB3 HIS B 119 -15.826 -38.196 11.137 1.00 0.00 H new ATOM 0 HD2 HIS B 119 -12.578 -36.571 9.517 1.00 0.00 H new ATOM 0 HE1 HIS B 119 -14.372 -39.235 6.751 1.00 0.00 H new ATOM 0 HE2 HIS B 119 -12.398 -37.685 7.169 1.00 0.00 H new TER 1868 HIS B 119