USER MOD reduce.3.24.130724 H: found=0, std=0, add=1177, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1177 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 130 THR OG1 : rot 180:sc= -0.252 USER MOD Set 1.2: A 135 LYS NZ :NH3+ 173:sc= -0.976 (180deg=-1.23) USER MOD Set 2.1: A 113 MET CE :methyl -172:sc= -3.86! (180deg=-2.76!) USER MOD Set 2.2: A 115 LYS NZ :NH3+ 159:sc= -3.81! (180deg=-5.17!) USER MOD Set 3.1: A 80 TYR OH : rot -89:sc= 1.17 USER MOD Set 3.2: A 89 GLN : amide:sc= -0.448 K(o=0.72,f=-0.39) USER MOD Set 4.1: A 47 SER OG : rot -57:sc= -0.924 USER MOD Set 4.2: A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 9 HIS : no HD1:sc= -0.446 X(o=-0.45,f=-0.068) USER MOD Single : A 10 MET CE :methyl 137:sc= -1.28 (180deg=-3.23!) USER MOD Single : A 19 CYS SG : rot 57:sc= 0.326 USER MOD Single : A 20 TYR OH : rot 130:sc= -3.74! USER MOD Single : A 21 CYS SG : rot 180:sc= -0.25 USER MOD Single : A 23 SER OG : rot -132:sc= 1.13 USER MOD Single : A 26 GLN : amide:sc= -0.0135 K(o=-0.014,f=-1.7!) USER MOD Single : A 29 GLN :FLIP amide:sc= -0.121 F(o=-0.79,f=-0.12) USER MOD Single : A 31 MET CE :methyl 145:sc= -0.819 (180deg=-1.95!) USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 GLN : amide:sc= -0.0494 K(o=-0.049,f=-2) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0.00198 USER MOD Single : A 39 ASN : amide:sc=-0.00192 K(o=-0.0019,f=-1.4) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ 156:sc= 0.122 (180deg=0.0715) USER MOD Single : A 45 CYS SG : rot 126:sc= -1.72 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 CYS SG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ -177:sc= 0.00236 (180deg=-0.003) USER MOD Single : A 69 CYS SG : rot 140:sc= -1.59 USER MOD Single : A 72 MET CE :methyl -121:sc= -0.379 (180deg=-3.86!) USER MOD Single : A 77 SER OG : rot -160:sc= -1.44 USER MOD Single : A 82 GLN : amide:sc= -1.3 K(o=-1.3,f=-2.2) USER MOD Single : A 83 SER OG : rot -58:sc= 0.303 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 CYS SG : rot -21:sc= -1.99! USER MOD Single : A 90 THR OG1 : rot 77:sc= 0.967 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot -60:sc= 0.377 USER MOD Single : A 97 SER OG : rot 180:sc= -0.0889 USER MOD Single : A 101 HIS :FLIP no HD1:sc= -0.188 F(o=-0.79,f=-0.19) USER MOD Single : A 102 GLN : amide:sc= -5.78! C(o=-5.8!,f=-6.9!) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 LYS NZ :NH3+ 177:sc= -1.29 (180deg=-1.32) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= -0.0216 (180deg=-0.0216) USER MOD Single : A 114 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00943) USER MOD Single : A 119 SER OG : rot 56:sc= 0.274 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 CYS SG : rot 180:sc= -0.0889 USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 ASN : amide:sc= -0.197 X(o=-0.2,f=0) USER MOD Single : A 133 CYS SG : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 SER OG : rot -125:sc= -0.669 USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A 9 -7.056 -12.826 -16.020 1.00 0.00 N ATOM 2 CA HIS A 9 -6.786 -11.693 -15.145 1.00 0.00 C ATOM 3 C HIS A 9 -6.732 -12.132 -13.685 1.00 0.00 C ATOM 4 O HIS A 9 -7.346 -13.127 -13.302 1.00 0.00 O ATOM 5 CB HIS A 9 -7.859 -10.618 -15.325 1.00 0.00 C ATOM 6 CG HIS A 9 -7.364 -9.230 -15.066 1.00 0.00 C ATOM 7 ND1 HIS A 9 -8.194 -8.130 -15.023 1.00 0.00 N ATOM 8 CD2 HIS A 9 -6.114 -8.764 -14.831 1.00 0.00 C ATOM 9 CE1 HIS A 9 -7.477 -7.047 -14.776 1.00 0.00 C ATOM 10 NE2 HIS A 9 -6.212 -7.406 -14.655 1.00 0.00 N ATOM 0 HA HIS A 9 -5.815 -11.279 -15.417 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -8.249 -10.672 -16.341 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -8.690 -10.830 -14.653 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -5.209 -9.351 -14.790 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -7.860 -6.041 -14.688 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -5.433 -6.776 -14.462 1.00 0.00 H new ATOM 19 N MET A 10 -5.993 -11.380 -12.876 1.00 0.00 N ATOM 20 CA MET A 10 -5.857 -11.688 -11.456 1.00 0.00 C ATOM 21 C MET A 10 -5.211 -13.056 -11.251 1.00 0.00 C ATOM 22 O MET A 10 -5.896 -14.038 -10.965 1.00 0.00 O ATOM 23 CB MET A 10 -7.224 -11.649 -10.769 1.00 0.00 C ATOM 24 CG MET A 10 -7.160 -11.919 -9.274 1.00 0.00 C ATOM 25 SD MET A 10 -8.717 -12.548 -8.615 1.00 0.00 S ATOM 26 CE MET A 10 -9.472 -11.033 -8.027 1.00 0.00 C ATOM 0 H MET A 10 -5.479 -10.553 -13.179 1.00 0.00 H new ATOM 0 HA MET A 10 -5.211 -10.932 -11.009 1.00 0.00 H new ATOM 0 HB2 MET A 10 -7.677 -10.672 -10.934 1.00 0.00 H new ATOM 0 HB3 MET A 10 -7.877 -12.386 -11.236 1.00 0.00 H new ATOM 0 HG2 MET A 10 -6.367 -12.639 -9.072 1.00 0.00 H new ATOM 0 HG3 MET A 10 -6.895 -10.999 -8.753 1.00 0.00 H new ATOM 0 HE1 MET A 10 -10.527 -11.022 -8.301 1.00 0.00 H new ATOM 0 HE2 MET A 10 -9.378 -10.977 -6.943 1.00 0.00 H new ATOM 0 HE3 MET A 10 -8.971 -10.177 -8.479 1.00 0.00 H new ATOM 36 N PRO A 11 -3.876 -13.138 -11.394 1.00 0.00 N ATOM 37 CA PRO A 11 -3.139 -14.394 -11.221 1.00 0.00 C ATOM 38 C PRO A 11 -3.399 -15.034 -9.861 1.00 0.00 C ATOM 39 O PRO A 11 -4.337 -14.662 -9.158 1.00 0.00 O ATOM 40 CB PRO A 11 -1.671 -13.970 -11.338 1.00 0.00 C ATOM 41 CG PRO A 11 -1.701 -12.698 -12.111 1.00 0.00 C ATOM 42 CD PRO A 11 -2.984 -12.015 -11.734 1.00 0.00 C ATOM 0 HA PRO A 11 -3.438 -15.144 -11.954 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -1.222 -13.825 -10.355 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -1.080 -14.730 -11.850 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -0.841 -12.074 -11.869 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -1.662 -12.892 -13.183 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -2.847 -11.339 -10.890 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -3.381 -11.421 -12.557 1.00 0.00 H new ATOM 50 N GLU A 12 -2.561 -15.999 -9.497 1.00 0.00 N ATOM 51 CA GLU A 12 -2.701 -16.692 -8.221 1.00 0.00 C ATOM 52 C GLU A 12 -1.834 -16.044 -7.148 1.00 0.00 C ATOM 53 O GLU A 12 -2.242 -15.927 -5.993 1.00 0.00 O ATOM 54 CB GLU A 12 -2.327 -18.168 -8.374 1.00 0.00 C ATOM 55 CG GLU A 12 -2.999 -18.846 -9.556 1.00 0.00 C ATOM 56 CD GLU A 12 -2.501 -20.262 -9.774 1.00 0.00 C ATOM 57 OE1 GLU A 12 -1.271 -20.448 -9.895 1.00 0.00 O ATOM 58 OE2 GLU A 12 -3.341 -21.185 -9.823 1.00 0.00 O ATOM 0 H GLU A 12 -1.778 -16.319 -10.067 1.00 0.00 H new ATOM 0 HA GLU A 12 -3.743 -16.618 -7.911 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -1.246 -18.251 -8.485 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -2.595 -18.699 -7.461 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -4.077 -18.864 -9.395 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -2.821 -18.259 -10.457 1.00 0.00 H new ATOM 65 N ARG A 13 -0.637 -15.624 -7.538 1.00 0.00 N ATOM 66 CA ARG A 13 0.292 -14.986 -6.611 1.00 0.00 C ATOM 67 C ARG A 13 0.431 -13.499 -6.917 1.00 0.00 C ATOM 68 O ARG A 13 0.544 -13.104 -8.079 1.00 0.00 O ATOM 69 CB ARG A 13 1.661 -15.664 -6.678 1.00 0.00 C ATOM 70 CG ARG A 13 1.654 -17.097 -6.172 1.00 0.00 C ATOM 71 CD ARG A 13 1.322 -17.164 -4.690 1.00 0.00 C ATOM 72 NE ARG A 13 2.315 -16.470 -3.873 1.00 0.00 N ATOM 73 CZ ARG A 13 3.491 -16.992 -3.535 1.00 0.00 C ATOM 74 NH1 ARG A 13 3.826 -18.211 -3.939 1.00 0.00 N ATOM 75 NH2 ARG A 13 4.336 -16.293 -2.789 1.00 0.00 N ATOM 0 H ARG A 13 -0.285 -15.713 -8.491 1.00 0.00 H new ATOM 0 HA ARG A 13 -0.109 -15.095 -5.603 1.00 0.00 H new ATOM 0 HB2 ARG A 13 2.013 -15.653 -7.710 1.00 0.00 H new ATOM 0 HB3 ARG A 13 2.374 -15.084 -6.092 1.00 0.00 H new ATOM 0 HG2 ARG A 13 0.925 -17.679 -6.736 1.00 0.00 H new ATOM 0 HG3 ARG A 13 2.629 -17.551 -6.348 1.00 0.00 H new ATOM 0 HD2 ARG A 13 0.340 -16.723 -4.519 1.00 0.00 H new ATOM 0 HD3 ARG A 13 1.262 -18.207 -4.379 1.00 0.00 H new ATOM 0 HE ARG A 13 2.094 -15.531 -3.543 1.00 0.00 H new ATOM 0 HH11 ARG A 13 3.180 -18.754 -4.512 1.00 0.00 H new ATOM 0 HH12 ARG A 13 4.729 -18.605 -3.676 1.00 0.00 H new ATOM 0 HH21 ARG A 13 4.084 -15.356 -2.475 1.00 0.00 H new ATOM 0 HH22 ARG A 13 5.238 -16.693 -2.529 1.00 0.00 H new ATOM 89 N PHE A 14 0.421 -12.679 -5.871 1.00 0.00 N ATOM 90 CA PHE A 14 0.545 -11.236 -6.032 1.00 0.00 C ATOM 91 C PHE A 14 1.744 -10.701 -5.260 1.00 0.00 C ATOM 92 O PHE A 14 2.341 -11.410 -4.449 1.00 0.00 O ATOM 93 CB PHE A 14 -0.735 -10.540 -5.571 1.00 0.00 C ATOM 94 CG PHE A 14 -1.880 -10.720 -6.525 1.00 0.00 C ATOM 95 CD1 PHE A 14 -1.853 -10.122 -7.773 1.00 0.00 C ATOM 96 CD2 PHE A 14 -2.976 -11.493 -6.178 1.00 0.00 C ATOM 97 CE1 PHE A 14 -2.901 -10.288 -8.659 1.00 0.00 C ATOM 98 CE2 PHE A 14 -4.027 -11.662 -7.059 1.00 0.00 C ATOM 99 CZ PHE A 14 -3.989 -11.059 -8.302 1.00 0.00 C ATOM 0 H PHE A 14 0.328 -12.989 -4.904 1.00 0.00 H new ATOM 0 HA PHE A 14 0.701 -11.025 -7.090 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -1.020 -10.928 -4.593 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -0.538 -9.475 -5.446 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -1.004 -9.519 -8.058 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -3.009 -11.968 -5.209 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -2.869 -9.815 -9.629 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -4.877 -12.265 -6.776 1.00 0.00 H new ATOM 0 HZ PHE A 14 -4.809 -11.191 -8.993 1.00 0.00 H new ATOM 109 N ASP A 15 2.099 -9.448 -5.525 1.00 0.00 N ATOM 110 CA ASP A 15 3.235 -8.820 -4.863 1.00 0.00 C ATOM 111 C ASP A 15 2.796 -8.018 -3.643 1.00 0.00 C ATOM 112 O ASP A 15 3.137 -8.359 -2.510 1.00 0.00 O ATOM 113 CB ASP A 15 3.982 -7.914 -5.845 1.00 0.00 C ATOM 114 CG ASP A 15 5.174 -8.605 -6.478 1.00 0.00 C ATOM 115 OD1 ASP A 15 6.253 -8.622 -5.850 1.00 0.00 O ATOM 116 OD2 ASP A 15 5.027 -9.129 -7.602 1.00 0.00 O ATOM 0 H ASP A 15 1.616 -8.848 -6.194 1.00 0.00 H new ATOM 0 HA ASP A 15 3.903 -9.611 -4.522 1.00 0.00 H new ATOM 0 HB2 ASP A 15 3.297 -7.588 -6.628 1.00 0.00 H new ATOM 0 HB3 ASP A 15 4.320 -7.018 -5.324 1.00 0.00 H new ATOM 121 N ALA A 16 2.049 -6.943 -3.876 1.00 0.00 N ATOM 122 CA ALA A 16 1.584 -6.096 -2.782 1.00 0.00 C ATOM 123 C ALA A 16 0.147 -5.635 -2.982 1.00 0.00 C ATOM 124 O ALA A 16 -0.477 -5.918 -4.005 1.00 0.00 O ATOM 125 CB ALA A 16 2.496 -4.886 -2.627 1.00 0.00 C ATOM 0 H ALA A 16 1.755 -6.639 -4.804 1.00 0.00 H new ATOM 0 HA ALA A 16 1.615 -6.698 -1.874 1.00 0.00 H new ATOM 0 HB1 ALA A 16 2.138 -4.263 -1.808 1.00 0.00 H new ATOM 0 HB2 ALA A 16 3.511 -5.220 -2.412 1.00 0.00 H new ATOM 0 HB3 ALA A 16 2.493 -4.308 -3.551 1.00 0.00 H new ATOM 131 N PHE A 17 -0.365 -4.909 -1.993 1.00 0.00 N ATOM 132 CA PHE A 17 -1.722 -4.383 -2.044 1.00 0.00 C ATOM 133 C PHE A 17 -1.714 -2.876 -1.801 1.00 0.00 C ATOM 134 O PHE A 17 -0.808 -2.348 -1.156 1.00 0.00 O ATOM 135 CB PHE A 17 -2.604 -5.077 -1.005 1.00 0.00 C ATOM 136 CG PHE A 17 -4.030 -4.606 -1.015 1.00 0.00 C ATOM 137 CD1 PHE A 17 -4.409 -3.486 -0.292 1.00 0.00 C ATOM 138 CD2 PHE A 17 -4.993 -5.285 -1.746 1.00 0.00 C ATOM 139 CE1 PHE A 17 -5.721 -3.052 -0.298 1.00 0.00 C ATOM 140 CE2 PHE A 17 -6.306 -4.855 -1.756 1.00 0.00 C ATOM 141 CZ PHE A 17 -6.670 -3.736 -1.031 1.00 0.00 C ATOM 0 H PHE A 17 0.144 -4.671 -1.142 1.00 0.00 H new ATOM 0 HA PHE A 17 -2.131 -4.578 -3.035 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -2.584 -6.152 -1.184 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -2.182 -4.911 -0.014 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -3.671 -2.946 0.283 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -4.714 -6.160 -2.314 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -6.004 -2.178 0.270 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -7.047 -5.392 -2.329 1.00 0.00 H new ATOM 0 HZ PHE A 17 -7.695 -3.397 -1.038 1.00 0.00 H new ATOM 151 N ILE A 18 -2.721 -2.186 -2.328 1.00 0.00 N ATOM 152 CA ILE A 18 -2.815 -0.739 -2.172 1.00 0.00 C ATOM 153 C ILE A 18 -4.002 -0.346 -1.294 1.00 0.00 C ATOM 154 O ILE A 18 -5.150 -0.658 -1.608 1.00 0.00 O ATOM 155 CB ILE A 18 -2.946 -0.035 -3.541 1.00 0.00 C ATOM 156 CG1 ILE A 18 -1.706 -0.301 -4.398 1.00 0.00 C ATOM 157 CG2 ILE A 18 -3.158 1.463 -3.361 1.00 0.00 C ATOM 158 CD1 ILE A 18 -0.455 0.374 -3.881 1.00 0.00 C ATOM 0 H ILE A 18 -3.481 -2.604 -2.865 1.00 0.00 H new ATOM 0 HA ILE A 18 -1.893 -0.416 -1.688 1.00 0.00 H new ATOM 0 HB ILE A 18 -3.817 -0.443 -4.053 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -1.534 -1.376 -4.449 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -1.898 0.039 -5.415 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -3.247 1.938 -4.338 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -4.070 1.635 -2.789 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -2.309 1.889 -2.827 1.00 0.00 H new ATOM 0 HD11 ILE A 18 0.383 0.141 -4.538 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -0.607 1.453 -3.856 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -0.237 0.015 -2.875 1.00 0.00 H new ATOM 170 N CYS A 19 -3.713 0.355 -0.203 1.00 0.00 N ATOM 171 CA CYS A 19 -4.751 0.813 0.711 1.00 0.00 C ATOM 172 C CYS A 19 -4.867 2.333 0.652 1.00 0.00 C ATOM 173 O CYS A 19 -4.104 3.049 1.300 1.00 0.00 O ATOM 174 CB CYS A 19 -4.442 0.364 2.140 1.00 0.00 C ATOM 175 SG CYS A 19 -5.293 -1.150 2.639 1.00 0.00 S ATOM 0 H CYS A 19 -2.766 0.618 0.070 1.00 0.00 H new ATOM 0 HA CYS A 19 -5.701 0.373 0.407 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -3.367 0.212 2.237 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -4.714 1.165 2.828 1.00 0.00 H new ATOM 0 HG CYS A 19 -4.998 -2.107 1.810 1.00 0.00 H new ATOM 181 N TYR A 20 -5.815 2.821 -0.144 1.00 0.00 N ATOM 182 CA TYR A 20 -6.017 4.258 -0.301 1.00 0.00 C ATOM 183 C TYR A 20 -7.447 4.662 0.041 1.00 0.00 C ATOM 184 O TYR A 20 -8.301 3.813 0.296 1.00 0.00 O ATOM 185 CB TYR A 20 -5.682 4.685 -1.733 1.00 0.00 C ATOM 186 CG TYR A 20 -6.169 3.721 -2.795 1.00 0.00 C ATOM 187 CD1 TYR A 20 -7.428 3.136 -2.716 1.00 0.00 C ATOM 188 CD2 TYR A 20 -5.367 3.402 -3.884 1.00 0.00 C ATOM 189 CE1 TYR A 20 -7.872 2.262 -3.689 1.00 0.00 C ATOM 190 CE2 TYR A 20 -5.805 2.528 -4.862 1.00 0.00 C ATOM 191 CZ TYR A 20 -7.056 1.960 -4.760 1.00 0.00 C ATOM 192 OH TYR A 20 -7.495 1.090 -5.733 1.00 0.00 O ATOM 0 H TYR A 20 -6.454 2.243 -0.689 1.00 0.00 H new ATOM 0 HA TYR A 20 -5.348 4.766 0.394 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -6.119 5.666 -1.920 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -4.601 4.795 -1.825 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -8.070 3.369 -1.879 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -4.385 3.844 -3.968 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -8.853 1.817 -3.612 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -5.169 2.292 -5.702 1.00 0.00 H new ATOM 0 HH TYR A 20 -7.361 1.492 -6.616 1.00 0.00 H new ATOM 202 N CYS A 21 -7.699 5.968 0.040 1.00 0.00 N ATOM 203 CA CYS A 21 -9.024 6.494 0.345 1.00 0.00 C ATOM 204 C CYS A 21 -9.692 7.047 -0.913 1.00 0.00 C ATOM 205 O CYS A 21 -9.014 7.477 -1.846 1.00 0.00 O ATOM 206 CB CYS A 21 -8.931 7.591 1.410 1.00 0.00 C ATOM 207 SG CYS A 21 -7.688 8.856 1.057 1.00 0.00 S ATOM 0 H CYS A 21 -7.001 6.682 -0.169 1.00 0.00 H new ATOM 0 HA CYS A 21 -9.632 5.675 0.730 1.00 0.00 H new ATOM 0 HB2 CYS A 21 -9.905 8.071 1.509 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -8.703 7.131 2.372 1.00 0.00 H new ATOM 0 HG CYS A 21 -7.685 9.739 2.011 1.00 0.00 H new ATOM 213 N PRO A 22 -11.037 7.038 -0.958 1.00 0.00 N ATOM 214 CA PRO A 22 -11.797 7.537 -2.111 1.00 0.00 C ATOM 215 C PRO A 22 -11.708 9.056 -2.273 1.00 0.00 C ATOM 216 O PRO A 22 -12.224 9.611 -3.243 1.00 0.00 O ATOM 217 CB PRO A 22 -13.246 7.122 -1.808 1.00 0.00 C ATOM 218 CG PRO A 22 -13.163 6.168 -0.663 1.00 0.00 C ATOM 219 CD PRO A 22 -11.926 6.541 0.099 1.00 0.00 C ATOM 0 HA PRO A 22 -11.407 7.130 -3.044 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -13.856 7.988 -1.552 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -13.708 6.652 -2.676 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -14.048 6.241 -0.030 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -13.108 5.138 -1.017 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -12.128 7.304 0.851 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -11.497 5.685 0.620 1.00 0.00 H new ATOM 227 N SER A 23 -11.058 9.724 -1.323 1.00 0.00 N ATOM 228 CA SER A 23 -10.916 11.174 -1.373 1.00 0.00 C ATOM 229 C SER A 23 -9.799 11.577 -2.328 1.00 0.00 C ATOM 230 O SER A 23 -9.854 12.635 -2.953 1.00 0.00 O ATOM 231 CB SER A 23 -10.633 11.728 0.025 1.00 0.00 C ATOM 232 OG SER A 23 -11.343 12.934 0.247 1.00 0.00 O ATOM 0 H SER A 23 -10.623 9.284 -0.512 1.00 0.00 H new ATOM 0 HA SER A 23 -11.853 11.594 -1.740 1.00 0.00 H new ATOM 0 HB2 SER A 23 -10.917 10.991 0.776 1.00 0.00 H new ATOM 0 HB3 SER A 23 -9.564 11.905 0.140 1.00 0.00 H new ATOM 0 HG SER A 23 -10.736 13.607 0.621 1.00 0.00 H new ATOM 238 N ASP A 24 -8.785 10.725 -2.437 1.00 0.00 N ATOM 239 CA ASP A 24 -7.657 10.993 -3.318 1.00 0.00 C ATOM 240 C ASP A 24 -7.082 9.696 -3.880 1.00 0.00 C ATOM 241 O ASP A 24 -5.880 9.449 -3.799 1.00 0.00 O ATOM 242 CB ASP A 24 -6.571 11.769 -2.570 1.00 0.00 C ATOM 243 CG ASP A 24 -5.908 12.819 -3.440 1.00 0.00 C ATOM 244 OD1 ASP A 24 -5.998 12.706 -4.681 1.00 0.00 O ATOM 245 OD2 ASP A 24 -5.298 13.755 -2.880 1.00 0.00 O ATOM 0 H ASP A 24 -8.722 9.844 -1.926 1.00 0.00 H new ATOM 0 HA ASP A 24 -8.015 11.598 -4.151 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -7.009 12.250 -1.695 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -5.816 11.072 -2.206 1.00 0.00 H new ATOM 250 N ILE A 25 -7.953 8.870 -4.451 1.00 0.00 N ATOM 251 CA ILE A 25 -7.536 7.597 -5.028 1.00 0.00 C ATOM 252 C ILE A 25 -6.948 7.794 -6.421 1.00 0.00 C ATOM 253 O ILE A 25 -5.948 7.172 -6.777 1.00 0.00 O ATOM 254 CB ILE A 25 -8.715 6.603 -5.100 1.00 0.00 C ATOM 255 CG1 ILE A 25 -8.194 5.165 -5.188 1.00 0.00 C ATOM 256 CG2 ILE A 25 -9.626 6.921 -6.280 1.00 0.00 C ATOM 257 CD1 ILE A 25 -7.464 4.855 -6.479 1.00 0.00 C ATOM 0 H ILE A 25 -8.952 9.060 -4.526 1.00 0.00 H new ATOM 0 HA ILE A 25 -6.768 7.183 -4.375 1.00 0.00 H new ATOM 0 HB ILE A 25 -9.303 6.703 -4.188 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -7.523 4.980 -4.349 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -9.033 4.478 -5.082 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -10.448 6.206 -6.308 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -10.025 7.929 -6.170 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -9.057 6.855 -7.207 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -7.126 3.819 -6.466 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -8.137 5.006 -7.323 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -6.603 5.516 -6.578 1.00 0.00 H new ATOM 269 N GLN A 26 -7.580 8.663 -7.206 1.00 0.00 N ATOM 270 CA GLN A 26 -7.127 8.945 -8.566 1.00 0.00 C ATOM 271 C GLN A 26 -5.619 9.176 -8.610 1.00 0.00 C ATOM 272 O GLN A 26 -4.921 8.643 -9.474 1.00 0.00 O ATOM 273 CB GLN A 26 -7.856 10.169 -9.123 1.00 0.00 C ATOM 274 CG GLN A 26 -9.308 9.900 -9.487 1.00 0.00 C ATOM 275 CD GLN A 26 -9.891 10.975 -10.383 1.00 0.00 C ATOM 276 OE1 GLN A 26 -9.183 11.873 -10.838 1.00 0.00 O ATOM 277 NE2 GLN A 26 -11.191 10.889 -10.641 1.00 0.00 N ATOM 0 H GLN A 26 -8.409 9.185 -6.923 1.00 0.00 H new ATOM 0 HA GLN A 26 -7.358 8.076 -9.182 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -7.818 10.971 -8.386 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -7.328 10.524 -10.008 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -9.381 8.935 -9.988 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -9.901 9.831 -8.575 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -11.741 10.128 -10.243 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -11.640 11.584 -11.237 1.00 0.00 H new ATOM 286 N PHE A 27 -5.129 9.972 -7.671 1.00 0.00 N ATOM 287 CA PHE A 27 -3.706 10.279 -7.593 1.00 0.00 C ATOM 288 C PHE A 27 -2.894 9.028 -7.273 1.00 0.00 C ATOM 289 O PHE A 27 -1.870 8.761 -7.904 1.00 0.00 O ATOM 290 CB PHE A 27 -3.449 11.351 -6.533 1.00 0.00 C ATOM 291 CG PHE A 27 -2.108 12.015 -6.663 1.00 0.00 C ATOM 292 CD1 PHE A 27 -0.973 11.426 -6.129 1.00 0.00 C ATOM 293 CD2 PHE A 27 -1.983 13.228 -7.319 1.00 0.00 C ATOM 294 CE1 PHE A 27 0.261 12.034 -6.249 1.00 0.00 C ATOM 295 CE2 PHE A 27 -0.750 13.842 -7.442 1.00 0.00 C ATOM 296 CZ PHE A 27 0.373 13.245 -6.906 1.00 0.00 C ATOM 0 H PHE A 27 -5.696 10.418 -6.950 1.00 0.00 H new ATOM 0 HA PHE A 27 -3.390 10.657 -8.566 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -4.229 12.110 -6.599 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -3.527 10.899 -5.544 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -1.054 10.481 -5.613 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -2.859 13.700 -7.739 1.00 0.00 H new ATOM 0 HE1 PHE A 27 1.138 11.564 -5.830 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -0.666 14.788 -7.957 1.00 0.00 H new ATOM 0 HZ PHE A 27 1.337 13.723 -7.000 1.00 0.00 H new ATOM 306 N VAL A 28 -3.356 8.263 -6.289 1.00 0.00 N ATOM 307 CA VAL A 28 -2.670 7.041 -5.886 1.00 0.00 C ATOM 308 C VAL A 28 -2.615 6.038 -7.034 1.00 0.00 C ATOM 309 O VAL A 28 -1.538 5.595 -7.430 1.00 0.00 O ATOM 310 CB VAL A 28 -3.349 6.378 -4.673 1.00 0.00 C ATOM 311 CG1 VAL A 28 -2.430 5.336 -4.053 1.00 0.00 C ATOM 312 CG2 VAL A 28 -3.755 7.423 -3.641 1.00 0.00 C ATOM 0 H VAL A 28 -4.202 8.468 -5.757 1.00 0.00 H new ATOM 0 HA VAL A 28 -1.657 7.330 -5.607 1.00 0.00 H new ATOM 0 HB VAL A 28 -4.253 5.877 -5.018 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -2.925 4.877 -3.197 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -2.198 4.569 -4.792 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -1.507 5.814 -3.725 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -4.232 6.931 -2.794 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -2.870 7.959 -3.298 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -4.454 8.128 -4.092 1.00 0.00 H new ATOM 322 N GLN A 29 -3.783 5.685 -7.569 1.00 0.00 N ATOM 323 CA GLN A 29 -3.866 4.737 -8.671 1.00 0.00 C ATOM 324 C GLN A 29 -2.898 5.115 -9.787 1.00 0.00 C ATOM 325 O GLN A 29 -2.304 4.247 -10.427 1.00 0.00 O ATOM 326 CB GLN A 29 -5.296 4.676 -9.205 1.00 0.00 C ATOM 327 CG GLN A 29 -5.806 5.999 -9.751 1.00 0.00 C ATOM 328 CD GLN A 29 -6.956 5.825 -10.723 1.00 0.00 C ATOM 329 OE1 GLN A 29 -8.148 5.575 -10.193 1.00 0.00 O flip ATOM 330 NE2 GLN A 29 -6.776 5.914 -11.937 1.00 0.00 N flip ATOM 0 H GLN A 29 -4.684 6.044 -7.254 1.00 0.00 H new ATOM 0 HA GLN A 29 -3.586 3.752 -8.299 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -5.347 3.925 -9.993 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -5.958 4.345 -8.405 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -6.128 6.630 -8.922 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -4.989 6.521 -10.250 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -5.843 6.107 -12.301 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -7.560 5.794 -12.579 1.00 0.00 H new ATOM 339 N GLU A 30 -2.731 6.415 -10.007 1.00 0.00 N ATOM 340 CA GLU A 30 -1.821 6.900 -11.035 1.00 0.00 C ATOM 341 C GLU A 30 -0.392 6.505 -10.689 1.00 0.00 C ATOM 342 O GLU A 30 0.381 6.086 -11.552 1.00 0.00 O ATOM 343 CB GLU A 30 -1.928 8.421 -11.170 1.00 0.00 C ATOM 344 CG GLU A 30 -1.507 8.943 -12.534 1.00 0.00 C ATOM 345 CD GLU A 30 -2.264 10.194 -12.938 1.00 0.00 C ATOM 346 OE1 GLU A 30 -3.482 10.264 -12.671 1.00 0.00 O ATOM 347 OE2 GLU A 30 -1.637 11.104 -13.523 1.00 0.00 O ATOM 0 H GLU A 30 -3.213 7.149 -9.488 1.00 0.00 H new ATOM 0 HA GLU A 30 -2.096 6.448 -11.988 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -2.957 8.723 -10.977 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -1.310 8.890 -10.404 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -0.438 9.157 -12.523 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -1.669 8.167 -13.282 1.00 0.00 H new ATOM 354 N MET A 31 -0.055 6.631 -9.411 1.00 0.00 N ATOM 355 CA MET A 31 1.272 6.277 -8.929 1.00 0.00 C ATOM 356 C MET A 31 1.472 4.767 -8.985 1.00 0.00 C ATOM 357 O MET A 31 2.472 4.281 -9.509 1.00 0.00 O ATOM 358 CB MET A 31 1.463 6.783 -7.495 1.00 0.00 C ATOM 359 CG MET A 31 2.747 6.303 -6.839 1.00 0.00 C ATOM 360 SD MET A 31 2.893 6.837 -5.124 1.00 0.00 S ATOM 361 CE MET A 31 1.310 6.312 -4.470 1.00 0.00 C ATOM 0 H MET A 31 -0.686 6.977 -8.688 1.00 0.00 H new ATOM 0 HA MET A 31 2.015 6.750 -9.572 1.00 0.00 H new ATOM 0 HB2 MET A 31 1.455 7.873 -7.501 1.00 0.00 H new ATOM 0 HB3 MET A 31 0.615 6.461 -6.890 1.00 0.00 H new ATOM 0 HG2 MET A 31 2.787 5.215 -6.881 1.00 0.00 H new ATOM 0 HG3 MET A 31 3.601 6.675 -7.405 1.00 0.00 H new ATOM 0 HE1 MET A 31 1.433 5.984 -3.438 1.00 0.00 H new ATOM 0 HE2 MET A 31 0.608 7.145 -4.505 1.00 0.00 H new ATOM 0 HE3 MET A 31 0.924 5.487 -5.069 1.00 0.00 H new ATOM 371 N ILE A 32 0.508 4.031 -8.439 1.00 0.00 N ATOM 372 CA ILE A 32 0.574 2.576 -8.424 1.00 0.00 C ATOM 373 C ILE A 32 0.633 2.012 -9.839 1.00 0.00 C ATOM 374 O ILE A 32 1.565 1.287 -10.187 1.00 0.00 O ATOM 375 CB ILE A 32 -0.638 1.965 -7.689 1.00 0.00 C ATOM 376 CG1 ILE A 32 -0.847 2.644 -6.332 1.00 0.00 C ATOM 377 CG2 ILE A 32 -0.449 0.466 -7.512 1.00 0.00 C ATOM 378 CD1 ILE A 32 0.429 2.855 -5.545 1.00 0.00 C ATOM 0 H ILE A 32 -0.327 4.420 -8.002 1.00 0.00 H new ATOM 0 HA ILE A 32 1.486 2.307 -7.891 1.00 0.00 H new ATOM 0 HB ILE A 32 -1.528 2.133 -8.295 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -1.327 3.609 -6.491 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -1.533 2.041 -5.737 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -1.312 0.049 -6.992 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -0.351 -0.006 -8.489 1.00 0.00 H new ATOM 0 HG23 ILE A 32 0.452 0.279 -6.927 1.00 0.00 H new ATOM 0 HD11 ILE A 32 0.196 3.341 -4.597 1.00 0.00 H new ATOM 0 HD12 ILE A 32 0.901 1.892 -5.353 1.00 0.00 H new ATOM 0 HD13 ILE A 32 1.110 3.485 -6.118 1.00 0.00 H new ATOM 390 N ARG A 33 -0.364 2.346 -10.654 1.00 0.00 N ATOM 391 CA ARG A 33 -0.417 1.872 -12.030 1.00 0.00 C ATOM 392 C ARG A 33 0.883 2.193 -12.762 1.00 0.00 C ATOM 393 O ARG A 33 1.331 1.430 -13.620 1.00 0.00 O ATOM 394 CB ARG A 33 -1.611 2.496 -12.755 1.00 0.00 C ATOM 395 CG ARG A 33 -1.429 3.965 -13.097 1.00 0.00 C ATOM 396 CD ARG A 33 -0.831 4.146 -14.482 1.00 0.00 C ATOM 397 NE ARG A 33 -1.861 4.287 -15.510 1.00 0.00 N ATOM 398 CZ ARG A 33 -2.516 5.421 -15.751 1.00 0.00 C ATOM 399 NH1 ARG A 33 -2.255 6.512 -15.043 1.00 0.00 N ATOM 400 NH2 ARG A 33 -3.437 5.463 -16.705 1.00 0.00 N ATOM 0 H ARG A 33 -1.145 2.943 -10.383 1.00 0.00 H new ATOM 0 HA ARG A 33 -0.541 0.789 -12.020 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -1.796 1.940 -13.674 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -2.499 2.386 -12.132 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -2.392 4.473 -13.046 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -0.782 4.434 -12.356 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -0.190 5.028 -14.488 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -0.198 3.291 -14.718 1.00 0.00 H new ATOM 0 HE ARG A 33 -2.091 3.470 -16.075 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -1.548 6.486 -14.308 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -2.761 7.377 -15.234 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -3.642 4.627 -17.253 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -3.940 6.331 -16.891 1.00 0.00 H new ATOM 414 N GLN A 34 1.491 3.321 -12.409 1.00 0.00 N ATOM 415 CA GLN A 34 2.745 3.738 -13.019 1.00 0.00 C ATOM 416 C GLN A 34 3.907 2.931 -12.449 1.00 0.00 C ATOM 417 O GLN A 34 4.964 2.820 -13.071 1.00 0.00 O ATOM 418 CB GLN A 34 2.982 5.232 -12.785 1.00 0.00 C ATOM 419 CG GLN A 34 4.236 5.764 -13.458 1.00 0.00 C ATOM 420 CD GLN A 34 3.931 6.646 -14.653 1.00 0.00 C ATOM 421 OE1 GLN A 34 4.149 6.256 -15.799 1.00 0.00 O ATOM 422 NE2 GLN A 34 3.422 7.845 -14.388 1.00 0.00 N ATOM 0 H GLN A 34 1.133 3.963 -11.702 1.00 0.00 H new ATOM 0 HA GLN A 34 2.682 3.556 -14.092 1.00 0.00 H new ATOM 0 HB2 GLN A 34 2.120 5.789 -13.151 1.00 0.00 H new ATOM 0 HB3 GLN A 34 3.049 5.417 -11.713 1.00 0.00 H new ATOM 0 HG2 GLN A 34 4.820 6.331 -12.733 1.00 0.00 H new ATOM 0 HG3 GLN A 34 4.854 4.926 -13.779 1.00 0.00 H new ATOM 0 HE21 GLN A 34 3.258 8.127 -13.422 1.00 0.00 H new ATOM 0 HE22 GLN A 34 3.196 8.483 -15.151 1.00 0.00 H new ATOM 431 N LEU A 35 3.701 2.369 -11.262 1.00 0.00 N ATOM 432 CA LEU A 35 4.723 1.572 -10.606 1.00 0.00 C ATOM 433 C LEU A 35 4.638 0.113 -11.045 1.00 0.00 C ATOM 434 O LEU A 35 5.653 -0.574 -11.153 1.00 0.00 O ATOM 435 CB LEU A 35 4.563 1.670 -9.089 1.00 0.00 C ATOM 436 CG LEU A 35 5.020 2.990 -8.469 1.00 0.00 C ATOM 437 CD1 LEU A 35 4.633 3.051 -6.999 1.00 0.00 C ATOM 438 CD2 LEU A 35 6.520 3.162 -8.633 1.00 0.00 C ATOM 0 H LEU A 35 2.831 2.453 -10.736 1.00 0.00 H new ATOM 0 HA LEU A 35 5.700 1.960 -10.892 1.00 0.00 H new ATOM 0 HB2 LEU A 35 3.513 1.515 -8.840 1.00 0.00 H new ATOM 0 HB3 LEU A 35 5.124 0.857 -8.628 1.00 0.00 H new ATOM 0 HG LEU A 35 4.521 3.807 -8.990 1.00 0.00 H new ATOM 0 HD11 LEU A 35 4.966 3.998 -6.574 1.00 0.00 H new ATOM 0 HD12 LEU A 35 3.550 2.972 -6.904 1.00 0.00 H new ATOM 0 HD13 LEU A 35 5.105 2.227 -6.464 1.00 0.00 H new ATOM 0 HD21 LEU A 35 6.829 4.107 -8.186 1.00 0.00 H new ATOM 0 HD22 LEU A 35 7.037 2.340 -8.137 1.00 0.00 H new ATOM 0 HD23 LEU A 35 6.772 3.163 -9.693 1.00 0.00 H new ATOM 450 N GLU A 36 3.417 -0.354 -11.288 1.00 0.00 N ATOM 451 CA GLU A 36 3.192 -1.735 -11.707 1.00 0.00 C ATOM 452 C GLU A 36 3.133 -1.862 -13.230 1.00 0.00 C ATOM 453 O GLU A 36 3.048 -2.969 -13.760 1.00 0.00 O ATOM 454 CB GLU A 36 1.897 -2.270 -11.090 1.00 0.00 C ATOM 455 CG GLU A 36 0.717 -1.323 -11.236 1.00 0.00 C ATOM 456 CD GLU A 36 -0.537 -2.022 -11.719 1.00 0.00 C ATOM 457 OE1 GLU A 36 -1.082 -2.854 -10.962 1.00 0.00 O ATOM 458 OE2 GLU A 36 -0.976 -1.741 -12.855 1.00 0.00 O ATOM 0 H GLU A 36 2.567 0.203 -11.202 1.00 0.00 H new ATOM 0 HA GLU A 36 4.036 -2.328 -11.354 1.00 0.00 H new ATOM 0 HB2 GLU A 36 1.648 -3.222 -11.558 1.00 0.00 H new ATOM 0 HB3 GLU A 36 2.064 -2.469 -10.031 1.00 0.00 H new ATOM 0 HG2 GLU A 36 0.516 -0.848 -10.276 1.00 0.00 H new ATOM 0 HG3 GLU A 36 0.978 -0.529 -11.936 1.00 0.00 H new ATOM 465 N GLN A 37 3.169 -0.731 -13.931 1.00 0.00 N ATOM 466 CA GLN A 37 3.115 -0.737 -15.386 1.00 0.00 C ATOM 467 C GLN A 37 4.256 -1.561 -15.982 1.00 0.00 C ATOM 468 O GLN A 37 4.178 -2.002 -17.129 1.00 0.00 O ATOM 469 CB GLN A 37 3.179 0.694 -15.914 1.00 0.00 C ATOM 470 CG GLN A 37 4.363 1.482 -15.382 1.00 0.00 C ATOM 471 CD GLN A 37 5.439 1.697 -16.431 1.00 0.00 C ATOM 472 OE1 GLN A 37 5.595 0.893 -17.350 1.00 0.00 O ATOM 473 NE2 GLN A 37 6.189 2.785 -16.296 1.00 0.00 N ATOM 0 H GLN A 37 3.235 0.197 -13.514 1.00 0.00 H new ATOM 0 HA GLN A 37 2.173 -1.196 -15.687 1.00 0.00 H new ATOM 0 HB2 GLN A 37 3.228 0.670 -17.003 1.00 0.00 H new ATOM 0 HB3 GLN A 37 2.258 1.213 -15.648 1.00 0.00 H new ATOM 0 HG2 GLN A 37 4.017 2.449 -15.018 1.00 0.00 H new ATOM 0 HG3 GLN A 37 4.792 0.955 -14.529 1.00 0.00 H new ATOM 0 HE21 GLN A 37 6.025 3.425 -15.519 1.00 0.00 H new ATOM 0 HE22 GLN A 37 6.929 2.981 -16.970 1.00 0.00 H new ATOM 482 N THR A 38 5.313 -1.767 -15.200 1.00 0.00 N ATOM 483 CA THR A 38 6.465 -2.539 -15.656 1.00 0.00 C ATOM 484 C THR A 38 6.032 -3.881 -16.241 1.00 0.00 C ATOM 485 O THR A 38 4.853 -4.233 -16.207 1.00 0.00 O ATOM 486 CB THR A 38 7.442 -2.766 -14.500 1.00 0.00 C ATOM 487 OG1 THR A 38 6.743 -3.063 -13.304 1.00 0.00 O ATOM 488 CG2 THR A 38 8.333 -1.574 -14.227 1.00 0.00 C ATOM 0 H THR A 38 5.395 -1.410 -14.248 1.00 0.00 H new ATOM 0 HA THR A 38 6.963 -1.968 -16.440 1.00 0.00 H new ATOM 0 HB THR A 38 8.067 -3.603 -14.810 1.00 0.00 H new ATOM 0 HG1 THR A 38 7.385 -3.207 -12.577 1.00 0.00 H new ATOM 0 HG21 THR A 38 9.001 -1.802 -13.396 1.00 0.00 H new ATOM 0 HG22 THR A 38 8.923 -1.349 -15.116 1.00 0.00 H new ATOM 0 HG23 THR A 38 7.718 -0.711 -13.972 1.00 0.00 H new ATOM 496 N ASN A 39 6.995 -4.624 -16.780 1.00 0.00 N ATOM 497 CA ASN A 39 6.713 -5.925 -17.375 1.00 0.00 C ATOM 498 C ASN A 39 6.384 -6.959 -16.301 1.00 0.00 C ATOM 499 O ASN A 39 5.218 -7.281 -16.074 1.00 0.00 O ATOM 500 CB ASN A 39 7.908 -6.396 -18.207 1.00 0.00 C ATOM 501 CG ASN A 39 8.098 -5.574 -19.466 1.00 0.00 C ATOM 502 OD1 ASN A 39 7.223 -4.799 -19.851 1.00 0.00 O ATOM 503 ND2 ASN A 39 9.245 -5.741 -20.115 1.00 0.00 N ATOM 0 H ASN A 39 7.976 -4.347 -16.816 1.00 0.00 H new ATOM 0 HA ASN A 39 5.844 -5.819 -18.025 1.00 0.00 H new ATOM 0 HB2 ASN A 39 8.813 -6.341 -17.601 1.00 0.00 H new ATOM 0 HB3 ASN A 39 7.768 -7.443 -18.478 1.00 0.00 H new ATOM 0 HD21 ASN A 39 9.429 -5.215 -20.970 1.00 0.00 H new ATOM 0 HD22 ASN A 39 9.942 -6.395 -19.759 1.00 0.00 H new ATOM 510 N TYR A 40 7.419 -7.475 -15.645 1.00 0.00 N ATOM 511 CA TYR A 40 7.238 -8.473 -14.597 1.00 0.00 C ATOM 512 C TYR A 40 8.158 -8.192 -13.414 1.00 0.00 C ATOM 513 O TYR A 40 9.353 -8.486 -13.460 1.00 0.00 O ATOM 514 CB TYR A 40 7.505 -9.877 -15.148 1.00 0.00 C ATOM 515 CG TYR A 40 6.311 -10.801 -15.052 1.00 0.00 C ATOM 516 CD1 TYR A 40 5.834 -11.226 -13.819 1.00 0.00 C ATOM 517 CD2 TYR A 40 5.665 -11.250 -16.198 1.00 0.00 C ATOM 518 CE1 TYR A 40 4.743 -12.072 -13.730 1.00 0.00 C ATOM 519 CE2 TYR A 40 4.573 -12.096 -16.116 1.00 0.00 C ATOM 520 CZ TYR A 40 4.118 -12.502 -14.880 1.00 0.00 C ATOM 521 OH TYR A 40 3.033 -13.345 -14.793 1.00 0.00 O ATOM 0 H TYR A 40 8.391 -7.219 -15.821 1.00 0.00 H new ATOM 0 HA TYR A 40 6.206 -8.418 -14.251 1.00 0.00 H new ATOM 0 HB2 TYR A 40 7.809 -9.797 -16.192 1.00 0.00 H new ATOM 0 HB3 TYR A 40 8.341 -10.319 -14.605 1.00 0.00 H new ATOM 0 HD1 TYR A 40 6.322 -10.891 -12.916 1.00 0.00 H new ATOM 0 HD2 TYR A 40 6.021 -10.934 -17.167 1.00 0.00 H new ATOM 0 HE1 TYR A 40 4.383 -12.394 -12.764 1.00 0.00 H new ATOM 0 HE2 TYR A 40 4.080 -12.436 -17.015 1.00 0.00 H new ATOM 0 HH TYR A 40 2.708 -13.553 -15.694 1.00 0.00 H new ATOM 531 N ARG A 41 7.596 -7.619 -12.355 1.00 0.00 N ATOM 532 CA ARG A 41 8.367 -7.297 -11.160 1.00 0.00 C ATOM 533 C ARG A 41 7.456 -6.792 -10.045 1.00 0.00 C ATOM 534 O ARG A 41 7.475 -7.313 -8.930 1.00 0.00 O ATOM 535 CB ARG A 41 9.433 -6.249 -11.478 1.00 0.00 C ATOM 536 CG ARG A 41 10.707 -6.414 -10.670 1.00 0.00 C ATOM 537 CD ARG A 41 11.750 -5.376 -11.053 1.00 0.00 C ATOM 538 NE ARG A 41 13.108 -5.829 -10.764 1.00 0.00 N ATOM 539 CZ ARG A 41 13.770 -6.711 -11.510 1.00 0.00 C ATOM 540 NH1 ARG A 41 13.202 -7.236 -12.590 1.00 0.00 N ATOM 541 NH2 ARG A 41 15.001 -7.070 -11.176 1.00 0.00 N ATOM 0 H ARG A 41 6.609 -7.368 -12.300 1.00 0.00 H new ATOM 0 HA ARG A 41 8.858 -8.209 -10.820 1.00 0.00 H new ATOM 0 HB2 ARG A 41 9.676 -6.301 -12.539 1.00 0.00 H new ATOM 0 HB3 ARG A 41 9.022 -5.257 -11.293 1.00 0.00 H new ATOM 0 HG2 ARG A 41 10.479 -6.327 -9.608 1.00 0.00 H new ATOM 0 HG3 ARG A 41 11.112 -7.413 -10.828 1.00 0.00 H new ATOM 0 HD2 ARG A 41 11.662 -5.150 -12.116 1.00 0.00 H new ATOM 0 HD3 ARG A 41 11.555 -4.450 -10.513 1.00 0.00 H new ATOM 0 HE ARG A 41 13.577 -5.447 -9.942 1.00 0.00 H new ATOM 0 HH11 ARG A 41 12.254 -6.964 -12.851 1.00 0.00 H new ATOM 0 HH12 ARG A 41 13.714 -7.911 -13.158 1.00 0.00 H new ATOM 0 HH21 ARG A 41 15.442 -6.671 -10.347 1.00 0.00 H new ATOM 0 HH22 ARG A 41 15.508 -7.746 -11.748 1.00 0.00 H new ATOM 555 N LEU A 42 6.660 -5.775 -10.355 1.00 0.00 N ATOM 556 CA LEU A 42 5.742 -5.200 -9.377 1.00 0.00 C ATOM 557 C LEU A 42 4.294 -5.521 -9.733 1.00 0.00 C ATOM 558 O LEU A 42 3.815 -5.170 -10.811 1.00 0.00 O ATOM 559 CB LEU A 42 5.933 -3.685 -9.292 1.00 0.00 C ATOM 560 CG LEU A 42 5.437 -3.042 -7.994 1.00 0.00 C ATOM 561 CD1 LEU A 42 6.564 -2.960 -6.977 1.00 0.00 C ATOM 562 CD2 LEU A 42 4.862 -1.661 -8.269 1.00 0.00 C ATOM 0 H LEU A 42 6.631 -5.332 -11.273 1.00 0.00 H new ATOM 0 HA LEU A 42 5.966 -5.642 -8.406 1.00 0.00 H new ATOM 0 HB2 LEU A 42 6.993 -3.460 -9.409 1.00 0.00 H new ATOM 0 HB3 LEU A 42 5.414 -3.221 -10.131 1.00 0.00 H new ATOM 0 HG LEU A 42 4.645 -3.666 -7.580 1.00 0.00 H new ATOM 0 HD11 LEU A 42 6.194 -2.500 -6.060 1.00 0.00 H new ATOM 0 HD12 LEU A 42 6.930 -3.963 -6.758 1.00 0.00 H new ATOM 0 HD13 LEU A 42 7.377 -2.358 -7.382 1.00 0.00 H new ATOM 0 HD21 LEU A 42 4.514 -1.219 -7.335 1.00 0.00 H new ATOM 0 HD22 LEU A 42 5.633 -1.026 -8.706 1.00 0.00 H new ATOM 0 HD23 LEU A 42 4.026 -1.747 -8.963 1.00 0.00 H new ATOM 574 N LYS A 43 3.604 -6.189 -8.815 1.00 0.00 N ATOM 575 CA LYS A 43 2.208 -6.559 -9.022 1.00 0.00 C ATOM 576 C LYS A 43 1.364 -6.185 -7.807 1.00 0.00 C ATOM 577 O LYS A 43 1.183 -6.992 -6.894 1.00 0.00 O ATOM 578 CB LYS A 43 2.093 -8.060 -9.297 1.00 0.00 C ATOM 579 CG LYS A 43 2.835 -8.508 -10.545 1.00 0.00 C ATOM 580 CD LYS A 43 2.119 -8.060 -11.809 1.00 0.00 C ATOM 581 CE LYS A 43 3.103 -7.682 -12.904 1.00 0.00 C ATOM 582 NZ LYS A 43 3.267 -8.773 -13.904 1.00 0.00 N ATOM 0 H LYS A 43 3.989 -6.486 -7.918 1.00 0.00 H new ATOM 0 HA LYS A 43 1.834 -6.010 -9.886 1.00 0.00 H new ATOM 0 HB2 LYS A 43 2.479 -8.609 -8.438 1.00 0.00 H new ATOM 0 HB3 LYS A 43 1.040 -8.323 -9.396 1.00 0.00 H new ATOM 0 HG2 LYS A 43 3.846 -8.101 -10.534 1.00 0.00 H new ATOM 0 HG3 LYS A 43 2.929 -9.594 -10.544 1.00 0.00 H new ATOM 0 HD2 LYS A 43 1.469 -8.860 -12.163 1.00 0.00 H new ATOM 0 HD3 LYS A 43 1.480 -7.207 -11.583 1.00 0.00 H new ATOM 0 HE2 LYS A 43 2.758 -6.778 -13.406 1.00 0.00 H new ATOM 0 HE3 LYS A 43 4.070 -7.449 -12.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 3.592 -8.371 -14.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 3.968 -9.459 -13.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 2.355 -9.253 -14.047 1.00 0.00 H new ATOM 596 N LEU A 44 0.854 -4.958 -7.802 1.00 0.00 N ATOM 597 CA LEU A 44 0.032 -4.481 -6.698 1.00 0.00 C ATOM 598 C LEU A 44 -1.442 -4.772 -6.953 1.00 0.00 C ATOM 599 O LEU A 44 -1.845 -5.032 -8.087 1.00 0.00 O ATOM 600 CB LEU A 44 0.247 -2.982 -6.485 1.00 0.00 C ATOM 601 CG LEU A 44 1.554 -2.613 -5.784 1.00 0.00 C ATOM 602 CD1 LEU A 44 2.046 -1.251 -6.246 1.00 0.00 C ATOM 603 CD2 LEU A 44 1.373 -2.628 -4.275 1.00 0.00 C ATOM 0 H LEU A 44 0.995 -4.278 -8.549 1.00 0.00 H new ATOM 0 HA LEU A 44 0.333 -5.012 -5.795 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.218 -2.484 -7.454 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.585 -2.590 -5.901 1.00 0.00 H new ATOM 0 HG LEU A 44 2.305 -3.357 -6.050 1.00 0.00 H new ATOM 0 HD11 LEU A 44 2.977 -1.008 -5.735 1.00 0.00 H new ATOM 0 HD12 LEU A 44 2.218 -1.272 -7.322 1.00 0.00 H new ATOM 0 HD13 LEU A 44 1.296 -0.495 -6.013 1.00 0.00 H new ATOM 0 HD21 LEU A 44 2.314 -2.363 -3.793 1.00 0.00 H new ATOM 0 HD22 LEU A 44 0.605 -1.907 -3.993 1.00 0.00 H new ATOM 0 HD23 LEU A 44 1.070 -3.625 -3.955 1.00 0.00 H new ATOM 615 N CYS A 45 -2.242 -4.733 -5.892 1.00 0.00 N ATOM 616 CA CYS A 45 -3.671 -5.002 -6.007 1.00 0.00 C ATOM 617 C CYS A 45 -4.476 -4.097 -5.078 1.00 0.00 C ATOM 618 O CYS A 45 -3.926 -3.480 -4.168 1.00 0.00 O ATOM 619 CB CYS A 45 -3.956 -6.469 -5.685 1.00 0.00 C ATOM 620 SG CYS A 45 -3.645 -7.605 -7.074 1.00 0.00 S ATOM 0 H CYS A 45 -1.926 -4.519 -4.946 1.00 0.00 H new ATOM 0 HA CYS A 45 -3.975 -4.794 -7.033 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -3.341 -6.771 -4.837 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -4.996 -6.567 -5.375 1.00 0.00 H new ATOM 0 HG CYS A 45 -2.827 -8.541 -6.694 1.00 0.00 H new ATOM 625 N VAL A 46 -5.781 -4.028 -5.315 1.00 0.00 N ATOM 626 CA VAL A 46 -6.665 -3.201 -4.500 1.00 0.00 C ATOM 627 C VAL A 46 -7.948 -3.947 -4.154 1.00 0.00 C ATOM 628 O VAL A 46 -8.265 -4.971 -4.761 1.00 0.00 O ATOM 629 CB VAL A 46 -7.022 -1.883 -5.215 1.00 0.00 C ATOM 630 CG1 VAL A 46 -5.781 -1.030 -5.417 1.00 0.00 C ATOM 631 CG2 VAL A 46 -7.706 -2.165 -6.544 1.00 0.00 C ATOM 0 H VAL A 46 -6.251 -4.535 -6.065 1.00 0.00 H new ATOM 0 HA VAL A 46 -6.125 -2.969 -3.582 1.00 0.00 H new ATOM 0 HB VAL A 46 -7.717 -1.327 -4.585 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -6.054 -0.104 -5.923 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -5.338 -0.797 -4.449 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -5.059 -1.576 -6.024 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -7.951 -1.223 -7.034 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -7.037 -2.743 -7.182 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -8.621 -2.731 -6.369 1.00 0.00 H new ATOM 641 N SER A 47 -8.686 -3.430 -3.177 1.00 0.00 N ATOM 642 CA SER A 47 -9.935 -4.049 -2.753 1.00 0.00 C ATOM 643 C SER A 47 -10.906 -3.006 -2.210 1.00 0.00 C ATOM 644 O SER A 47 -11.339 -3.084 -1.060 1.00 0.00 O ATOM 645 CB SER A 47 -9.663 -5.118 -1.690 1.00 0.00 C ATOM 646 OG SER A 47 -10.859 -5.776 -1.311 1.00 0.00 O ATOM 0 H SER A 47 -8.440 -2.583 -2.664 1.00 0.00 H new ATOM 0 HA SER A 47 -10.391 -4.520 -3.623 1.00 0.00 H new ATOM 0 HB2 SER A 47 -8.950 -5.846 -2.076 1.00 0.00 H new ATOM 0 HB3 SER A 47 -9.205 -4.657 -0.815 1.00 0.00 H new ATOM 0 HG SER A 47 -11.506 -5.116 -0.986 1.00 0.00 H new ATOM 652 N ASP A 48 -11.246 -2.032 -3.046 1.00 0.00 N ATOM 653 CA ASP A 48 -12.167 -0.972 -2.652 1.00 0.00 C ATOM 654 C ASP A 48 -13.403 -0.970 -3.547 1.00 0.00 C ATOM 655 O ASP A 48 -13.351 -1.413 -4.694 1.00 0.00 O ATOM 656 CB ASP A 48 -11.471 0.390 -2.714 1.00 0.00 C ATOM 657 CG ASP A 48 -11.127 0.926 -1.339 1.00 0.00 C ATOM 658 OD1 ASP A 48 -10.054 0.562 -0.812 1.00 0.00 O ATOM 659 OD2 ASP A 48 -11.930 1.709 -0.788 1.00 0.00 O ATOM 0 H ASP A 48 -10.898 -1.954 -4.002 1.00 0.00 H new ATOM 0 HA ASP A 48 -12.483 -1.160 -1.626 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -10.560 0.303 -3.305 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -12.117 1.102 -3.227 1.00 0.00 H new ATOM 664 N ARG A 49 -14.514 -0.471 -3.014 1.00 0.00 N ATOM 665 CA ARG A 49 -15.763 -0.414 -3.764 1.00 0.00 C ATOM 666 C ARG A 49 -15.881 0.901 -4.530 1.00 0.00 C ATOM 667 O ARG A 49 -16.059 0.907 -5.747 1.00 0.00 O ATOM 668 CB ARG A 49 -16.955 -0.580 -2.821 1.00 0.00 C ATOM 669 CG ARG A 49 -18.043 -1.489 -3.371 1.00 0.00 C ATOM 670 CD ARG A 49 -17.538 -2.912 -3.553 1.00 0.00 C ATOM 671 NE ARG A 49 -17.916 -3.775 -2.435 1.00 0.00 N ATOM 672 CZ ARG A 49 -17.849 -5.104 -2.470 1.00 0.00 C ATOM 673 NH1 ARG A 49 -17.424 -5.726 -3.563 1.00 0.00 N ATOM 674 NH2 ARG A 49 -18.212 -5.813 -1.411 1.00 0.00 N ATOM 0 H ARG A 49 -14.574 -0.100 -2.066 1.00 0.00 H new ATOM 0 HA ARG A 49 -15.763 -1.232 -4.485 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -16.603 -0.982 -1.871 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -17.383 0.401 -2.613 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -18.897 -1.488 -2.693 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -18.394 -1.101 -4.327 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -17.939 -3.323 -4.480 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -16.453 -2.902 -3.652 1.00 0.00 H new ATOM 0 HE ARG A 49 -18.250 -3.333 -1.579 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -17.147 -5.185 -4.382 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -17.375 -6.745 -3.584 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -18.543 -5.340 -0.570 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -18.161 -6.831 -1.437 1.00 0.00 H new ATOM 688 N ASP A 50 -15.779 2.012 -3.808 1.00 0.00 N ATOM 689 CA ASP A 50 -15.875 3.332 -4.420 1.00 0.00 C ATOM 690 C ASP A 50 -14.490 3.941 -4.617 1.00 0.00 C ATOM 691 O ASP A 50 -13.984 4.654 -3.749 1.00 0.00 O ATOM 692 CB ASP A 50 -16.733 4.258 -3.555 1.00 0.00 C ATOM 693 CG ASP A 50 -17.356 5.384 -4.355 1.00 0.00 C ATOM 694 OD1 ASP A 50 -16.622 6.324 -4.728 1.00 0.00 O ATOM 695 OD2 ASP A 50 -18.578 5.325 -4.609 1.00 0.00 O ATOM 0 H ASP A 50 -15.630 2.024 -2.799 1.00 0.00 H new ATOM 0 HA ASP A 50 -16.346 3.219 -5.396 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -17.521 3.677 -3.077 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -16.119 4.678 -2.758 1.00 0.00 H new ATOM 700 N VAL A 51 -13.881 3.657 -5.765 1.00 0.00 N ATOM 701 CA VAL A 51 -12.557 4.177 -6.076 1.00 0.00 C ATOM 702 C VAL A 51 -12.335 4.260 -7.583 1.00 0.00 C ATOM 703 O VAL A 51 -11.927 5.297 -8.105 1.00 0.00 O ATOM 704 CB VAL A 51 -11.446 3.308 -5.455 1.00 0.00 C ATOM 705 CG1 VAL A 51 -11.298 3.609 -3.971 1.00 0.00 C ATOM 706 CG2 VAL A 51 -11.727 1.830 -5.680 1.00 0.00 C ATOM 0 H VAL A 51 -14.285 3.069 -6.494 1.00 0.00 H new ATOM 0 HA VAL A 51 -12.507 5.178 -5.647 1.00 0.00 H new ATOM 0 HB VAL A 51 -10.506 3.552 -5.949 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -10.509 2.986 -3.550 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -11.041 4.660 -3.837 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -12.238 3.397 -3.461 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -10.930 1.236 -5.233 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -12.678 1.566 -5.218 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -11.774 1.627 -6.750 1.00 0.00 H new ATOM 716 N LEU A 52 -12.602 3.157 -8.276 1.00 0.00 N ATOM 717 CA LEU A 52 -12.428 3.104 -9.723 1.00 0.00 C ATOM 718 C LEU A 52 -13.724 2.672 -10.410 1.00 0.00 C ATOM 719 O LEU A 52 -14.469 1.847 -9.883 1.00 0.00 O ATOM 720 CB LEU A 52 -11.299 2.138 -10.086 1.00 0.00 C ATOM 721 CG LEU A 52 -9.885 2.698 -9.921 1.00 0.00 C ATOM 722 CD1 LEU A 52 -9.690 3.256 -8.520 1.00 0.00 C ATOM 723 CD2 LEU A 52 -8.847 1.626 -10.217 1.00 0.00 C ATOM 0 H LEU A 52 -12.939 2.289 -7.859 1.00 0.00 H new ATOM 0 HA LEU A 52 -12.168 4.104 -10.071 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -11.393 1.245 -9.468 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -11.430 1.824 -11.122 1.00 0.00 H new ATOM 0 HG LEU A 52 -9.754 3.511 -10.636 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -8.678 3.649 -8.423 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -10.409 4.056 -8.344 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -9.843 2.463 -7.788 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -7.848 2.043 -10.094 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -8.979 0.792 -9.528 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -8.970 1.274 -11.241 1.00 0.00 H new ATOM 735 N PRO A 53 -14.008 3.227 -11.603 1.00 0.00 N ATOM 736 CA PRO A 53 -15.218 2.892 -12.358 1.00 0.00 C ATOM 737 C PRO A 53 -15.156 1.493 -12.961 1.00 0.00 C ATOM 738 O PRO A 53 -16.185 0.846 -13.165 1.00 0.00 O ATOM 739 CB PRO A 53 -15.251 3.949 -13.461 1.00 0.00 C ATOM 740 CG PRO A 53 -13.825 4.329 -13.660 1.00 0.00 C ATOM 741 CD PRO A 53 -13.174 4.219 -12.306 1.00 0.00 C ATOM 0 HA PRO A 53 -16.106 2.889 -11.726 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -15.687 3.552 -14.378 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -15.853 4.809 -13.168 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -13.342 3.669 -14.380 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -13.742 5.343 -14.052 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -12.138 3.889 -12.384 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -13.165 5.177 -11.786 1.00 0.00 H new ATOM 749 N GLY A 54 -13.944 1.031 -13.246 1.00 0.00 N ATOM 750 CA GLY A 54 -13.767 -0.289 -13.824 1.00 0.00 C ATOM 751 C GLY A 54 -13.076 -0.243 -15.173 1.00 0.00 C ATOM 752 O GLY A 54 -11.945 0.235 -15.281 1.00 0.00 O ATOM 0 H GLY A 54 -13.079 1.548 -13.087 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -13.183 -0.906 -13.141 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -14.740 -0.768 -13.934 1.00 0.00 H new ATOM 756 N THR A 55 -13.757 -0.736 -16.202 1.00 0.00 N ATOM 757 CA THR A 55 -13.206 -0.752 -17.555 1.00 0.00 C ATOM 758 C THR A 55 -12.044 -1.735 -17.659 1.00 0.00 C ATOM 759 O THR A 55 -12.140 -2.753 -18.345 1.00 0.00 O ATOM 760 CB THR A 55 -12.742 0.648 -17.961 1.00 0.00 C ATOM 761 OG1 THR A 55 -13.722 1.617 -17.627 1.00 0.00 O ATOM 762 CG2 THR A 55 -12.458 0.778 -19.442 1.00 0.00 C ATOM 0 H THR A 55 -14.694 -1.131 -16.126 1.00 0.00 H new ATOM 0 HA THR A 55 -13.995 -1.075 -18.234 1.00 0.00 H new ATOM 0 HB THR A 55 -11.815 0.816 -17.412 1.00 0.00 H new ATOM 0 HG1 THR A 55 -13.407 2.506 -17.893 1.00 0.00 H new ATOM 0 HG21 THR A 55 -12.133 1.795 -19.662 1.00 0.00 H new ATOM 0 HG22 THR A 55 -11.673 0.077 -19.725 1.00 0.00 H new ATOM 0 HG23 THR A 55 -13.363 0.556 -20.007 1.00 0.00 H new ATOM 770 N CYS A 56 -10.949 -1.424 -16.974 1.00 0.00 N ATOM 771 CA CYS A 56 -9.769 -2.281 -16.991 1.00 0.00 C ATOM 772 C CYS A 56 -8.723 -1.787 -15.998 1.00 0.00 C ATOM 773 O CYS A 56 -7.820 -1.031 -16.358 1.00 0.00 O ATOM 774 CB CYS A 56 -9.171 -2.331 -18.397 1.00 0.00 C ATOM 775 SG CYS A 56 -8.454 -3.933 -18.837 1.00 0.00 S ATOM 0 H CYS A 56 -10.854 -0.586 -16.401 1.00 0.00 H new ATOM 0 HA CYS A 56 -10.075 -3.285 -16.698 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -9.948 -2.082 -19.120 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -8.400 -1.565 -18.480 1.00 0.00 H new ATOM 0 HG CYS A 56 -7.976 -3.877 -20.045 1.00 0.00 H new ATOM 781 N VAL A 57 -8.849 -2.218 -14.747 1.00 0.00 N ATOM 782 CA VAL A 57 -7.913 -1.818 -13.703 1.00 0.00 C ATOM 783 C VAL A 57 -7.457 -3.020 -12.883 1.00 0.00 C ATOM 784 O VAL A 57 -8.121 -4.056 -12.857 1.00 0.00 O ATOM 785 CB VAL A 57 -8.536 -0.773 -12.759 1.00 0.00 C ATOM 786 CG1 VAL A 57 -8.713 0.559 -13.473 1.00 0.00 C ATOM 787 CG2 VAL A 57 -9.863 -1.271 -12.209 1.00 0.00 C ATOM 0 H VAL A 57 -9.590 -2.844 -14.432 1.00 0.00 H new ATOM 0 HA VAL A 57 -7.052 -1.376 -14.204 1.00 0.00 H new ATOM 0 HB VAL A 57 -7.856 -0.621 -11.921 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -9.155 1.283 -12.788 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -7.742 0.923 -13.810 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -9.369 0.426 -14.333 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -10.287 -0.518 -11.544 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -10.552 -1.457 -13.033 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -9.703 -2.196 -11.655 1.00 0.00 H new ATOM 797 N TRP A 58 -6.319 -2.871 -12.213 1.00 0.00 N ATOM 798 CA TRP A 58 -5.770 -3.937 -11.388 1.00 0.00 C ATOM 799 C TRP A 58 -6.448 -3.960 -10.023 1.00 0.00 C ATOM 800 O TRP A 58 -6.343 -3.007 -9.252 1.00 0.00 O ATOM 801 CB TRP A 58 -4.263 -3.739 -11.225 1.00 0.00 C ATOM 802 CG TRP A 58 -3.492 -5.020 -11.211 1.00 0.00 C ATOM 803 CD1 TRP A 58 -3.719 -6.095 -10.408 1.00 0.00 C ATOM 804 CD2 TRP A 58 -2.374 -5.361 -12.038 1.00 0.00 C ATOM 805 NE1 TRP A 58 -2.807 -7.086 -10.678 1.00 0.00 N ATOM 806 CE2 TRP A 58 -1.971 -6.659 -11.676 1.00 0.00 C ATOM 807 CE3 TRP A 58 -1.674 -4.695 -13.047 1.00 0.00 C ATOM 808 CZ2 TRP A 58 -0.900 -7.306 -12.289 1.00 0.00 C ATOM 809 CZ3 TRP A 58 -0.611 -5.337 -13.655 1.00 0.00 C ATOM 810 CH2 TRP A 58 -0.232 -6.630 -13.274 1.00 0.00 C ATOM 0 H TRP A 58 -5.759 -2.019 -12.227 1.00 0.00 H new ATOM 0 HA TRP A 58 -5.955 -4.892 -11.879 1.00 0.00 H new ATOM 0 HB2 TRP A 58 -3.897 -3.112 -12.038 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -4.074 -3.200 -10.297 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -4.502 -6.160 -9.667 1.00 0.00 H new ATOM 0 HE1 TRP A 58 -2.760 -7.992 -10.212 1.00 0.00 H new ATOM 0 HE3 TRP A 58 -1.958 -3.697 -13.347 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 -0.608 -8.304 -11.998 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 -0.064 -4.832 -14.437 1.00 0.00 H new ATOM 0 HH2 TRP A 58 0.604 -7.103 -13.767 1.00 0.00 H new ATOM 821 N SER A 59 -7.152 -5.051 -9.729 1.00 0.00 N ATOM 822 CA SER A 59 -7.851 -5.187 -8.455 1.00 0.00 C ATOM 823 C SER A 59 -7.847 -6.633 -7.971 1.00 0.00 C ATOM 824 O SER A 59 -7.526 -7.553 -8.725 1.00 0.00 O ATOM 825 CB SER A 59 -9.292 -4.689 -8.588 1.00 0.00 C ATOM 826 OG SER A 59 -9.800 -4.935 -9.888 1.00 0.00 O ATOM 0 H SER A 59 -7.253 -5.851 -10.354 1.00 0.00 H new ATOM 0 HA SER A 59 -7.324 -4.580 -7.719 1.00 0.00 H new ATOM 0 HB2 SER A 59 -9.921 -5.185 -7.849 1.00 0.00 H new ATOM 0 HB3 SER A 59 -9.332 -3.621 -8.375 1.00 0.00 H new ATOM 0 HG SER A 59 -10.722 -4.609 -9.946 1.00 0.00 H new ATOM 832 N ILE A 60 -8.208 -6.826 -6.704 1.00 0.00 N ATOM 833 CA ILE A 60 -8.251 -8.156 -6.108 1.00 0.00 C ATOM 834 C ILE A 60 -9.223 -8.197 -4.932 1.00 0.00 C ATOM 835 O ILE A 60 -9.500 -7.172 -4.309 1.00 0.00 O ATOM 836 CB ILE A 60 -6.849 -8.603 -5.626 1.00 0.00 C ATOM 837 CG1 ILE A 60 -6.708 -10.126 -5.741 1.00 0.00 C ATOM 838 CG2 ILE A 60 -6.595 -8.136 -4.195 1.00 0.00 C ATOM 839 CD1 ILE A 60 -5.698 -10.729 -4.784 1.00 0.00 C ATOM 0 H ILE A 60 -8.476 -6.074 -6.070 1.00 0.00 H new ATOM 0 HA ILE A 60 -8.594 -8.842 -6.882 1.00 0.00 H new ATOM 0 HB ILE A 60 -6.098 -8.140 -6.266 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -7.681 -10.585 -5.562 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -6.420 -10.377 -6.762 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -5.604 -8.461 -3.877 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -6.651 -7.048 -4.152 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -7.348 -8.565 -3.533 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -5.659 -11.809 -4.929 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -4.714 -10.301 -4.976 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -5.994 -10.511 -3.758 1.00 0.00 H new ATOM 851 N ALA A 61 -9.725 -9.387 -4.622 1.00 0.00 N ATOM 852 CA ALA A 61 -10.647 -9.552 -3.509 1.00 0.00 C ATOM 853 C ALA A 61 -9.935 -9.295 -2.185 1.00 0.00 C ATOM 854 O ALA A 61 -8.738 -9.550 -2.055 1.00 0.00 O ATOM 855 CB ALA A 61 -11.258 -10.946 -3.527 1.00 0.00 C ATOM 0 H ALA A 61 -9.509 -10.248 -5.125 1.00 0.00 H new ATOM 0 HA ALA A 61 -11.451 -8.823 -3.614 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -11.945 -11.053 -2.688 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -11.800 -11.094 -4.461 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -10.467 -11.691 -3.445 1.00 0.00 H new ATOM 861 N SER A 62 -10.673 -8.783 -1.207 1.00 0.00 N ATOM 862 CA SER A 62 -10.104 -8.486 0.103 1.00 0.00 C ATOM 863 C SER A 62 -9.802 -9.759 0.895 1.00 0.00 C ATOM 864 O SER A 62 -9.215 -9.700 1.974 1.00 0.00 O ATOM 865 CB SER A 62 -11.055 -7.593 0.903 1.00 0.00 C ATOM 866 OG SER A 62 -10.345 -6.585 1.601 1.00 0.00 O ATOM 0 H SER A 62 -11.665 -8.565 -1.296 1.00 0.00 H new ATOM 0 HA SER A 62 -9.162 -7.963 -0.062 1.00 0.00 H new ATOM 0 HB2 SER A 62 -11.778 -7.132 0.230 1.00 0.00 H new ATOM 0 HB3 SER A 62 -11.620 -8.200 1.611 1.00 0.00 H new ATOM 0 HG SER A 62 -10.976 -6.028 2.103 1.00 0.00 H new ATOM 872 N GLU A 63 -10.206 -10.910 0.359 1.00 0.00 N ATOM 873 CA GLU A 63 -9.972 -12.182 1.033 1.00 0.00 C ATOM 874 C GLU A 63 -8.700 -12.861 0.526 1.00 0.00 C ATOM 875 O GLU A 63 -8.158 -13.747 1.186 1.00 0.00 O ATOM 876 CB GLU A 63 -11.172 -13.117 0.848 1.00 0.00 C ATOM 877 CG GLU A 63 -11.793 -13.056 -0.540 1.00 0.00 C ATOM 878 CD GLU A 63 -12.770 -14.188 -0.790 1.00 0.00 C ATOM 879 OE1 GLU A 63 -13.255 -14.782 0.195 1.00 0.00 O ATOM 880 OE2 GLU A 63 -13.052 -14.478 -1.973 1.00 0.00 O ATOM 0 H GLU A 63 -10.693 -10.986 -0.534 1.00 0.00 H new ATOM 0 HA GLU A 63 -9.843 -11.971 2.094 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -10.857 -14.141 1.050 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -11.933 -12.866 1.587 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -12.307 -12.103 -0.663 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -11.003 -13.090 -1.290 1.00 0.00 H new ATOM 887 N LEU A 64 -8.223 -12.443 -0.646 1.00 0.00 N ATOM 888 CA LEU A 64 -7.015 -13.021 -1.224 1.00 0.00 C ATOM 889 C LEU A 64 -5.783 -12.169 -0.919 1.00 0.00 C ATOM 890 O LEU A 64 -4.680 -12.488 -1.357 1.00 0.00 O ATOM 891 CB LEU A 64 -7.164 -13.188 -2.740 1.00 0.00 C ATOM 892 CG LEU A 64 -8.569 -12.978 -3.300 1.00 0.00 C ATOM 893 CD1 LEU A 64 -8.525 -12.844 -4.814 1.00 0.00 C ATOM 894 CD2 LEU A 64 -9.478 -14.126 -2.895 1.00 0.00 C ATOM 0 H LEU A 64 -8.653 -11.710 -1.210 1.00 0.00 H new ATOM 0 HA LEU A 64 -6.876 -14.001 -0.767 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -6.490 -12.487 -3.231 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -6.833 -14.191 -3.010 1.00 0.00 H new ATOM 0 HG LEU A 64 -8.971 -12.054 -2.884 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -9.535 -12.695 -5.196 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -7.905 -11.990 -5.086 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -8.104 -13.751 -5.247 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -10.476 -13.961 -3.302 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -9.077 -15.062 -3.284 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -9.534 -14.180 -1.808 1.00 0.00 H new ATOM 906 N ILE A 65 -5.973 -11.084 -0.173 1.00 0.00 N ATOM 907 CA ILE A 65 -4.866 -10.199 0.172 1.00 0.00 C ATOM 908 C ILE A 65 -3.924 -10.853 1.177 1.00 0.00 C ATOM 909 O ILE A 65 -2.749 -11.080 0.885 1.00 0.00 O ATOM 910 CB ILE A 65 -5.372 -8.866 0.753 1.00 0.00 C ATOM 911 CG1 ILE A 65 -6.441 -8.260 -0.159 1.00 0.00 C ATOM 912 CG2 ILE A 65 -4.215 -7.896 0.939 1.00 0.00 C ATOM 913 CD1 ILE A 65 -6.955 -6.920 0.318 1.00 0.00 C ATOM 0 H ILE A 65 -6.878 -10.798 0.202 1.00 0.00 H new ATOM 0 HA ILE A 65 -4.323 -10.003 -0.753 1.00 0.00 H new ATOM 0 HB ILE A 65 -5.820 -9.058 1.728 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -6.029 -8.146 -1.162 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -7.278 -8.954 -0.235 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -4.589 -6.958 1.350 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -3.485 -8.327 1.624 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -3.741 -7.706 -0.024 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -7.709 -6.551 -0.377 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -7.397 -7.031 1.308 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -6.129 -6.210 0.367 1.00 0.00 H new ATOM 925 N GLU A 66 -4.443 -11.150 2.363 1.00 0.00 N ATOM 926 CA GLU A 66 -3.652 -11.770 3.415 1.00 0.00 C ATOM 927 C GLU A 66 -3.114 -13.134 2.981 1.00 0.00 C ATOM 928 O GLU A 66 -2.174 -13.656 3.580 1.00 0.00 O ATOM 929 CB GLU A 66 -4.494 -11.922 4.680 1.00 0.00 C ATOM 930 CG GLU A 66 -5.890 -12.468 4.424 1.00 0.00 C ATOM 931 CD GLU A 66 -6.546 -13.005 5.681 1.00 0.00 C ATOM 932 OE1 GLU A 66 -6.896 -12.191 6.561 1.00 0.00 O ATOM 933 OE2 GLU A 66 -6.709 -14.238 5.785 1.00 0.00 O ATOM 0 H GLU A 66 -5.414 -10.969 2.619 1.00 0.00 H new ATOM 0 HA GLU A 66 -2.800 -11.122 3.620 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -3.976 -12.585 5.373 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -4.577 -10.951 5.169 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -6.513 -11.679 4.002 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -5.834 -13.262 3.680 1.00 0.00 H new ATOM 940 N LYS A 67 -3.717 -13.712 1.945 1.00 0.00 N ATOM 941 CA LYS A 67 -3.292 -15.018 1.451 1.00 0.00 C ATOM 942 C LYS A 67 -2.365 -14.886 0.247 1.00 0.00 C ATOM 943 O LYS A 67 -1.241 -15.389 0.258 1.00 0.00 O ATOM 944 CB LYS A 67 -4.511 -15.864 1.078 1.00 0.00 C ATOM 945 CG LYS A 67 -5.580 -15.902 2.158 1.00 0.00 C ATOM 946 CD LYS A 67 -6.103 -17.314 2.379 1.00 0.00 C ATOM 947 CE LYS A 67 -7.006 -17.757 1.240 1.00 0.00 C ATOM 948 NZ LYS A 67 -8.363 -17.153 1.338 1.00 0.00 N ATOM 0 H LYS A 67 -4.497 -13.299 1.434 1.00 0.00 H new ATOM 0 HA LYS A 67 -2.739 -15.511 2.251 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -4.948 -15.471 0.160 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -4.185 -16.882 0.866 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -5.170 -15.515 3.091 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -6.405 -15.248 1.877 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -5.264 -18.004 2.469 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -6.653 -17.357 3.319 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -6.553 -17.478 0.289 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -7.091 -18.844 1.246 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -8.963 -17.520 0.572 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -8.786 -17.397 2.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -8.290 -16.119 1.255 1.00 0.00 H new ATOM 962 N ARG A 68 -2.842 -14.212 -0.796 1.00 0.00 N ATOM 963 CA ARG A 68 -2.054 -14.024 -2.010 1.00 0.00 C ATOM 964 C ARG A 68 -1.029 -12.908 -1.841 1.00 0.00 C ATOM 965 O ARG A 68 0.175 -13.144 -1.921 1.00 0.00 O ATOM 966 CB ARG A 68 -2.970 -13.719 -3.197 1.00 0.00 C ATOM 967 CG ARG A 68 -4.168 -14.650 -3.293 1.00 0.00 C ATOM 968 CD ARG A 68 -4.766 -14.649 -4.690 1.00 0.00 C ATOM 969 NE ARG A 68 -5.129 -15.995 -5.130 1.00 0.00 N ATOM 970 CZ ARG A 68 -6.002 -16.249 -6.102 1.00 0.00 C ATOM 971 NH1 ARG A 68 -6.602 -15.254 -6.742 1.00 0.00 N ATOM 972 NH2 ARG A 68 -6.275 -17.503 -6.435 1.00 0.00 N ATOM 0 H ARG A 68 -3.769 -13.788 -0.825 1.00 0.00 H new ATOM 0 HA ARG A 68 -1.515 -14.952 -2.203 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -3.324 -12.691 -3.118 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -2.392 -13.787 -4.119 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -3.865 -15.663 -3.027 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -4.926 -14.344 -2.572 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -5.650 -14.011 -4.706 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -4.050 -14.219 -5.391 1.00 0.00 H new ATOM 0 HE ARG A 68 -4.687 -16.787 -4.664 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -6.395 -14.287 -6.490 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -7.270 -15.455 -7.486 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -5.816 -18.272 -5.946 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -6.944 -17.699 -7.180 1.00 0.00 H new ATOM 986 N CYS A 69 -1.512 -11.690 -1.608 1.00 0.00 N ATOM 987 CA CYS A 69 -0.628 -10.541 -1.431 1.00 0.00 C ATOM 988 C CYS A 69 0.367 -10.790 -0.303 1.00 0.00 C ATOM 989 O CYS A 69 0.003 -11.286 0.762 1.00 0.00 O ATOM 990 CB CYS A 69 -1.445 -9.280 -1.141 1.00 0.00 C ATOM 991 SG CYS A 69 -1.800 -8.277 -2.603 1.00 0.00 S ATOM 0 H CYS A 69 -2.506 -11.474 -1.538 1.00 0.00 H new ATOM 0 HA CYS A 69 -0.071 -10.397 -2.357 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -2.387 -9.570 -0.675 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -0.906 -8.669 -0.417 1.00 0.00 H new ATOM 0 HG CYS A 69 -3.018 -7.828 -2.536 1.00 0.00 H new ATOM 997 N ARG A 70 1.629 -10.445 -0.546 1.00 0.00 N ATOM 998 CA ARG A 70 2.677 -10.635 0.449 1.00 0.00 C ATOM 999 C ARG A 70 2.865 -9.376 1.290 1.00 0.00 C ATOM 1000 O ARG A 70 3.009 -9.449 2.511 1.00 0.00 O ATOM 1001 CB ARG A 70 3.994 -11.013 -0.234 1.00 0.00 C ATOM 1002 CG ARG A 70 4.395 -12.464 -0.020 1.00 0.00 C ATOM 1003 CD ARG A 70 5.661 -12.580 0.815 1.00 0.00 C ATOM 1004 NE ARG A 70 5.556 -13.630 1.826 1.00 0.00 N ATOM 1005 CZ ARG A 70 6.600 -14.141 2.474 1.00 0.00 C ATOM 1006 NH1 ARG A 70 7.828 -13.706 2.217 1.00 0.00 N ATOM 1007 NH2 ARG A 70 6.417 -15.092 3.379 1.00 0.00 N ATOM 0 H ARG A 70 1.949 -10.033 -1.423 1.00 0.00 H new ATOM 0 HA ARG A 70 2.374 -11.447 1.110 1.00 0.00 H new ATOM 0 HB2 ARG A 70 3.907 -10.823 -1.304 1.00 0.00 H new ATOM 0 HB3 ARG A 70 4.787 -10.366 0.141 1.00 0.00 H new ATOM 0 HG2 ARG A 70 3.583 -12.997 0.474 1.00 0.00 H new ATOM 0 HG3 ARG A 70 4.551 -12.945 -0.986 1.00 0.00 H new ATOM 0 HD2 ARG A 70 6.508 -12.789 0.162 1.00 0.00 H new ATOM 0 HD3 ARG A 70 5.862 -11.626 1.303 1.00 0.00 H new ATOM 0 HE ARG A 70 4.629 -13.992 2.048 1.00 0.00 H new ATOM 0 HH11 ARG A 70 7.975 -12.976 1.520 1.00 0.00 H new ATOM 0 HH12 ARG A 70 8.624 -14.102 2.717 1.00 0.00 H new ATOM 0 HH21 ARG A 70 5.476 -15.432 3.579 1.00 0.00 H new ATOM 0 HH22 ARG A 70 7.217 -15.484 3.876 1.00 0.00 H new ATOM 1021 N ARG A 71 2.866 -8.221 0.631 1.00 0.00 N ATOM 1022 CA ARG A 71 3.038 -6.949 1.324 1.00 0.00 C ATOM 1023 C ARG A 71 1.875 -6.004 1.036 1.00 0.00 C ATOM 1024 O ARG A 71 1.056 -6.256 0.152 1.00 0.00 O ATOM 1025 CB ARG A 71 4.361 -6.290 0.922 1.00 0.00 C ATOM 1026 CG ARG A 71 4.753 -6.526 -0.529 1.00 0.00 C ATOM 1027 CD ARG A 71 5.778 -7.643 -0.660 1.00 0.00 C ATOM 1028 NE ARG A 71 7.004 -7.359 0.088 1.00 0.00 N ATOM 1029 CZ ARG A 71 7.270 -7.848 1.299 1.00 0.00 C ATOM 1030 NH1 ARG A 71 6.394 -8.629 1.921 1.00 0.00 N ATOM 1031 NH2 ARG A 71 8.416 -7.547 1.893 1.00 0.00 N ATOM 0 H ARG A 71 2.750 -8.140 -0.379 1.00 0.00 H new ATOM 0 HA ARG A 71 3.057 -7.154 2.394 1.00 0.00 H new ATOM 0 HB2 ARG A 71 4.289 -5.217 1.098 1.00 0.00 H new ATOM 0 HB3 ARG A 71 5.154 -6.667 1.568 1.00 0.00 H new ATOM 0 HG2 ARG A 71 3.865 -6.777 -1.110 1.00 0.00 H new ATOM 0 HG3 ARG A 71 5.160 -5.607 -0.950 1.00 0.00 H new ATOM 0 HD2 ARG A 71 5.344 -8.576 -0.302 1.00 0.00 H new ATOM 0 HD3 ARG A 71 6.022 -7.788 -1.712 1.00 0.00 H new ATOM 0 HE ARG A 71 7.698 -6.749 -0.344 1.00 0.00 H new ATOM 0 HH11 ARG A 71 5.508 -8.860 1.472 1.00 0.00 H new ATOM 0 HH12 ARG A 71 6.608 -8.998 2.848 1.00 0.00 H new ATOM 0 HH21 ARG A 71 9.091 -6.943 1.423 1.00 0.00 H new ATOM 0 HH22 ARG A 71 8.623 -7.919 2.820 1.00 0.00 H new ATOM 1045 N MET A 72 1.806 -4.915 1.794 1.00 0.00 N ATOM 1046 CA MET A 72 0.742 -3.938 1.627 1.00 0.00 C ATOM 1047 C MET A 72 1.308 -2.524 1.535 1.00 0.00 C ATOM 1048 O MET A 72 2.417 -2.250 1.996 1.00 0.00 O ATOM 1049 CB MET A 72 -0.241 -4.033 2.795 1.00 0.00 C ATOM 1050 CG MET A 72 -1.507 -4.806 2.462 1.00 0.00 C ATOM 1051 SD MET A 72 -2.436 -5.280 3.932 1.00 0.00 S ATOM 1052 CE MET A 72 -2.389 -7.065 3.798 1.00 0.00 C ATOM 0 H MET A 72 2.475 -4.689 2.530 1.00 0.00 H new ATOM 0 HA MET A 72 0.219 -4.157 0.696 1.00 0.00 H new ATOM 0 HB2 MET A 72 0.256 -4.511 3.639 1.00 0.00 H new ATOM 0 HB3 MET A 72 -0.513 -3.027 3.113 1.00 0.00 H new ATOM 0 HG2 MET A 72 -2.141 -4.198 1.817 1.00 0.00 H new ATOM 0 HG3 MET A 72 -1.244 -5.701 1.898 1.00 0.00 H new ATOM 0 HE1 MET A 72 -3.406 -7.453 3.751 1.00 0.00 H new ATOM 0 HE2 MET A 72 -1.850 -7.348 2.894 1.00 0.00 H new ATOM 0 HE3 MET A 72 -1.882 -7.482 4.668 1.00 0.00 H new ATOM 1062 N VAL A 73 0.532 -1.627 0.942 1.00 0.00 N ATOM 1063 CA VAL A 73 0.946 -0.240 0.794 1.00 0.00 C ATOM 1064 C VAL A 73 -0.211 0.690 1.131 1.00 0.00 C ATOM 1065 O VAL A 73 -1.060 0.972 0.287 1.00 0.00 O ATOM 1066 CB VAL A 73 1.438 0.047 -0.636 1.00 0.00 C ATOM 1067 CG1 VAL A 73 1.912 1.487 -0.770 1.00 0.00 C ATOM 1068 CG2 VAL A 73 2.546 -0.923 -1.020 1.00 0.00 C ATOM 0 H VAL A 73 -0.388 -1.836 0.555 1.00 0.00 H new ATOM 0 HA VAL A 73 1.771 -0.063 1.484 1.00 0.00 H new ATOM 0 HB VAL A 73 0.601 -0.095 -1.320 1.00 0.00 H new ATOM 0 HG11 VAL A 73 2.254 1.664 -1.790 1.00 0.00 H new ATOM 0 HG12 VAL A 73 1.089 2.164 -0.541 1.00 0.00 H new ATOM 0 HG13 VAL A 73 2.733 1.666 -0.075 1.00 0.00 H new ATOM 0 HG21 VAL A 73 2.883 -0.707 -2.034 1.00 0.00 H new ATOM 0 HG22 VAL A 73 3.381 -0.813 -0.329 1.00 0.00 H new ATOM 0 HG23 VAL A 73 2.168 -1.944 -0.973 1.00 0.00 H new ATOM 1078 N VAL A 74 -0.241 1.157 2.374 1.00 0.00 N ATOM 1079 CA VAL A 74 -1.300 2.042 2.825 1.00 0.00 C ATOM 1080 C VAL A 74 -0.949 3.500 2.559 1.00 0.00 C ATOM 1081 O VAL A 74 0.220 3.875 2.531 1.00 0.00 O ATOM 1082 CB VAL A 74 -1.592 1.861 4.328 1.00 0.00 C ATOM 1083 CG1 VAL A 74 -2.507 0.668 4.553 1.00 0.00 C ATOM 1084 CG2 VAL A 74 -0.303 1.711 5.122 1.00 0.00 C ATOM 0 H VAL A 74 0.457 0.936 3.084 1.00 0.00 H new ATOM 0 HA VAL A 74 -2.192 1.775 2.258 1.00 0.00 H new ATOM 0 HB VAL A 74 -2.100 2.757 4.685 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -2.702 0.555 5.619 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -3.448 0.827 4.026 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -2.027 -0.235 4.175 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -0.539 1.585 6.179 1.00 0.00 H new ATOM 0 HG22 VAL A 74 0.244 0.838 4.766 1.00 0.00 H new ATOM 0 HG23 VAL A 74 0.311 2.602 4.991 1.00 0.00 H new ATOM 1094 N VAL A 75 -1.978 4.315 2.362 1.00 0.00 N ATOM 1095 CA VAL A 75 -1.788 5.733 2.098 1.00 0.00 C ATOM 1096 C VAL A 75 -2.367 6.575 3.229 1.00 0.00 C ATOM 1097 O VAL A 75 -3.560 6.878 3.243 1.00 0.00 O ATOM 1098 CB VAL A 75 -2.448 6.143 0.765 1.00 0.00 C ATOM 1099 CG1 VAL A 75 -2.210 7.620 0.474 1.00 0.00 C ATOM 1100 CG2 VAL A 75 -1.927 5.278 -0.372 1.00 0.00 C ATOM 0 H VAL A 75 -2.953 4.016 2.380 1.00 0.00 H new ATOM 0 HA VAL A 75 -0.715 5.912 2.030 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.523 5.987 0.852 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -2.684 7.886 -0.471 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -2.636 8.222 1.276 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -1.139 7.810 0.408 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -2.402 5.579 -1.306 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -0.847 5.401 -0.458 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -2.158 4.232 -0.169 1.00 0.00 H new ATOM 1110 N VAL A 76 -1.516 6.951 4.178 1.00 0.00 N ATOM 1111 CA VAL A 76 -1.952 7.756 5.311 1.00 0.00 C ATOM 1112 C VAL A 76 -1.945 9.240 4.966 1.00 0.00 C ATOM 1113 O VAL A 76 -0.910 9.899 5.027 1.00 0.00 O ATOM 1114 CB VAL A 76 -1.076 7.521 6.561 1.00 0.00 C ATOM 1115 CG1 VAL A 76 0.377 7.876 6.285 1.00 0.00 C ATOM 1116 CG2 VAL A 76 -1.610 8.317 7.746 1.00 0.00 C ATOM 0 H VAL A 76 -0.524 6.712 4.185 1.00 0.00 H new ATOM 0 HA VAL A 76 -2.970 7.441 5.539 1.00 0.00 H new ATOM 0 HB VAL A 76 -1.120 6.461 6.810 1.00 0.00 H new ATOM 0 HG11 VAL A 76 0.971 7.701 7.182 1.00 0.00 H new ATOM 0 HG12 VAL A 76 0.755 7.255 5.473 1.00 0.00 H new ATOM 0 HG13 VAL A 76 0.448 8.926 6.002 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -0.980 8.139 8.618 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -1.602 9.380 7.504 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -2.630 8.003 7.965 1.00 0.00 H new ATOM 1126 N SER A 77 -3.111 9.757 4.609 1.00 0.00 N ATOM 1127 CA SER A 77 -3.251 11.163 4.260 1.00 0.00 C ATOM 1128 C SER A 77 -4.408 11.792 5.027 1.00 0.00 C ATOM 1129 O SER A 77 -5.335 11.099 5.444 1.00 0.00 O ATOM 1130 CB SER A 77 -3.474 11.321 2.754 1.00 0.00 C ATOM 1131 OG SER A 77 -3.183 12.643 2.331 1.00 0.00 O ATOM 0 H SER A 77 -3.977 9.222 4.553 1.00 0.00 H new ATOM 0 HA SER A 77 -2.329 11.676 4.535 1.00 0.00 H new ATOM 0 HB2 SER A 77 -2.843 10.616 2.214 1.00 0.00 H new ATOM 0 HB3 SER A 77 -4.507 11.076 2.509 1.00 0.00 H new ATOM 0 HG SER A 77 -3.619 12.814 1.470 1.00 0.00 H new ATOM 1137 N ASP A 78 -4.344 13.108 5.208 1.00 0.00 N ATOM 1138 CA ASP A 78 -5.382 13.853 5.925 1.00 0.00 C ATOM 1139 C ASP A 78 -6.781 13.311 5.631 1.00 0.00 C ATOM 1140 O ASP A 78 -7.468 12.797 6.515 1.00 0.00 O ATOM 1141 CB ASP A 78 -5.326 15.327 5.515 1.00 0.00 C ATOM 1142 CG ASP A 78 -5.304 16.269 6.700 1.00 0.00 C ATOM 1143 OD1 ASP A 78 -4.203 16.543 7.219 1.00 0.00 O ATOM 1144 OD2 ASP A 78 -6.390 16.732 7.109 1.00 0.00 O ATOM 0 H ASP A 78 -3.578 13.688 4.866 1.00 0.00 H new ATOM 0 HA ASP A 78 -5.191 13.741 6.992 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -4.437 15.496 4.907 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -6.189 15.558 4.890 1.00 0.00 H new ATOM 1149 N ASP A 79 -7.192 13.452 4.378 1.00 0.00 N ATOM 1150 CA ASP A 79 -8.508 13.009 3.927 1.00 0.00 C ATOM 1151 C ASP A 79 -8.752 11.533 4.235 1.00 0.00 C ATOM 1152 O ASP A 79 -9.899 11.087 4.288 1.00 0.00 O ATOM 1153 CB ASP A 79 -8.652 13.254 2.426 1.00 0.00 C ATOM 1154 CG ASP A 79 -8.904 14.711 2.097 1.00 0.00 C ATOM 1155 OD1 ASP A 79 -8.091 15.562 2.515 1.00 0.00 O ATOM 1156 OD2 ASP A 79 -9.915 15.002 1.424 1.00 0.00 O ATOM 0 H ASP A 79 -6.624 13.876 3.645 1.00 0.00 H new ATOM 0 HA ASP A 79 -9.254 13.588 4.471 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -7.746 12.922 1.919 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -9.473 12.650 2.040 1.00 0.00 H new ATOM 1161 N TYR A 80 -7.680 10.778 4.429 1.00 0.00 N ATOM 1162 CA TYR A 80 -7.799 9.356 4.721 1.00 0.00 C ATOM 1163 C TYR A 80 -8.171 9.130 6.182 1.00 0.00 C ATOM 1164 O TYR A 80 -8.970 8.252 6.499 1.00 0.00 O ATOM 1165 CB TYR A 80 -6.487 8.636 4.403 1.00 0.00 C ATOM 1166 CG TYR A 80 -6.603 7.128 4.422 1.00 0.00 C ATOM 1167 CD1 TYR A 80 -6.825 6.444 5.611 1.00 0.00 C ATOM 1168 CD2 TYR A 80 -6.489 6.388 3.251 1.00 0.00 C ATOM 1169 CE1 TYR A 80 -6.932 5.067 5.633 1.00 0.00 C ATOM 1170 CE2 TYR A 80 -6.594 5.010 3.266 1.00 0.00 C ATOM 1171 CZ TYR A 80 -6.815 4.355 4.459 1.00 0.00 C ATOM 1172 OH TYR A 80 -6.919 2.983 4.477 1.00 0.00 O ATOM 0 H TYR A 80 -6.721 11.124 4.390 1.00 0.00 H new ATOM 0 HA TYR A 80 -8.592 8.948 4.094 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -6.138 8.953 3.420 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -5.730 8.943 5.125 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -6.915 6.998 6.533 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -6.316 6.898 2.315 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -7.106 4.551 6.566 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -6.503 4.449 2.348 1.00 0.00 H new ATOM 0 HH TYR A 80 -6.034 2.590 4.625 1.00 0.00 H new ATOM 1182 N LEU A 81 -7.584 9.928 7.064 1.00 0.00 N ATOM 1183 CA LEU A 81 -7.844 9.815 8.487 1.00 0.00 C ATOM 1184 C LEU A 81 -9.149 10.501 8.864 1.00 0.00 C ATOM 1185 O LEU A 81 -9.845 10.070 9.782 1.00 0.00 O ATOM 1186 CB LEU A 81 -6.690 10.431 9.268 1.00 0.00 C ATOM 1187 CG LEU A 81 -5.310 9.875 8.920 1.00 0.00 C ATOM 1188 CD1 LEU A 81 -4.221 10.613 9.683 1.00 0.00 C ATOM 1189 CD2 LEU A 81 -5.259 8.389 9.220 1.00 0.00 C ATOM 0 H LEU A 81 -6.922 10.663 6.814 1.00 0.00 H new ATOM 0 HA LEU A 81 -7.934 8.758 8.737 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.687 11.507 9.095 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -6.869 10.280 10.333 1.00 0.00 H new ATOM 0 HG LEU A 81 -5.134 10.025 7.855 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -3.248 10.200 9.419 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -4.248 11.671 9.424 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -4.385 10.498 10.754 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -4.272 8.001 8.969 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -5.455 8.225 10.280 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -6.014 7.872 8.627 1.00 0.00 H new ATOM 1201 N GLN A 82 -9.478 11.569 8.148 1.00 0.00 N ATOM 1202 CA GLN A 82 -10.701 12.310 8.407 1.00 0.00 C ATOM 1203 C GLN A 82 -11.932 11.446 8.137 1.00 0.00 C ATOM 1204 O GLN A 82 -13.044 11.796 8.529 1.00 0.00 O ATOM 1205 CB GLN A 82 -10.736 13.581 7.552 1.00 0.00 C ATOM 1206 CG GLN A 82 -11.235 13.366 6.131 1.00 0.00 C ATOM 1207 CD GLN A 82 -11.310 14.656 5.339 1.00 0.00 C ATOM 1208 OE1 GLN A 82 -10.934 15.722 5.828 1.00 0.00 O ATOM 1209 NE2 GLN A 82 -11.796 14.565 4.105 1.00 0.00 N ATOM 0 H GLN A 82 -8.913 11.940 7.384 1.00 0.00 H new ATOM 0 HA GLN A 82 -10.716 12.593 9.459 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -11.374 14.317 8.041 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -9.733 14.006 7.512 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -10.573 12.667 5.619 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -12.222 12.905 6.162 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -12.096 13.661 3.740 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -11.869 15.399 3.523 1.00 0.00 H new ATOM 1218 N SER A 83 -11.725 10.316 7.463 1.00 0.00 N ATOM 1219 CA SER A 83 -12.819 9.410 7.139 1.00 0.00 C ATOM 1220 C SER A 83 -12.811 8.190 8.058 1.00 0.00 C ATOM 1221 O SER A 83 -11.771 7.814 8.599 1.00 0.00 O ATOM 1222 CB SER A 83 -12.722 8.966 5.679 1.00 0.00 C ATOM 1223 OG SER A 83 -11.858 7.852 5.537 1.00 0.00 O ATOM 0 H SER A 83 -10.810 10.009 7.132 1.00 0.00 H new ATOM 0 HA SER A 83 -13.757 9.945 7.289 1.00 0.00 H new ATOM 0 HB2 SER A 83 -13.714 8.709 5.308 1.00 0.00 H new ATOM 0 HB3 SER A 83 -12.357 9.792 5.069 1.00 0.00 H new ATOM 0 HG SER A 83 -10.971 8.080 5.885 1.00 0.00 H new ATOM 1229 N LYS A 84 -13.979 7.575 8.225 1.00 0.00 N ATOM 1230 CA LYS A 84 -14.112 6.399 9.070 1.00 0.00 C ATOM 1231 C LYS A 84 -13.476 5.180 8.409 1.00 0.00 C ATOM 1232 O LYS A 84 -13.096 4.223 9.083 1.00 0.00 O ATOM 1233 CB LYS A 84 -15.587 6.133 9.354 1.00 0.00 C ATOM 1234 CG LYS A 84 -16.239 7.193 10.226 1.00 0.00 C ATOM 1235 CD LYS A 84 -17.617 7.576 9.708 1.00 0.00 C ATOM 1236 CE LYS A 84 -17.523 8.488 8.496 1.00 0.00 C ATOM 1237 NZ LYS A 84 -18.494 9.615 8.573 1.00 0.00 N ATOM 0 H LYS A 84 -14.848 7.875 7.783 1.00 0.00 H new ATOM 0 HA LYS A 84 -13.592 6.586 10.009 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -16.125 6.071 8.408 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -15.686 5.163 9.841 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -16.324 6.822 11.248 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -15.604 8.078 10.260 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -18.171 6.675 9.445 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -18.178 8.076 10.498 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -16.511 8.885 8.418 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -17.709 7.910 7.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -18.398 10.214 7.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -19.462 9.237 8.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -18.301 10.182 9.423 1.00 0.00 H new ATOM 1251 N GLU A 85 -13.357 5.225 7.084 1.00 0.00 N ATOM 1252 CA GLU A 85 -12.759 4.130 6.331 1.00 0.00 C ATOM 1253 C GLU A 85 -11.406 3.755 6.921 1.00 0.00 C ATOM 1254 O GLU A 85 -10.976 2.604 6.838 1.00 0.00 O ATOM 1255 CB GLU A 85 -12.601 4.519 4.860 1.00 0.00 C ATOM 1256 CG GLU A 85 -13.876 5.064 4.236 1.00 0.00 C ATOM 1257 CD GLU A 85 -13.785 5.172 2.726 1.00 0.00 C ATOM 1258 OE1 GLU A 85 -13.557 4.134 2.069 1.00 0.00 O ATOM 1259 OE2 GLU A 85 -13.940 6.294 2.201 1.00 0.00 O ATOM 0 H GLU A 85 -13.668 6.010 6.511 1.00 0.00 H new ATOM 0 HA GLU A 85 -13.420 3.266 6.396 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -11.814 5.269 4.773 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -12.274 3.646 4.295 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -14.712 4.416 4.501 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -14.090 6.047 4.655 1.00 0.00 H new ATOM 1266 N CYS A 86 -10.745 4.734 7.532 1.00 0.00 N ATOM 1267 CA CYS A 86 -9.453 4.506 8.153 1.00 0.00 C ATOM 1268 C CYS A 86 -9.639 3.777 9.474 1.00 0.00 C ATOM 1269 O CYS A 86 -8.819 2.944 9.855 1.00 0.00 O ATOM 1270 CB CYS A 86 -8.723 5.832 8.381 1.00 0.00 C ATOM 1271 SG CYS A 86 -7.116 5.664 9.196 1.00 0.00 S ATOM 0 H CYS A 86 -11.087 5.692 7.608 1.00 0.00 H new ATOM 0 HA CYS A 86 -8.848 3.892 7.486 1.00 0.00 H new ATOM 0 HB2 CYS A 86 -8.580 6.325 7.419 1.00 0.00 H new ATOM 0 HB3 CYS A 86 -9.356 6.484 8.983 1.00 0.00 H new ATOM 0 HG CYS A 86 -7.071 4.535 9.838 1.00 0.00 H new ATOM 1277 N ASP A 87 -10.738 4.086 10.161 1.00 0.00 N ATOM 1278 CA ASP A 87 -11.045 3.448 11.432 1.00 0.00 C ATOM 1279 C ASP A 87 -11.133 1.938 11.248 1.00 0.00 C ATOM 1280 O ASP A 87 -10.652 1.167 12.078 1.00 0.00 O ATOM 1281 CB ASP A 87 -12.357 3.991 12.004 1.00 0.00 C ATOM 1282 CG ASP A 87 -12.146 4.793 13.272 1.00 0.00 C ATOM 1283 OD1 ASP A 87 -11.529 4.258 14.218 1.00 0.00 O ATOM 1284 OD2 ASP A 87 -12.596 5.957 13.321 1.00 0.00 O ATOM 0 H ASP A 87 -11.427 4.774 9.856 1.00 0.00 H new ATOM 0 HA ASP A 87 -10.245 3.673 12.137 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -12.844 4.618 11.257 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -13.032 3.160 12.211 1.00 0.00 H new ATOM 1289 N PHE A 88 -11.737 1.528 10.137 1.00 0.00 N ATOM 1290 CA PHE A 88 -11.872 0.113 9.823 1.00 0.00 C ATOM 1291 C PHE A 88 -10.511 -0.462 9.454 1.00 0.00 C ATOM 1292 O PHE A 88 -10.107 -1.517 9.950 1.00 0.00 O ATOM 1293 CB PHE A 88 -12.859 -0.086 8.671 1.00 0.00 C ATOM 1294 CG PHE A 88 -13.230 -1.523 8.441 1.00 0.00 C ATOM 1295 CD1 PHE A 88 -14.184 -2.140 9.234 1.00 0.00 C ATOM 1296 CD2 PHE A 88 -12.627 -2.256 7.433 1.00 0.00 C ATOM 1297 CE1 PHE A 88 -14.529 -3.462 9.026 1.00 0.00 C ATOM 1298 CE2 PHE A 88 -12.967 -3.578 7.218 1.00 0.00 C ATOM 1299 CZ PHE A 88 -13.919 -4.182 8.016 1.00 0.00 C ATOM 0 H PHE A 88 -12.140 2.156 9.441 1.00 0.00 H new ATOM 0 HA PHE A 88 -12.256 -0.409 10.699 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -13.764 0.486 8.875 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -12.425 0.320 7.757 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -14.664 -1.581 10.024 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -11.881 -1.789 6.807 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -15.274 -3.932 9.651 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -12.489 -4.138 6.428 1.00 0.00 H new ATOM 0 HZ PHE A 88 -14.186 -5.215 7.851 1.00 0.00 H new ATOM 1309 N GLN A 89 -9.792 0.262 8.600 1.00 0.00 N ATOM 1310 CA GLN A 89 -8.461 -0.152 8.181 1.00 0.00 C ATOM 1311 C GLN A 89 -7.567 -0.287 9.404 1.00 0.00 C ATOM 1312 O GLN A 89 -6.698 -1.153 9.462 1.00 0.00 O ATOM 1313 CB GLN A 89 -7.866 0.860 7.199 1.00 0.00 C ATOM 1314 CG GLN A 89 -6.664 0.331 6.433 1.00 0.00 C ATOM 1315 CD GLN A 89 -5.423 1.178 6.635 1.00 0.00 C ATOM 1316 OE1 GLN A 89 -5.036 1.952 5.759 1.00 0.00 O ATOM 1317 NE2 GLN A 89 -4.791 1.036 7.794 1.00 0.00 N ATOM 0 H GLN A 89 -10.111 1.138 8.186 1.00 0.00 H new ATOM 0 HA GLN A 89 -8.531 -1.115 7.675 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -8.636 1.160 6.488 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -7.572 1.755 7.747 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -6.457 -0.691 6.750 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -6.904 0.292 5.370 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -5.147 0.383 8.492 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -3.950 1.580 7.986 1.00 0.00 H new ATOM 1326 N THR A 90 -7.811 0.573 10.388 1.00 0.00 N ATOM 1327 CA THR A 90 -7.061 0.559 11.633 1.00 0.00 C ATOM 1328 C THR A 90 -7.187 -0.782 12.309 1.00 0.00 C ATOM 1329 O THR A 90 -6.205 -1.498 12.449 1.00 0.00 O ATOM 1330 CB THR A 90 -7.562 1.665 12.568 1.00 0.00 C ATOM 1331 OG1 THR A 90 -7.566 2.923 11.909 1.00 0.00 O ATOM 1332 CG2 THR A 90 -6.741 1.801 13.831 1.00 0.00 C ATOM 0 H THR A 90 -8.531 1.294 10.343 1.00 0.00 H new ATOM 0 HA THR A 90 -6.011 0.739 11.404 1.00 0.00 H new ATOM 0 HB THR A 90 -8.573 1.369 12.847 1.00 0.00 H new ATOM 0 HG1 THR A 90 -8.338 2.974 11.307 1.00 0.00 H new ATOM 0 HG21 THR A 90 -7.151 2.602 14.447 1.00 0.00 H new ATOM 0 HG22 THR A 90 -6.771 0.864 14.387 1.00 0.00 H new ATOM 0 HG23 THR A 90 -5.709 2.035 13.571 1.00 0.00 H new ATOM 1340 N LYS A 91 -8.394 -1.122 12.727 1.00 0.00 N ATOM 1341 CA LYS A 91 -8.623 -2.390 13.401 1.00 0.00 C ATOM 1342 C LYS A 91 -8.022 -3.549 12.615 1.00 0.00 C ATOM 1343 O LYS A 91 -7.644 -4.571 13.191 1.00 0.00 O ATOM 1344 CB LYS A 91 -10.117 -2.619 13.624 1.00 0.00 C ATOM 1345 CG LYS A 91 -10.635 -2.046 14.934 1.00 0.00 C ATOM 1346 CD LYS A 91 -10.714 -0.528 14.884 1.00 0.00 C ATOM 1347 CE LYS A 91 -11.148 0.050 16.222 1.00 0.00 C ATOM 1348 NZ LYS A 91 -12.597 0.389 16.236 1.00 0.00 N ATOM 0 H LYS A 91 -9.226 -0.543 12.613 1.00 0.00 H new ATOM 0 HA LYS A 91 -8.127 -2.345 14.371 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -10.671 -2.173 12.798 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -10.319 -3.690 13.601 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -11.622 -2.456 15.147 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -9.980 -2.351 15.750 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -9.741 -0.121 14.608 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -11.418 -0.224 14.109 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -10.935 -0.668 17.014 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -10.564 0.945 16.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -12.853 0.780 17.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -12.796 1.093 15.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -13.156 -0.469 16.056 1.00 0.00 H new ATOM 1362 N PHE A 92 -7.925 -3.384 11.304 1.00 0.00 N ATOM 1363 CA PHE A 92 -7.355 -4.421 10.456 1.00 0.00 C ATOM 1364 C PHE A 92 -5.852 -4.215 10.284 1.00 0.00 C ATOM 1365 O PHE A 92 -5.116 -5.152 9.979 1.00 0.00 O ATOM 1366 CB PHE A 92 -8.043 -4.433 9.090 1.00 0.00 C ATOM 1367 CG PHE A 92 -8.281 -5.815 8.550 1.00 0.00 C ATOM 1368 CD1 PHE A 92 -8.831 -6.801 9.353 1.00 0.00 C ATOM 1369 CD2 PHE A 92 -7.954 -6.127 7.240 1.00 0.00 C ATOM 1370 CE1 PHE A 92 -9.051 -8.073 8.860 1.00 0.00 C ATOM 1371 CE2 PHE A 92 -8.172 -7.397 6.741 1.00 0.00 C ATOM 1372 CZ PHE A 92 -8.721 -8.371 7.552 1.00 0.00 C ATOM 0 H PHE A 92 -8.231 -2.548 10.807 1.00 0.00 H new ATOM 0 HA PHE A 92 -7.519 -5.383 10.941 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -8.998 -3.913 9.168 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -7.433 -3.874 8.380 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -9.091 -6.573 10.376 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -7.524 -5.369 6.602 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -9.480 -8.833 9.496 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -7.913 -7.628 5.718 1.00 0.00 H new ATOM 0 HZ PHE A 92 -8.892 -9.364 7.164 1.00 0.00 H new ATOM 1382 N ALA A 93 -5.403 -2.977 10.481 1.00 0.00 N ATOM 1383 CA ALA A 93 -3.991 -2.640 10.349 1.00 0.00 C ATOM 1384 C ALA A 93 -3.263 -2.770 11.683 1.00 0.00 C ATOM 1385 O ALA A 93 -2.064 -3.038 11.727 1.00 0.00 O ATOM 1386 CB ALA A 93 -3.838 -1.235 9.798 1.00 0.00 C ATOM 0 H ALA A 93 -6.001 -2.190 10.733 1.00 0.00 H new ATOM 0 HA ALA A 93 -3.539 -3.346 9.652 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -2.779 -0.994 9.704 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -4.312 -1.175 8.818 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -4.313 -0.525 10.475 1.00 0.00 H new ATOM 1392 N LEU A 94 -3.999 -2.584 12.771 1.00 0.00 N ATOM 1393 CA LEU A 94 -3.431 -2.686 14.102 1.00 0.00 C ATOM 1394 C LEU A 94 -3.460 -4.124 14.565 1.00 0.00 C ATOM 1395 O LEU A 94 -2.474 -4.667 15.063 1.00 0.00 O ATOM 1396 CB LEU A 94 -4.230 -1.815 15.066 1.00 0.00 C ATOM 1397 CG LEU A 94 -5.750 -2.015 15.058 1.00 0.00 C ATOM 1398 CD1 LEU A 94 -6.160 -3.117 16.006 1.00 0.00 C ATOM 1399 CD2 LEU A 94 -6.457 -0.717 15.419 1.00 0.00 C ATOM 0 H LEU A 94 -4.994 -2.361 12.754 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.397 -2.343 14.079 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -3.866 -1.999 16.077 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -4.021 -0.770 14.837 1.00 0.00 H new ATOM 0 HG LEU A 94 -6.046 -2.309 14.051 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -7.243 -3.236 15.979 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -5.685 -4.051 15.706 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -5.848 -2.861 17.019 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -7.535 -0.875 15.409 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -6.146 -0.398 16.414 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -6.197 0.053 14.693 1.00 0.00 H new ATOM 1411 N SER A 95 -4.615 -4.724 14.378 1.00 0.00 N ATOM 1412 CA SER A 95 -4.837 -6.114 14.751 1.00 0.00 C ATOM 1413 C SER A 95 -4.869 -7.005 13.514 1.00 0.00 C ATOM 1414 O SER A 95 -5.820 -7.757 13.300 1.00 0.00 O ATOM 1415 CB SER A 95 -6.146 -6.251 15.534 1.00 0.00 C ATOM 1416 OG SER A 95 -6.325 -7.577 16.000 1.00 0.00 O ATOM 0 H SER A 95 -5.428 -4.268 13.964 1.00 0.00 H new ATOM 0 HA SER A 95 -4.011 -6.435 15.386 1.00 0.00 H new ATOM 0 HB2 SER A 95 -6.142 -5.563 16.379 1.00 0.00 H new ATOM 0 HB3 SER A 95 -6.985 -5.969 14.898 1.00 0.00 H new ATOM 0 HG SER A 95 -6.353 -8.191 15.237 1.00 0.00 H new ATOM 1422 N LEU A 96 -3.821 -6.913 12.703 1.00 0.00 N ATOM 1423 CA LEU A 96 -3.729 -7.715 11.483 1.00 0.00 C ATOM 1424 C LEU A 96 -3.230 -9.123 11.795 1.00 0.00 C ATOM 1425 O LEU A 96 -4.016 -10.067 11.885 1.00 0.00 O ATOM 1426 CB LEU A 96 -2.813 -7.058 10.435 1.00 0.00 C ATOM 1427 CG LEU A 96 -2.116 -5.764 10.859 1.00 0.00 C ATOM 1428 CD1 LEU A 96 -0.890 -6.066 11.711 1.00 0.00 C ATOM 1429 CD2 LEU A 96 -1.725 -4.956 9.632 1.00 0.00 C ATOM 0 H LEU A 96 -3.026 -6.295 12.865 1.00 0.00 H new ATOM 0 HA LEU A 96 -4.734 -7.776 11.065 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -2.049 -7.780 10.148 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -3.406 -6.851 9.544 1.00 0.00 H new ATOM 0 HG LEU A 96 -2.810 -5.177 11.460 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -0.410 -5.132 12.001 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -1.193 -6.611 12.605 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -0.188 -6.672 11.137 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -1.230 -4.037 9.944 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -1.046 -5.541 9.012 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -2.619 -4.710 9.059 1.00 0.00 H new ATOM 1441 N SER A 97 -1.919 -9.254 11.957 1.00 0.00 N ATOM 1442 CA SER A 97 -1.303 -10.541 12.256 1.00 0.00 C ATOM 1443 C SER A 97 -0.222 -10.390 13.326 1.00 0.00 C ATOM 1444 O SER A 97 0.129 -9.275 13.711 1.00 0.00 O ATOM 1445 CB SER A 97 -0.703 -11.145 10.984 1.00 0.00 C ATOM 1446 OG SER A 97 -1.440 -12.279 10.561 1.00 0.00 O ATOM 0 H SER A 97 -1.259 -8.480 11.886 1.00 0.00 H new ATOM 0 HA SER A 97 -2.074 -11.210 12.639 1.00 0.00 H new ATOM 0 HB2 SER A 97 -0.694 -10.397 10.191 1.00 0.00 H new ATOM 0 HB3 SER A 97 0.334 -11.428 11.166 1.00 0.00 H new ATOM 0 HG SER A 97 -1.038 -12.645 9.746 1.00 0.00 H new ATOM 1452 N PRO A 98 0.319 -11.515 13.825 1.00 0.00 N ATOM 1453 CA PRO A 98 1.360 -11.499 14.856 1.00 0.00 C ATOM 1454 C PRO A 98 2.725 -11.099 14.303 1.00 0.00 C ATOM 1455 O PRO A 98 3.589 -11.949 14.079 1.00 0.00 O ATOM 1456 CB PRO A 98 1.386 -12.946 15.346 1.00 0.00 C ATOM 1457 CG PRO A 98 0.950 -13.747 14.168 1.00 0.00 C ATOM 1458 CD PRO A 98 -0.042 -12.892 13.427 1.00 0.00 C ATOM 0 HA PRO A 98 1.149 -10.769 15.638 1.00 0.00 H new ATOM 0 HB2 PRO A 98 2.384 -13.236 15.675 1.00 0.00 H new ATOM 0 HB3 PRO A 98 0.716 -13.090 16.194 1.00 0.00 H new ATOM 0 HG2 PRO A 98 1.799 -13.999 13.532 1.00 0.00 H new ATOM 0 HG3 PRO A 98 0.497 -14.687 14.482 1.00 0.00 H new ATOM 0 HD2 PRO A 98 0.036 -13.031 12.349 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -1.067 -13.134 13.706 1.00 0.00 H new ATOM 1466 N GLY A 99 2.915 -9.802 14.088 1.00 0.00 N ATOM 1467 CA GLY A 99 4.180 -9.314 13.567 1.00 0.00 C ATOM 1468 C GLY A 99 4.058 -8.764 12.160 1.00 0.00 C ATOM 1469 O GLY A 99 4.892 -9.049 11.300 1.00 0.00 O ATOM 0 H GLY A 99 2.217 -9.080 14.265 1.00 0.00 H new ATOM 0 HA2 GLY A 99 4.564 -8.535 14.226 1.00 0.00 H new ATOM 0 HA3 GLY A 99 4.909 -10.125 13.574 1.00 0.00 H new ATOM 1473 N ALA A 100 3.017 -7.972 11.921 1.00 0.00 N ATOM 1474 CA ALA A 100 2.791 -7.380 10.608 1.00 0.00 C ATOM 1475 C ALA A 100 2.183 -5.985 10.729 1.00 0.00 C ATOM 1476 O ALA A 100 1.228 -5.652 10.028 1.00 0.00 O ATOM 1477 CB ALA A 100 1.894 -8.281 9.774 1.00 0.00 C ATOM 0 H ALA A 100 2.317 -7.726 12.620 1.00 0.00 H new ATOM 0 HA ALA A 100 3.755 -7.282 10.109 1.00 0.00 H new ATOM 0 HB1 ALA A 100 1.732 -7.828 8.796 1.00 0.00 H new ATOM 0 HB2 ALA A 100 2.370 -9.254 9.650 1.00 0.00 H new ATOM 0 HB3 ALA A 100 0.936 -8.408 10.278 1.00 0.00 H new ATOM 1483 N HIS A 101 2.744 -5.176 11.619 1.00 0.00 N ATOM 1484 CA HIS A 101 2.256 -3.816 11.827 1.00 0.00 C ATOM 1485 C HIS A 101 2.855 -2.865 10.797 1.00 0.00 C ATOM 1486 O HIS A 101 2.162 -2.011 10.244 1.00 0.00 O ATOM 1487 CB HIS A 101 2.598 -3.339 13.239 1.00 0.00 C ATOM 1488 CG HIS A 101 1.545 -2.468 13.848 1.00 0.00 C ATOM 1489 ND1 HIS A 101 1.190 -1.188 13.581 1.00 0.00 N flip ATOM 1490 CD2 HIS A 101 0.713 -2.888 14.866 1.00 0.00 C flip ATOM 1491 CE1 HIS A 101 0.162 -0.865 14.432 1.00 0.00 C flip ATOM 1492 NE2 HIS A 101 -0.107 -1.907 15.195 1.00 0.00 N flip ATOM 0 H HIS A 101 3.535 -5.436 12.208 1.00 0.00 H new ATOM 0 HA HIS A 101 1.173 -3.821 11.707 1.00 0.00 H new ATOM 0 HB2 HIS A 101 2.754 -4.207 13.879 1.00 0.00 H new ATOM 0 HB3 HIS A 101 3.540 -2.791 13.210 1.00 0.00 H new ATOM 0 HD2 HIS A 101 0.730 -3.867 15.322 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -0.345 0.088 14.470 1.00 0.00 H new ATOM 0 HE2 HIS A 101 -0.827 -1.948 15.917 1.00 0.00 H new ATOM 1501 N GLN A 102 4.148 -3.023 10.546 1.00 0.00 N ATOM 1502 CA GLN A 102 4.853 -2.188 9.582 1.00 0.00 C ATOM 1503 C GLN A 102 5.950 -2.980 8.877 1.00 0.00 C ATOM 1504 O GLN A 102 6.921 -2.410 8.378 1.00 0.00 O ATOM 1505 CB GLN A 102 5.456 -0.967 10.277 1.00 0.00 C ATOM 1506 CG GLN A 102 6.200 -1.303 11.560 1.00 0.00 C ATOM 1507 CD GLN A 102 7.198 -0.232 11.953 1.00 0.00 C ATOM 1508 OE1 GLN A 102 7.065 0.404 12.999 1.00 0.00 O ATOM 1509 NE2 GLN A 102 8.208 -0.027 11.114 1.00 0.00 N ATOM 0 H GLN A 102 4.732 -3.725 10.999 1.00 0.00 H new ATOM 0 HA GLN A 102 4.134 -1.853 8.835 1.00 0.00 H new ATOM 0 HB2 GLN A 102 6.140 -0.469 9.590 1.00 0.00 H new ATOM 0 HB3 GLN A 102 4.660 -0.258 10.504 1.00 0.00 H new ATOM 0 HG2 GLN A 102 5.481 -1.438 12.368 1.00 0.00 H new ATOM 0 HG3 GLN A 102 6.721 -2.252 11.435 1.00 0.00 H new ATOM 0 HE21 GLN A 102 8.280 -0.577 10.258 1.00 0.00 H new ATOM 0 HE22 GLN A 102 8.912 0.680 11.326 1.00 0.00 H new ATOM 1518 N LYS A 103 5.788 -4.301 8.841 1.00 0.00 N ATOM 1519 CA LYS A 103 6.762 -5.174 8.202 1.00 0.00 C ATOM 1520 C LYS A 103 6.379 -5.439 6.750 1.00 0.00 C ATOM 1521 O LYS A 103 7.242 -5.555 5.880 1.00 0.00 O ATOM 1522 CB LYS A 103 6.856 -6.495 8.964 1.00 0.00 C ATOM 1523 CG LYS A 103 7.750 -6.427 10.192 1.00 0.00 C ATOM 1524 CD LYS A 103 6.947 -6.136 11.448 1.00 0.00 C ATOM 1525 CE LYS A 103 7.801 -6.276 12.698 1.00 0.00 C ATOM 1526 NZ LYS A 103 7.889 -7.690 13.155 1.00 0.00 N ATOM 0 H LYS A 103 4.989 -4.788 9.248 1.00 0.00 H new ATOM 0 HA LYS A 103 7.733 -4.678 8.218 1.00 0.00 H new ATOM 0 HB2 LYS A 103 5.855 -6.800 9.270 1.00 0.00 H new ATOM 0 HB3 LYS A 103 7.233 -7.266 8.292 1.00 0.00 H new ATOM 0 HG2 LYS A 103 8.282 -7.371 10.309 1.00 0.00 H new ATOM 0 HG3 LYS A 103 8.504 -5.652 10.053 1.00 0.00 H new ATOM 0 HD2 LYS A 103 6.540 -5.126 11.395 1.00 0.00 H new ATOM 0 HD3 LYS A 103 6.100 -6.819 11.506 1.00 0.00 H new ATOM 0 HE2 LYS A 103 8.803 -5.896 12.498 1.00 0.00 H new ATOM 0 HE3 LYS A 103 7.381 -5.662 13.495 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 8.480 -7.743 14.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 6.936 -8.045 13.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 8.313 -8.272 12.404 1.00 0.00 H new ATOM 1540 N ARG A 104 5.078 -5.535 6.497 1.00 0.00 N ATOM 1541 CA ARG A 104 4.577 -5.786 5.150 1.00 0.00 C ATOM 1542 C ARG A 104 3.825 -4.574 4.611 1.00 0.00 C ATOM 1543 O ARG A 104 3.909 -4.262 3.423 1.00 0.00 O ATOM 1544 CB ARG A 104 3.659 -7.016 5.139 1.00 0.00 C ATOM 1545 CG ARG A 104 2.919 -7.247 6.446 1.00 0.00 C ATOM 1546 CD ARG A 104 1.719 -8.162 6.250 1.00 0.00 C ATOM 1547 NE ARG A 104 2.117 -9.504 5.831 1.00 0.00 N ATOM 1548 CZ ARG A 104 1.290 -10.375 5.257 1.00 0.00 C ATOM 1549 NH1 ARG A 104 0.024 -10.052 5.034 1.00 0.00 N ATOM 1550 NH2 ARG A 104 1.733 -11.576 4.906 1.00 0.00 N ATOM 0 H ARG A 104 4.351 -5.443 7.207 1.00 0.00 H new ATOM 0 HA ARG A 104 5.435 -5.976 4.505 1.00 0.00 H new ATOM 0 HB2 ARG A 104 2.931 -6.906 4.336 1.00 0.00 H new ATOM 0 HB3 ARG A 104 4.255 -7.899 4.910 1.00 0.00 H new ATOM 0 HG2 ARG A 104 3.598 -7.686 7.177 1.00 0.00 H new ATOM 0 HG3 ARG A 104 2.587 -6.291 6.852 1.00 0.00 H new ATOM 0 HD2 ARG A 104 1.155 -8.225 7.181 1.00 0.00 H new ATOM 0 HD3 ARG A 104 1.053 -7.731 5.502 1.00 0.00 H new ATOM 0 HE ARG A 104 3.084 -9.790 5.987 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -0.322 -9.131 5.303 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -0.604 -10.724 4.594 1.00 0.00 H new ATOM 0 HH21 ARG A 104 2.706 -11.831 5.076 1.00 0.00 H new ATOM 0 HH22 ARG A 104 1.100 -12.244 4.466 1.00 0.00 H new ATOM 1564 N LEU A 105 3.094 -3.892 5.486 1.00 0.00 N ATOM 1565 CA LEU A 105 2.331 -2.716 5.088 1.00 0.00 C ATOM 1566 C LEU A 105 3.085 -1.438 5.429 1.00 0.00 C ATOM 1567 O LEU A 105 3.574 -1.274 6.547 1.00 0.00 O ATOM 1568 CB LEU A 105 0.960 -2.705 5.767 1.00 0.00 C ATOM 1569 CG LEU A 105 0.918 -3.306 7.171 1.00 0.00 C ATOM 1570 CD1 LEU A 105 -0.116 -2.589 8.026 1.00 0.00 C ATOM 1571 CD2 LEU A 105 0.617 -4.794 7.100 1.00 0.00 C ATOM 0 H LEU A 105 3.014 -4.133 6.474 1.00 0.00 H new ATOM 0 HA LEU A 105 2.190 -2.761 4.008 1.00 0.00 H new ATOM 0 HB2 LEU A 105 0.609 -1.675 5.821 1.00 0.00 H new ATOM 0 HB3 LEU A 105 0.257 -3.249 5.136 1.00 0.00 H new ATOM 0 HG LEU A 105 1.895 -3.174 7.635 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -0.133 -3.030 9.023 1.00 0.00 H new ATOM 0 HD12 LEU A 105 0.143 -1.533 8.101 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -1.100 -2.690 7.568 1.00 0.00 H new ATOM 0 HD21 LEU A 105 0.590 -5.208 8.108 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -0.349 -4.947 6.619 1.00 0.00 H new ATOM 0 HD23 LEU A 105 1.394 -5.295 6.522 1.00 0.00 H new ATOM 1583 N ILE A 106 3.175 -0.533 4.459 1.00 0.00 N ATOM 1584 CA ILE A 106 3.870 0.731 4.661 1.00 0.00 C ATOM 1585 C ILE A 106 2.996 1.922 4.260 1.00 0.00 C ATOM 1586 O ILE A 106 2.418 1.940 3.173 1.00 0.00 O ATOM 1587 CB ILE A 106 5.187 0.788 3.863 1.00 0.00 C ATOM 1588 CG1 ILE A 106 4.958 0.343 2.412 1.00 0.00 C ATOM 1589 CG2 ILE A 106 6.255 -0.065 4.538 1.00 0.00 C ATOM 1590 CD1 ILE A 106 5.019 -1.157 2.206 1.00 0.00 C ATOM 0 H ILE A 106 2.776 -0.652 3.528 1.00 0.00 H new ATOM 0 HA ILE A 106 4.094 0.792 5.726 1.00 0.00 H new ATOM 0 HB ILE A 106 5.540 1.819 3.845 1.00 0.00 H new ATOM 0 HG12 ILE A 106 3.984 0.705 2.082 1.00 0.00 H new ATOM 0 HG13 ILE A 106 5.706 0.817 1.776 1.00 0.00 H new ATOM 0 HG21 ILE A 106 7.179 -0.014 3.962 1.00 0.00 H new ATOM 0 HG22 ILE A 106 6.435 0.308 5.546 1.00 0.00 H new ATOM 0 HG23 ILE A 106 5.916 -1.100 4.589 1.00 0.00 H new ATOM 0 HD11 ILE A 106 4.847 -1.387 1.155 1.00 0.00 H new ATOM 0 HD12 ILE A 106 6.001 -1.525 2.502 1.00 0.00 H new ATOM 0 HD13 ILE A 106 4.253 -1.639 2.813 1.00 0.00 H new ATOM 1602 N PRO A 107 2.886 2.932 5.143 1.00 0.00 N ATOM 1603 CA PRO A 107 2.081 4.133 4.887 1.00 0.00 C ATOM 1604 C PRO A 107 2.733 5.078 3.881 1.00 0.00 C ATOM 1605 O PRO A 107 3.957 5.138 3.772 1.00 0.00 O ATOM 1606 CB PRO A 107 2.009 4.801 6.260 1.00 0.00 C ATOM 1607 CG PRO A 107 3.263 4.379 6.941 1.00 0.00 C ATOM 1608 CD PRO A 107 3.533 2.978 6.468 1.00 0.00 C ATOM 0 HA PRO A 107 1.112 3.884 4.455 1.00 0.00 H new ATOM 0 HB2 PRO A 107 1.950 5.886 6.172 1.00 0.00 H new ATOM 0 HB3 PRO A 107 1.128 4.478 6.814 1.00 0.00 H new ATOM 0 HG2 PRO A 107 4.089 5.044 6.687 1.00 0.00 H new ATOM 0 HG3 PRO A 107 3.150 4.411 8.025 1.00 0.00 H new ATOM 0 HD2 PRO A 107 4.602 2.776 6.400 1.00 0.00 H new ATOM 0 HD3 PRO A 107 3.111 2.237 7.147 1.00 0.00 H new ATOM 1616 N ILE A 108 1.901 5.814 3.153 1.00 0.00 N ATOM 1617 CA ILE A 108 2.383 6.764 2.156 1.00 0.00 C ATOM 1618 C ILE A 108 1.409 7.934 2.016 1.00 0.00 C ATOM 1619 O ILE A 108 0.244 7.831 2.402 1.00 0.00 O ATOM 1620 CB ILE A 108 2.580 6.074 0.786 1.00 0.00 C ATOM 1621 CG1 ILE A 108 3.741 5.082 0.859 1.00 0.00 C ATOM 1622 CG2 ILE A 108 2.830 7.098 -0.315 1.00 0.00 C ATOM 1623 CD1 ILE A 108 3.327 3.696 1.299 1.00 0.00 C ATOM 0 H ILE A 108 0.885 5.771 3.235 1.00 0.00 H new ATOM 0 HA ILE A 108 3.347 7.145 2.493 1.00 0.00 H new ATOM 0 HB ILE A 108 1.665 5.535 0.543 1.00 0.00 H new ATOM 0 HG12 ILE A 108 4.214 5.017 -0.121 1.00 0.00 H new ATOM 0 HG13 ILE A 108 4.492 5.464 1.551 1.00 0.00 H new ATOM 0 HG21 ILE A 108 2.965 6.584 -1.266 1.00 0.00 H new ATOM 0 HG22 ILE A 108 1.977 7.773 -0.385 1.00 0.00 H new ATOM 0 HG23 ILE A 108 3.727 7.671 -0.082 1.00 0.00 H new ATOM 0 HD11 ILE A 108 4.202 3.047 1.328 1.00 0.00 H new ATOM 0 HD12 ILE A 108 2.881 3.748 2.292 1.00 0.00 H new ATOM 0 HD13 ILE A 108 2.599 3.293 0.595 1.00 0.00 H new ATOM 1635 N LYS A 109 1.888 9.047 1.464 1.00 0.00 N ATOM 1636 CA LYS A 109 1.049 10.226 1.282 1.00 0.00 C ATOM 1637 C LYS A 109 1.733 11.265 0.396 1.00 0.00 C ATOM 1638 O LYS A 109 2.957 11.392 0.401 1.00 0.00 O ATOM 1639 CB LYS A 109 0.695 10.843 2.637 1.00 0.00 C ATOM 1640 CG LYS A 109 1.874 11.483 3.353 1.00 0.00 C ATOM 1641 CD LYS A 109 2.596 10.484 4.243 1.00 0.00 C ATOM 1642 CE LYS A 109 2.225 10.669 5.706 1.00 0.00 C ATOM 1643 NZ LYS A 109 3.106 11.663 6.382 1.00 0.00 N ATOM 0 H LYS A 109 2.848 9.156 1.137 1.00 0.00 H new ATOM 0 HA LYS A 109 0.133 9.908 0.784 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -0.080 11.596 2.491 1.00 0.00 H new ATOM 0 HB3 LYS A 109 0.271 10.069 3.277 1.00 0.00 H new ATOM 0 HG2 LYS A 109 2.571 11.887 2.619 1.00 0.00 H new ATOM 0 HG3 LYS A 109 1.524 12.321 3.955 1.00 0.00 H new ATOM 0 HD2 LYS A 109 2.348 9.470 3.929 1.00 0.00 H new ATOM 0 HD3 LYS A 109 3.673 10.600 4.122 1.00 0.00 H new ATOM 0 HE2 LYS A 109 1.187 10.995 5.779 1.00 0.00 H new ATOM 0 HE3 LYS A 109 2.295 9.712 6.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 2.788 11.798 7.363 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 4.086 11.316 6.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 3.059 12.570 5.875 1.00 0.00 H new ATOM 1657 N TYR A 110 0.928 12.008 -0.357 1.00 0.00 N ATOM 1658 CA TYR A 110 1.444 13.044 -1.244 1.00 0.00 C ATOM 1659 C TYR A 110 0.955 14.420 -0.798 1.00 0.00 C ATOM 1660 O TYR A 110 0.464 15.209 -1.605 1.00 0.00 O ATOM 1661 CB TYR A 110 1.006 12.774 -2.685 1.00 0.00 C ATOM 1662 CG TYR A 110 1.953 13.334 -3.724 1.00 0.00 C ATOM 1663 CD1 TYR A 110 1.843 14.650 -4.155 1.00 0.00 C ATOM 1664 CD2 TYR A 110 2.956 12.546 -4.273 1.00 0.00 C ATOM 1665 CE1 TYR A 110 2.706 15.166 -5.103 1.00 0.00 C ATOM 1666 CE2 TYR A 110 3.823 13.055 -5.221 1.00 0.00 C ATOM 1667 CZ TYR A 110 3.694 14.364 -5.633 1.00 0.00 C ATOM 1668 OH TYR A 110 4.556 14.873 -6.578 1.00 0.00 O ATOM 0 H TYR A 110 -0.087 11.911 -0.370 1.00 0.00 H new ATOM 0 HA TYR A 110 2.533 13.028 -1.197 1.00 0.00 H new ATOM 0 HB2 TYR A 110 0.915 11.698 -2.832 1.00 0.00 H new ATOM 0 HB3 TYR A 110 0.016 13.202 -2.841 1.00 0.00 H new ATOM 0 HD1 TYR A 110 1.070 15.281 -3.742 1.00 0.00 H new ATOM 0 HD2 TYR A 110 3.060 11.519 -3.954 1.00 0.00 H new ATOM 0 HE1 TYR A 110 2.607 16.192 -5.427 1.00 0.00 H new ATOM 0 HE2 TYR A 110 4.599 12.430 -5.638 1.00 0.00 H new ATOM 0 HH TYR A 110 5.193 14.179 -6.847 1.00 0.00 H new ATOM 1678 N LYS A 111 1.086 14.694 0.495 1.00 0.00 N ATOM 1679 CA LYS A 111 0.653 15.969 1.054 1.00 0.00 C ATOM 1680 C LYS A 111 1.093 16.098 2.510 1.00 0.00 C ATOM 1681 O LYS A 111 1.892 15.301 2.998 1.00 0.00 O ATOM 1682 CB LYS A 111 -0.869 16.095 0.953 1.00 0.00 C ATOM 1683 CG LYS A 111 -1.613 15.001 1.700 1.00 0.00 C ATOM 1684 CD LYS A 111 -2.794 15.561 2.478 1.00 0.00 C ATOM 1685 CE LYS A 111 -3.866 16.106 1.547 1.00 0.00 C ATOM 1686 NZ LYS A 111 -5.235 15.900 2.096 1.00 0.00 N ATOM 0 H LYS A 111 1.489 14.050 1.176 1.00 0.00 H new ATOM 0 HA LYS A 111 1.117 16.772 0.482 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -1.173 17.065 1.346 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -1.160 16.071 -0.097 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -1.965 14.251 0.992 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -0.931 14.498 2.385 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -3.220 14.780 3.107 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -2.450 16.354 3.143 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -3.697 17.170 1.382 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -3.787 15.617 0.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -5.937 16.285 1.432 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -5.406 14.883 2.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -5.319 16.388 3.010 1.00 0.00 H new ATOM 1700 N ALA A 112 0.568 17.107 3.201 1.00 0.00 N ATOM 1701 CA ALA A 112 0.910 17.334 4.599 1.00 0.00 C ATOM 1702 C ALA A 112 -0.284 17.073 5.513 1.00 0.00 C ATOM 1703 O ALA A 112 -1.334 17.700 5.380 1.00 0.00 O ATOM 1704 CB ALA A 112 1.424 18.752 4.792 1.00 0.00 C ATOM 0 H ALA A 112 -0.095 17.779 2.814 1.00 0.00 H new ATOM 0 HA ALA A 112 1.698 16.631 4.870 1.00 0.00 H new ATOM 0 HB1 ALA A 112 1.676 18.908 5.841 1.00 0.00 H new ATOM 0 HB2 ALA A 112 2.313 18.904 4.179 1.00 0.00 H new ATOM 0 HB3 ALA A 112 0.653 19.462 4.494 1.00 0.00 H new ATOM 1710 N MET A 113 -0.110 16.135 6.440 1.00 0.00 N ATOM 1711 CA MET A 113 -1.157 15.771 7.381 1.00 0.00 C ATOM 1712 C MET A 113 -1.166 16.709 8.585 1.00 0.00 C ATOM 1713 O MET A 113 -0.129 16.960 9.198 1.00 0.00 O ATOM 1714 CB MET A 113 -0.930 14.337 7.841 1.00 0.00 C ATOM 1715 CG MET A 113 -1.527 13.297 6.908 1.00 0.00 C ATOM 1716 SD MET A 113 -0.973 11.623 7.287 1.00 0.00 S ATOM 1717 CE MET A 113 -0.828 11.698 9.070 1.00 0.00 C ATOM 0 H MET A 113 0.757 15.610 6.557 1.00 0.00 H new ATOM 0 HA MET A 113 -2.123 15.857 6.884 1.00 0.00 H new ATOM 0 HB2 MET A 113 0.141 14.159 7.932 1.00 0.00 H new ATOM 0 HB3 MET A 113 -1.360 14.211 8.835 1.00 0.00 H new ATOM 0 HG2 MET A 113 -2.614 13.339 6.972 1.00 0.00 H new ATOM 0 HG3 MET A 113 -1.259 13.540 5.880 1.00 0.00 H new ATOM 0 HE1 MET A 113 -0.360 10.784 9.436 1.00 0.00 H new ATOM 0 HE2 MET A 113 -0.216 12.556 9.350 1.00 0.00 H new ATOM 0 HE3 MET A 113 -1.819 11.800 9.512 1.00 0.00 H new ATOM 1727 N LYS A 114 -2.347 17.226 8.916 1.00 0.00 N ATOM 1728 CA LYS A 114 -2.497 18.140 10.043 1.00 0.00 C ATOM 1729 C LYS A 114 -3.546 17.637 11.041 1.00 0.00 C ATOM 1730 O LYS A 114 -3.747 18.244 12.093 1.00 0.00 O ATOM 1731 CB LYS A 114 -2.887 19.532 9.543 1.00 0.00 C ATOM 1732 CG LYS A 114 -1.721 20.505 9.481 1.00 0.00 C ATOM 1733 CD LYS A 114 -1.708 21.277 8.171 1.00 0.00 C ATOM 1734 CE LYS A 114 -1.373 20.372 6.997 1.00 0.00 C ATOM 1735 NZ LYS A 114 -1.428 21.101 5.699 1.00 0.00 N ATOM 0 H LYS A 114 -3.215 17.026 8.418 1.00 0.00 H new ATOM 0 HA LYS A 114 -1.537 18.191 10.557 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -3.327 19.442 8.550 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -3.657 19.941 10.197 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -1.784 21.203 10.315 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -0.784 19.959 9.592 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -2.682 21.739 8.010 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -0.978 22.084 8.230 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -0.377 19.952 7.135 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -2.071 19.535 6.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -1.243 20.437 4.920 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -2.371 21.523 5.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -0.709 21.852 5.692 1.00 0.00 H new ATOM 1749 N LYS A 115 -4.208 16.530 10.712 1.00 0.00 N ATOM 1750 CA LYS A 115 -5.227 15.965 11.594 1.00 0.00 C ATOM 1751 C LYS A 115 -4.593 14.996 12.591 1.00 0.00 C ATOM 1752 O LYS A 115 -3.396 15.084 12.867 1.00 0.00 O ATOM 1753 CB LYS A 115 -6.335 15.291 10.775 1.00 0.00 C ATOM 1754 CG LYS A 115 -5.870 14.754 9.441 1.00 0.00 C ATOM 1755 CD LYS A 115 -5.006 13.526 9.622 1.00 0.00 C ATOM 1756 CE LYS A 115 -3.530 13.815 9.417 1.00 0.00 C ATOM 1757 NZ LYS A 115 -2.780 13.842 10.703 1.00 0.00 N ATOM 0 H LYS A 115 -4.059 16.009 9.848 1.00 0.00 H new ATOM 0 HA LYS A 115 -5.685 16.773 12.164 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -6.757 14.472 11.358 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -7.137 16.010 10.607 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -6.734 14.507 8.823 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -5.308 15.523 8.911 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -5.158 13.124 10.624 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -5.323 12.756 8.918 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -3.100 13.056 8.763 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -3.416 14.774 8.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -1.769 13.685 10.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -2.909 14.767 11.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -3.138 13.093 11.329 1.00 0.00 H new ATOM 1771 N GLU A 116 -5.385 14.083 13.140 1.00 0.00 N ATOM 1772 CA GLU A 116 -4.869 13.124 14.111 1.00 0.00 C ATOM 1773 C GLU A 116 -4.397 11.852 13.419 1.00 0.00 C ATOM 1774 O GLU A 116 -5.113 11.277 12.600 1.00 0.00 O ATOM 1775 CB GLU A 116 -5.924 12.780 15.174 1.00 0.00 C ATOM 1776 CG GLU A 116 -7.247 13.518 15.012 1.00 0.00 C ATOM 1777 CD GLU A 116 -8.222 13.221 16.134 1.00 0.00 C ATOM 1778 OE1 GLU A 116 -8.109 13.858 17.202 1.00 0.00 O ATOM 1779 OE2 GLU A 116 -9.099 12.353 15.944 1.00 0.00 O ATOM 0 H GLU A 116 -6.379 13.986 12.932 1.00 0.00 H new ATOM 0 HA GLU A 116 -4.019 13.591 14.609 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -6.115 11.707 15.145 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -5.515 13.004 16.159 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -7.058 14.591 14.975 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -7.699 13.241 14.060 1.00 0.00 H new ATOM 1786 N PHE A 117 -3.191 11.415 13.761 1.00 0.00 N ATOM 1787 CA PHE A 117 -2.625 10.207 13.176 1.00 0.00 C ATOM 1788 C PHE A 117 -3.060 8.972 13.962 1.00 0.00 C ATOM 1789 O PHE A 117 -3.041 8.972 15.191 1.00 0.00 O ATOM 1790 CB PHE A 117 -1.094 10.274 13.132 1.00 0.00 C ATOM 1791 CG PHE A 117 -0.475 11.061 14.253 1.00 0.00 C ATOM 1792 CD1 PHE A 117 -0.489 10.572 15.551 1.00 0.00 C ATOM 1793 CD2 PHE A 117 0.121 12.288 14.010 1.00 0.00 C ATOM 1794 CE1 PHE A 117 0.079 11.294 16.584 1.00 0.00 C ATOM 1795 CE2 PHE A 117 0.691 13.013 15.039 1.00 0.00 C ATOM 1796 CZ PHE A 117 0.670 12.516 16.328 1.00 0.00 C ATOM 0 H PHE A 117 -2.587 11.879 14.440 1.00 0.00 H new ATOM 0 HA PHE A 117 -2.999 10.133 12.155 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -0.697 9.259 13.154 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -0.789 10.715 12.183 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -0.949 9.617 15.757 1.00 0.00 H new ATOM 0 HD2 PHE A 117 0.140 12.682 13.005 1.00 0.00 H new ATOM 0 HE1 PHE A 117 0.061 10.903 17.591 1.00 0.00 H new ATOM 0 HE2 PHE A 117 1.153 13.968 14.836 1.00 0.00 H new ATOM 0 HZ PHE A 117 1.115 13.082 17.134 1.00 0.00 H new ATOM 1806 N PRO A 118 -3.462 7.902 13.257 1.00 0.00 N ATOM 1807 CA PRO A 118 -3.900 6.665 13.893 1.00 0.00 C ATOM 1808 C PRO A 118 -2.742 5.816 14.375 1.00 0.00 C ATOM 1809 O PRO A 118 -1.687 5.788 13.744 1.00 0.00 O ATOM 1810 CB PRO A 118 -4.664 5.954 12.778 1.00 0.00 C ATOM 1811 CG PRO A 118 -4.022 6.421 11.518 1.00 0.00 C ATOM 1812 CD PRO A 118 -3.517 7.814 11.785 1.00 0.00 C ATOM 0 HA PRO A 118 -4.495 6.852 14.787 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -4.594 4.871 12.879 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -5.724 6.209 12.800 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -3.204 5.760 11.232 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -4.736 6.419 10.695 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -2.535 7.974 11.339 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -4.184 8.567 11.365 1.00 0.00 H new ATOM 1820 N SER A 119 -2.954 5.108 15.484 1.00 0.00 N ATOM 1821 CA SER A 119 -1.931 4.221 16.033 1.00 0.00 C ATOM 1822 C SER A 119 -1.641 3.163 14.989 1.00 0.00 C ATOM 1823 O SER A 119 -2.075 2.015 15.096 1.00 0.00 O ATOM 1824 CB SER A 119 -2.409 3.574 17.335 1.00 0.00 C ATOM 1825 OG SER A 119 -3.692 2.996 17.176 1.00 0.00 O ATOM 0 H SER A 119 -3.823 5.132 16.018 1.00 0.00 H new ATOM 0 HA SER A 119 -1.029 4.786 16.269 1.00 0.00 H new ATOM 0 HB2 SER A 119 -1.698 2.809 17.647 1.00 0.00 H new ATOM 0 HB3 SER A 119 -2.439 4.322 18.127 1.00 0.00 H new ATOM 0 HG SER A 119 -3.671 2.349 16.440 1.00 0.00 H new ATOM 1831 N ILE A 120 -0.972 3.600 13.937 1.00 0.00 N ATOM 1832 CA ILE A 120 -0.683 2.760 12.801 1.00 0.00 C ATOM 1833 C ILE A 120 0.631 3.176 12.144 1.00 0.00 C ATOM 1834 O ILE A 120 1.472 2.340 11.822 1.00 0.00 O ATOM 1835 CB ILE A 120 -1.859 2.900 11.813 1.00 0.00 C ATOM 1836 CG1 ILE A 120 -3.120 2.291 12.421 1.00 0.00 C ATOM 1837 CG2 ILE A 120 -1.562 2.275 10.471 1.00 0.00 C ATOM 1838 CD1 ILE A 120 -4.292 2.251 11.471 1.00 0.00 C ATOM 0 H ILE A 120 -0.615 4.552 13.852 1.00 0.00 H new ATOM 0 HA ILE A 120 -0.571 1.721 13.112 1.00 0.00 H new ATOM 0 HB ILE A 120 -2.016 3.964 11.636 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -2.899 1.277 12.754 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -3.400 2.864 13.305 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -2.422 2.401 9.813 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -0.692 2.760 10.028 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -1.358 1.212 10.602 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -5.152 1.806 11.972 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -4.540 3.265 11.157 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -4.032 1.654 10.597 1.00 0.00 H new ATOM 1850 N LEU A 121 0.794 4.482 11.965 1.00 0.00 N ATOM 1851 CA LEU A 121 2.004 5.036 11.366 1.00 0.00 C ATOM 1852 C LEU A 121 2.664 6.022 12.324 1.00 0.00 C ATOM 1853 O LEU A 121 3.274 7.005 11.903 1.00 0.00 O ATOM 1854 CB LEU A 121 1.680 5.732 10.039 1.00 0.00 C ATOM 1855 CG LEU A 121 0.375 6.535 10.015 1.00 0.00 C ATOM 1856 CD1 LEU A 121 -0.826 5.602 9.999 1.00 0.00 C ATOM 1857 CD2 LEU A 121 0.305 7.482 11.208 1.00 0.00 C ATOM 0 H LEU A 121 0.099 5.181 12.228 1.00 0.00 H new ATOM 0 HA LEU A 121 2.695 4.216 11.169 1.00 0.00 H new ATOM 0 HB2 LEU A 121 2.503 6.402 9.790 1.00 0.00 H new ATOM 0 HB3 LEU A 121 1.636 4.977 9.254 1.00 0.00 H new ATOM 0 HG LEU A 121 0.356 7.133 9.104 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -1.743 6.190 9.982 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -0.784 4.970 9.112 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -0.813 4.976 10.891 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -0.629 8.043 11.173 1.00 0.00 H new ATOM 0 HD22 LEU A 121 0.348 6.906 12.133 1.00 0.00 H new ATOM 0 HD23 LEU A 121 1.146 8.175 11.173 1.00 0.00 H new ATOM 1869 N ARG A 122 2.524 5.751 13.619 1.00 0.00 N ATOM 1870 CA ARG A 122 3.086 6.605 14.664 1.00 0.00 C ATOM 1871 C ARG A 122 4.513 7.043 14.346 1.00 0.00 C ATOM 1872 O ARG A 122 4.882 8.193 14.585 1.00 0.00 O ATOM 1873 CB ARG A 122 3.054 5.876 16.009 1.00 0.00 C ATOM 1874 CG ARG A 122 3.583 4.452 15.943 1.00 0.00 C ATOM 1875 CD ARG A 122 3.067 3.610 17.098 1.00 0.00 C ATOM 1876 NE ARG A 122 4.008 2.557 17.473 1.00 0.00 N ATOM 1877 CZ ARG A 122 3.668 1.467 18.157 1.00 0.00 C ATOM 1878 NH1 ARG A 122 2.412 1.281 18.543 1.00 0.00 N ATOM 1879 NH2 ARG A 122 4.586 0.558 18.454 1.00 0.00 N ATOM 0 H ARG A 122 2.021 4.938 13.973 1.00 0.00 H new ATOM 0 HA ARG A 122 2.471 7.503 14.715 1.00 0.00 H new ATOM 0 HB2 ARG A 122 3.643 6.440 16.732 1.00 0.00 H new ATOM 0 HB3 ARG A 122 2.029 5.857 16.378 1.00 0.00 H new ATOM 0 HG2 ARG A 122 3.286 3.996 14.998 1.00 0.00 H new ATOM 0 HG3 ARG A 122 4.673 4.467 15.961 1.00 0.00 H new ATOM 0 HD2 ARG A 122 2.880 4.252 17.959 1.00 0.00 H new ATOM 0 HD3 ARG A 122 2.113 3.161 16.821 1.00 0.00 H new ATOM 0 HE ARG A 122 4.983 2.664 17.194 1.00 0.00 H new ATOM 0 HH11 ARG A 122 1.700 1.976 18.316 1.00 0.00 H new ATOM 0 HH12 ARG A 122 2.158 0.443 19.067 1.00 0.00 H new ATOM 0 HH21 ARG A 122 5.553 0.694 18.158 1.00 0.00 H new ATOM 0 HH22 ARG A 122 4.326 -0.277 18.978 1.00 0.00 H new ATOM 1893 N PHE A 123 5.312 6.126 13.815 1.00 0.00 N ATOM 1894 CA PHE A 123 6.698 6.439 13.478 1.00 0.00 C ATOM 1895 C PHE A 123 7.305 5.371 12.577 1.00 0.00 C ATOM 1896 O PHE A 123 8.515 5.139 12.602 1.00 0.00 O ATOM 1897 CB PHE A 123 7.533 6.574 14.754 1.00 0.00 C ATOM 1898 CG PHE A 123 8.611 7.617 14.658 1.00 0.00 C ATOM 1899 CD1 PHE A 123 8.286 8.958 14.532 1.00 0.00 C ATOM 1900 CD2 PHE A 123 9.947 7.256 14.695 1.00 0.00 C ATOM 1901 CE1 PHE A 123 9.274 9.920 14.443 1.00 0.00 C ATOM 1902 CE2 PHE A 123 10.941 8.213 14.608 1.00 0.00 C ATOM 1903 CZ PHE A 123 10.603 9.546 14.482 1.00 0.00 C ATOM 0 H PHE A 123 5.029 5.168 13.609 1.00 0.00 H new ATOM 0 HA PHE A 123 6.704 7.385 12.937 1.00 0.00 H new ATOM 0 HB2 PHE A 123 6.873 6.820 15.586 1.00 0.00 H new ATOM 0 HB3 PHE A 123 7.990 5.611 14.983 1.00 0.00 H new ATOM 0 HD1 PHE A 123 7.248 9.255 14.503 1.00 0.00 H new ATOM 0 HD2 PHE A 123 10.216 6.215 14.793 1.00 0.00 H new ATOM 0 HE1 PHE A 123 9.008 10.962 14.343 1.00 0.00 H new ATOM 0 HE2 PHE A 123 11.980 7.919 14.639 1.00 0.00 H new ATOM 0 HZ PHE A 123 11.377 10.296 14.414 1.00 0.00 H new ATOM 1913 N ILE A 124 6.463 4.722 11.784 1.00 0.00 N ATOM 1914 CA ILE A 124 6.914 3.683 10.884 1.00 0.00 C ATOM 1915 C ILE A 124 7.381 4.272 9.553 1.00 0.00 C ATOM 1916 O ILE A 124 7.343 5.486 9.356 1.00 0.00 O ATOM 1917 CB ILE A 124 5.791 2.661 10.641 1.00 0.00 C ATOM 1918 CG1 ILE A 124 4.683 3.266 9.770 1.00 0.00 C ATOM 1919 CG2 ILE A 124 5.227 2.172 11.968 1.00 0.00 C ATOM 1920 CD1 ILE A 124 3.487 2.353 9.588 1.00 0.00 C ATOM 0 H ILE A 124 5.460 4.902 11.750 1.00 0.00 H new ATOM 0 HA ILE A 124 7.760 3.179 11.351 1.00 0.00 H new ATOM 0 HB ILE A 124 6.210 1.808 10.107 1.00 0.00 H new ATOM 0 HG12 ILE A 124 4.350 4.202 10.219 1.00 0.00 H new ATOM 0 HG13 ILE A 124 5.095 3.511 8.791 1.00 0.00 H new ATOM 0 HG21 ILE A 124 4.433 1.449 11.782 1.00 0.00 H new ATOM 0 HG22 ILE A 124 6.019 1.699 12.548 1.00 0.00 H new ATOM 0 HG23 ILE A 124 4.824 3.017 12.526 1.00 0.00 H new ATOM 0 HD11 ILE A 124 2.744 2.847 8.961 1.00 0.00 H new ATOM 0 HD12 ILE A 124 3.806 1.426 9.111 1.00 0.00 H new ATOM 0 HD13 ILE A 124 3.049 2.128 10.561 1.00 0.00 H new ATOM 1932 N THR A 125 7.825 3.405 8.644 1.00 0.00 N ATOM 1933 CA THR A 125 8.299 3.849 7.336 1.00 0.00 C ATOM 1934 C THR A 125 7.206 4.611 6.590 1.00 0.00 C ATOM 1935 O THR A 125 6.321 4.008 5.985 1.00 0.00 O ATOM 1936 CB THR A 125 8.760 2.647 6.507 1.00 0.00 C ATOM 1937 OG1 THR A 125 9.855 1.999 7.131 1.00 0.00 O ATOM 1938 CG2 THR A 125 9.187 3.012 5.101 1.00 0.00 C ATOM 0 H THR A 125 7.866 2.396 8.789 1.00 0.00 H new ATOM 0 HA THR A 125 9.142 4.522 7.489 1.00 0.00 H new ATOM 0 HB THR A 125 7.891 1.991 6.446 1.00 0.00 H new ATOM 0 HG1 THR A 125 10.134 1.233 6.588 1.00 0.00 H new ATOM 0 HG21 THR A 125 9.501 2.113 4.571 1.00 0.00 H new ATOM 0 HG22 THR A 125 8.350 3.470 4.574 1.00 0.00 H new ATOM 0 HG23 THR A 125 10.018 3.716 5.144 1.00 0.00 H new ATOM 1946 N VAL A 126 7.275 5.936 6.637 1.00 0.00 N ATOM 1947 CA VAL A 126 6.292 6.777 5.969 1.00 0.00 C ATOM 1948 C VAL A 126 6.921 7.575 4.831 1.00 0.00 C ATOM 1949 O VAL A 126 8.036 8.082 4.958 1.00 0.00 O ATOM 1950 CB VAL A 126 5.625 7.747 6.962 1.00 0.00 C ATOM 1951 CG1 VAL A 126 6.630 8.766 7.483 1.00 0.00 C ATOM 1952 CG2 VAL A 126 4.436 8.441 6.317 1.00 0.00 C ATOM 0 H VAL A 126 8.003 6.451 7.132 1.00 0.00 H new ATOM 0 HA VAL A 126 5.535 6.111 5.555 1.00 0.00 H new ATOM 0 HB VAL A 126 5.262 7.168 7.811 1.00 0.00 H new ATOM 0 HG11 VAL A 126 6.135 9.440 8.182 1.00 0.00 H new ATOM 0 HG12 VAL A 126 7.443 8.248 7.992 1.00 0.00 H new ATOM 0 HG13 VAL A 126 7.032 9.340 6.648 1.00 0.00 H new ATOM 0 HG21 VAL A 126 3.979 9.122 7.035 1.00 0.00 H new ATOM 0 HG22 VAL A 126 4.772 9.004 5.446 1.00 0.00 H new ATOM 0 HG23 VAL A 126 3.704 7.695 6.007 1.00 0.00 H new ATOM 1962 N CYS A 127 6.198 7.686 3.723 1.00 0.00 N ATOM 1963 CA CYS A 127 6.683 8.427 2.565 1.00 0.00 C ATOM 1964 C CYS A 127 5.885 9.713 2.372 1.00 0.00 C ATOM 1965 O CYS A 127 4.862 9.724 1.688 1.00 0.00 O ATOM 1966 CB CYS A 127 6.592 7.563 1.306 1.00 0.00 C ATOM 1967 SG CYS A 127 7.531 6.021 1.402 1.00 0.00 S ATOM 0 H CYS A 127 5.274 7.272 3.602 1.00 0.00 H new ATOM 0 HA CYS A 127 7.726 8.689 2.742 1.00 0.00 H new ATOM 0 HB2 CYS A 127 5.545 7.327 1.114 1.00 0.00 H new ATOM 0 HB3 CYS A 127 6.950 8.142 0.454 1.00 0.00 H new ATOM 0 HG CYS A 127 7.391 5.358 0.292 1.00 0.00 H new ATOM 1973 N ASP A 128 6.361 10.796 2.979 1.00 0.00 N ATOM 1974 CA ASP A 128 5.695 12.086 2.876 1.00 0.00 C ATOM 1975 C ASP A 128 6.482 13.027 1.974 1.00 0.00 C ATOM 1976 O ASP A 128 7.677 13.240 2.176 1.00 0.00 O ATOM 1977 CB ASP A 128 5.521 12.713 4.262 1.00 0.00 C ATOM 1978 CG ASP A 128 6.662 12.387 5.207 1.00 0.00 C ATOM 1979 OD1 ASP A 128 6.878 11.189 5.489 1.00 0.00 O ATOM 1980 OD2 ASP A 128 7.341 13.330 5.666 1.00 0.00 O ATOM 0 H ASP A 128 7.207 10.804 3.548 1.00 0.00 H new ATOM 0 HA ASP A 128 4.710 11.925 2.437 1.00 0.00 H new ATOM 0 HB2 ASP A 128 5.441 13.795 4.158 1.00 0.00 H new ATOM 0 HB3 ASP A 128 4.585 12.364 4.698 1.00 0.00 H new ATOM 1985 N TYR A 129 5.806 13.591 0.978 1.00 0.00 N ATOM 1986 CA TYR A 129 6.454 14.508 0.053 1.00 0.00 C ATOM 1987 C TYR A 129 6.668 15.870 0.702 1.00 0.00 C ATOM 1988 O TYR A 129 5.853 16.779 0.554 1.00 0.00 O ATOM 1989 CB TYR A 129 5.633 14.660 -1.229 1.00 0.00 C ATOM 1990 CG TYR A 129 5.744 13.473 -2.158 1.00 0.00 C ATOM 1991 CD1 TYR A 129 5.092 12.280 -1.874 1.00 0.00 C ATOM 1992 CD2 TYR A 129 6.505 13.544 -3.319 1.00 0.00 C ATOM 1993 CE1 TYR A 129 5.193 11.192 -2.720 1.00 0.00 C ATOM 1994 CE2 TYR A 129 6.611 12.461 -4.169 1.00 0.00 C ATOM 1995 CZ TYR A 129 5.954 11.287 -3.866 1.00 0.00 C ATOM 1996 OH TYR A 129 6.058 10.206 -4.710 1.00 0.00 O ATOM 0 H TYR A 129 4.816 13.429 0.793 1.00 0.00 H new ATOM 0 HA TYR A 129 7.426 14.089 -0.206 1.00 0.00 H new ATOM 0 HB2 TYR A 129 4.586 14.809 -0.965 1.00 0.00 H new ATOM 0 HB3 TYR A 129 5.959 15.556 -1.756 1.00 0.00 H new ATOM 0 HD1 TYR A 129 4.496 12.201 -0.977 1.00 0.00 H new ATOM 0 HD2 TYR A 129 7.022 14.461 -3.560 1.00 0.00 H new ATOM 0 HE1 TYR A 129 4.679 10.272 -2.485 1.00 0.00 H new ATOM 0 HE2 TYR A 129 7.206 12.533 -5.067 1.00 0.00 H new ATOM 0 HH TYR A 129 6.630 10.439 -5.471 1.00 0.00 H new ATOM 2006 N THR A 130 7.783 16.000 1.410 1.00 0.00 N ATOM 2007 CA THR A 130 8.129 17.252 2.075 1.00 0.00 C ATOM 2008 C THR A 130 8.836 18.169 1.091 1.00 0.00 C ATOM 2009 O THR A 130 8.482 19.337 0.937 1.00 0.00 O ATOM 2010 CB THR A 130 9.026 16.985 3.285 1.00 0.00 C ATOM 2011 OG1 THR A 130 10.363 16.754 2.878 1.00 0.00 O ATOM 2012 CG2 THR A 130 8.585 15.792 4.110 1.00 0.00 C ATOM 0 H THR A 130 8.465 15.253 1.539 1.00 0.00 H new ATOM 0 HA THR A 130 7.216 17.733 2.425 1.00 0.00 H new ATOM 0 HB THR A 130 8.949 17.880 3.902 1.00 0.00 H new ATOM 0 HG1 THR A 130 10.921 16.587 3.666 1.00 0.00 H new ATOM 0 HG21 THR A 130 9.265 15.660 4.952 1.00 0.00 H new ATOM 0 HG22 THR A 130 7.575 15.961 4.483 1.00 0.00 H new ATOM 0 HG23 THR A 130 8.598 14.896 3.490 1.00 0.00 H new ATOM 2020 N ASN A 131 9.821 17.606 0.405 1.00 0.00 N ATOM 2021 CA ASN A 131 10.580 18.331 -0.600 1.00 0.00 C ATOM 2022 C ASN A 131 10.427 17.618 -1.940 1.00 0.00 C ATOM 2023 O ASN A 131 11.406 17.166 -2.535 1.00 0.00 O ATOM 2024 CB ASN A 131 12.055 18.421 -0.203 1.00 0.00 C ATOM 2025 CG ASN A 131 12.641 19.796 -0.460 1.00 0.00 C ATOM 2026 OD1 ASN A 131 13.386 20.329 0.363 1.00 0.00 O ATOM 2027 ND2 ASN A 131 12.306 20.377 -1.604 1.00 0.00 N ATOM 0 H ASN A 131 10.114 16.637 0.530 1.00 0.00 H new ATOM 0 HA ASN A 131 10.197 19.348 -0.681 1.00 0.00 H new ATOM 0 HB2 ASN A 131 12.159 18.177 0.854 1.00 0.00 H new ATOM 0 HB3 ASN A 131 12.624 17.677 -0.760 1.00 0.00 H new ATOM 0 HD21 ASN A 131 12.669 21.303 -1.831 1.00 0.00 H new ATOM 0 HD22 ASN A 131 11.685 19.898 -2.257 1.00 0.00 H new ATOM 2034 N PRO A 132 9.177 17.488 -2.420 1.00 0.00 N ATOM 2035 CA PRO A 132 8.866 16.808 -3.676 1.00 0.00 C ATOM 2036 C PRO A 132 9.804 17.212 -4.807 1.00 0.00 C ATOM 2037 O PRO A 132 10.048 16.438 -5.733 1.00 0.00 O ATOM 2038 CB PRO A 132 7.424 17.243 -3.989 1.00 0.00 C ATOM 2039 CG PRO A 132 7.058 18.247 -2.941 1.00 0.00 C ATOM 2040 CD PRO A 132 7.959 17.981 -1.770 1.00 0.00 C ATOM 0 HA PRO A 132 8.982 15.728 -3.584 1.00 0.00 H new ATOM 0 HB2 PRO A 132 7.356 17.678 -4.986 1.00 0.00 H new ATOM 0 HB3 PRO A 132 6.746 16.390 -3.966 1.00 0.00 H new ATOM 0 HG2 PRO A 132 7.192 19.263 -3.312 1.00 0.00 H new ATOM 0 HG3 PRO A 132 6.011 18.148 -2.656 1.00 0.00 H new ATOM 0 HD2 PRO A 132 8.146 18.883 -1.187 1.00 0.00 H new ATOM 0 HD3 PRO A 132 7.534 17.243 -1.089 1.00 0.00 H new ATOM 2048 N CYS A 133 10.327 18.427 -4.723 1.00 0.00 N ATOM 2049 CA CYS A 133 11.242 18.943 -5.738 1.00 0.00 C ATOM 2050 C CYS A 133 12.362 17.947 -6.022 1.00 0.00 C ATOM 2051 O CYS A 133 12.772 17.767 -7.168 1.00 0.00 O ATOM 2052 CB CYS A 133 11.835 20.279 -5.287 1.00 0.00 C ATOM 2053 SG CYS A 133 11.972 21.508 -6.608 1.00 0.00 S ATOM 0 H CYS A 133 10.134 19.077 -3.961 1.00 0.00 H new ATOM 0 HA CYS A 133 10.675 19.095 -6.657 1.00 0.00 H new ATOM 0 HB2 CYS A 133 11.217 20.688 -4.488 1.00 0.00 H new ATOM 0 HB3 CYS A 133 12.825 20.102 -4.866 1.00 0.00 H new ATOM 0 HG CYS A 133 12.482 22.604 -6.130 1.00 0.00 H new ATOM 2059 N THR A 134 12.849 17.301 -4.968 1.00 0.00 N ATOM 2060 CA THR A 134 13.922 16.320 -5.098 1.00 0.00 C ATOM 2061 C THR A 134 13.456 14.935 -4.660 1.00 0.00 C ATOM 2062 O THR A 134 13.966 13.920 -5.136 1.00 0.00 O ATOM 2063 CB THR A 134 15.136 16.749 -4.275 1.00 0.00 C ATOM 2064 OG1 THR A 134 14.857 16.665 -2.888 1.00 0.00 O ATOM 2065 CG2 THR A 134 15.587 18.164 -4.566 1.00 0.00 C ATOM 0 H THR A 134 12.518 17.439 -4.013 1.00 0.00 H new ATOM 0 HA THR A 134 14.205 16.268 -6.149 1.00 0.00 H new ATOM 0 HB THR A 134 15.934 16.064 -4.560 1.00 0.00 H new ATOM 0 HG1 THR A 134 15.647 16.942 -2.378 1.00 0.00 H new ATOM 0 HG21 THR A 134 16.452 18.404 -3.948 1.00 0.00 H new ATOM 0 HG22 THR A 134 15.857 18.251 -5.618 1.00 0.00 H new ATOM 0 HG23 THR A 134 14.777 18.858 -4.341 1.00 0.00 H new ATOM 2073 N LYS A 135 12.483 14.898 -3.756 1.00 0.00 N ATOM 2074 CA LYS A 135 11.947 13.635 -3.260 1.00 0.00 C ATOM 2075 C LYS A 135 11.035 12.975 -4.295 1.00 0.00 C ATOM 2076 O LYS A 135 10.561 11.858 -4.091 1.00 0.00 O ATOM 2077 CB LYS A 135 11.179 13.863 -1.957 1.00 0.00 C ATOM 2078 CG LYS A 135 12.034 13.697 -0.710 1.00 0.00 C ATOM 2079 CD LYS A 135 11.945 14.912 0.199 1.00 0.00 C ATOM 2080 CE LYS A 135 13.046 14.906 1.248 1.00 0.00 C ATOM 2081 NZ LYS A 135 13.327 16.273 1.767 1.00 0.00 N ATOM 0 H LYS A 135 12.049 15.728 -3.352 1.00 0.00 H new ATOM 0 HA LYS A 135 12.786 12.966 -3.071 1.00 0.00 H new ATOM 0 HB2 LYS A 135 10.755 14.867 -1.966 1.00 0.00 H new ATOM 0 HB3 LYS A 135 10.344 13.165 -1.910 1.00 0.00 H new ATOM 0 HG2 LYS A 135 11.713 12.810 -0.164 1.00 0.00 H new ATOM 0 HG3 LYS A 135 13.072 13.535 -1.000 1.00 0.00 H new ATOM 0 HD2 LYS A 135 12.016 15.821 -0.399 1.00 0.00 H new ATOM 0 HD3 LYS A 135 10.973 14.929 0.691 1.00 0.00 H new ATOM 0 HE2 LYS A 135 12.756 14.257 2.074 1.00 0.00 H new ATOM 0 HE3 LYS A 135 13.955 14.487 0.817 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 13.996 16.212 2.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 13.740 16.854 1.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 12.441 16.709 2.094 1.00 0.00 H new ATOM 2095 N SER A 136 10.789 13.669 -5.407 1.00 0.00 N ATOM 2096 CA SER A 136 9.931 13.146 -6.467 1.00 0.00 C ATOM 2097 C SER A 136 10.356 11.741 -6.888 1.00 0.00 C ATOM 2098 O SER A 136 9.550 10.973 -7.414 1.00 0.00 O ATOM 2099 CB SER A 136 9.956 14.081 -7.677 1.00 0.00 C ATOM 2100 OG SER A 136 9.248 13.520 -8.769 1.00 0.00 O ATOM 0 H SER A 136 11.173 14.595 -5.596 1.00 0.00 H new ATOM 0 HA SER A 136 8.916 13.089 -6.074 1.00 0.00 H new ATOM 0 HB2 SER A 136 9.515 15.041 -7.408 1.00 0.00 H new ATOM 0 HB3 SER A 136 10.988 14.275 -7.970 1.00 0.00 H new ATOM 0 HG SER A 136 9.277 14.137 -9.530 1.00 0.00 H new ATOM 2106 N TRP A 137 11.623 11.407 -6.657 1.00 0.00 N ATOM 2107 CA TRP A 137 12.144 10.091 -7.018 1.00 0.00 C ATOM 2108 C TRP A 137 11.705 9.018 -6.020 1.00 0.00 C ATOM 2109 O TRP A 137 12.055 7.847 -6.168 1.00 0.00 O ATOM 2110 CB TRP A 137 13.672 10.129 -7.100 1.00 0.00 C ATOM 2111 CG TRP A 137 14.188 11.068 -8.148 1.00 0.00 C ATOM 2112 CD1 TRP A 137 14.305 12.425 -8.046 1.00 0.00 C ATOM 2113 CD2 TRP A 137 14.653 10.722 -9.458 1.00 0.00 C ATOM 2114 NE1 TRP A 137 14.818 12.943 -9.212 1.00 0.00 N ATOM 2115 CE2 TRP A 137 15.039 11.917 -10.093 1.00 0.00 C ATOM 2116 CE3 TRP A 137 14.783 9.517 -10.155 1.00 0.00 C ATOM 2117 CZ2 TRP A 137 15.545 11.942 -11.391 1.00 0.00 C ATOM 2118 CZ3 TRP A 137 15.285 9.542 -11.443 1.00 0.00 C ATOM 2119 CH2 TRP A 137 15.661 10.747 -12.047 1.00 0.00 C ATOM 0 H TRP A 137 12.306 12.027 -6.223 1.00 0.00 H new ATOM 0 HA TRP A 137 11.735 9.832 -7.994 1.00 0.00 H new ATOM 0 HB2 TRP A 137 14.073 10.423 -6.130 1.00 0.00 H new ATOM 0 HB3 TRP A 137 14.043 9.125 -7.308 1.00 0.00 H new ATOM 0 HD1 TRP A 137 14.034 13.006 -7.177 1.00 0.00 H new ATOM 0 HE1 TRP A 137 15.004 13.930 -9.392 1.00 0.00 H new ATOM 0 HE3 TRP A 137 14.496 8.583 -9.695 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 15.835 12.870 -11.862 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 15.389 8.617 -11.991 1.00 0.00 H new ATOM 0 HH2 TRP A 137 16.052 10.733 -13.054 1.00 0.00 H new ATOM 2130 N PHE A 138 10.937 9.416 -5.004 1.00 0.00 N ATOM 2131 CA PHE A 138 10.456 8.477 -3.993 1.00 0.00 C ATOM 2132 C PHE A 138 9.807 7.254 -4.639 1.00 0.00 C ATOM 2133 O PHE A 138 9.785 6.170 -4.054 1.00 0.00 O ATOM 2134 CB PHE A 138 9.457 9.168 -3.060 1.00 0.00 C ATOM 2135 CG PHE A 138 9.939 9.283 -1.642 1.00 0.00 C ATOM 2136 CD1 PHE A 138 10.972 10.147 -1.315 1.00 0.00 C ATOM 2137 CD2 PHE A 138 9.357 8.527 -0.636 1.00 0.00 C ATOM 2138 CE1 PHE A 138 11.415 10.254 -0.011 1.00 0.00 C ATOM 2139 CE2 PHE A 138 9.797 8.631 0.669 1.00 0.00 C ATOM 2140 CZ PHE A 138 10.829 9.494 0.983 1.00 0.00 C ATOM 0 H PHE A 138 10.636 10.380 -4.861 1.00 0.00 H new ATOM 0 HA PHE A 138 11.315 8.140 -3.412 1.00 0.00 H new ATOM 0 HB2 PHE A 138 9.244 10.165 -3.444 1.00 0.00 H new ATOM 0 HB3 PHE A 138 8.518 8.614 -3.072 1.00 0.00 H new ATOM 0 HD1 PHE A 138 11.435 10.743 -2.088 1.00 0.00 H new ATOM 0 HD2 PHE A 138 8.551 7.849 -0.875 1.00 0.00 H new ATOM 0 HE1 PHE A 138 12.220 10.932 0.232 1.00 0.00 H new ATOM 0 HE2 PHE A 138 9.334 8.038 1.444 1.00 0.00 H new ATOM 0 HZ PHE A 138 11.177 9.574 2.002 1.00 0.00 H new ATOM 2150 N TRP A 139 9.282 7.434 -5.849 1.00 0.00 N ATOM 2151 CA TRP A 139 8.634 6.346 -6.575 1.00 0.00 C ATOM 2152 C TRP A 139 9.536 5.117 -6.636 1.00 0.00 C ATOM 2153 O TRP A 139 9.059 3.982 -6.608 1.00 0.00 O ATOM 2154 CB TRP A 139 8.276 6.795 -7.993 1.00 0.00 C ATOM 2155 CG TRP A 139 7.105 7.726 -8.045 1.00 0.00 C ATOM 2156 CD1 TRP A 139 5.888 7.545 -7.453 1.00 0.00 C ATOM 2157 CD2 TRP A 139 7.036 8.983 -8.728 1.00 0.00 C ATOM 2158 NE1 TRP A 139 5.066 8.611 -7.728 1.00 0.00 N ATOM 2159 CE2 TRP A 139 5.748 9.508 -8.507 1.00 0.00 C ATOM 2160 CE3 TRP A 139 7.938 9.717 -9.504 1.00 0.00 C ATOM 2161 CZ2 TRP A 139 5.341 10.731 -9.035 1.00 0.00 C ATOM 2162 CZ3 TRP A 139 7.534 10.931 -10.027 1.00 0.00 C ATOM 2163 CH2 TRP A 139 6.246 11.428 -9.789 1.00 0.00 C ATOM 0 H TRP A 139 9.293 8.324 -6.347 1.00 0.00 H new ATOM 0 HA TRP A 139 7.722 6.080 -6.040 1.00 0.00 H new ATOM 0 HB2 TRP A 139 9.141 7.286 -8.440 1.00 0.00 H new ATOM 0 HB3 TRP A 139 8.059 5.916 -8.600 1.00 0.00 H new ATOM 0 HD1 TRP A 139 5.612 6.689 -6.856 1.00 0.00 H new ATOM 0 HE1 TRP A 139 4.104 8.717 -7.405 1.00 0.00 H new ATOM 0 HE3 TRP A 139 8.933 9.342 -9.692 1.00 0.00 H new ATOM 0 HZ2 TRP A 139 4.348 11.115 -8.856 1.00 0.00 H new ATOM 0 HZ3 TRP A 139 8.222 11.506 -10.629 1.00 0.00 H new ATOM 0 HH2 TRP A 139 5.961 12.381 -10.209 1.00 0.00 H new ATOM 2174 N THR A 140 10.840 5.354 -6.716 1.00 0.00 N ATOM 2175 CA THR A 140 11.814 4.269 -6.781 1.00 0.00 C ATOM 2176 C THR A 140 11.891 3.528 -5.451 1.00 0.00 C ATOM 2177 O THR A 140 12.065 2.311 -5.416 1.00 0.00 O ATOM 2178 CB THR A 140 13.192 4.821 -7.154 1.00 0.00 C ATOM 2179 OG1 THR A 140 13.142 5.492 -8.400 1.00 0.00 O ATOM 2180 CG2 THR A 140 14.260 3.754 -7.252 1.00 0.00 C ATOM 0 H THR A 140 11.248 6.288 -6.737 1.00 0.00 H new ATOM 0 HA THR A 140 11.491 3.565 -7.548 1.00 0.00 H new ATOM 0 HB THR A 140 13.457 5.503 -6.346 1.00 0.00 H new ATOM 0 HG1 THR A 140 14.032 5.839 -8.620 1.00 0.00 H new ATOM 0 HG21 THR A 140 15.211 4.215 -7.520 1.00 0.00 H new ATOM 0 HG22 THR A 140 14.359 3.249 -6.291 1.00 0.00 H new ATOM 0 HG23 THR A 140 13.981 3.029 -8.016 1.00 0.00 H new ATOM 2188 N ARG A 141 11.761 4.271 -4.356 1.00 0.00 N ATOM 2189 CA ARG A 141 11.816 3.684 -3.023 1.00 0.00 C ATOM 2190 C ARG A 141 10.684 2.680 -2.823 1.00 0.00 C ATOM 2191 O ARG A 141 10.895 1.590 -2.294 1.00 0.00 O ATOM 2192 CB ARG A 141 11.737 4.779 -1.958 1.00 0.00 C ATOM 2193 CG ARG A 141 13.059 5.489 -1.717 1.00 0.00 C ATOM 2194 CD ARG A 141 13.219 5.889 -0.259 1.00 0.00 C ATOM 2195 NE ARG A 141 14.607 5.793 0.187 1.00 0.00 N ATOM 2196 CZ ARG A 141 15.217 4.644 0.464 1.00 0.00 C ATOM 2197 NH1 ARG A 141 14.567 3.492 0.347 1.00 0.00 N ATOM 2198 NH2 ARG A 141 16.481 4.645 0.864 1.00 0.00 N ATOM 0 H ARG A 141 11.617 5.281 -4.366 1.00 0.00 H new ATOM 0 HA ARG A 141 12.765 3.158 -2.923 1.00 0.00 H new ATOM 0 HB2 ARG A 141 10.989 5.513 -2.258 1.00 0.00 H new ATOM 0 HB3 ARG A 141 11.394 4.339 -1.021 1.00 0.00 H new ATOM 0 HG2 ARG A 141 13.882 4.837 -2.009 1.00 0.00 H new ATOM 0 HG3 ARG A 141 13.117 6.376 -2.347 1.00 0.00 H new ATOM 0 HD2 ARG A 141 12.864 6.911 -0.123 1.00 0.00 H new ATOM 0 HD3 ARG A 141 12.593 5.249 0.363 1.00 0.00 H new ATOM 0 HE ARG A 141 15.139 6.657 0.292 1.00 0.00 H new ATOM 0 HH11 ARG A 141 13.593 3.484 0.043 1.00 0.00 H new ATOM 0 HH12 ARG A 141 15.041 2.615 0.561 1.00 0.00 H new ATOM 0 HH21 ARG A 141 16.985 5.527 0.959 1.00 0.00 H new ATOM 0 HH22 ARG A 141 16.949 3.764 1.077 1.00 0.00 H new ATOM 2212 N LEU A 142 9.484 3.057 -3.251 1.00 0.00 N ATOM 2213 CA LEU A 142 8.320 2.190 -3.116 1.00 0.00 C ATOM 2214 C LEU A 142 8.316 1.107 -4.192 1.00 0.00 C ATOM 2215 O LEU A 142 7.800 0.010 -3.980 1.00 0.00 O ATOM 2216 CB LEU A 142 7.031 3.011 -3.202 1.00 0.00 C ATOM 2217 CG LEU A 142 5.820 2.390 -2.505 1.00 0.00 C ATOM 2218 CD1 LEU A 142 5.974 2.473 -0.994 1.00 0.00 C ATOM 2219 CD2 LEU A 142 4.538 3.075 -2.952 1.00 0.00 C ATOM 0 H LEU A 142 9.292 3.956 -3.694 1.00 0.00 H new ATOM 0 HA LEU A 142 8.373 1.708 -2.140 1.00 0.00 H new ATOM 0 HB2 LEU A 142 7.215 3.994 -2.769 1.00 0.00 H new ATOM 0 HB3 LEU A 142 6.786 3.166 -4.253 1.00 0.00 H new ATOM 0 HG LEU A 142 5.762 1.338 -2.786 1.00 0.00 H new ATOM 0 HD11 LEU A 142 5.103 2.026 -0.514 1.00 0.00 H new ATOM 0 HD12 LEU A 142 6.872 1.935 -0.690 1.00 0.00 H new ATOM 0 HD13 LEU A 142 6.058 3.517 -0.694 1.00 0.00 H new ATOM 0 HD21 LEU A 142 3.687 2.620 -2.446 1.00 0.00 H new ATOM 0 HD22 LEU A 142 4.585 4.135 -2.701 1.00 0.00 H new ATOM 0 HD23 LEU A 142 4.422 2.962 -4.030 1.00 0.00 H new ATOM 2231 N ALA A 143 8.895 1.423 -5.348 1.00 0.00 N ATOM 2232 CA ALA A 143 8.955 0.476 -6.454 1.00 0.00 C ATOM 2233 C ALA A 143 9.803 -0.740 -6.094 1.00 0.00 C ATOM 2234 O ALA A 143 9.456 -1.873 -6.431 1.00 0.00 O ATOM 2235 CB ALA A 143 9.502 1.157 -7.700 1.00 0.00 C ATOM 0 H ALA A 143 9.328 2.326 -5.541 1.00 0.00 H new ATOM 0 HA ALA A 143 7.942 0.128 -6.658 1.00 0.00 H new ATOM 0 HB1 ALA A 143 9.542 0.439 -8.519 1.00 0.00 H new ATOM 0 HB2 ALA A 143 8.852 1.987 -7.976 1.00 0.00 H new ATOM 0 HB3 ALA A 143 10.505 1.533 -7.498 1.00 0.00 H new ATOM 2241 N LYS A 144 10.918 -0.499 -5.411 1.00 0.00 N ATOM 2242 CA LYS A 144 11.817 -1.576 -5.007 1.00 0.00 C ATOM 2243 C LYS A 144 11.444 -2.122 -3.630 1.00 0.00 C ATOM 2244 O LYS A 144 11.832 -3.232 -3.268 1.00 0.00 O ATOM 2245 CB LYS A 144 13.263 -1.080 -4.994 1.00 0.00 C ATOM 2246 CG LYS A 144 13.471 0.169 -4.151 1.00 0.00 C ATOM 2247 CD LYS A 144 14.468 -0.073 -3.027 1.00 0.00 C ATOM 2248 CE LYS A 144 13.806 -0.738 -1.831 1.00 0.00 C ATOM 2249 NZ LYS A 144 14.569 -0.504 -0.573 1.00 0.00 N ATOM 0 H LYS A 144 11.221 0.432 -5.126 1.00 0.00 H new ATOM 0 HA LYS A 144 11.719 -2.383 -5.733 1.00 0.00 H new ATOM 0 HB2 LYS A 144 13.907 -1.874 -4.617 1.00 0.00 H new ATOM 0 HB3 LYS A 144 13.577 -0.874 -6.017 1.00 0.00 H new ATOM 0 HG2 LYS A 144 13.827 0.981 -4.785 1.00 0.00 H new ATOM 0 HG3 LYS A 144 12.517 0.487 -3.730 1.00 0.00 H new ATOM 0 HD2 LYS A 144 15.282 -0.701 -3.390 1.00 0.00 H new ATOM 0 HD3 LYS A 144 14.909 0.875 -2.720 1.00 0.00 H new ATOM 0 HE2 LYS A 144 12.792 -0.354 -1.717 1.00 0.00 H new ATOM 0 HE3 LYS A 144 13.723 -1.810 -2.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 14.085 -0.973 0.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 15.529 -0.893 -0.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 14.627 0.518 -0.387 1.00 0.00 H new ATOM 2263 N ALA A 145 10.690 -1.336 -2.867 1.00 0.00 N ATOM 2264 CA ALA A 145 10.265 -1.742 -1.532 1.00 0.00 C ATOM 2265 C ALA A 145 8.996 -2.590 -1.584 1.00 0.00 C ATOM 2266 O ALA A 145 8.651 -3.264 -0.612 1.00 0.00 O ATOM 2267 CB ALA A 145 10.046 -0.518 -0.657 1.00 0.00 C ATOM 0 H ALA A 145 10.361 -0.413 -3.151 1.00 0.00 H new ATOM 0 HA ALA A 145 11.057 -2.354 -1.099 1.00 0.00 H new ATOM 0 HB1 ALA A 145 9.729 -0.833 0.337 1.00 0.00 H new ATOM 0 HB2 ALA A 145 10.976 0.045 -0.580 1.00 0.00 H new ATOM 0 HB3 ALA A 145 9.276 0.113 -1.100 1.00 0.00 H new ATOM 2273 N LEU A 146 8.305 -2.552 -2.719 1.00 0.00 N ATOM 2274 CA LEU A 146 7.074 -3.313 -2.891 1.00 0.00 C ATOM 2275 C LEU A 146 7.348 -4.662 -3.553 1.00 0.00 C ATOM 2276 O LEU A 146 6.555 -5.595 -3.430 1.00 0.00 O ATOM 2277 CB LEU A 146 6.073 -2.514 -3.729 1.00 0.00 C ATOM 2278 CG LEU A 146 5.079 -1.665 -2.930 1.00 0.00 C ATOM 2279 CD1 LEU A 146 5.781 -0.941 -1.790 1.00 0.00 C ATOM 2280 CD2 LEU A 146 4.379 -0.671 -3.844 1.00 0.00 C ATOM 0 H LEU A 146 8.577 -2.002 -3.533 1.00 0.00 H new ATOM 0 HA LEU A 146 6.651 -3.497 -1.904 1.00 0.00 H new ATOM 0 HB2 LEU A 146 6.628 -1.858 -4.400 1.00 0.00 H new ATOM 0 HB3 LEU A 146 5.512 -3.209 -4.354 1.00 0.00 H new ATOM 0 HG LEU A 146 4.329 -2.329 -2.499 1.00 0.00 H new ATOM 0 HD11 LEU A 146 5.056 -0.344 -1.237 1.00 0.00 H new ATOM 0 HD12 LEU A 146 6.236 -1.671 -1.121 1.00 0.00 H new ATOM 0 HD13 LEU A 146 6.554 -0.288 -2.195 1.00 0.00 H new ATOM 0 HD21 LEU A 146 3.676 -0.075 -3.263 1.00 0.00 H new ATOM 0 HD22 LEU A 146 5.119 -0.015 -4.302 1.00 0.00 H new ATOM 0 HD23 LEU A 146 3.840 -1.210 -4.623 1.00 0.00 H new ATOM 2292 N SER A 147 8.473 -4.759 -4.257 1.00 0.00 N ATOM 2293 CA SER A 147 8.836 -5.994 -4.938 1.00 0.00 C ATOM 2294 C SER A 147 10.324 -6.296 -4.782 1.00 0.00 C ATOM 2295 O SER A 147 11.011 -6.605 -5.756 1.00 0.00 O ATOM 2296 CB SER A 147 8.471 -5.909 -6.421 1.00 0.00 C ATOM 2297 OG SER A 147 7.137 -6.330 -6.644 1.00 0.00 O ATOM 0 H SER A 147 9.145 -4.000 -4.369 1.00 0.00 H new ATOM 0 HA SER A 147 8.275 -6.807 -4.477 1.00 0.00 H new ATOM 0 HB2 SER A 147 8.595 -4.884 -6.771 1.00 0.00 H new ATOM 0 HB3 SER A 147 9.153 -6.529 -7.002 1.00 0.00 H new ATOM 0 HG SER A 147 7.128 -7.049 -7.310 1.00 0.00 H new ATOM 2303 N LEU A 148 10.818 -6.217 -3.550 1.00 0.00 N ATOM 2304 CA LEU A 148 12.226 -6.494 -3.276 1.00 0.00 C ATOM 2305 C LEU A 148 12.549 -7.955 -3.575 1.00 0.00 C ATOM 2306 O LEU A 148 13.464 -8.253 -4.343 1.00 0.00 O ATOM 2307 CB LEU A 148 12.596 -6.177 -1.818 1.00 0.00 C ATOM 2308 CG LEU A 148 11.667 -5.206 -1.082 1.00 0.00 C ATOM 2309 CD1 LEU A 148 10.774 -5.953 -0.104 1.00 0.00 C ATOM 2310 CD2 LEU A 148 12.478 -4.143 -0.356 1.00 0.00 C ATOM 0 H LEU A 148 10.268 -5.965 -2.729 1.00 0.00 H new ATOM 0 HA LEU A 148 12.815 -5.847 -3.926 1.00 0.00 H new ATOM 0 HB2 LEU A 148 12.625 -7.113 -1.260 1.00 0.00 H new ATOM 0 HB3 LEU A 148 13.605 -5.765 -1.802 1.00 0.00 H new ATOM 0 HG LEU A 148 11.031 -4.715 -1.819 1.00 0.00 H new ATOM 0 HD11 LEU A 148 10.122 -5.245 0.408 1.00 0.00 H new ATOM 0 HD12 LEU A 148 10.167 -6.678 -0.646 1.00 0.00 H new ATOM 0 HD13 LEU A 148 11.392 -6.473 0.629 1.00 0.00 H new ATOM 0 HD21 LEU A 148 11.803 -3.461 0.162 1.00 0.00 H new ATOM 0 HD22 LEU A 148 13.138 -4.620 0.368 1.00 0.00 H new ATOM 0 HD23 LEU A 148 13.075 -3.585 -1.077 1.00 0.00 H new ATOM 2322 N PRO A 149 11.798 -8.891 -2.966 1.00 0.00 N ATOM 2323 CA PRO A 149 12.011 -10.327 -3.167 1.00 0.00 C ATOM 2324 C PRO A 149 11.492 -10.807 -4.519 1.00 0.00 C ATOM 2325 O PRO A 149 11.115 -9.949 -5.346 1.00 0.00 O ATOM 2326 CB PRO A 149 11.210 -10.961 -2.030 1.00 0.00 C ATOM 2327 CG PRO A 149 10.115 -9.989 -1.754 1.00 0.00 C ATOM 2328 CD PRO A 149 10.686 -8.623 -2.030 1.00 0.00 C ATOM 2329 OXT PRO A 149 11.466 -12.036 -4.739 1.00 0.00 O ATOM 0 HA PRO A 149 13.069 -10.589 -3.162 1.00 0.00 H new ATOM 0 HB2 PRO A 149 10.813 -11.934 -2.319 1.00 0.00 H new ATOM 0 HB3 PRO A 149 11.831 -11.120 -1.148 1.00 0.00 H new ATOM 0 HG2 PRO A 149 9.251 -10.185 -2.389 1.00 0.00 H new ATOM 0 HG3 PRO A 149 9.776 -10.068 -0.721 1.00 0.00 H new ATOM 0 HD2 PRO A 149 9.942 -7.960 -2.471 1.00 0.00 H new ATOM 0 HD3 PRO A 149 11.038 -8.144 -1.116 1.00 0.00 H new TER 2337 PRO A 149