USER MOD reduce.3.24.130724 H: found=0, std=0, add=875, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 876 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 85 THR OG1 : rot -143:sc= 0.192 USER MOD Set 1.2: A 142 SER OG : rot -54:sc= 0.852 USER MOD Set 2.1: A 135 GLN : amide:sc= 0.481 K(o=1.7,f=-5.6!) USER MOD Set 2.2: A 137 SER OG : rot 97:sc= 1.26 USER MOD Set 3.1: A 59 GLN : amide:sc= -0.346 X(o=-0.42,f=-0.69) USER MOD Set 3.2: A 88 ASN : amide:sc= -0.0707 X(o=-0.42,f=-0.69) USER MOD Set 4.1: A 66 ASN : amide:sc= 0 K(o=-2.5,f=-3.2) USER MOD Set 4.2: A 129 GLN : amide:sc= -2.53! C(o=-2.5!,f=-4.7!) USER MOD Set 5.1: A 48 THR OG1 : rot 180:sc= 0.236 USER MOD Set 5.2: A 51 GLN : amide:sc= 0.498 K(o=0.73,f=-5!) USER MOD Single : A 50 LYS NZ :NH3+ -169:sc= -0.042 (180deg=-0.268) USER MOD Single : A 53 THR OG1 : rot 74:sc= -0.227 USER MOD Single : A 55 LYS NZ :NH3+ -178:sc= 0.316 (180deg=0.314) USER MOD Single : A 61 GLN : amide:sc= 1.19 K(o=1.2,f=-0.92) USER MOD Single : A 63 SER OG : rot -68:sc= 1.3 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 TYR OH : rot 166:sc= 0.0494 USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 180:sc=-0.00596 USER MOD Single : A 96 THR OG1 : rot 135:sc= 1.13 USER MOD Single : A 103 ASN : amide:sc= 0.869 K(o=0.87,f=-0.0012) USER MOD Single : A 104 GLN : amide:sc= -0.26 X(o=-0.26,f=-0.19) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 107 LYS NZ :NH3+ 171:sc= 0.281 (180deg=0.152) USER MOD Single : A 111 GLN : amide:sc= -0.393 K(o=-0.39,f=-0.98) USER MOD Single : A 120 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 124 ASN : amide:sc= -1.47! C(o=-1.5!,f=-7.8!) USER MOD Single : A 125 GLN :FLIP amide:sc= -0.175 F(o=-2.3!,f=-0.17) USER MOD Single : A 126 LYS NZ :NH3+ 178:sc= 1.12 (180deg=1.12) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 ASN : amide:sc= -0.378 K(o=-0.38,f=-1.9) USER MOD Single : A 136 ASN :FLIP amide:sc= -0.849 F(o=-2.6!,f=-0.85) USER MOD Single : A 139 SER OG : rot 180:sc= 0.0494 USER MOD Single : A 144 SER OG : rot 170:sc= -1.58! USER MOD Single : A 157 SER OG : rot -42:sc= -0.63 USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 39 1.202 -4.430 -8.361 1.00 0.00 N ATOM 2 CA VAL A 39 0.979 -3.075 -7.895 1.00 0.00 C ATOM 3 C VAL A 39 0.947 -2.108 -9.082 1.00 0.00 C ATOM 4 O VAL A 39 1.939 -1.935 -9.795 1.00 0.00 O ATOM 5 CB VAL A 39 2.047 -2.651 -6.854 1.00 0.00 C ATOM 6 CG1 VAL A 39 3.459 -2.749 -7.418 1.00 0.00 C ATOM 7 CG2 VAL A 39 1.769 -1.250 -6.337 1.00 0.00 C ATOM 0 HA VAL A 39 0.011 -3.040 -7.394 1.00 0.00 H new ATOM 0 HB VAL A 39 1.982 -3.348 -6.018 1.00 0.00 H new ATOM 0 HG11 VAL A 39 4.177 -2.443 -6.657 1.00 0.00 H new ATOM 0 HG12 VAL A 39 3.661 -3.778 -7.715 1.00 0.00 H new ATOM 0 HG13 VAL A 39 3.550 -2.096 -8.286 1.00 0.00 H new ATOM 0 HG21 VAL A 39 2.531 -0.973 -5.608 1.00 0.00 H new ATOM 0 HG22 VAL A 39 1.789 -0.545 -7.168 1.00 0.00 H new ATOM 0 HG23 VAL A 39 0.788 -1.225 -5.863 1.00 0.00 H new ATOM 17 N ARG A 40 -0.215 -1.506 -9.310 1.00 0.00 N ATOM 18 CA ARG A 40 -0.394 -0.591 -10.437 1.00 0.00 C ATOM 19 C ARG A 40 0.215 0.783 -10.144 1.00 0.00 C ATOM 20 O ARG A 40 0.604 1.505 -11.061 1.00 0.00 O ATOM 21 CB ARG A 40 -1.888 -0.471 -10.795 1.00 0.00 C ATOM 22 CG ARG A 40 -2.168 0.359 -12.054 1.00 0.00 C ATOM 23 CD ARG A 40 -3.580 0.121 -12.597 1.00 0.00 C ATOM 24 NE ARG A 40 -4.642 0.450 -11.632 1.00 0.00 N ATOM 25 CZ ARG A 40 -5.819 -0.189 -11.566 1.00 0.00 C ATOM 26 NH1 ARG A 40 -6.096 -1.197 -12.389 1.00 0.00 N1+ ATOM 27 NH2 ARG A 40 -6.728 0.179 -10.676 1.00 0.00 N ATOM 0 H ARG A 40 -1.046 -1.633 -8.733 1.00 0.00 H new ATOM 0 HA ARG A 40 0.135 -1.003 -11.296 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -2.298 -1.471 -10.934 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -2.417 -0.024 -9.953 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -2.041 1.417 -11.826 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -1.437 0.109 -12.823 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -3.720 0.719 -13.498 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -3.677 -0.924 -12.890 1.00 0.00 H new ATOM 0 HE ARG A 40 -4.472 1.210 -10.974 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -5.409 -1.493 -13.082 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -6.996 -1.674 -12.327 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -6.534 0.951 -10.038 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -7.622 -0.309 -10.629 1.00 0.00 H new ATOM 41 N PHE A 41 0.312 1.131 -8.867 1.00 0.00 N ATOM 42 CA PHE A 41 0.889 2.409 -8.465 1.00 0.00 C ATOM 43 C PHE A 41 2.017 2.181 -7.465 1.00 0.00 C ATOM 44 O PHE A 41 1.784 2.140 -6.253 1.00 0.00 O ATOM 45 CB PHE A 41 -0.176 3.331 -7.858 1.00 0.00 C ATOM 46 CG PHE A 41 -1.222 3.790 -8.835 1.00 0.00 C ATOM 47 CD1 PHE A 41 -2.377 3.050 -9.036 1.00 0.00 C ATOM 48 CD2 PHE A 41 -1.053 4.966 -9.551 1.00 0.00 C ATOM 49 CE1 PHE A 41 -3.339 3.470 -9.930 1.00 0.00 C ATOM 50 CE2 PHE A 41 -2.015 5.390 -10.447 1.00 0.00 C ATOM 51 CZ PHE A 41 -3.159 4.641 -10.637 1.00 0.00 C ATOM 0 H PHE A 41 -0.001 0.547 -8.092 1.00 0.00 H new ATOM 0 HA PHE A 41 1.290 2.895 -9.354 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -0.666 2.809 -7.036 1.00 0.00 H new ATOM 0 HB3 PHE A 41 0.316 4.205 -7.432 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -2.525 2.133 -8.485 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -0.160 5.556 -9.406 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -4.233 2.882 -10.077 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -1.872 6.307 -10.999 1.00 0.00 H new ATOM 0 HZ PHE A 41 -3.912 4.971 -11.338 1.00 0.00 H new ATOM 61 N PRO A 42 3.252 2.004 -7.961 1.00 0.00 N ATOM 62 CA PRO A 42 4.411 1.707 -7.113 1.00 0.00 C ATOM 63 C PRO A 42 4.803 2.868 -6.203 1.00 0.00 C ATOM 64 O PRO A 42 4.672 4.039 -6.562 1.00 0.00 O ATOM 65 CB PRO A 42 5.531 1.419 -8.118 1.00 0.00 C ATOM 66 CG PRO A 42 5.119 2.120 -9.367 1.00 0.00 C ATOM 67 CD PRO A 42 3.614 2.074 -9.391 1.00 0.00 C ATOM 0 HA PRO A 42 4.201 0.881 -6.433 1.00 0.00 H new ATOM 0 HB2 PRO A 42 6.490 1.789 -7.756 1.00 0.00 H new ATOM 0 HB3 PRO A 42 5.645 0.348 -8.286 1.00 0.00 H new ATOM 0 HG2 PRO A 42 5.478 3.149 -9.374 1.00 0.00 H new ATOM 0 HG3 PRO A 42 5.538 1.630 -10.246 1.00 0.00 H new ATOM 0 HD2 PRO A 42 3.192 2.958 -9.870 1.00 0.00 H new ATOM 0 HD3 PRO A 42 3.247 1.208 -9.941 1.00 0.00 H new ATOM 75 N VAL A 43 5.285 2.523 -5.017 1.00 0.00 N ATOM 76 CA VAL A 43 5.748 3.503 -4.049 1.00 0.00 C ATOM 77 C VAL A 43 7.194 3.871 -4.357 1.00 0.00 C ATOM 78 O VAL A 43 8.008 2.983 -4.617 1.00 0.00 O ATOM 79 CB VAL A 43 5.657 2.929 -2.617 1.00 0.00 C ATOM 80 CG1 VAL A 43 6.029 3.973 -1.571 1.00 0.00 C ATOM 81 CG2 VAL A 43 4.266 2.383 -2.357 1.00 0.00 C ATOM 0 H VAL A 43 5.365 1.557 -4.701 1.00 0.00 H new ATOM 0 HA VAL A 43 5.118 4.390 -4.113 1.00 0.00 H new ATOM 0 HB VAL A 43 6.376 2.114 -2.536 1.00 0.00 H new ATOM 0 HG11 VAL A 43 5.954 3.534 -0.576 1.00 0.00 H new ATOM 0 HG12 VAL A 43 7.051 4.311 -1.742 1.00 0.00 H new ATOM 0 HG13 VAL A 43 5.349 4.821 -1.646 1.00 0.00 H new ATOM 0 HG21 VAL A 43 4.216 1.982 -1.345 1.00 0.00 H new ATOM 0 HG22 VAL A 43 3.535 3.184 -2.467 1.00 0.00 H new ATOM 0 HG23 VAL A 43 4.047 1.591 -3.073 1.00 0.00 H new ATOM 91 N PRO A 44 7.524 5.177 -4.383 1.00 0.00 N ATOM 92 CA PRO A 44 8.898 5.632 -4.621 1.00 0.00 C ATOM 93 C PRO A 44 9.898 4.947 -3.693 1.00 0.00 C ATOM 94 O PRO A 44 9.676 4.847 -2.485 1.00 0.00 O ATOM 95 CB PRO A 44 8.832 7.132 -4.326 1.00 0.00 C ATOM 96 CG PRO A 44 7.414 7.510 -4.583 1.00 0.00 C ATOM 97 CD PRO A 44 6.587 6.307 -4.218 1.00 0.00 C ATOM 0 HA PRO A 44 9.238 5.400 -5.630 1.00 0.00 H new ATOM 0 HB2 PRO A 44 9.117 7.345 -3.296 1.00 0.00 H new ATOM 0 HB3 PRO A 44 9.513 7.691 -4.968 1.00 0.00 H new ATOM 0 HG2 PRO A 44 7.127 8.375 -3.986 1.00 0.00 H new ATOM 0 HG3 PRO A 44 7.267 7.781 -5.628 1.00 0.00 H new ATOM 0 HD2 PRO A 44 6.214 6.372 -3.196 1.00 0.00 H new ATOM 0 HD3 PRO A 44 5.718 6.206 -4.868 1.00 0.00 H new ATOM 105 N ASP A 45 11.011 4.510 -4.273 1.00 0.00 N ATOM 106 CA ASP A 45 12.005 3.704 -3.565 1.00 0.00 C ATOM 107 C ASP A 45 12.703 4.513 -2.474 1.00 0.00 C ATOM 108 O ASP A 45 13.292 3.951 -1.554 1.00 0.00 O ATOM 109 CB ASP A 45 13.045 3.180 -4.567 1.00 0.00 C ATOM 110 CG ASP A 45 13.894 2.048 -4.021 1.00 0.00 C ATOM 111 OD1 ASP A 45 13.541 0.871 -4.247 1.00 0.00 O ATOM 112 OD2 ASP A 45 14.944 2.321 -3.400 1.00 0.00 O1- ATOM 0 H ASP A 45 11.251 4.703 -5.245 1.00 0.00 H new ATOM 0 HA ASP A 45 11.492 2.869 -3.089 1.00 0.00 H new ATOM 0 HB2 ASP A 45 12.532 2.838 -5.466 1.00 0.00 H new ATOM 0 HB3 ASP A 45 13.697 4.001 -4.865 1.00 0.00 H new ATOM 117 N ASP A 46 12.609 5.833 -2.570 1.00 0.00 N ATOM 118 CA ASP A 46 13.319 6.726 -1.656 1.00 0.00 C ATOM 119 C ASP A 46 12.459 7.102 -0.450 1.00 0.00 C ATOM 120 O ASP A 46 12.830 7.978 0.333 1.00 0.00 O ATOM 121 CB ASP A 46 13.775 7.997 -2.389 1.00 0.00 C ATOM 122 CG ASP A 46 12.626 8.817 -2.947 1.00 0.00 C ATOM 123 OD1 ASP A 46 12.232 9.815 -2.306 1.00 0.00 O ATOM 124 OD2 ASP A 46 12.127 8.483 -4.044 1.00 0.00 O1- ATOM 0 H ASP A 46 12.047 6.313 -3.273 1.00 0.00 H new ATOM 0 HA ASP A 46 14.194 6.188 -1.291 1.00 0.00 H new ATOM 0 HB2 ASP A 46 14.353 8.616 -1.703 1.00 0.00 H new ATOM 0 HB3 ASP A 46 14.442 7.717 -3.205 1.00 0.00 H new ATOM 129 N ILE A 47 11.324 6.440 -0.293 1.00 0.00 N ATOM 130 CA ILE A 47 10.442 6.702 0.835 1.00 0.00 C ATOM 131 C ILE A 47 10.687 5.694 1.951 1.00 0.00 C ATOM 132 O ILE A 47 10.544 4.483 1.759 1.00 0.00 O ATOM 133 CB ILE A 47 8.958 6.660 0.411 1.00 0.00 C ATOM 134 CG1 ILE A 47 8.658 7.788 -0.585 1.00 0.00 C ATOM 135 CG2 ILE A 47 8.051 6.772 1.629 1.00 0.00 C ATOM 136 CD1 ILE A 47 8.710 9.174 0.026 1.00 0.00 C ATOM 0 H ILE A 47 10.991 5.718 -0.931 1.00 0.00 H new ATOM 0 HA ILE A 47 10.666 7.704 1.201 1.00 0.00 H new ATOM 0 HB ILE A 47 8.764 5.704 -0.075 1.00 0.00 H new ATOM 0 HG12 ILE A 47 9.374 7.736 -1.405 1.00 0.00 H new ATOM 0 HG13 ILE A 47 7.669 7.627 -1.014 1.00 0.00 H new ATOM 0 HG21 ILE A 47 7.009 6.741 1.311 1.00 0.00 H new ATOM 0 HG22 ILE A 47 8.248 5.942 2.307 1.00 0.00 H new ATOM 0 HG23 ILE A 47 8.245 7.714 2.142 1.00 0.00 H new ATOM 0 HD11 ILE A 47 8.487 9.918 -0.739 1.00 0.00 H new ATOM 0 HD12 ILE A 47 7.974 9.246 0.827 1.00 0.00 H new ATOM 0 HD13 ILE A 47 9.706 9.356 0.430 1.00 0.00 H new ATOM 148 N THR A 48 11.080 6.199 3.111 1.00 0.00 N ATOM 149 CA THR A 48 11.290 5.348 4.268 1.00 0.00 C ATOM 150 C THR A 48 9.954 4.949 4.881 1.00 0.00 C ATOM 151 O THR A 48 8.937 5.595 4.625 1.00 0.00 O ATOM 152 CB THR A 48 12.169 6.028 5.342 1.00 0.00 C ATOM 153 OG1 THR A 48 11.514 7.191 5.868 1.00 0.00 O ATOM 154 CG2 THR A 48 13.518 6.424 4.762 1.00 0.00 C ATOM 0 H THR A 48 11.259 7.190 3.274 1.00 0.00 H new ATOM 0 HA THR A 48 11.817 4.460 3.919 1.00 0.00 H new ATOM 0 HB THR A 48 12.326 5.311 6.148 1.00 0.00 H new ATOM 0 HG1 THR A 48 12.084 7.608 6.548 1.00 0.00 H new ATOM 0 HG21 THR A 48 14.121 6.901 5.535 1.00 0.00 H new ATOM 0 HG22 THR A 48 14.033 5.535 4.398 1.00 0.00 H new ATOM 0 HG23 THR A 48 13.369 7.121 3.937 1.00 0.00 H new ATOM 162 N VAL A 49 9.946 3.892 5.679 1.00 0.00 N ATOM 163 CA VAL A 49 8.717 3.442 6.325 1.00 0.00 C ATOM 164 C VAL A 49 8.111 4.565 7.170 1.00 0.00 C ATOM 165 O VAL A 49 6.891 4.736 7.218 1.00 0.00 O ATOM 166 CB VAL A 49 8.960 2.190 7.199 1.00 0.00 C ATOM 167 CG1 VAL A 49 7.643 1.618 7.697 1.00 0.00 C ATOM 168 CG2 VAL A 49 9.739 1.135 6.424 1.00 0.00 C ATOM 0 H VAL A 49 10.770 3.331 5.895 1.00 0.00 H new ATOM 0 HA VAL A 49 8.013 3.171 5.538 1.00 0.00 H new ATOM 0 HB VAL A 49 9.553 2.490 8.063 1.00 0.00 H new ATOM 0 HG11 VAL A 49 7.837 0.738 8.310 1.00 0.00 H new ATOM 0 HG12 VAL A 49 7.123 2.368 8.293 1.00 0.00 H new ATOM 0 HG13 VAL A 49 7.023 1.338 6.846 1.00 0.00 H new ATOM 0 HG21 VAL A 49 9.899 0.263 7.057 1.00 0.00 H new ATOM 0 HG22 VAL A 49 9.174 0.842 5.539 1.00 0.00 H new ATOM 0 HG23 VAL A 49 10.702 1.544 6.120 1.00 0.00 H new ATOM 178 N LYS A 50 8.976 5.353 7.799 1.00 0.00 N ATOM 179 CA LYS A 50 8.529 6.488 8.602 1.00 0.00 C ATOM 180 C LYS A 50 7.897 7.565 7.713 1.00 0.00 C ATOM 181 O LYS A 50 6.808 8.060 8.007 1.00 0.00 O ATOM 182 CB LYS A 50 9.700 7.085 9.394 1.00 0.00 C ATOM 183 CG LYS A 50 9.282 8.189 10.352 1.00 0.00 C ATOM 184 CD LYS A 50 10.482 8.930 10.915 1.00 0.00 C ATOM 185 CE LYS A 50 10.056 9.995 11.914 1.00 0.00 C ATOM 186 NZ LYS A 50 9.105 10.972 11.319 1.00 0.00 N1+ ATOM 0 H LYS A 50 9.988 5.228 7.769 1.00 0.00 H new ATOM 0 HA LYS A 50 7.777 6.128 9.304 1.00 0.00 H new ATOM 0 HB2 LYS A 50 10.189 6.291 9.958 1.00 0.00 H new ATOM 0 HB3 LYS A 50 10.437 7.481 8.695 1.00 0.00 H new ATOM 0 HG2 LYS A 50 8.630 8.893 9.834 1.00 0.00 H new ATOM 0 HG3 LYS A 50 8.703 7.761 11.170 1.00 0.00 H new ATOM 0 HD2 LYS A 50 11.154 8.222 11.400 1.00 0.00 H new ATOM 0 HD3 LYS A 50 11.040 9.394 10.102 1.00 0.00 H new ATOM 0 HE2 LYS A 50 9.592 9.517 12.777 1.00 0.00 H new ATOM 0 HE3 LYS A 50 10.937 10.523 12.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 8.986 11.778 11.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 9.479 11.310 10.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 8.185 10.512 11.166 1.00 0.00 H new ATOM 200 N GLN A 51 8.569 7.902 6.611 1.00 0.00 N ATOM 201 CA GLN A 51 8.073 8.919 5.685 1.00 0.00 C ATOM 202 C GLN A 51 6.764 8.479 5.053 1.00 0.00 C ATOM 203 O GLN A 51 5.837 9.272 4.901 1.00 0.00 O ATOM 204 CB GLN A 51 9.101 9.195 4.585 1.00 0.00 C ATOM 205 CG GLN A 51 10.267 10.065 5.028 1.00 0.00 C ATOM 206 CD GLN A 51 11.384 10.098 4.001 1.00 0.00 C ATOM 207 OE1 GLN A 51 11.582 9.139 3.252 1.00 0.00 O ATOM 208 NE2 GLN A 51 12.128 11.194 3.955 1.00 0.00 N ATOM 0 H GLN A 51 9.459 7.485 6.339 1.00 0.00 H new ATOM 0 HA GLN A 51 7.904 9.833 6.254 1.00 0.00 H new ATOM 0 HB2 GLN A 51 9.489 8.245 4.219 1.00 0.00 H new ATOM 0 HB3 GLN A 51 8.599 9.678 3.747 1.00 0.00 H new ATOM 0 HG2 GLN A 51 9.912 11.080 5.208 1.00 0.00 H new ATOM 0 HG3 GLN A 51 10.658 9.691 5.974 1.00 0.00 H new ATOM 0 HE21 GLN A 51 11.935 11.968 4.590 1.00 0.00 H new ATOM 0 HE22 GLN A 51 12.893 11.263 3.284 1.00 0.00 H new ATOM 217 N ALA A 52 6.696 7.204 4.697 1.00 0.00 N ATOM 218 CA ALA A 52 5.501 6.636 4.105 1.00 0.00 C ATOM 219 C ALA A 52 4.320 6.744 5.061 1.00 0.00 C ATOM 220 O ALA A 52 3.201 7.064 4.656 1.00 0.00 O ATOM 221 CB ALA A 52 5.757 5.189 3.724 1.00 0.00 C ATOM 0 H ALA A 52 7.463 6.541 4.811 1.00 0.00 H new ATOM 0 HA ALA A 52 5.251 7.198 3.205 1.00 0.00 H new ATOM 0 HB1 ALA A 52 4.857 4.765 3.279 1.00 0.00 H new ATOM 0 HB2 ALA A 52 6.574 5.141 3.004 1.00 0.00 H new ATOM 0 HB3 ALA A 52 6.024 4.620 4.615 1.00 0.00 H new ATOM 227 N THR A 53 4.582 6.496 6.337 1.00 0.00 N ATOM 228 CA THR A 53 3.557 6.605 7.362 1.00 0.00 C ATOM 229 C THR A 53 3.095 8.053 7.519 1.00 0.00 C ATOM 230 O THR A 53 1.900 8.325 7.614 1.00 0.00 O ATOM 231 CB THR A 53 4.071 6.065 8.711 1.00 0.00 C ATOM 232 OG1 THR A 53 4.525 4.715 8.544 1.00 0.00 O ATOM 233 CG2 THR A 53 2.981 6.104 9.775 1.00 0.00 C ATOM 0 H THR A 53 5.499 6.217 6.686 1.00 0.00 H new ATOM 0 HA THR A 53 2.706 6.001 7.047 1.00 0.00 H new ATOM 0 HB THR A 53 4.893 6.700 9.041 1.00 0.00 H new ATOM 0 HG1 THR A 53 5.379 4.714 8.064 1.00 0.00 H new ATOM 0 HG21 THR A 53 3.375 5.717 10.714 1.00 0.00 H new ATOM 0 HG22 THR A 53 2.648 7.132 9.918 1.00 0.00 H new ATOM 0 HG23 THR A 53 2.138 5.491 9.455 1.00 0.00 H new ATOM 241 N GLU A 54 4.041 8.985 7.523 1.00 0.00 N ATOM 242 CA GLU A 54 3.706 10.404 7.604 1.00 0.00 C ATOM 243 C GLU A 54 2.922 10.847 6.375 1.00 0.00 C ATOM 244 O GLU A 54 2.027 11.689 6.463 1.00 0.00 O ATOM 245 CB GLU A 54 4.968 11.255 7.741 1.00 0.00 C ATOM 246 CG GLU A 54 5.673 11.092 9.078 1.00 0.00 C ATOM 247 CD GLU A 54 4.783 11.453 10.248 1.00 0.00 C ATOM 248 OE1 GLU A 54 4.583 12.659 10.501 1.00 0.00 O ATOM 249 OE2 GLU A 54 4.284 10.532 10.926 1.00 0.00 O1- ATOM 0 H GLU A 54 5.040 8.787 7.472 1.00 0.00 H new ATOM 0 HA GLU A 54 3.086 10.546 8.489 1.00 0.00 H new ATOM 0 HB2 GLU A 54 5.660 10.993 6.941 1.00 0.00 H new ATOM 0 HB3 GLU A 54 4.705 12.304 7.605 1.00 0.00 H new ATOM 0 HG2 GLU A 54 6.009 10.061 9.185 1.00 0.00 H new ATOM 0 HG3 GLU A 54 6.563 11.720 9.095 1.00 0.00 H new ATOM 256 N LYS A 55 3.254 10.263 5.235 1.00 0.00 N ATOM 257 CA LYS A 55 2.626 10.628 3.972 1.00 0.00 C ATOM 258 C LYS A 55 1.159 10.201 3.948 1.00 0.00 C ATOM 259 O LYS A 55 0.296 10.941 3.472 1.00 0.00 O ATOM 260 CB LYS A 55 3.387 9.990 2.801 1.00 0.00 C ATOM 261 CG LYS A 55 2.973 10.515 1.426 1.00 0.00 C ATOM 262 CD LYS A 55 3.220 12.014 1.291 1.00 0.00 C ATOM 263 CE LYS A 55 2.954 12.496 -0.128 1.00 0.00 C ATOM 264 NZ LYS A 55 1.564 12.204 -0.571 1.00 0.00 N1+ ATOM 0 H LYS A 55 3.959 9.530 5.157 1.00 0.00 H new ATOM 0 HA LYS A 55 2.664 11.713 3.870 1.00 0.00 H new ATOM 0 HB2 LYS A 55 4.454 10.164 2.938 1.00 0.00 H new ATOM 0 HB3 LYS A 55 3.234 8.911 2.827 1.00 0.00 H new ATOM 0 HG2 LYS A 55 3.529 9.985 0.653 1.00 0.00 H new ATOM 0 HG3 LYS A 55 1.916 10.305 1.260 1.00 0.00 H new ATOM 0 HD2 LYS A 55 2.578 12.554 1.987 1.00 0.00 H new ATOM 0 HD3 LYS A 55 4.250 12.241 1.567 1.00 0.00 H new ATOM 0 HE2 LYS A 55 3.133 13.570 -0.184 1.00 0.00 H new ATOM 0 HE3 LYS A 55 3.658 12.019 -0.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 1.439 12.519 -1.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 1.388 11.181 -0.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 0.891 12.707 0.042 1.00 0.00 H new ATOM 278 N CYS A 56 0.876 9.016 4.473 1.00 0.00 N ATOM 279 CA CYS A 56 -0.486 8.489 4.469 1.00 0.00 C ATOM 280 C CYS A 56 -1.291 8.939 5.688 1.00 0.00 C ATOM 281 O CYS A 56 -2.487 8.663 5.781 1.00 0.00 O ATOM 282 CB CYS A 56 -0.465 6.965 4.376 1.00 0.00 C ATOM 283 SG CYS A 56 0.112 6.344 2.764 1.00 0.00 S ATOM 0 H CYS A 56 1.567 8.403 4.906 1.00 0.00 H new ATOM 0 HA CYS A 56 -0.985 8.897 3.590 1.00 0.00 H new ATOM 0 HB2 CYS A 56 0.180 6.570 5.161 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -1.468 6.583 4.566 1.00 0.00 H new ATOM 288 N GLY A 57 -0.645 9.623 6.622 1.00 0.00 N ATOM 289 CA GLY A 57 -1.361 10.165 7.761 1.00 0.00 C ATOM 290 C GLY A 57 -1.116 9.386 9.037 1.00 0.00 C ATOM 291 O GLY A 57 -0.539 8.299 9.013 1.00 0.00 O ATOM 0 H GLY A 57 0.357 9.812 6.613 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -1.062 11.202 7.912 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -2.429 10.170 7.544 1.00 0.00 H new ATOM 295 N ASP A 58 -1.575 9.932 10.158 1.00 0.00 N ATOM 296 CA ASP A 58 -1.294 9.347 11.467 1.00 0.00 C ATOM 297 C ASP A 58 -2.223 8.177 11.765 1.00 0.00 C ATOM 298 O ASP A 58 -1.949 7.370 12.653 1.00 0.00 O ATOM 299 CB ASP A 58 -1.416 10.407 12.571 1.00 0.00 C ATOM 300 CG ASP A 58 -2.850 10.820 12.839 1.00 0.00 C ATOM 301 OD1 ASP A 58 -3.380 10.465 13.913 1.00 0.00 O ATOM 302 OD2 ASP A 58 -3.450 11.506 11.986 1.00 0.00 O1- ATOM 0 H ASP A 58 -2.143 10.779 10.188 1.00 0.00 H new ATOM 0 HA ASP A 58 -0.271 8.972 11.445 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -0.978 10.019 13.490 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -0.837 11.286 12.289 1.00 0.00 H new ATOM 307 N GLN A 59 -3.312 8.080 11.018 1.00 0.00 N ATOM 308 CA GLN A 59 -4.276 7.005 11.213 1.00 0.00 C ATOM 309 C GLN A 59 -4.040 5.877 10.216 1.00 0.00 C ATOM 310 O GLN A 59 -4.896 5.013 10.024 1.00 0.00 O ATOM 311 CB GLN A 59 -5.705 7.538 11.066 1.00 0.00 C ATOM 312 CG GLN A 59 -6.135 8.470 12.188 1.00 0.00 C ATOM 313 CD GLN A 59 -7.537 9.015 11.985 1.00 0.00 C ATOM 314 OE1 GLN A 59 -8.265 9.258 12.946 1.00 0.00 O ATOM 315 NE2 GLN A 59 -7.923 9.224 10.733 1.00 0.00 N ATOM 0 H GLN A 59 -3.551 8.732 10.271 1.00 0.00 H new ATOM 0 HA GLN A 59 -4.144 6.611 12.221 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -5.789 8.066 10.116 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -6.394 6.695 11.024 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -6.090 7.936 13.137 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -5.432 9.300 12.256 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -7.291 9.010 9.962 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -8.852 9.599 10.542 1.00 0.00 H new ATOM 324 N ALA A 60 -2.878 5.883 9.584 1.00 0.00 N ATOM 325 CA ALA A 60 -2.557 4.879 8.589 1.00 0.00 C ATOM 326 C ALA A 60 -1.198 4.261 8.857 1.00 0.00 C ATOM 327 O ALA A 60 -0.294 4.920 9.371 1.00 0.00 O ATOM 328 CB ALA A 60 -2.594 5.484 7.199 1.00 0.00 C ATOM 0 H ALA A 60 -2.143 6.572 9.744 1.00 0.00 H new ATOM 0 HA ALA A 60 -3.307 4.090 8.651 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -2.351 4.718 6.462 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -3.591 5.876 6.999 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -1.866 6.293 7.135 1.00 0.00 H new ATOM 334 N GLN A 61 -1.073 2.986 8.538 1.00 0.00 N ATOM 335 CA GLN A 61 0.196 2.289 8.657 1.00 0.00 C ATOM 336 C GLN A 61 0.432 1.455 7.402 1.00 0.00 C ATOM 337 O GLN A 61 -0.521 0.937 6.813 1.00 0.00 O ATOM 338 CB GLN A 61 0.210 1.403 9.903 1.00 0.00 C ATOM 339 CG GLN A 61 1.603 0.926 10.288 1.00 0.00 C ATOM 340 CD GLN A 61 1.612 0.122 11.577 1.00 0.00 C ATOM 341 OE1 GLN A 61 0.754 0.308 12.443 1.00 0.00 O ATOM 342 NE2 GLN A 61 2.592 -0.755 11.732 1.00 0.00 N ATOM 0 H GLN A 61 -1.839 2.408 8.192 1.00 0.00 H new ATOM 0 HA GLN A 61 0.998 3.020 8.759 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -0.221 1.956 10.738 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -0.428 0.536 9.731 1.00 0.00 H new ATOM 0 HG2 GLN A 61 2.010 0.316 9.481 1.00 0.00 H new ATOM 0 HG3 GLN A 61 2.260 1.788 10.398 1.00 0.00 H new ATOM 0 HE21 GLN A 61 3.284 -0.882 10.994 1.00 0.00 H new ATOM 0 HE22 GLN A 61 2.655 -1.303 12.590 1.00 0.00 H new ATOM 351 N LEU A 62 1.688 1.365 6.979 1.00 0.00 N ATOM 352 CA LEU A 62 2.042 0.621 5.775 1.00 0.00 C ATOM 353 C LEU A 62 1.779 -0.863 5.956 1.00 0.00 C ATOM 354 O LEU A 62 2.092 -1.440 7.000 1.00 0.00 O ATOM 355 CB LEU A 62 3.518 0.829 5.405 1.00 0.00 C ATOM 356 CG LEU A 62 3.866 2.162 4.733 1.00 0.00 C ATOM 357 CD1 LEU A 62 3.072 2.348 3.450 1.00 0.00 C ATOM 358 CD2 LEU A 62 3.633 3.328 5.678 1.00 0.00 C ATOM 0 H LEU A 62 2.480 1.799 7.453 1.00 0.00 H new ATOM 0 HA LEU A 62 1.417 1.002 4.968 1.00 0.00 H new ATOM 0 HB2 LEU A 62 4.115 0.737 6.312 1.00 0.00 H new ATOM 0 HB3 LEU A 62 3.822 0.021 4.740 1.00 0.00 H new ATOM 0 HG LEU A 62 4.926 2.138 4.479 1.00 0.00 H new ATOM 0 HD11 LEU A 62 3.337 3.301 2.993 1.00 0.00 H new ATOM 0 HD12 LEU A 62 3.302 1.537 2.759 1.00 0.00 H new ATOM 0 HD13 LEU A 62 2.006 2.339 3.677 1.00 0.00 H new ATOM 0 HD21 LEU A 62 3.888 4.261 5.175 1.00 0.00 H new ATOM 0 HD22 LEU A 62 2.585 3.351 5.976 1.00 0.00 H new ATOM 0 HD23 LEU A 62 4.259 3.210 6.563 1.00 0.00 H new ATOM 370 N SER A 63 1.204 -1.470 4.935 1.00 0.00 N ATOM 371 CA SER A 63 0.920 -2.887 4.951 1.00 0.00 C ATOM 372 C SER A 63 1.244 -3.481 3.582 1.00 0.00 C ATOM 373 O SER A 63 0.992 -2.857 2.549 1.00 0.00 O ATOM 374 CB SER A 63 -0.549 -3.124 5.321 1.00 0.00 C ATOM 375 OG SER A 63 -0.761 -4.450 5.772 1.00 0.00 O ATOM 0 H SER A 63 0.923 -0.995 4.077 1.00 0.00 H new ATOM 0 HA SER A 63 1.539 -3.379 5.701 1.00 0.00 H new ATOM 0 HB2 SER A 63 -0.848 -2.421 6.099 1.00 0.00 H new ATOM 0 HB3 SER A 63 -1.180 -2.927 4.454 1.00 0.00 H new ATOM 0 HG SER A 63 -0.644 -5.072 5.024 1.00 0.00 H new ATOM 381 N CYS A 64 1.821 -4.670 3.583 1.00 0.00 N ATOM 382 CA CYS A 64 2.218 -5.334 2.351 1.00 0.00 C ATOM 383 C CYS A 64 1.321 -6.533 2.078 1.00 0.00 C ATOM 384 O CYS A 64 1.277 -7.480 2.868 1.00 0.00 O ATOM 385 CB CYS A 64 3.683 -5.766 2.437 1.00 0.00 C ATOM 386 SG CYS A 64 4.865 -4.396 2.254 1.00 0.00 S ATOM 0 H CYS A 64 2.027 -5.200 4.430 1.00 0.00 H new ATOM 0 HA CYS A 64 2.109 -4.633 1.524 1.00 0.00 H new ATOM 0 HB2 CYS A 64 3.852 -6.254 3.397 1.00 0.00 H new ATOM 0 HB3 CYS A 64 3.879 -6.508 1.663 1.00 0.00 H new ATOM 391 N CYS A 65 0.594 -6.485 0.970 1.00 0.00 N ATOM 392 CA CYS A 65 -0.369 -7.532 0.654 1.00 0.00 C ATOM 393 C CYS A 65 0.021 -8.255 -0.633 1.00 0.00 C ATOM 394 O CYS A 65 0.494 -7.633 -1.586 1.00 0.00 O ATOM 395 CB CYS A 65 -1.770 -6.935 0.499 1.00 0.00 C ATOM 396 SG CYS A 65 -2.103 -5.458 1.526 1.00 0.00 S ATOM 0 H CYS A 65 0.652 -5.737 0.279 1.00 0.00 H new ATOM 0 HA CYS A 65 -0.370 -8.249 1.475 1.00 0.00 H new ATOM 0 HB2 CYS A 65 -1.922 -6.672 -0.548 1.00 0.00 H new ATOM 0 HB3 CYS A 65 -2.504 -7.702 0.745 1.00 0.00 H new ATOM 401 N ASN A 66 -0.188 -9.570 -0.653 1.00 0.00 N ATOM 402 CA ASN A 66 0.179 -10.393 -1.804 1.00 0.00 C ATOM 403 C ASN A 66 -0.922 -10.387 -2.870 1.00 0.00 C ATOM 404 O ASN A 66 -0.663 -10.655 -4.045 1.00 0.00 O ATOM 405 CB ASN A 66 0.479 -11.830 -1.344 1.00 0.00 C ATOM 406 CG ASN A 66 0.994 -12.725 -2.465 1.00 0.00 C ATOM 407 OD1 ASN A 66 1.598 -12.257 -3.428 1.00 0.00 O ATOM 408 ND2 ASN A 66 0.785 -14.028 -2.330 1.00 0.00 N ATOM 0 H ASN A 66 -0.610 -10.089 0.117 1.00 0.00 H new ATOM 0 HA ASN A 66 1.075 -9.968 -2.256 1.00 0.00 H new ATOM 0 HB2 ASN A 66 1.217 -11.801 -0.543 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -0.428 -12.267 -0.926 1.00 0.00 H new ATOM 0 HD21 ASN A 66 1.130 -14.676 -3.038 1.00 0.00 H new ATOM 0 HD22 ASN A 66 0.280 -14.382 -1.518 1.00 0.00 H new ATOM 415 N LYS A 67 -2.151 -10.074 -2.465 1.00 0.00 N ATOM 416 CA LYS A 67 -3.269 -9.990 -3.399 1.00 0.00 C ATOM 417 C LYS A 67 -3.936 -8.624 -3.296 1.00 0.00 C ATOM 418 O LYS A 67 -4.086 -8.080 -2.198 1.00 0.00 O ATOM 419 CB LYS A 67 -4.292 -11.094 -3.118 1.00 0.00 C ATOM 420 CG LYS A 67 -3.751 -12.505 -3.322 1.00 0.00 C ATOM 421 CD LYS A 67 -4.819 -13.554 -3.042 1.00 0.00 C ATOM 422 CE LYS A 67 -4.273 -14.973 -3.163 1.00 0.00 C ATOM 423 NZ LYS A 67 -5.315 -15.990 -2.862 1.00 0.00 N1+ ATOM 0 H LYS A 67 -2.397 -9.874 -1.495 1.00 0.00 H new ATOM 0 HA LYS A 67 -2.884 -10.124 -4.410 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -4.645 -10.996 -2.091 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -5.156 -10.949 -3.767 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -3.391 -12.614 -4.345 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -2.897 -12.668 -2.664 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -5.220 -13.404 -2.040 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -5.647 -13.424 -3.739 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -3.891 -15.131 -4.171 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -3.433 -15.099 -2.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -4.907 -16.942 -2.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -5.662 -15.855 -1.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -6.105 -15.885 -3.530 1.00 0.00 H new ATOM 437 N ALA A 68 -4.334 -8.069 -4.434 1.00 0.00 N ATOM 438 CA ALA A 68 -4.926 -6.740 -4.467 1.00 0.00 C ATOM 439 C ALA A 68 -6.151 -6.691 -5.374 1.00 0.00 C ATOM 440 O ALA A 68 -6.088 -7.101 -6.537 1.00 0.00 O ATOM 441 CB ALA A 68 -3.898 -5.721 -4.934 1.00 0.00 C ATOM 0 H ALA A 68 -4.257 -8.520 -5.346 1.00 0.00 H new ATOM 0 HA ALA A 68 -5.248 -6.497 -3.454 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -4.352 -4.730 -4.955 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -3.051 -5.718 -4.248 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -3.554 -5.984 -5.934 1.00 0.00 H new ATOM 447 N THR A 69 -7.262 -6.199 -4.842 1.00 0.00 N ATOM 448 CA THR A 69 -8.454 -5.964 -5.638 1.00 0.00 C ATOM 449 C THR A 69 -8.810 -4.482 -5.600 1.00 0.00 C ATOM 450 O THR A 69 -9.148 -3.941 -4.547 1.00 0.00 O ATOM 451 CB THR A 69 -9.649 -6.793 -5.123 1.00 0.00 C ATOM 452 OG1 THR A 69 -9.303 -8.186 -5.088 1.00 0.00 O ATOM 453 CG2 THR A 69 -10.872 -6.594 -6.010 1.00 0.00 C ATOM 0 H THR A 69 -7.360 -5.954 -3.857 1.00 0.00 H new ATOM 0 HA THR A 69 -8.242 -6.272 -6.662 1.00 0.00 H new ATOM 0 HB THR A 69 -9.889 -6.452 -4.116 1.00 0.00 H new ATOM 0 HG1 THR A 69 -10.066 -8.705 -4.758 1.00 0.00 H new ATOM 0 HG21 THR A 69 -11.701 -7.189 -5.626 1.00 0.00 H new ATOM 0 HG22 THR A 69 -11.152 -5.541 -6.013 1.00 0.00 H new ATOM 0 HG23 THR A 69 -10.639 -6.910 -7.027 1.00 0.00 H new ATOM 461 N TYR A 70 -8.734 -3.826 -6.747 1.00 0.00 N ATOM 462 CA TYR A 70 -9.035 -2.405 -6.821 1.00 0.00 C ATOM 463 C TYR A 70 -10.520 -2.213 -7.119 1.00 0.00 C ATOM 464 O TYR A 70 -11.080 -2.872 -7.994 1.00 0.00 O ATOM 465 CB TYR A 70 -8.173 -1.718 -7.888 1.00 0.00 C ATOM 466 CG TYR A 70 -6.677 -1.892 -7.687 1.00 0.00 C ATOM 467 CD1 TYR A 70 -6.013 -1.268 -6.633 1.00 0.00 C ATOM 468 CD2 TYR A 70 -5.923 -2.667 -8.565 1.00 0.00 C ATOM 469 CE1 TYR A 70 -4.648 -1.408 -6.464 1.00 0.00 C ATOM 470 CE2 TYR A 70 -4.559 -2.816 -8.396 1.00 0.00 C ATOM 471 CZ TYR A 70 -3.925 -2.184 -7.345 1.00 0.00 C ATOM 472 OH TYR A 70 -2.563 -2.319 -7.183 1.00 0.00 O ATOM 0 H TYR A 70 -8.468 -4.252 -7.635 1.00 0.00 H new ATOM 0 HA TYR A 70 -8.802 -1.944 -5.861 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -8.445 -2.112 -8.867 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -8.406 -0.653 -7.897 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -6.575 -0.664 -5.936 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -6.412 -3.160 -9.392 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -4.150 -0.911 -5.645 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -3.991 -3.425 -9.084 1.00 0.00 H new ATOM 0 HH TYR A 70 -2.241 -3.066 -7.730 1.00 0.00 H new ATOM 482 N ALA A 71 -11.145 -1.302 -6.382 1.00 0.00 N ATOM 483 CA ALA A 71 -12.594 -1.161 -6.383 1.00 0.00 C ATOM 484 C ALA A 71 -13.134 -0.694 -7.727 1.00 0.00 C ATOM 485 O ALA A 71 -14.255 -1.026 -8.094 1.00 0.00 O ATOM 486 CB ALA A 71 -13.020 -0.203 -5.288 1.00 0.00 C ATOM 0 H ALA A 71 -10.663 -0.644 -5.770 1.00 0.00 H new ATOM 0 HA ALA A 71 -13.016 -2.148 -6.195 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -14.105 -0.102 -5.295 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -12.697 -0.589 -4.321 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -12.564 0.772 -5.460 1.00 0.00 H new ATOM 492 N GLY A 72 -12.351 0.095 -8.440 1.00 0.00 N ATOM 493 CA GLY A 72 -12.758 0.559 -9.755 1.00 0.00 C ATOM 494 C GLY A 72 -12.584 -0.497 -10.827 1.00 0.00 C ATOM 495 O GLY A 72 -13.036 -0.325 -11.960 1.00 0.00 O ATOM 0 H GLY A 72 -11.436 0.426 -8.134 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -13.803 0.867 -9.720 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -12.175 1.441 -10.021 1.00 0.00 H new ATOM 499 N ASP A 73 -11.924 -1.590 -10.479 1.00 0.00 N ATOM 500 CA ASP A 73 -11.674 -2.667 -11.428 1.00 0.00 C ATOM 501 C ASP A 73 -12.768 -3.724 -11.340 1.00 0.00 C ATOM 502 O ASP A 73 -12.923 -4.555 -12.238 1.00 0.00 O ATOM 503 CB ASP A 73 -10.302 -3.301 -11.173 1.00 0.00 C ATOM 504 CG ASP A 73 -9.153 -2.396 -11.573 1.00 0.00 C ATOM 505 OD1 ASP A 73 -8.951 -1.348 -10.923 1.00 0.00 O ATOM 506 OD2 ASP A 73 -8.438 -2.730 -12.545 1.00 0.00 O1- ATOM 0 H ASP A 73 -11.550 -1.756 -9.545 1.00 0.00 H new ATOM 0 HA ASP A 73 -11.680 -2.244 -12.433 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -10.212 -3.549 -10.115 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -10.231 -4.237 -11.727 1.00 0.00 H new ATOM 511 N VAL A 74 -13.521 -3.688 -10.252 1.00 0.00 N ATOM 512 CA VAL A 74 -14.625 -4.605 -10.043 1.00 0.00 C ATOM 513 C VAL A 74 -15.925 -3.822 -9.884 1.00 0.00 C ATOM 514 O VAL A 74 -15.918 -2.681 -9.436 1.00 0.00 O ATOM 515 CB VAL A 74 -14.377 -5.490 -8.804 1.00 0.00 C ATOM 516 CG1 VAL A 74 -13.240 -6.464 -9.065 1.00 0.00 C ATOM 517 CG2 VAL A 74 -14.066 -4.634 -7.590 1.00 0.00 C ATOM 0 H VAL A 74 -13.383 -3.023 -9.491 1.00 0.00 H new ATOM 0 HA VAL A 74 -14.705 -5.257 -10.913 1.00 0.00 H new ATOM 0 HB VAL A 74 -15.285 -6.059 -8.604 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -13.079 -7.080 -8.181 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -13.495 -7.103 -9.911 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -12.330 -5.909 -9.291 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -13.894 -5.276 -6.726 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -13.173 -4.039 -7.783 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -14.907 -3.971 -7.387 1.00 0.00 H new ATOM 527 N THR A 75 -17.031 -4.420 -10.282 1.00 0.00 N ATOM 528 CA THR A 75 -18.309 -3.722 -10.291 1.00 0.00 C ATOM 529 C THR A 75 -19.130 -3.999 -9.033 1.00 0.00 C ATOM 530 O THR A 75 -20.027 -3.227 -8.684 1.00 0.00 O ATOM 531 CB THR A 75 -19.126 -4.112 -11.533 1.00 0.00 C ATOM 532 OG1 THR A 75 -19.296 -5.534 -11.581 1.00 0.00 O ATOM 533 CG2 THR A 75 -18.429 -3.646 -12.799 1.00 0.00 C ATOM 0 H THR A 75 -17.074 -5.387 -10.604 1.00 0.00 H new ATOM 0 HA THR A 75 -18.086 -2.655 -10.316 1.00 0.00 H new ATOM 0 HB THR A 75 -20.101 -3.629 -11.467 1.00 0.00 H new ATOM 0 HG1 THR A 75 -19.819 -5.774 -12.374 1.00 0.00 H new ATOM 0 HG21 THR A 75 -19.023 -3.931 -13.667 1.00 0.00 H new ATOM 0 HG22 THR A 75 -18.318 -2.562 -12.775 1.00 0.00 H new ATOM 0 HG23 THR A 75 -17.445 -4.110 -12.864 1.00 0.00 H new ATOM 541 N ASP A 76 -18.819 -5.090 -8.346 1.00 0.00 N ATOM 542 CA ASP A 76 -19.579 -5.483 -7.159 1.00 0.00 C ATOM 543 C ASP A 76 -19.109 -4.727 -5.919 1.00 0.00 C ATOM 544 O ASP A 76 -19.634 -4.923 -4.826 1.00 0.00 O ATOM 545 CB ASP A 76 -19.498 -6.997 -6.920 1.00 0.00 C ATOM 546 CG ASP A 76 -18.118 -7.481 -6.516 1.00 0.00 C ATOM 547 OD1 ASP A 76 -17.885 -7.680 -5.308 1.00 0.00 O ATOM 548 OD2 ASP A 76 -17.272 -7.698 -7.409 1.00 0.00 O1- ATOM 0 H ASP A 76 -18.051 -5.718 -8.585 1.00 0.00 H new ATOM 0 HA ASP A 76 -20.620 -5.220 -7.345 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -20.211 -7.271 -6.142 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -19.803 -7.516 -7.829 1.00 0.00 H new ATOM 553 N ILE A 77 -18.131 -3.852 -6.099 1.00 0.00 N ATOM 554 CA ILE A 77 -17.636 -3.024 -5.012 1.00 0.00 C ATOM 555 C ILE A 77 -17.808 -1.553 -5.361 1.00 0.00 C ATOM 556 O ILE A 77 -17.430 -1.115 -6.450 1.00 0.00 O ATOM 557 CB ILE A 77 -16.149 -3.292 -4.707 1.00 0.00 C ATOM 558 CG1 ILE A 77 -15.902 -4.784 -4.455 1.00 0.00 C ATOM 559 CG2 ILE A 77 -15.695 -2.466 -3.513 1.00 0.00 C ATOM 560 CD1 ILE A 77 -14.465 -5.105 -4.108 1.00 0.00 C ATOM 0 H ILE A 77 -17.663 -3.697 -6.992 1.00 0.00 H new ATOM 0 HA ILE A 77 -18.217 -3.278 -4.126 1.00 0.00 H new ATOM 0 HB ILE A 77 -15.564 -2.995 -5.577 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -16.548 -5.120 -3.643 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -16.188 -5.347 -5.343 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -14.643 -2.667 -3.311 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -15.827 -1.406 -3.732 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -16.290 -2.732 -2.639 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -14.361 -6.177 -3.943 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -13.816 -4.800 -4.929 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -14.181 -4.569 -3.202 1.00 0.00 H new ATOM 572 N ASP A 78 -18.387 -0.802 -4.443 1.00 0.00 N ATOM 573 CA ASP A 78 -18.618 0.619 -4.646 1.00 0.00 C ATOM 574 C ASP A 78 -17.406 1.421 -4.183 1.00 0.00 C ATOM 575 O ASP A 78 -17.124 1.514 -2.985 1.00 0.00 O ATOM 576 CB ASP A 78 -19.869 1.065 -3.891 1.00 0.00 C ATOM 577 CG ASP A 78 -20.262 2.495 -4.209 1.00 0.00 C ATOM 578 OD1 ASP A 78 -21.226 2.692 -4.976 1.00 0.00 O ATOM 579 OD2 ASP A 78 -19.609 3.432 -3.706 1.00 0.00 O1- ATOM 0 H ASP A 78 -18.709 -1.155 -3.542 1.00 0.00 H new ATOM 0 HA ASP A 78 -18.771 0.800 -5.710 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -20.696 0.400 -4.141 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -19.696 0.969 -2.819 1.00 0.00 H new ATOM 584 N GLU A 79 -16.691 1.992 -5.144 1.00 0.00 N ATOM 585 CA GLU A 79 -15.483 2.766 -4.861 1.00 0.00 C ATOM 586 C GLU A 79 -15.799 4.012 -4.036 1.00 0.00 C ATOM 587 O GLU A 79 -14.972 4.463 -3.252 1.00 0.00 O ATOM 588 CB GLU A 79 -14.800 3.167 -6.177 1.00 0.00 C ATOM 589 CG GLU A 79 -13.498 3.940 -6.008 1.00 0.00 C ATOM 590 CD GLU A 79 -12.921 4.395 -7.334 1.00 0.00 C ATOM 591 OE1 GLU A 79 -12.437 3.540 -8.104 1.00 0.00 O ATOM 592 OE2 GLU A 79 -12.947 5.612 -7.613 1.00 0.00 O1- ATOM 0 H GLU A 79 -16.927 1.934 -6.135 1.00 0.00 H new ATOM 0 HA GLU A 79 -14.809 2.139 -4.277 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -14.599 2.265 -6.756 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -15.493 3.773 -6.761 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -13.674 4.809 -5.374 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -12.770 3.312 -5.494 1.00 0.00 H new ATOM 599 N GLY A 80 -17.004 4.542 -4.198 1.00 0.00 N ATOM 600 CA GLY A 80 -17.377 5.774 -3.523 1.00 0.00 C ATOM 601 C GLY A 80 -17.438 5.616 -2.017 1.00 0.00 C ATOM 602 O GLY A 80 -17.085 6.534 -1.273 1.00 0.00 O ATOM 0 H GLY A 80 -17.734 4.140 -4.787 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -16.658 6.554 -3.774 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -18.348 6.106 -3.890 1.00 0.00 H new ATOM 606 N ILE A 81 -17.881 4.451 -1.569 1.00 0.00 N ATOM 607 CA ILE A 81 -17.948 4.158 -0.147 1.00 0.00 C ATOM 608 C ILE A 81 -16.545 4.047 0.437 1.00 0.00 C ATOM 609 O ILE A 81 -16.236 4.655 1.463 1.00 0.00 O ATOM 610 CB ILE A 81 -18.721 2.853 0.124 1.00 0.00 C ATOM 611 CG1 ILE A 81 -20.186 3.000 -0.305 1.00 0.00 C ATOM 612 CG2 ILE A 81 -18.631 2.478 1.595 1.00 0.00 C ATOM 613 CD1 ILE A 81 -21.009 1.741 -0.119 1.00 0.00 C ATOM 0 H ILE A 81 -18.200 3.692 -2.172 1.00 0.00 H new ATOM 0 HA ILE A 81 -18.480 4.980 0.333 1.00 0.00 H new ATOM 0 HB ILE A 81 -18.268 2.054 -0.463 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -20.642 3.808 0.266 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -20.220 3.293 -1.354 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -19.182 1.554 1.769 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -17.586 2.335 1.871 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -19.060 3.276 2.201 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -22.033 1.924 -0.444 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -20.579 0.934 -0.712 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -21.008 1.458 0.934 1.00 0.00 H new ATOM 625 N LEU A 82 -15.695 3.285 -0.239 1.00 0.00 N ATOM 626 CA LEU A 82 -14.323 3.088 0.212 1.00 0.00 C ATOM 627 C LEU A 82 -13.532 4.388 0.138 1.00 0.00 C ATOM 628 O LEU A 82 -12.738 4.697 1.027 1.00 0.00 O ATOM 629 CB LEU A 82 -13.624 2.009 -0.614 1.00 0.00 C ATOM 630 CG LEU A 82 -14.173 0.589 -0.446 1.00 0.00 C ATOM 631 CD1 LEU A 82 -13.408 -0.379 -1.331 1.00 0.00 C ATOM 632 CD2 LEU A 82 -14.093 0.149 1.008 1.00 0.00 C ATOM 0 H LEU A 82 -15.931 2.793 -1.101 1.00 0.00 H new ATOM 0 HA LEU A 82 -14.364 2.761 1.251 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -13.690 2.283 -1.667 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -12.566 2.004 -0.352 1.00 0.00 H new ATOM 0 HG LEU A 82 -15.220 0.589 -0.747 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -13.809 -1.384 -1.202 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -13.512 -0.078 -2.374 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -12.354 -0.370 -1.054 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -14.488 -0.862 1.104 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -13.054 0.165 1.336 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -14.680 0.828 1.626 1.00 0.00 H new ATOM 644 N ALA A 83 -13.752 5.148 -0.928 1.00 0.00 N ATOM 645 CA ALA A 83 -13.095 6.431 -1.099 1.00 0.00 C ATOM 646 C ALA A 83 -13.491 7.396 0.004 1.00 0.00 C ATOM 647 O ALA A 83 -12.683 8.201 0.443 1.00 0.00 O ATOM 648 CB ALA A 83 -13.423 7.026 -2.458 1.00 0.00 C ATOM 0 H ALA A 83 -14.383 4.894 -1.688 1.00 0.00 H new ATOM 0 HA ALA A 83 -12.019 6.265 -1.041 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -12.920 7.987 -2.565 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -13.084 6.350 -3.243 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -14.500 7.168 -2.542 1.00 0.00 H new ATOM 654 N GLY A 84 -14.735 7.302 0.453 1.00 0.00 N ATOM 655 CA GLY A 84 -15.206 8.168 1.516 1.00 0.00 C ATOM 656 C GLY A 84 -14.420 7.993 2.801 1.00 0.00 C ATOM 657 O GLY A 84 -13.983 8.973 3.409 1.00 0.00 O ATOM 0 H GLY A 84 -15.427 6.641 0.100 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -15.138 9.206 1.191 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -16.259 7.962 1.708 1.00 0.00 H new ATOM 661 N THR A 85 -14.226 6.749 3.212 1.00 0.00 N ATOM 662 CA THR A 85 -13.503 6.457 4.439 1.00 0.00 C ATOM 663 C THR A 85 -12.002 6.684 4.280 1.00 0.00 C ATOM 664 O THR A 85 -11.347 7.233 5.170 1.00 0.00 O ATOM 665 CB THR A 85 -13.768 5.015 4.902 1.00 0.00 C ATOM 666 OG1 THR A 85 -13.795 4.137 3.769 1.00 0.00 O ATOM 667 CG2 THR A 85 -15.083 4.922 5.655 1.00 0.00 C ATOM 0 H THR A 85 -14.560 5.925 2.712 1.00 0.00 H new ATOM 0 HA THR A 85 -13.871 7.147 5.198 1.00 0.00 H new ATOM 0 HB THR A 85 -12.963 4.717 5.574 1.00 0.00 H new ATOM 0 HG1 THR A 85 -14.477 3.447 3.906 1.00 0.00 H new ATOM 0 HG21 THR A 85 -15.249 3.892 5.972 1.00 0.00 H new ATOM 0 HG22 THR A 85 -15.048 5.570 6.530 1.00 0.00 H new ATOM 0 HG23 THR A 85 -15.898 5.236 5.003 1.00 0.00 H new ATOM 675 N LEU A 86 -11.464 6.272 3.140 1.00 0.00 N ATOM 676 CA LEU A 86 -10.033 6.381 2.882 1.00 0.00 C ATOM 677 C LEU A 86 -9.627 7.834 2.629 1.00 0.00 C ATOM 678 O LEU A 86 -8.475 8.211 2.841 1.00 0.00 O ATOM 679 CB LEU A 86 -9.628 5.492 1.702 1.00 0.00 C ATOM 680 CG LEU A 86 -8.463 4.527 1.966 1.00 0.00 C ATOM 681 CD1 LEU A 86 -7.223 5.284 2.410 1.00 0.00 C ATOM 682 CD2 LEU A 86 -8.851 3.477 3.003 1.00 0.00 C ATOM 0 H LEU A 86 -11.998 5.858 2.376 1.00 0.00 H new ATOM 0 HA LEU A 86 -9.504 6.036 3.770 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -10.496 4.909 1.395 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -9.361 6.133 0.862 1.00 0.00 H new ATOM 0 HG LEU A 86 -8.233 4.015 1.032 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -6.412 4.579 2.591 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -6.927 5.986 1.631 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -7.440 5.831 3.328 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -8.010 2.805 3.173 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -9.116 3.970 3.938 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -9.705 2.905 2.640 1.00 0.00 H new ATOM 694 N LYS A 87 -10.581 8.642 2.178 1.00 0.00 N ATOM 695 CA LYS A 87 -10.344 10.062 1.905 1.00 0.00 C ATOM 696 C LYS A 87 -9.791 10.765 3.142 1.00 0.00 C ATOM 697 O LYS A 87 -9.022 11.720 3.040 1.00 0.00 O ATOM 698 CB LYS A 87 -11.648 10.734 1.465 1.00 0.00 C ATOM 699 CG LYS A 87 -11.476 12.146 0.931 1.00 0.00 C ATOM 700 CD LYS A 87 -12.808 12.743 0.497 1.00 0.00 C ATOM 701 CE LYS A 87 -13.483 11.897 -0.575 1.00 0.00 C ATOM 702 NZ LYS A 87 -14.783 12.474 -1.007 1.00 0.00 N1+ ATOM 0 H LYS A 87 -11.536 8.337 1.991 1.00 0.00 H new ATOM 0 HA LYS A 87 -9.609 10.141 1.104 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -12.116 10.122 0.695 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -12.333 10.760 2.312 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -11.027 12.775 1.700 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -10.788 12.135 0.086 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -13.467 12.829 1.361 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -12.648 13.752 0.117 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -12.821 11.810 -1.437 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -13.644 10.889 -0.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -15.207 11.866 -1.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -15.425 12.534 -0.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -14.628 13.426 -1.396 1.00 0.00 H new ATOM 716 N ASN A 88 -10.183 10.265 4.308 1.00 0.00 N ATOM 717 CA ASN A 88 -9.731 10.807 5.587 1.00 0.00 C ATOM 718 C ASN A 88 -8.211 10.685 5.723 1.00 0.00 C ATOM 719 O ASN A 88 -7.571 11.488 6.397 1.00 0.00 O ATOM 720 CB ASN A 88 -10.424 10.060 6.734 1.00 0.00 C ATOM 721 CG ASN A 88 -10.124 10.635 8.108 1.00 0.00 C ATOM 722 OD1 ASN A 88 -10.044 9.898 9.090 1.00 0.00 O ATOM 723 ND2 ASN A 88 -9.983 11.948 8.199 1.00 0.00 N ATOM 0 H ASN A 88 -10.822 9.474 4.395 1.00 0.00 H new ATOM 0 HA ASN A 88 -9.992 11.864 5.631 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -11.501 10.079 6.569 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -10.117 9.014 6.713 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -9.802 12.380 9.105 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -10.056 12.528 7.363 1.00 0.00 H new ATOM 730 N LEU A 89 -7.641 9.689 5.056 1.00 0.00 N ATOM 731 CA LEU A 89 -6.201 9.464 5.098 1.00 0.00 C ATOM 732 C LEU A 89 -5.504 10.265 4.007 1.00 0.00 C ATOM 733 O LEU A 89 -4.350 10.670 4.155 1.00 0.00 O ATOM 734 CB LEU A 89 -5.881 7.975 4.934 1.00 0.00 C ATOM 735 CG LEU A 89 -6.434 7.065 6.030 1.00 0.00 C ATOM 736 CD1 LEU A 89 -6.029 5.624 5.771 1.00 0.00 C ATOM 737 CD2 LEU A 89 -5.952 7.520 7.399 1.00 0.00 C ATOM 0 H LEU A 89 -8.155 9.023 4.479 1.00 0.00 H new ATOM 0 HA LEU A 89 -5.835 9.796 6.070 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -6.273 7.639 3.974 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -4.798 7.855 4.896 1.00 0.00 H new ATOM 0 HG LEU A 89 -7.522 7.127 6.016 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -6.429 4.986 6.559 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -6.425 5.302 4.808 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -4.942 5.548 5.760 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -6.357 6.859 8.165 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -4.863 7.488 7.430 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -6.290 8.540 7.584 1.00 0.00 H new ATOM 749 N ILE A 90 -6.212 10.492 2.910 1.00 0.00 N ATOM 750 CA ILE A 90 -5.672 11.265 1.804 1.00 0.00 C ATOM 751 C ILE A 90 -5.612 12.744 2.178 1.00 0.00 C ATOM 752 O ILE A 90 -4.640 13.437 1.871 1.00 0.00 O ATOM 753 CB ILE A 90 -6.510 11.085 0.516 1.00 0.00 C ATOM 754 CG1 ILE A 90 -6.577 9.607 0.118 1.00 0.00 C ATOM 755 CG2 ILE A 90 -5.926 11.912 -0.620 1.00 0.00 C ATOM 756 CD1 ILE A 90 -7.436 9.343 -1.101 1.00 0.00 C ATOM 0 H ILE A 90 -7.162 10.151 2.763 1.00 0.00 H new ATOM 0 HA ILE A 90 -4.666 10.896 1.604 1.00 0.00 H new ATOM 0 HB ILE A 90 -7.523 11.435 0.716 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -5.567 9.246 -0.075 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -6.966 9.031 0.958 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -6.528 11.773 -1.518 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -5.928 12.966 -0.341 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -4.903 11.590 -0.816 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -7.436 8.276 -1.322 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -8.456 9.673 -0.905 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -7.035 9.890 -1.954 1.00 0.00 H new ATOM 768 N GLY A 91 -6.654 13.213 2.857 1.00 0.00 N ATOM 769 CA GLY A 91 -6.710 14.594 3.294 1.00 0.00 C ATOM 770 C GLY A 91 -7.041 15.539 2.159 1.00 0.00 C ATOM 771 O GLY A 91 -8.138 16.100 2.103 1.00 0.00 O ATOM 0 H GLY A 91 -7.468 12.654 3.114 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -7.459 14.695 4.079 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -5.751 14.875 3.730 1.00 0.00 H new ATOM 775 N GLY A 92 -6.092 15.701 1.253 1.00 0.00 N ATOM 776 CA GLY A 92 -6.285 16.552 0.105 1.00 0.00 C ATOM 777 C GLY A 92 -5.549 16.021 -1.106 1.00 0.00 C ATOM 778 O GLY A 92 -4.325 16.125 -1.191 1.00 0.00 O ATOM 0 H GLY A 92 -5.178 15.250 1.296 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -7.349 16.628 -0.119 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -5.934 17.559 0.333 1.00 0.00 H new ATOM 782 N GLY A 93 -6.289 15.439 -2.036 1.00 0.00 N ATOM 783 CA GLY A 93 -5.681 14.848 -3.205 1.00 0.00 C ATOM 784 C GLY A 93 -6.640 13.926 -3.919 1.00 0.00 C ATOM 785 O GLY A 93 -7.831 13.907 -3.603 1.00 0.00 O ATOM 0 H GLY A 93 -7.306 15.366 -2.000 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -5.356 15.635 -3.885 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -4.790 14.293 -2.912 1.00 0.00 H new ATOM 789 N SER A 94 -6.138 13.162 -4.875 1.00 0.00 N ATOM 790 CA SER A 94 -6.971 12.234 -5.623 1.00 0.00 C ATOM 791 C SER A 94 -6.169 11.008 -6.050 1.00 0.00 C ATOM 792 O SER A 94 -5.085 11.135 -6.620 1.00 0.00 O ATOM 793 CB SER A 94 -7.563 12.930 -6.851 1.00 0.00 C ATOM 794 OG SER A 94 -8.362 14.037 -6.469 1.00 0.00 O ATOM 0 H SER A 94 -5.156 13.166 -5.152 1.00 0.00 H new ATOM 0 HA SER A 94 -7.783 11.904 -4.975 1.00 0.00 H new ATOM 0 HB2 SER A 94 -6.759 13.265 -7.507 1.00 0.00 H new ATOM 0 HB3 SER A 94 -8.164 12.222 -7.421 1.00 0.00 H new ATOM 0 HG SER A 94 -8.729 14.468 -7.269 1.00 0.00 H new ATOM 800 N GLY A 95 -6.692 9.824 -5.755 1.00 0.00 N ATOM 801 CA GLY A 95 -6.024 8.607 -6.165 1.00 0.00 C ATOM 802 C GLY A 95 -6.808 7.362 -5.810 1.00 0.00 C ATOM 803 O GLY A 95 -6.258 6.419 -5.250 1.00 0.00 O ATOM 0 H GLY A 95 -7.563 9.687 -5.242 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -5.860 8.633 -7.242 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -5.042 8.560 -5.694 1.00 0.00 H new ATOM 807 N THR A 96 -8.087 7.346 -6.153 1.00 0.00 N ATOM 808 CA THR A 96 -8.944 6.210 -5.836 1.00 0.00 C ATOM 809 C THR A 96 -8.643 5.017 -6.739 1.00 0.00 C ATOM 810 O THR A 96 -9.083 3.898 -6.477 1.00 0.00 O ATOM 811 CB THR A 96 -10.431 6.580 -5.959 1.00 0.00 C ATOM 812 OG1 THR A 96 -10.699 7.127 -7.256 1.00 0.00 O ATOM 813 CG2 THR A 96 -10.823 7.582 -4.890 1.00 0.00 C ATOM 0 H THR A 96 -8.555 8.104 -6.650 1.00 0.00 H new ATOM 0 HA THR A 96 -8.732 5.933 -4.803 1.00 0.00 H new ATOM 0 HB THR A 96 -11.021 5.674 -5.823 1.00 0.00 H new ATOM 0 HG1 THR A 96 -11.518 6.728 -7.616 1.00 0.00 H new ATOM 0 HG21 THR A 96 -11.879 7.831 -4.994 1.00 0.00 H new ATOM 0 HG22 THR A 96 -10.648 7.150 -3.905 1.00 0.00 H new ATOM 0 HG23 THR A 96 -10.224 8.486 -5.002 1.00 0.00 H new ATOM 821 N GLU A 97 -7.868 5.266 -7.787 1.00 0.00 N ATOM 822 CA GLU A 97 -7.492 4.233 -8.751 1.00 0.00 C ATOM 823 C GLU A 97 -6.628 3.150 -8.105 1.00 0.00 C ATOM 824 O GLU A 97 -6.417 2.080 -8.680 1.00 0.00 O ATOM 825 CB GLU A 97 -6.746 4.862 -9.931 1.00 0.00 C ATOM 826 CG GLU A 97 -7.613 5.771 -10.791 1.00 0.00 C ATOM 827 CD GLU A 97 -6.814 6.512 -11.839 1.00 0.00 C ATOM 828 OE1 GLU A 97 -6.522 7.711 -11.631 1.00 0.00 O ATOM 829 OE2 GLU A 97 -6.469 5.902 -12.874 1.00 0.00 O1- ATOM 0 H GLU A 97 -7.482 6.187 -7.995 1.00 0.00 H new ATOM 0 HA GLU A 97 -8.408 3.762 -9.109 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -5.901 5.435 -9.551 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -6.337 4.068 -10.556 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -8.384 5.176 -11.280 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -8.124 6.491 -10.152 1.00 0.00 H new ATOM 836 N GLY A 98 -6.124 3.435 -6.914 1.00 0.00 N ATOM 837 CA GLY A 98 -5.342 2.460 -6.182 1.00 0.00 C ATOM 838 C GLY A 98 -6.009 2.088 -4.876 1.00 0.00 C ATOM 839 O GLY A 98 -5.348 1.666 -3.927 1.00 0.00 O ATOM 0 H GLY A 98 -6.243 4.330 -6.439 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -5.208 1.566 -6.792 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -4.349 2.862 -5.984 1.00 0.00 H new ATOM 843 N LEU A 99 -7.324 2.256 -4.832 1.00 0.00 N ATOM 844 CA LEU A 99 -8.097 2.017 -3.629 1.00 0.00 C ATOM 845 C LEU A 99 -8.958 0.767 -3.802 1.00 0.00 C ATOM 846 O LEU A 99 -9.459 0.500 -4.897 1.00 0.00 O ATOM 847 CB LEU A 99 -8.985 3.238 -3.372 1.00 0.00 C ATOM 848 CG LEU A 99 -9.080 3.725 -1.924 1.00 0.00 C ATOM 849 CD1 LEU A 99 -9.821 5.048 -1.880 1.00 0.00 C ATOM 850 CD2 LEU A 99 -9.776 2.703 -1.040 1.00 0.00 C ATOM 0 H LEU A 99 -7.881 2.562 -5.630 1.00 0.00 H new ATOM 0 HA LEU A 99 -7.430 1.860 -2.781 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -8.618 4.061 -3.985 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -9.992 3.006 -3.720 1.00 0.00 H new ATOM 0 HG LEU A 99 -8.069 3.860 -1.540 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -9.888 5.393 -0.848 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -9.284 5.786 -2.476 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -10.825 4.917 -2.284 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -9.827 3.080 -0.019 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -10.785 2.527 -1.412 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -9.216 1.768 -1.054 1.00 0.00 H new ATOM 862 N GLY A 100 -9.124 0.001 -2.734 1.00 0.00 N ATOM 863 CA GLY A 100 -9.975 -1.170 -2.800 1.00 0.00 C ATOM 864 C GLY A 100 -9.756 -2.116 -1.639 1.00 0.00 C ATOM 865 O GLY A 100 -9.429 -1.682 -0.532 1.00 0.00 O ATOM 0 H GLY A 100 -8.688 0.167 -1.827 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -11.019 -0.856 -2.816 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -9.787 -1.699 -3.735 1.00 0.00 H new ATOM 869 N LEU A 101 -9.929 -3.405 -1.895 1.00 0.00 N ATOM 870 CA LEU A 101 -9.774 -4.420 -0.865 1.00 0.00 C ATOM 871 C LEU A 101 -8.482 -5.190 -1.086 1.00 0.00 C ATOM 872 O LEU A 101 -8.208 -5.669 -2.188 1.00 0.00 O ATOM 873 CB LEU A 101 -10.968 -5.386 -0.863 1.00 0.00 C ATOM 874 CG LEU A 101 -12.322 -4.773 -0.473 1.00 0.00 C ATOM 875 CD1 LEU A 101 -13.423 -5.821 -0.548 1.00 0.00 C ATOM 876 CD2 LEU A 101 -12.273 -4.160 0.922 1.00 0.00 C ATOM 0 H LEU A 101 -10.178 -3.773 -2.813 1.00 0.00 H new ATOM 0 HA LEU A 101 -9.735 -3.922 0.104 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -11.061 -5.822 -1.858 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -10.749 -6.203 -0.176 1.00 0.00 H new ATOM 0 HG LEU A 101 -12.543 -3.977 -1.184 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -14.375 -5.369 -0.269 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -13.489 -6.207 -1.565 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -13.195 -6.638 0.136 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -13.246 -3.735 1.167 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -12.020 -4.931 1.650 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -11.517 -3.375 0.948 1.00 0.00 H new ATOM 888 N PHE A 102 -7.688 -5.291 -0.041 1.00 0.00 N ATOM 889 CA PHE A 102 -6.415 -5.988 -0.116 1.00 0.00 C ATOM 890 C PHE A 102 -6.454 -7.234 0.767 1.00 0.00 C ATOM 891 O PHE A 102 -6.889 -7.176 1.918 1.00 0.00 O ATOM 892 CB PHE A 102 -5.269 -5.045 0.291 1.00 0.00 C ATOM 893 CG PHE A 102 -4.959 -3.980 -0.741 1.00 0.00 C ATOM 894 CD1 PHE A 102 -5.868 -2.967 -1.017 1.00 0.00 C ATOM 895 CD2 PHE A 102 -3.754 -3.987 -1.431 1.00 0.00 C ATOM 896 CE1 PHE A 102 -5.585 -1.995 -1.957 1.00 0.00 C ATOM 897 CE2 PHE A 102 -3.468 -3.015 -2.371 1.00 0.00 C ATOM 898 CZ PHE A 102 -4.384 -2.019 -2.633 1.00 0.00 C ATOM 0 H PHE A 102 -7.900 -4.898 0.876 1.00 0.00 H new ATOM 0 HA PHE A 102 -6.235 -6.306 -1.143 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -5.526 -4.561 1.233 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -4.371 -5.636 0.471 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -6.810 -2.939 -0.489 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -3.030 -4.763 -1.230 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -6.305 -1.216 -2.162 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -2.527 -3.036 -2.900 1.00 0.00 H new ATOM 0 HZ PHE A 102 -4.161 -1.259 -3.367 1.00 0.00 H new ATOM 908 N ASN A 103 -6.022 -8.366 0.215 1.00 0.00 N ATOM 909 CA ASN A 103 -6.114 -9.645 0.913 1.00 0.00 C ATOM 910 C ASN A 103 -4.732 -10.255 1.092 1.00 0.00 C ATOM 911 O ASN A 103 -3.818 -9.964 0.314 1.00 0.00 O ATOM 912 CB ASN A 103 -7.006 -10.619 0.127 1.00 0.00 C ATOM 913 CG ASN A 103 -8.458 -10.177 0.038 1.00 0.00 C ATOM 914 OD1 ASN A 103 -8.825 -9.402 -0.845 1.00 0.00 O ATOM 915 ND2 ASN A 103 -9.303 -10.689 0.922 1.00 0.00 N ATOM 0 H ASN A 103 -5.605 -8.423 -0.714 1.00 0.00 H new ATOM 0 HA ASN A 103 -6.554 -9.466 1.894 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -6.607 -10.732 -0.881 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -6.962 -11.601 0.599 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -10.292 -10.443 0.883 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -8.964 -11.329 1.641 1.00 0.00 H new ATOM 922 N GLN A 104 -4.586 -11.098 2.117 1.00 0.00 N ATOM 923 CA GLN A 104 -3.311 -11.755 2.411 1.00 0.00 C ATOM 924 C GLN A 104 -2.246 -10.705 2.672 1.00 0.00 C ATOM 925 O GLN A 104 -1.222 -10.644 1.984 1.00 0.00 O ATOM 926 CB GLN A 104 -2.882 -12.680 1.263 1.00 0.00 C ATOM 927 CG GLN A 104 -3.825 -13.850 1.028 1.00 0.00 C ATOM 928 CD GLN A 104 -4.035 -14.698 2.273 1.00 0.00 C ATOM 929 OE1 GLN A 104 -3.280 -15.637 2.530 1.00 0.00 O ATOM 930 NE2 GLN A 104 -5.068 -14.387 3.043 1.00 0.00 N ATOM 0 H GLN A 104 -5.339 -11.342 2.760 1.00 0.00 H new ATOM 0 HA GLN A 104 -3.437 -12.372 3.301 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -2.809 -12.095 0.346 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -1.885 -13.067 1.474 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -4.788 -13.471 0.685 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -3.427 -14.477 0.230 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -5.670 -13.602 2.796 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -5.261 -14.933 3.883 1.00 0.00 H new ATOM 939 N CYS A 105 -2.504 -9.868 3.660 1.00 0.00 N ATOM 940 CA CYS A 105 -1.662 -8.716 3.908 1.00 0.00 C ATOM 941 C CYS A 105 -0.982 -8.810 5.270 1.00 0.00 C ATOM 942 O CYS A 105 -1.461 -9.503 6.170 1.00 0.00 O ATOM 943 CB CYS A 105 -2.496 -7.435 3.812 1.00 0.00 C ATOM 944 SG CYS A 105 -1.522 -5.956 3.408 1.00 0.00 S ATOM 0 H CYS A 105 -3.290 -9.966 4.303 1.00 0.00 H new ATOM 0 HA CYS A 105 -0.879 -8.692 3.150 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -3.266 -7.570 3.053 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -3.008 -7.274 4.761 1.00 0.00 H new ATOM 949 N SER A 106 0.143 -8.125 5.402 1.00 0.00 N ATOM 950 CA SER A 106 0.881 -8.079 6.653 1.00 0.00 C ATOM 951 C SER A 106 1.376 -6.655 6.892 1.00 0.00 C ATOM 952 O SER A 106 1.937 -6.027 5.991 1.00 0.00 O ATOM 953 CB SER A 106 2.061 -9.060 6.605 1.00 0.00 C ATOM 954 OG SER A 106 2.716 -9.150 7.859 1.00 0.00 O ATOM 0 H SER A 106 0.569 -7.587 4.647 1.00 0.00 H new ATOM 0 HA SER A 106 0.227 -8.372 7.475 1.00 0.00 H new ATOM 0 HB2 SER A 106 1.703 -10.046 6.309 1.00 0.00 H new ATOM 0 HB3 SER A 106 2.772 -8.738 5.845 1.00 0.00 H new ATOM 0 HG SER A 106 3.461 -9.784 7.794 1.00 0.00 H new ATOM 960 N LYS A 107 1.149 -6.148 8.097 1.00 0.00 N ATOM 961 CA LYS A 107 1.516 -4.776 8.440 1.00 0.00 C ATOM 962 C LYS A 107 3.029 -4.631 8.582 1.00 0.00 C ATOM 963 O LYS A 107 3.715 -5.563 9.006 1.00 0.00 O ATOM 964 CB LYS A 107 0.827 -4.349 9.746 1.00 0.00 C ATOM 965 CG LYS A 107 1.264 -5.150 10.971 1.00 0.00 C ATOM 966 CD LYS A 107 0.640 -4.601 12.249 1.00 0.00 C ATOM 967 CE LYS A 107 1.016 -5.434 13.470 1.00 0.00 C ATOM 968 NZ LYS A 107 2.489 -5.547 13.644 1.00 0.00 N1+ ATOM 0 H LYS A 107 0.711 -6.667 8.858 1.00 0.00 H new ATOM 0 HA LYS A 107 1.182 -4.128 7.630 1.00 0.00 H new ATOM 0 HB2 LYS A 107 1.031 -3.293 9.924 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -0.252 -4.449 9.625 1.00 0.00 H new ATOM 0 HG2 LYS A 107 0.979 -6.194 10.845 1.00 0.00 H new ATOM 0 HG3 LYS A 107 2.350 -5.124 11.055 1.00 0.00 H new ATOM 0 HD2 LYS A 107 0.965 -3.571 12.398 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -0.445 -4.581 12.144 1.00 0.00 H new ATOM 0 HE2 LYS A 107 0.580 -4.984 14.362 1.00 0.00 H new ATOM 0 HE3 LYS A 107 0.586 -6.431 13.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 2.697 -5.988 14.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 2.885 -6.132 12.881 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 2.916 -4.599 13.610 1.00 0.00 H new ATOM 982 N LEU A 108 3.545 -3.460 8.230 1.00 0.00 N ATOM 983 CA LEU A 108 4.965 -3.178 8.366 1.00 0.00 C ATOM 984 C LEU A 108 5.207 -2.387 9.644 1.00 0.00 C ATOM 985 O LEU A 108 4.596 -1.338 9.861 1.00 0.00 O ATOM 986 CB LEU A 108 5.493 -2.402 7.154 1.00 0.00 C ATOM 987 CG LEU A 108 5.399 -3.134 5.809 1.00 0.00 C ATOM 988 CD1 LEU A 108 5.947 -2.262 4.694 1.00 0.00 C ATOM 989 CD2 LEU A 108 6.149 -4.459 5.853 1.00 0.00 C ATOM 0 H LEU A 108 2.998 -2.689 7.847 1.00 0.00 H new ATOM 0 HA LEU A 108 5.503 -4.124 8.417 1.00 0.00 H new ATOM 0 HB2 LEU A 108 4.942 -1.464 7.077 1.00 0.00 H new ATOM 0 HB3 LEU A 108 6.537 -2.145 7.336 1.00 0.00 H new ATOM 0 HG LEU A 108 4.347 -3.343 5.612 1.00 0.00 H new ATOM 0 HD11 LEU A 108 5.874 -2.795 3.746 1.00 0.00 H new ATOM 0 HD12 LEU A 108 5.370 -1.339 4.637 1.00 0.00 H new ATOM 0 HD13 LEU A 108 6.991 -2.025 4.897 1.00 0.00 H new ATOM 0 HD21 LEU A 108 6.066 -4.956 4.887 1.00 0.00 H new ATOM 0 HD22 LEU A 108 7.200 -4.275 6.077 1.00 0.00 H new ATOM 0 HD23 LEU A 108 5.719 -5.095 6.627 1.00 0.00 H new ATOM 1001 N ASP A 109 6.081 -2.899 10.493 1.00 0.00 N ATOM 1002 CA ASP A 109 6.345 -2.272 11.782 1.00 0.00 C ATOM 1003 C ASP A 109 7.351 -1.141 11.632 1.00 0.00 C ATOM 1004 O ASP A 109 8.361 -1.278 10.938 1.00 0.00 O ATOM 1005 CB ASP A 109 6.849 -3.308 12.794 1.00 0.00 C ATOM 1006 CG ASP A 109 5.808 -4.369 13.099 1.00 0.00 C ATOM 1007 OD1 ASP A 109 4.913 -4.114 13.930 1.00 0.00 O ATOM 1008 OD2 ASP A 109 5.876 -5.463 12.498 1.00 0.00 O1- ATOM 0 H ASP A 109 6.621 -3.746 10.316 1.00 0.00 H new ATOM 0 HA ASP A 109 5.410 -1.853 12.155 1.00 0.00 H new ATOM 0 HB2 ASP A 109 7.748 -3.786 12.404 1.00 0.00 H new ATOM 0 HB3 ASP A 109 7.131 -2.803 13.718 1.00 0.00 H new ATOM 1013 N LEU A 110 7.060 -0.025 12.285 1.00 0.00 N ATOM 1014 CA LEU A 110 7.887 1.170 12.195 1.00 0.00 C ATOM 1015 C LEU A 110 9.244 0.959 12.846 1.00 0.00 C ATOM 1016 O LEU A 110 9.341 0.440 13.960 1.00 0.00 O ATOM 1017 CB LEU A 110 7.176 2.356 12.857 1.00 0.00 C ATOM 1018 CG LEU A 110 5.982 2.924 12.088 1.00 0.00 C ATOM 1019 CD1 LEU A 110 5.189 3.879 12.965 1.00 0.00 C ATOM 1020 CD2 LEU A 110 6.448 3.639 10.829 1.00 0.00 C ATOM 0 H LEU A 110 6.246 0.078 12.891 1.00 0.00 H new ATOM 0 HA LEU A 110 8.046 1.383 11.138 1.00 0.00 H new ATOM 0 HB2 LEU A 110 6.835 2.047 13.845 1.00 0.00 H new ATOM 0 HB3 LEU A 110 7.902 3.155 13.006 1.00 0.00 H new ATOM 0 HG LEU A 110 5.337 2.094 11.800 1.00 0.00 H new ATOM 0 HD11 LEU A 110 4.343 4.273 12.401 1.00 0.00 H new ATOM 0 HD12 LEU A 110 4.823 3.348 13.844 1.00 0.00 H new ATOM 0 HD13 LEU A 110 5.831 4.702 13.280 1.00 0.00 H new ATOM 0 HD21 LEU A 110 5.585 4.036 10.295 1.00 0.00 H new ATOM 0 HD22 LEU A 110 7.115 4.457 11.101 1.00 0.00 H new ATOM 0 HD23 LEU A 110 6.979 2.936 10.187 1.00 0.00 H new ATOM 1032 N GLN A 111 10.285 1.358 12.137 1.00 0.00 N ATOM 1033 CA GLN A 111 11.635 1.347 12.675 1.00 0.00 C ATOM 1034 C GLN A 111 11.866 2.614 13.482 1.00 0.00 C ATOM 1035 O GLN A 111 11.202 3.627 13.256 1.00 0.00 O ATOM 1036 CB GLN A 111 12.668 1.232 11.549 1.00 0.00 C ATOM 1037 CG GLN A 111 12.773 -0.166 10.953 1.00 0.00 C ATOM 1038 CD GLN A 111 13.136 -1.212 11.990 1.00 0.00 C ATOM 1039 OE1 GLN A 111 13.815 -0.923 12.974 1.00 0.00 O ATOM 1040 NE2 GLN A 111 12.682 -2.435 11.782 1.00 0.00 N ATOM 0 H GLN A 111 10.220 1.697 11.177 1.00 0.00 H new ATOM 0 HA GLN A 111 11.751 0.480 13.325 1.00 0.00 H new ATOM 0 HB2 GLN A 111 12.410 1.936 10.758 1.00 0.00 H new ATOM 0 HB3 GLN A 111 13.644 1.528 11.932 1.00 0.00 H new ATOM 0 HG2 GLN A 111 11.823 -0.432 10.489 1.00 0.00 H new ATOM 0 HG3 GLN A 111 13.524 -0.166 10.163 1.00 0.00 H new ATOM 0 HE21 GLN A 111 12.122 -2.637 10.954 1.00 0.00 H new ATOM 0 HE22 GLN A 111 12.892 -3.177 12.449 1.00 0.00 H new ATOM 1049 N ILE A 112 12.788 2.548 14.432 1.00 0.00 N ATOM 1050 CA ILE A 112 13.032 3.664 15.340 1.00 0.00 C ATOM 1051 C ILE A 112 13.688 4.834 14.604 1.00 0.00 C ATOM 1052 O ILE A 112 14.798 4.701 14.085 1.00 0.00 O ATOM 1053 CB ILE A 112 13.919 3.246 16.536 1.00 0.00 C ATOM 1054 CG1 ILE A 112 13.252 2.123 17.343 1.00 0.00 C ATOM 1055 CG2 ILE A 112 14.195 4.446 17.431 1.00 0.00 C ATOM 1056 CD1 ILE A 112 14.061 1.672 18.542 1.00 0.00 C ATOM 0 H ILE A 112 13.380 1.734 14.595 1.00 0.00 H new ATOM 0 HA ILE A 112 12.061 3.978 15.724 1.00 0.00 H new ATOM 0 HB ILE A 112 14.866 2.871 16.146 1.00 0.00 H new ATOM 0 HG12 ILE A 112 12.274 2.463 17.683 1.00 0.00 H new ATOM 0 HG13 ILE A 112 13.082 1.268 16.688 1.00 0.00 H new ATOM 0 HG21 ILE A 112 14.820 4.139 18.269 1.00 0.00 H new ATOM 0 HG22 ILE A 112 14.710 5.217 16.858 1.00 0.00 H new ATOM 0 HG23 ILE A 112 13.253 4.843 17.808 1.00 0.00 H new ATOM 0 HD11 ILE A 112 13.527 0.877 19.063 1.00 0.00 H new ATOM 0 HD12 ILE A 112 15.030 1.300 18.208 1.00 0.00 H new ATOM 0 HD13 ILE A 112 14.209 2.514 19.219 1.00 0.00 H new ATOM 1068 N PRO A 113 12.996 5.992 14.541 1.00 0.00 N ATOM 1069 CA PRO A 113 13.503 7.191 13.860 1.00 0.00 C ATOM 1070 C PRO A 113 14.848 7.656 14.408 1.00 0.00 C ATOM 1071 O PRO A 113 14.917 8.280 15.470 1.00 0.00 O ATOM 1072 CB PRO A 113 12.432 8.252 14.136 1.00 0.00 C ATOM 1073 CG PRO A 113 11.197 7.484 14.452 1.00 0.00 C ATOM 1074 CD PRO A 113 11.654 6.215 15.116 1.00 0.00 C ATOM 0 HA PRO A 113 13.674 7.000 12.801 1.00 0.00 H new ATOM 0 HB2 PRO A 113 12.720 8.895 14.968 1.00 0.00 H new ATOM 0 HB3 PRO A 113 12.284 8.897 13.270 1.00 0.00 H new ATOM 0 HG2 PRO A 113 10.541 8.054 15.110 1.00 0.00 H new ATOM 0 HG3 PRO A 113 10.630 7.268 13.547 1.00 0.00 H new ATOM 0 HD2 PRO A 113 11.694 6.321 16.200 1.00 0.00 H new ATOM 0 HD3 PRO A 113 10.982 5.384 14.901 1.00 0.00 H new ATOM 1082 N ILE A 114 15.907 7.340 13.668 1.00 0.00 N ATOM 1083 CA ILE A 114 17.272 7.726 14.031 1.00 0.00 C ATOM 1084 C ILE A 114 17.628 7.210 15.427 1.00 0.00 C ATOM 1085 O ILE A 114 17.623 7.955 16.408 1.00 0.00 O ATOM 1086 CB ILE A 114 17.483 9.262 13.975 1.00 0.00 C ATOM 1087 CG1 ILE A 114 17.035 9.835 12.620 1.00 0.00 C ATOM 1088 CG2 ILE A 114 18.945 9.605 14.229 1.00 0.00 C ATOM 1089 CD1 ILE A 114 17.824 9.315 11.435 1.00 0.00 C ATOM 0 H ILE A 114 15.846 6.809 12.799 1.00 0.00 H new ATOM 0 HA ILE A 114 17.933 7.270 13.294 1.00 0.00 H new ATOM 0 HB ILE A 114 16.870 9.713 14.755 1.00 0.00 H new ATOM 0 HG12 ILE A 114 15.981 9.603 12.471 1.00 0.00 H new ATOM 0 HG13 ILE A 114 17.121 10.921 12.651 1.00 0.00 H new ATOM 0 HG21 ILE A 114 19.078 10.686 14.187 1.00 0.00 H new ATOM 0 HG22 ILE A 114 19.238 9.242 15.214 1.00 0.00 H new ATOM 0 HG23 ILE A 114 19.567 9.133 13.468 1.00 0.00 H new ATOM 0 HD11 ILE A 114 17.445 9.768 10.519 1.00 0.00 H new ATOM 0 HD12 ILE A 114 18.876 9.571 11.558 1.00 0.00 H new ATOM 0 HD13 ILE A 114 17.718 8.232 11.375 1.00 0.00 H new ATOM 1101 N ILE A 115 17.921 5.923 15.510 1.00 0.00 N ATOM 1102 CA ILE A 115 18.305 5.307 16.769 1.00 0.00 C ATOM 1103 C ILE A 115 19.826 5.400 16.950 1.00 0.00 C ATOM 1104 O ILE A 115 20.550 4.402 16.963 1.00 0.00 O ATOM 1105 CB ILE A 115 17.799 3.835 16.841 1.00 0.00 C ATOM 1106 CG1 ILE A 115 18.177 3.169 18.171 1.00 0.00 C ATOM 1107 CG2 ILE A 115 18.314 3.014 15.663 1.00 0.00 C ATOM 1108 CD1 ILE A 115 17.577 3.849 19.384 1.00 0.00 C ATOM 0 H ILE A 115 17.900 5.282 14.717 1.00 0.00 H new ATOM 0 HA ILE A 115 17.834 5.846 17.591 1.00 0.00 H new ATOM 0 HB ILE A 115 16.711 3.868 16.783 1.00 0.00 H new ATOM 0 HG12 ILE A 115 17.853 2.128 18.151 1.00 0.00 H new ATOM 0 HG13 ILE A 115 19.263 3.163 18.269 1.00 0.00 H new ATOM 0 HG21 ILE A 115 17.944 1.992 15.742 1.00 0.00 H new ATOM 0 HG22 ILE A 115 17.963 3.456 14.730 1.00 0.00 H new ATOM 0 HG23 ILE A 115 19.404 3.007 15.673 1.00 0.00 H new ATOM 0 HD11 ILE A 115 17.888 3.323 20.287 1.00 0.00 H new ATOM 0 HD12 ILE A 115 17.921 4.882 19.429 1.00 0.00 H new ATOM 0 HD13 ILE A 115 16.490 3.832 19.310 1.00 0.00 H new ATOM 1120 N GLY A 116 20.310 6.631 17.064 1.00 0.00 N ATOM 1121 CA GLY A 116 21.739 6.866 17.165 1.00 0.00 C ATOM 1122 C GLY A 116 22.405 6.829 15.806 1.00 0.00 C ATOM 1123 O GLY A 116 23.086 7.774 15.409 1.00 0.00 O ATOM 0 H GLY A 116 19.736 7.474 17.088 1.00 0.00 H new ATOM 0 HA2 GLY A 116 21.917 7.834 17.632 1.00 0.00 H new ATOM 0 HA3 GLY A 116 22.188 6.112 17.812 1.00 0.00 H new ATOM 1127 N ILE A 117 22.197 5.732 15.099 1.00 0.00 N ATOM 1128 CA ILE A 117 22.705 5.568 13.748 1.00 0.00 C ATOM 1129 C ILE A 117 21.653 6.052 12.752 1.00 0.00 C ATOM 1130 O ILE A 117 20.480 5.688 12.866 1.00 0.00 O ATOM 1131 CB ILE A 117 23.047 4.085 13.461 1.00 0.00 C ATOM 1132 CG1 ILE A 117 24.050 3.560 14.494 1.00 0.00 C ATOM 1133 CG2 ILE A 117 23.600 3.918 12.052 1.00 0.00 C ATOM 1134 CD1 ILE A 117 24.420 2.106 14.298 1.00 0.00 C ATOM 0 H ILE A 117 21.671 4.930 15.445 1.00 0.00 H new ATOM 0 HA ILE A 117 23.617 6.156 13.645 1.00 0.00 H new ATOM 0 HB ILE A 117 22.129 3.503 13.537 1.00 0.00 H new ATOM 0 HG12 ILE A 117 24.955 4.165 14.449 1.00 0.00 H new ATOM 0 HG13 ILE A 117 23.631 3.688 15.492 1.00 0.00 H new ATOM 0 HG21 ILE A 117 23.833 2.868 11.874 1.00 0.00 H new ATOM 0 HG22 ILE A 117 22.857 4.253 11.328 1.00 0.00 H new ATOM 0 HG23 ILE A 117 24.506 4.514 11.944 1.00 0.00 H new ATOM 0 HD11 ILE A 117 25.133 1.805 15.066 1.00 0.00 H new ATOM 0 HD12 ILE A 117 23.524 1.489 14.373 1.00 0.00 H new ATOM 0 HD13 ILE A 117 24.869 1.974 13.314 1.00 0.00 H new ATOM 1146 N PRO A 118 22.040 6.902 11.784 1.00 0.00 N ATOM 1147 CA PRO A 118 21.111 7.408 10.774 1.00 0.00 C ATOM 1148 C PRO A 118 20.739 6.341 9.747 1.00 0.00 C ATOM 1149 O PRO A 118 21.273 6.303 8.638 1.00 0.00 O ATOM 1150 CB PRO A 118 21.883 8.553 10.115 1.00 0.00 C ATOM 1151 CG PRO A 118 23.321 8.220 10.320 1.00 0.00 C ATOM 1152 CD PRO A 118 23.402 7.442 11.608 1.00 0.00 C ATOM 0 HA PRO A 118 20.163 7.722 11.211 1.00 0.00 H new ATOM 0 HB2 PRO A 118 21.644 8.631 9.054 1.00 0.00 H new ATOM 0 HB3 PRO A 118 21.631 9.511 10.570 1.00 0.00 H new ATOM 0 HG2 PRO A 118 23.705 7.632 9.487 1.00 0.00 H new ATOM 0 HG3 PRO A 118 23.925 9.126 10.376 1.00 0.00 H new ATOM 0 HD2 PRO A 118 24.143 6.645 11.547 1.00 0.00 H new ATOM 0 HD3 PRO A 118 23.689 8.081 12.443 1.00 0.00 H new ATOM 1160 N ILE A 119 19.820 5.473 10.133 1.00 0.00 N ATOM 1161 CA ILE A 119 19.371 4.397 9.267 1.00 0.00 C ATOM 1162 C ILE A 119 18.157 4.849 8.465 1.00 0.00 C ATOM 1163 O ILE A 119 17.193 5.370 9.024 1.00 0.00 O ATOM 1164 CB ILE A 119 19.007 3.131 10.078 1.00 0.00 C ATOM 1165 CG1 ILE A 119 20.178 2.704 10.976 1.00 0.00 C ATOM 1166 CG2 ILE A 119 18.615 1.997 9.140 1.00 0.00 C ATOM 1167 CD1 ILE A 119 19.864 1.520 11.867 1.00 0.00 C ATOM 0 H ILE A 119 19.368 5.493 11.047 1.00 0.00 H new ATOM 0 HA ILE A 119 20.191 4.148 8.593 1.00 0.00 H new ATOM 0 HB ILE A 119 18.156 3.366 10.717 1.00 0.00 H new ATOM 0 HG12 ILE A 119 21.034 2.458 10.348 1.00 0.00 H new ATOM 0 HG13 ILE A 119 20.472 3.548 11.599 1.00 0.00 H new ATOM 0 HG21 ILE A 119 18.361 1.113 9.724 1.00 0.00 H new ATOM 0 HG22 ILE A 119 17.753 2.298 8.545 1.00 0.00 H new ATOM 0 HG23 ILE A 119 19.450 1.767 8.478 1.00 0.00 H new ATOM 0 HD11 ILE A 119 20.738 1.277 12.471 1.00 0.00 H new ATOM 0 HD12 ILE A 119 19.028 1.769 12.521 1.00 0.00 H new ATOM 0 HD13 ILE A 119 19.599 0.661 11.251 1.00 0.00 H new ATOM 1179 N GLN A 120 18.214 4.659 7.157 1.00 0.00 N ATOM 1180 CA GLN A 120 17.119 5.054 6.285 1.00 0.00 C ATOM 1181 C GLN A 120 16.412 3.818 5.747 1.00 0.00 C ATOM 1182 O GLN A 120 16.688 3.357 4.635 1.00 0.00 O ATOM 1183 CB GLN A 120 17.625 5.932 5.137 1.00 0.00 C ATOM 1184 CG GLN A 120 18.223 7.254 5.601 1.00 0.00 C ATOM 1185 CD GLN A 120 18.755 8.094 4.456 1.00 0.00 C ATOM 1186 OE1 GLN A 120 19.921 7.972 4.071 1.00 0.00 O ATOM 1187 NE2 GLN A 120 17.915 8.962 3.909 1.00 0.00 N ATOM 0 H GLN A 120 19.006 4.234 6.675 1.00 0.00 H new ATOM 0 HA GLN A 120 16.407 5.641 6.865 1.00 0.00 H new ATOM 0 HB2 GLN A 120 18.377 5.380 4.573 1.00 0.00 H new ATOM 0 HB3 GLN A 120 16.800 6.135 4.455 1.00 0.00 H new ATOM 0 HG2 GLN A 120 17.464 7.821 6.139 1.00 0.00 H new ATOM 0 HG3 GLN A 120 19.031 7.055 6.305 1.00 0.00 H new ATOM 0 HE21 GLN A 120 16.958 9.033 4.255 1.00 0.00 H new ATOM 0 HE22 GLN A 120 18.226 9.558 3.142 1.00 0.00 H new ATOM 1196 N ASP A 121 15.517 3.275 6.559 1.00 0.00 N ATOM 1197 CA ASP A 121 14.785 2.067 6.204 1.00 0.00 C ATOM 1198 C ASP A 121 13.717 2.357 5.157 1.00 0.00 C ATOM 1199 O ASP A 121 12.659 2.913 5.463 1.00 0.00 O ATOM 1200 CB ASP A 121 14.148 1.447 7.449 1.00 0.00 C ATOM 1201 CG ASP A 121 15.177 0.887 8.408 1.00 0.00 C ATOM 1202 OD1 ASP A 121 15.794 -0.151 8.083 1.00 0.00 O ATOM 1203 OD2 ASP A 121 15.363 1.473 9.490 1.00 0.00 O1- ATOM 0 H ASP A 121 15.279 3.655 7.475 1.00 0.00 H new ATOM 0 HA ASP A 121 15.494 1.358 5.777 1.00 0.00 H new ATOM 0 HB2 ASP A 121 13.551 2.201 7.962 1.00 0.00 H new ATOM 0 HB3 ASP A 121 13.467 0.652 7.147 1.00 0.00 H new ATOM 1208 N LEU A 122 14.003 1.965 3.924 1.00 0.00 N ATOM 1209 CA LEU A 122 13.106 2.200 2.802 1.00 0.00 C ATOM 1210 C LEU A 122 12.094 1.066 2.681 1.00 0.00 C ATOM 1211 O LEU A 122 12.434 -0.108 2.841 1.00 0.00 O ATOM 1212 CB LEU A 122 13.925 2.320 1.516 1.00 0.00 C ATOM 1213 CG LEU A 122 15.008 3.402 1.543 1.00 0.00 C ATOM 1214 CD1 LEU A 122 15.891 3.313 0.315 1.00 0.00 C ATOM 1215 CD2 LEU A 122 14.384 4.782 1.631 1.00 0.00 C ATOM 0 H LEU A 122 14.862 1.476 3.673 1.00 0.00 H new ATOM 0 HA LEU A 122 12.558 3.127 2.970 1.00 0.00 H new ATOM 0 HB2 LEU A 122 14.397 1.359 1.311 1.00 0.00 H new ATOM 0 HB3 LEU A 122 13.247 2.525 0.688 1.00 0.00 H new ATOM 0 HG LEU A 122 15.623 3.236 2.427 1.00 0.00 H new ATOM 0 HD11 LEU A 122 16.652 4.092 0.357 1.00 0.00 H new ATOM 0 HD12 LEU A 122 16.373 2.336 0.283 1.00 0.00 H new ATOM 0 HD13 LEU A 122 15.284 3.447 -0.580 1.00 0.00 H new ATOM 0 HD21 LEU A 122 15.170 5.536 1.649 1.00 0.00 H new ATOM 0 HD22 LEU A 122 13.743 4.947 0.765 1.00 0.00 H new ATOM 0 HD23 LEU A 122 13.790 4.855 2.542 1.00 0.00 H new ATOM 1227 N VAL A 123 10.847 1.433 2.395 1.00 0.00 N ATOM 1228 CA VAL A 123 9.751 0.467 2.312 1.00 0.00 C ATOM 1229 C VAL A 123 9.980 -0.572 1.214 1.00 0.00 C ATOM 1230 O VAL A 123 9.713 -1.757 1.414 1.00 0.00 O ATOM 1231 CB VAL A 123 8.380 1.154 2.092 1.00 0.00 C ATOM 1232 CG1 VAL A 123 7.954 1.908 3.333 1.00 0.00 C ATOM 1233 CG2 VAL A 123 8.407 2.096 0.897 1.00 0.00 C ATOM 0 H VAL A 123 10.568 2.398 2.216 1.00 0.00 H new ATOM 0 HA VAL A 123 9.734 -0.042 3.276 1.00 0.00 H new ATOM 0 HB VAL A 123 7.655 0.367 1.885 1.00 0.00 H new ATOM 0 HG11 VAL A 123 6.989 2.383 3.157 1.00 0.00 H new ATOM 0 HG12 VAL A 123 7.870 1.214 4.169 1.00 0.00 H new ATOM 0 HG13 VAL A 123 8.696 2.671 3.568 1.00 0.00 H new ATOM 0 HG21 VAL A 123 7.427 2.558 0.776 1.00 0.00 H new ATOM 0 HG22 VAL A 123 9.156 2.871 1.061 1.00 0.00 H new ATOM 0 HG23 VAL A 123 8.657 1.535 -0.003 1.00 0.00 H new ATOM 1243 N ASN A 124 10.494 -0.139 0.065 1.00 0.00 N ATOM 1244 CA ASN A 124 10.727 -1.048 -1.060 1.00 0.00 C ATOM 1245 C ASN A 124 11.893 -1.985 -0.767 1.00 0.00 C ATOM 1246 O ASN A 124 12.077 -2.998 -1.440 1.00 0.00 O ATOM 1247 CB ASN A 124 11.023 -0.279 -2.358 1.00 0.00 C ATOM 1248 CG ASN A 124 9.881 0.626 -2.805 1.00 0.00 C ATOM 1249 OD1 ASN A 124 9.165 1.196 -1.990 1.00 0.00 O ATOM 1250 ND2 ASN A 124 9.698 0.758 -4.113 1.00 0.00 N ATOM 0 H ASN A 124 10.757 0.830 -0.113 1.00 0.00 H new ATOM 0 HA ASN A 124 9.813 -1.627 -1.193 1.00 0.00 H new ATOM 0 HB2 ASN A 124 11.920 0.324 -2.216 1.00 0.00 H new ATOM 0 HB3 ASN A 124 11.242 -0.993 -3.152 1.00 0.00 H new ATOM 0 HD21 ASN A 124 8.944 1.347 -4.466 1.00 0.00 H new ATOM 0 HD22 ASN A 124 10.312 0.270 -4.766 1.00 0.00 H new ATOM 1257 N GLN A 125 12.681 -1.644 0.239 1.00 0.00 N ATOM 1258 CA GLN A 125 13.890 -2.389 0.535 1.00 0.00 C ATOM 1259 C GLN A 125 13.582 -3.605 1.403 1.00 0.00 C ATOM 1260 O GLN A 125 14.314 -4.592 1.373 1.00 0.00 O ATOM 1261 CB GLN A 125 14.914 -1.476 1.213 1.00 0.00 C ATOM 1262 CG GLN A 125 16.314 -2.067 1.305 1.00 0.00 C ATOM 1263 CD GLN A 125 17.360 -1.030 1.677 1.00 0.00 C ATOM 1264 OE1 GLN A 125 17.167 0.207 1.238 1.00 0.00 O flip ATOM 1265 NE2 GLN A 125 18.348 -1.344 2.342 1.00 0.00 N flip ATOM 0 H GLN A 125 12.504 -0.857 0.863 1.00 0.00 H new ATOM 0 HA GLN A 125 14.314 -2.752 -0.401 1.00 0.00 H new ATOM 0 HB2 GLN A 125 14.964 -0.535 0.665 1.00 0.00 H new ATOM 0 HB3 GLN A 125 14.565 -1.241 2.218 1.00 0.00 H new ATOM 0 HG2 GLN A 125 16.320 -2.866 2.046 1.00 0.00 H new ATOM 0 HG3 GLN A 125 16.578 -2.518 0.348 1.00 0.00 H new ATOM 0 HE21 GLN A 125 18.463 -2.306 2.662 1.00 0.00 H new ATOM 0 HE22 GLN A 125 19.052 -0.642 2.572 1.00 0.00 H new ATOM 1274 N LYS A 126 12.498 -3.548 2.170 1.00 0.00 N ATOM 1275 CA LYS A 126 12.134 -4.687 3.009 1.00 0.00 C ATOM 1276 C LYS A 126 10.888 -5.395 2.488 1.00 0.00 C ATOM 1277 O LYS A 126 10.611 -6.534 2.861 1.00 0.00 O ATOM 1278 CB LYS A 126 11.864 -4.231 4.444 1.00 0.00 C ATOM 1279 CG LYS A 126 13.004 -3.457 5.083 1.00 0.00 C ATOM 1280 CD LYS A 126 12.660 -3.068 6.508 1.00 0.00 C ATOM 1281 CE LYS A 126 13.645 -2.063 7.070 1.00 0.00 C ATOM 1282 NZ LYS A 126 15.034 -2.594 7.133 1.00 0.00 N1+ ATOM 0 H LYS A 126 11.869 -2.747 2.229 1.00 0.00 H new ATOM 0 HA LYS A 126 12.975 -5.380 2.984 1.00 0.00 H new ATOM 0 HB2 LYS A 126 10.969 -3.608 4.452 1.00 0.00 H new ATOM 0 HB3 LYS A 126 11.648 -5.107 5.056 1.00 0.00 H new ATOM 0 HG2 LYS A 126 13.910 -4.063 5.076 1.00 0.00 H new ATOM 0 HG3 LYS A 126 13.215 -2.562 4.498 1.00 0.00 H new ATOM 0 HD2 LYS A 126 11.655 -2.647 6.537 1.00 0.00 H new ATOM 0 HD3 LYS A 126 12.651 -3.959 7.136 1.00 0.00 H new ATOM 0 HE2 LYS A 126 13.632 -1.164 6.454 1.00 0.00 H new ATOM 0 HE3 LYS A 126 13.327 -1.769 8.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 15.672 -1.856 7.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 15.063 -3.416 7.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 15.339 -2.882 6.181 1.00 0.00 H new ATOM 1296 N CYS A 127 10.138 -4.726 1.630 1.00 0.00 N ATOM 1297 CA CYS A 127 8.926 -5.304 1.078 1.00 0.00 C ATOM 1298 C CYS A 127 9.078 -5.606 -0.412 1.00 0.00 C ATOM 1299 O CYS A 127 9.613 -4.790 -1.164 1.00 0.00 O ATOM 1300 CB CYS A 127 7.746 -4.364 1.323 1.00 0.00 C ATOM 1301 SG CYS A 127 6.138 -5.047 0.816 1.00 0.00 S ATOM 0 H CYS A 127 10.347 -3.783 1.301 1.00 0.00 H new ATOM 0 HA CYS A 127 8.737 -6.251 1.583 1.00 0.00 H new ATOM 0 HB2 CYS A 127 7.706 -4.117 2.384 1.00 0.00 H new ATOM 0 HB3 CYS A 127 7.919 -3.432 0.785 1.00 0.00 H new ATOM 1306 N LYS A 128 8.623 -6.780 -0.836 1.00 0.00 N ATOM 1307 CA LYS A 128 8.548 -7.103 -2.260 1.00 0.00 C ATOM 1308 C LYS A 128 7.089 -7.389 -2.638 1.00 0.00 C ATOM 1309 O LYS A 128 6.787 -7.936 -3.700 1.00 0.00 O ATOM 1310 CB LYS A 128 9.446 -8.307 -2.596 1.00 0.00 C ATOM 1311 CG LYS A 128 9.739 -8.468 -4.090 1.00 0.00 C ATOM 1312 CD LYS A 128 10.606 -7.338 -4.631 1.00 0.00 C ATOM 1313 CE LYS A 128 12.020 -7.386 -4.068 1.00 0.00 C ATOM 1314 NZ LYS A 128 12.881 -6.316 -4.638 1.00 0.00 N1+ ATOM 0 H LYS A 128 8.301 -7.524 -0.217 1.00 0.00 H new ATOM 0 HA LYS A 128 8.908 -6.253 -2.839 1.00 0.00 H new ATOM 0 HB2 LYS A 128 10.390 -8.204 -2.060 1.00 0.00 H new ATOM 0 HB3 LYS A 128 8.969 -9.216 -2.230 1.00 0.00 H new ATOM 0 HG2 LYS A 128 10.240 -9.421 -4.260 1.00 0.00 H new ATOM 0 HG3 LYS A 128 8.799 -8.499 -4.642 1.00 0.00 H new ATOM 0 HD2 LYS A 128 10.646 -7.400 -5.718 1.00 0.00 H new ATOM 0 HD3 LYS A 128 10.149 -6.380 -4.383 1.00 0.00 H new ATOM 0 HE2 LYS A 128 11.983 -7.283 -2.984 1.00 0.00 H new ATOM 0 HE3 LYS A 128 12.462 -8.359 -4.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 13.835 -6.383 -4.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 12.938 -6.429 -5.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 12.473 -5.386 -4.414 1.00 0.00 H new ATOM 1328 N GLN A 129 6.193 -7.009 -1.739 1.00 0.00 N ATOM 1329 CA GLN A 129 4.757 -7.170 -1.928 1.00 0.00 C ATOM 1330 C GLN A 129 4.106 -5.814 -2.175 1.00 0.00 C ATOM 1331 O GLN A 129 4.764 -4.781 -2.062 1.00 0.00 O ATOM 1332 CB GLN A 129 4.110 -7.859 -0.719 1.00 0.00 C ATOM 1333 CG GLN A 129 4.358 -9.359 -0.650 1.00 0.00 C ATOM 1334 CD GLN A 129 3.974 -10.072 -1.931 1.00 0.00 C ATOM 1335 OE1 GLN A 129 3.099 -9.620 -2.666 1.00 0.00 O ATOM 1336 NE2 GLN A 129 4.612 -11.201 -2.198 1.00 0.00 N ATOM 0 H GLN A 129 6.443 -6.576 -0.850 1.00 0.00 H new ATOM 0 HA GLN A 129 4.599 -7.806 -2.799 1.00 0.00 H new ATOM 0 HB2 GLN A 129 4.488 -7.397 0.193 1.00 0.00 H new ATOM 0 HB3 GLN A 129 3.035 -7.681 -0.745 1.00 0.00 H new ATOM 0 HG2 GLN A 129 5.412 -9.540 -0.440 1.00 0.00 H new ATOM 0 HG3 GLN A 129 3.790 -9.780 0.180 1.00 0.00 H new ATOM 0 HE21 GLN A 129 5.333 -11.542 -1.562 1.00 0.00 H new ATOM 0 HE22 GLN A 129 4.383 -11.729 -3.040 1.00 0.00 H new ATOM 1345 N ASN A 130 2.829 -5.819 -2.542 1.00 0.00 N ATOM 1346 CA ASN A 130 2.110 -4.577 -2.818 1.00 0.00 C ATOM 1347 C ASN A 130 1.997 -3.737 -1.551 1.00 0.00 C ATOM 1348 O ASN A 130 1.349 -4.140 -0.583 1.00 0.00 O ATOM 1349 CB ASN A 130 0.706 -4.874 -3.353 1.00 0.00 C ATOM 1350 CG ASN A 130 0.723 -5.711 -4.615 1.00 0.00 C ATOM 1351 OD1 ASN A 130 1.639 -5.613 -5.428 1.00 0.00 O ATOM 1352 ND2 ASN A 130 -0.283 -6.559 -4.776 1.00 0.00 N ATOM 0 H ASN A 130 2.271 -6.665 -2.655 1.00 0.00 H new ATOM 0 HA ASN A 130 2.670 -4.023 -3.571 1.00 0.00 H new ATOM 0 HB2 ASN A 130 0.132 -5.394 -2.586 1.00 0.00 H new ATOM 0 HB3 ASN A 130 0.192 -3.934 -3.553 1.00 0.00 H new ATOM 0 HD21 ASN A 130 -0.316 -7.161 -5.599 1.00 0.00 H new ATOM 0 HD22 ASN A 130 -1.024 -6.610 -4.077 1.00 0.00 H new ATOM 1359 N ILE A 131 2.640 -2.576 -1.565 1.00 0.00 N ATOM 1360 CA ILE A 131 2.671 -1.694 -0.406 1.00 0.00 C ATOM 1361 C ILE A 131 1.478 -0.742 -0.422 1.00 0.00 C ATOM 1362 O ILE A 131 1.304 0.033 -1.366 1.00 0.00 O ATOM 1363 CB ILE A 131 3.968 -0.857 -0.376 1.00 0.00 C ATOM 1364 CG1 ILE A 131 5.194 -1.748 -0.592 1.00 0.00 C ATOM 1365 CG2 ILE A 131 4.082 -0.112 0.946 1.00 0.00 C ATOM 1366 CD1 ILE A 131 6.499 -0.980 -0.638 1.00 0.00 C ATOM 0 H ILE A 131 3.151 -2.222 -2.374 1.00 0.00 H new ATOM 0 HA ILE A 131 2.629 -2.326 0.481 1.00 0.00 H new ATOM 0 HB ILE A 131 3.927 -0.130 -1.187 1.00 0.00 H new ATOM 0 HG12 ILE A 131 5.243 -2.485 0.210 1.00 0.00 H new ATOM 0 HG13 ILE A 131 5.073 -2.299 -1.525 1.00 0.00 H new ATOM 0 HG21 ILE A 131 5.001 0.475 0.955 1.00 0.00 H new ATOM 0 HG22 ILE A 131 3.226 0.552 1.064 1.00 0.00 H new ATOM 0 HG23 ILE A 131 4.101 -0.829 1.767 1.00 0.00 H new ATOM 0 HD11 ILE A 131 7.325 -1.674 -0.794 1.00 0.00 H new ATOM 0 HD12 ILE A 131 6.470 -0.262 -1.457 1.00 0.00 H new ATOM 0 HD13 ILE A 131 6.643 -0.450 0.304 1.00 0.00 H new ATOM 1378 N ALA A 132 0.662 -0.799 0.619 1.00 0.00 N ATOM 1379 CA ALA A 132 -0.500 0.066 0.721 1.00 0.00 C ATOM 1380 C ALA A 132 -0.638 0.630 2.128 1.00 0.00 C ATOM 1381 O ALA A 132 -0.074 0.094 3.081 1.00 0.00 O ATOM 1382 CB ALA A 132 -1.754 -0.702 0.338 1.00 0.00 C ATOM 0 H ALA A 132 0.784 -1.437 1.406 1.00 0.00 H new ATOM 0 HA ALA A 132 -0.368 0.901 0.033 1.00 0.00 H new ATOM 0 HB1 ALA A 132 -2.621 -0.046 0.417 1.00 0.00 H new ATOM 0 HB2 ALA A 132 -1.662 -1.060 -0.687 1.00 0.00 H new ATOM 0 HB3 ALA A 132 -1.879 -1.552 1.009 1.00 0.00 H new ATOM 1388 N CYS A 133 -1.374 1.723 2.248 1.00 0.00 N ATOM 1389 CA CYS A 133 -1.649 2.325 3.540 1.00 0.00 C ATOM 1390 C CYS A 133 -3.067 1.984 3.971 1.00 0.00 C ATOM 1391 O CYS A 133 -4.020 2.196 3.217 1.00 0.00 O ATOM 1392 CB CYS A 133 -1.460 3.839 3.470 1.00 0.00 C ATOM 1393 SG CYS A 133 0.232 4.335 3.017 1.00 0.00 S ATOM 0 H CYS A 133 -1.794 2.214 1.459 1.00 0.00 H new ATOM 0 HA CYS A 133 -0.950 1.927 4.276 1.00 0.00 H new ATOM 0 HB2 CYS A 133 -2.159 4.252 2.743 1.00 0.00 H new ATOM 0 HB3 CYS A 133 -1.712 4.274 4.437 1.00 0.00 H new ATOM 1398 N CYS A 134 -3.206 1.448 5.171 1.00 0.00 N ATOM 1399 CA CYS A 134 -4.499 0.980 5.644 1.00 0.00 C ATOM 1400 C CYS A 134 -5.002 1.834 6.800 1.00 0.00 C ATOM 1401 O CYS A 134 -4.216 2.298 7.630 1.00 0.00 O ATOM 1402 CB CYS A 134 -4.395 -0.483 6.071 1.00 0.00 C ATOM 1403 SG CYS A 134 -3.769 -1.583 4.757 1.00 0.00 S ATOM 0 H CYS A 134 -2.442 1.326 5.835 1.00 0.00 H new ATOM 0 HA CYS A 134 -5.216 1.066 4.828 1.00 0.00 H new ATOM 0 HB2 CYS A 134 -3.737 -0.554 6.937 1.00 0.00 H new ATOM 0 HB3 CYS A 134 -5.378 -0.831 6.388 1.00 0.00 H new ATOM 1408 N GLN A 135 -6.314 2.050 6.828 1.00 0.00 N ATOM 1409 CA GLN A 135 -6.953 2.827 7.882 1.00 0.00 C ATOM 1410 C GLN A 135 -6.943 2.050 9.192 1.00 0.00 C ATOM 1411 O GLN A 135 -7.449 0.930 9.267 1.00 0.00 O ATOM 1412 CB GLN A 135 -8.396 3.179 7.477 1.00 0.00 C ATOM 1413 CG GLN A 135 -9.216 3.834 8.581 1.00 0.00 C ATOM 1414 CD GLN A 135 -8.701 5.205 8.981 1.00 0.00 C ATOM 1415 OE1 GLN A 135 -7.844 5.325 9.852 1.00 0.00 O ATOM 1416 NE2 GLN A 135 -9.242 6.249 8.373 1.00 0.00 N ATOM 0 H GLN A 135 -6.960 1.693 6.124 1.00 0.00 H new ATOM 0 HA GLN A 135 -6.394 3.752 8.025 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -8.366 3.848 6.617 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -8.903 2.269 7.156 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -10.251 3.925 8.250 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -9.217 3.185 9.457 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -9.952 6.109 7.654 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -8.949 7.193 8.624 1.00 0.00 H new ATOM 1425 N ASN A 136 -6.372 2.653 10.222 1.00 0.00 N ATOM 1426 CA ASN A 136 -6.281 2.017 11.531 1.00 0.00 C ATOM 1427 C ASN A 136 -7.405 2.500 12.429 1.00 0.00 C ATOM 1428 O ASN A 136 -7.198 2.801 13.605 1.00 0.00 O ATOM 1429 CB ASN A 136 -4.930 2.313 12.189 1.00 0.00 C ATOM 1430 CG ASN A 136 -3.761 1.670 11.467 1.00 0.00 C ATOM 1431 OD1 ASN A 136 -2.595 2.294 11.546 1.00 0.00 O flip ATOM 1432 ND2 ASN A 136 -3.900 0.613 10.849 1.00 0.00 N flip ATOM 0 H ASN A 136 -5.962 3.586 10.179 1.00 0.00 H new ATOM 0 HA ASN A 136 -6.371 0.940 11.390 1.00 0.00 H new ATOM 0 HB2 ASN A 136 -4.778 3.392 12.224 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -4.950 1.961 13.220 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -4.814 0.161 10.810 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -3.101 0.190 10.376 1.00 0.00 H new ATOM 1439 N SER A 137 -8.592 2.587 11.861 1.00 0.00 N ATOM 1440 CA SER A 137 -9.758 3.036 12.597 1.00 0.00 C ATOM 1441 C SER A 137 -10.944 2.114 12.318 1.00 0.00 C ATOM 1442 O SER A 137 -11.585 2.219 11.269 1.00 0.00 O ATOM 1443 CB SER A 137 -10.096 4.477 12.207 1.00 0.00 C ATOM 1444 OG SER A 137 -8.964 5.323 12.355 1.00 0.00 O ATOM 0 H SER A 137 -8.775 2.351 10.886 1.00 0.00 H new ATOM 0 HA SER A 137 -9.540 3.004 13.664 1.00 0.00 H new ATOM 0 HB2 SER A 137 -10.444 4.506 11.174 1.00 0.00 H new ATOM 0 HB3 SER A 137 -10.913 4.844 12.829 1.00 0.00 H new ATOM 0 HG SER A 137 -8.517 5.425 11.489 1.00 0.00 H new ATOM 1450 N PRO A 138 -11.235 1.179 13.240 1.00 0.00 N ATOM 1451 CA PRO A 138 -12.336 0.231 13.073 1.00 0.00 C ATOM 1452 C PRO A 138 -13.698 0.902 13.212 1.00 0.00 C ATOM 1453 O PRO A 138 -14.176 1.148 14.320 1.00 0.00 O ATOM 1454 CB PRO A 138 -12.116 -0.786 14.197 1.00 0.00 C ATOM 1455 CG PRO A 138 -11.351 -0.048 15.239 1.00 0.00 C ATOM 1456 CD PRO A 138 -10.513 0.971 14.512 1.00 0.00 C ATOM 0 HA PRO A 138 -12.339 -0.218 12.080 1.00 0.00 H new ATOM 0 HB2 PRO A 138 -13.065 -1.152 14.589 1.00 0.00 H new ATOM 0 HB3 PRO A 138 -11.562 -1.654 13.841 1.00 0.00 H new ATOM 0 HG2 PRO A 138 -12.025 0.437 15.945 1.00 0.00 H new ATOM 0 HG3 PRO A 138 -10.723 -0.728 15.814 1.00 0.00 H new ATOM 0 HD2 PRO A 138 -10.428 1.898 15.080 1.00 0.00 H new ATOM 0 HD3 PRO A 138 -9.500 0.607 14.342 1.00 0.00 H new ATOM 1464 N SER A 139 -14.312 1.205 12.083 1.00 0.00 N ATOM 1465 CA SER A 139 -15.628 1.820 12.070 1.00 0.00 C ATOM 1466 C SER A 139 -16.664 0.809 11.597 1.00 0.00 C ATOM 1467 O SER A 139 -16.336 -0.141 10.881 1.00 0.00 O ATOM 1468 CB SER A 139 -15.634 3.055 11.159 1.00 0.00 C ATOM 1469 OG SER A 139 -16.914 3.664 11.134 1.00 0.00 O ATOM 0 H SER A 139 -13.918 1.034 11.158 1.00 0.00 H new ATOM 0 HA SER A 139 -15.879 2.139 13.082 1.00 0.00 H new ATOM 0 HB2 SER A 139 -14.893 3.773 11.510 1.00 0.00 H new ATOM 0 HB3 SER A 139 -15.345 2.767 10.148 1.00 0.00 H new ATOM 0 HG SER A 139 -16.891 4.449 10.548 1.00 0.00 H new ATOM 1475 N ASP A 140 -17.911 1.007 12.007 1.00 0.00 N ATOM 1476 CA ASP A 140 -18.987 0.093 11.640 1.00 0.00 C ATOM 1477 C ASP A 140 -19.610 0.520 10.319 1.00 0.00 C ATOM 1478 O ASP A 140 -20.522 -0.126 9.803 1.00 0.00 O ATOM 1479 CB ASP A 140 -20.057 0.017 12.739 1.00 0.00 C ATOM 1480 CG ASP A 140 -20.965 1.229 12.777 1.00 0.00 C ATOM 1481 OD1 ASP A 140 -22.141 1.108 12.370 1.00 0.00 O ATOM 1482 OD2 ASP A 140 -20.517 2.305 13.230 1.00 0.00 O1- ATOM 0 H ASP A 140 -18.202 1.790 12.592 1.00 0.00 H new ATOM 0 HA ASP A 140 -18.559 -0.903 11.525 1.00 0.00 H new ATOM 0 HB2 ASP A 140 -20.662 -0.877 12.586 1.00 0.00 H new ATOM 0 HB3 ASP A 140 -19.567 -0.092 13.707 1.00 0.00 H new ATOM 1487 N ALA A 141 -19.102 1.615 9.780 1.00 0.00 N ATOM 1488 CA ALA A 141 -19.497 2.084 8.469 1.00 0.00 C ATOM 1489 C ALA A 141 -18.325 1.950 7.506 1.00 0.00 C ATOM 1490 O ALA A 141 -17.308 2.632 7.670 1.00 0.00 O ATOM 1491 CB ALA A 141 -19.966 3.526 8.543 1.00 0.00 C ATOM 0 H ALA A 141 -18.405 2.201 10.240 1.00 0.00 H new ATOM 0 HA ALA A 141 -20.326 1.477 8.105 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -20.260 3.865 7.549 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -20.819 3.597 9.217 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -19.156 4.153 8.915 1.00 0.00 H new ATOM 1497 N SER A 142 -18.467 1.065 6.519 1.00 0.00 N ATOM 1498 CA SER A 142 -17.393 0.777 5.573 1.00 0.00 C ATOM 1499 C SER A 142 -16.186 0.175 6.301 1.00 0.00 C ATOM 1500 O SER A 142 -15.045 0.599 6.106 1.00 0.00 O ATOM 1501 CB SER A 142 -17.008 2.054 4.807 1.00 0.00 C ATOM 1502 OG SER A 142 -15.945 1.826 3.895 1.00 0.00 O ATOM 0 H SER A 142 -19.322 0.533 6.355 1.00 0.00 H new ATOM 0 HA SER A 142 -17.743 0.041 4.849 1.00 0.00 H new ATOM 0 HB2 SER A 142 -17.877 2.428 4.265 1.00 0.00 H new ATOM 0 HB3 SER A 142 -16.717 2.829 5.516 1.00 0.00 H new ATOM 0 HG SER A 142 -15.187 1.426 4.370 1.00 0.00 H new ATOM 1508 N GLY A 143 -16.450 -0.820 7.143 1.00 0.00 N ATOM 1509 CA GLY A 143 -15.380 -1.483 7.862 1.00 0.00 C ATOM 1510 C GLY A 143 -15.787 -2.836 8.422 1.00 0.00 C ATOM 1511 O GLY A 143 -15.180 -3.858 8.102 1.00 0.00 O ATOM 0 H GLY A 143 -17.385 -1.178 7.339 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -14.528 -1.614 7.194 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -15.049 -0.843 8.680 1.00 0.00 H new ATOM 1515 N SER A 144 -16.828 -2.848 9.240 1.00 0.00 N ATOM 1516 CA SER A 144 -17.224 -4.052 9.960 1.00 0.00 C ATOM 1517 C SER A 144 -17.990 -5.031 9.072 1.00 0.00 C ATOM 1518 O SER A 144 -17.774 -6.243 9.140 1.00 0.00 O ATOM 1519 CB SER A 144 -18.079 -3.662 11.164 1.00 0.00 C ATOM 1520 OG SER A 144 -19.144 -2.816 10.768 1.00 0.00 O ATOM 0 H SER A 144 -17.417 -2.035 9.423 1.00 0.00 H new ATOM 0 HA SER A 144 -16.317 -4.558 10.290 1.00 0.00 H new ATOM 0 HB2 SER A 144 -18.477 -4.558 11.639 1.00 0.00 H new ATOM 0 HB3 SER A 144 -17.462 -3.155 11.906 1.00 0.00 H new ATOM 0 HG SER A 144 -19.770 -2.707 11.514 1.00 0.00 H new ATOM 1526 N LEU A 145 -18.878 -4.507 8.242 1.00 0.00 N ATOM 1527 CA LEU A 145 -19.760 -5.343 7.438 1.00 0.00 C ATOM 1528 C LEU A 145 -19.189 -5.610 6.050 1.00 0.00 C ATOM 1529 O LEU A 145 -19.885 -6.115 5.173 1.00 0.00 O ATOM 1530 CB LEU A 145 -21.144 -4.696 7.319 1.00 0.00 C ATOM 1531 CG LEU A 145 -21.883 -4.489 8.645 1.00 0.00 C ATOM 1532 CD1 LEU A 145 -23.205 -3.774 8.413 1.00 0.00 C ATOM 1533 CD2 LEU A 145 -22.116 -5.820 9.345 1.00 0.00 C ATOM 0 H LEU A 145 -19.008 -3.505 8.106 1.00 0.00 H new ATOM 0 HA LEU A 145 -19.850 -6.302 7.948 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -21.035 -3.729 6.828 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -21.762 -5.315 6.670 1.00 0.00 H new ATOM 0 HG LEU A 145 -21.261 -3.867 9.288 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -23.716 -3.636 9.366 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -23.018 -2.802 7.957 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -23.830 -4.371 7.749 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -22.642 -5.650 10.284 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -22.716 -6.467 8.705 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -21.157 -6.297 9.547 1.00 0.00 H new ATOM 1545 N ILE A 146 -17.925 -5.268 5.850 1.00 0.00 N ATOM 1546 CA ILE A 146 -17.254 -5.552 4.586 1.00 0.00 C ATOM 1547 C ILE A 146 -15.891 -6.186 4.836 1.00 0.00 C ATOM 1548 O ILE A 146 -14.890 -5.823 4.219 1.00 0.00 O ATOM 1549 CB ILE A 146 -17.092 -4.293 3.702 1.00 0.00 C ATOM 1550 CG1 ILE A 146 -16.322 -3.198 4.439 1.00 0.00 C ATOM 1551 CG2 ILE A 146 -18.453 -3.775 3.260 1.00 0.00 C ATOM 1552 CD1 ILE A 146 -16.017 -1.989 3.581 1.00 0.00 C ATOM 0 H ILE A 146 -17.344 -4.795 6.542 1.00 0.00 H new ATOM 0 HA ILE A 146 -17.891 -6.251 4.044 1.00 0.00 H new ATOM 0 HB ILE A 146 -16.519 -4.574 2.819 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -16.900 -2.881 5.307 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -15.386 -3.613 4.813 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -18.321 -2.889 2.639 1.00 0.00 H new ATOM 0 HG22 ILE A 146 -18.967 -4.546 2.687 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -19.047 -3.518 4.137 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -15.469 -1.254 4.170 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -15.412 -2.293 2.726 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -16.950 -1.549 3.228 1.00 0.00 H new ATOM 1564 N GLY A 147 -15.875 -7.171 5.721 1.00 0.00 N ATOM 1565 CA GLY A 147 -14.631 -7.807 6.120 1.00 0.00 C ATOM 1566 C GLY A 147 -14.164 -8.851 5.127 1.00 0.00 C ATOM 1567 O GLY A 147 -13.570 -9.860 5.508 1.00 0.00 O ATOM 0 H GLY A 147 -16.708 -7.546 6.175 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -13.858 -7.046 6.232 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -14.763 -8.273 7.096 1.00 0.00 H new ATOM 1571 N LEU A 148 -14.431 -8.607 3.852 1.00 0.00 N ATOM 1572 CA LEU A 148 -13.995 -9.500 2.789 1.00 0.00 C ATOM 1573 C LEU A 148 -12.514 -9.293 2.512 1.00 0.00 C ATOM 1574 O LEU A 148 -11.860 -10.118 1.874 1.00 0.00 O ATOM 1575 CB LEU A 148 -14.807 -9.245 1.518 1.00 0.00 C ATOM 1576 CG LEU A 148 -16.322 -9.403 1.667 1.00 0.00 C ATOM 1577 CD1 LEU A 148 -17.015 -9.118 0.347 1.00 0.00 C ATOM 1578 CD2 LEU A 148 -16.670 -10.799 2.160 1.00 0.00 C ATOM 0 H LEU A 148 -14.951 -7.792 3.527 1.00 0.00 H new ATOM 0 HA LEU A 148 -14.156 -10.530 3.107 1.00 0.00 H new ATOM 0 HB2 LEU A 148 -14.596 -8.234 1.169 1.00 0.00 H new ATOM 0 HB3 LEU A 148 -14.461 -9.929 0.743 1.00 0.00 H new ATOM 0 HG LEU A 148 -16.672 -8.682 2.406 1.00 0.00 H new ATOM 0 HD11 LEU A 148 -18.092 -9.234 0.469 1.00 0.00 H new ATOM 0 HD12 LEU A 148 -16.794 -8.098 0.033 1.00 0.00 H new ATOM 0 HD13 LEU A 148 -16.658 -9.817 -0.410 1.00 0.00 H new ATOM 0 HD21 LEU A 148 -17.752 -10.891 2.259 1.00 0.00 H new ATOM 0 HD22 LEU A 148 -16.307 -11.538 1.446 1.00 0.00 H new ATOM 0 HD23 LEU A 148 -16.201 -10.970 3.129 1.00 0.00 H new ATOM 1590 N GLY A 149 -12.009 -8.176 3.006 1.00 0.00 N ATOM 1591 CA GLY A 149 -10.611 -7.844 2.884 1.00 0.00 C ATOM 1592 C GLY A 149 -10.283 -6.620 3.702 1.00 0.00 C ATOM 1593 O GLY A 149 -11.135 -6.123 4.438 1.00 0.00 O ATOM 0 H GLY A 149 -12.562 -7.477 3.502 1.00 0.00 H new ATOM 0 HA2 GLY A 149 -10.002 -8.684 3.217 1.00 0.00 H new ATOM 0 HA3 GLY A 149 -10.364 -7.666 1.837 1.00 0.00 H new ATOM 1597 N LEU A 150 -9.065 -6.128 3.579 1.00 0.00 N ATOM 1598 CA LEU A 150 -8.661 -4.930 4.296 1.00 0.00 C ATOM 1599 C LEU A 150 -8.747 -3.729 3.369 1.00 0.00 C ATOM 1600 O LEU A 150 -8.146 -3.738 2.293 1.00 0.00 O ATOM 1601 CB LEU A 150 -7.228 -5.050 4.848 1.00 0.00 C ATOM 1602 CG LEU A 150 -7.014 -6.082 5.964 1.00 0.00 C ATOM 1603 CD1 LEU A 150 -7.006 -7.505 5.418 1.00 0.00 C ATOM 1604 CD2 LEU A 150 -5.719 -5.791 6.707 1.00 0.00 C ATOM 0 H LEU A 150 -8.338 -6.537 2.991 1.00 0.00 H new ATOM 0 HA LEU A 150 -9.337 -4.803 5.141 1.00 0.00 H new ATOM 0 HB2 LEU A 150 -6.562 -5.297 4.021 1.00 0.00 H new ATOM 0 HB3 LEU A 150 -6.922 -4.073 5.222 1.00 0.00 H new ATOM 0 HG LEU A 150 -7.850 -6.000 6.659 1.00 0.00 H new ATOM 0 HD11 LEU A 150 -6.852 -8.208 6.237 1.00 0.00 H new ATOM 0 HD12 LEU A 150 -7.960 -7.714 4.934 1.00 0.00 H new ATOM 0 HD13 LEU A 150 -6.200 -7.612 4.692 1.00 0.00 H new ATOM 0 HD21 LEU A 150 -5.578 -6.530 7.496 1.00 0.00 H new ATOM 0 HD22 LEU A 150 -4.881 -5.839 6.011 1.00 0.00 H new ATOM 0 HD23 LEU A 150 -5.768 -4.795 7.147 1.00 0.00 H new ATOM 1616 N PRO A 151 -9.522 -2.696 3.737 1.00 0.00 N ATOM 1617 CA PRO A 151 -9.576 -1.472 2.952 1.00 0.00 C ATOM 1618 C PRO A 151 -8.274 -0.692 3.084 1.00 0.00 C ATOM 1619 O PRO A 151 -7.891 -0.279 4.182 1.00 0.00 O ATOM 1620 CB PRO A 151 -10.743 -0.678 3.560 1.00 0.00 C ATOM 1621 CG PRO A 151 -11.413 -1.602 4.528 1.00 0.00 C ATOM 1622 CD PRO A 151 -10.395 -2.639 4.914 1.00 0.00 C ATOM 0 HA PRO A 151 -9.714 -1.667 1.888 1.00 0.00 H new ATOM 0 HB2 PRO A 151 -10.384 0.220 4.063 1.00 0.00 H new ATOM 0 HB3 PRO A 151 -11.438 -0.353 2.786 1.00 0.00 H new ATOM 0 HG2 PRO A 151 -11.761 -1.057 5.405 1.00 0.00 H new ATOM 0 HG3 PRO A 151 -12.288 -2.069 4.075 1.00 0.00 H new ATOM 0 HD2 PRO A 151 -9.846 -2.352 5.811 1.00 0.00 H new ATOM 0 HD3 PRO A 151 -10.859 -3.604 5.120 1.00 0.00 H new ATOM 1630 N CYS A 152 -7.618 -0.467 1.960 1.00 0.00 N ATOM 1631 CA CYS A 152 -6.310 0.164 1.948 1.00 0.00 C ATOM 1632 C CYS A 152 -6.114 0.881 0.618 1.00 0.00 C ATOM 1633 O CYS A 152 -6.837 0.615 -0.345 1.00 0.00 O ATOM 1634 CB CYS A 152 -5.200 -0.888 2.149 1.00 0.00 C ATOM 1635 SG CYS A 152 -5.408 -1.957 3.617 1.00 0.00 S ATOM 0 H CYS A 152 -7.973 -0.714 1.036 1.00 0.00 H new ATOM 0 HA CYS A 152 -6.252 0.883 2.765 1.00 0.00 H new ATOM 0 HB2 CYS A 152 -5.153 -1.519 1.262 1.00 0.00 H new ATOM 0 HB3 CYS A 152 -4.242 -0.374 2.225 1.00 0.00 H new ATOM 1640 N ILE A 153 -5.162 1.798 0.569 1.00 0.00 N ATOM 1641 CA ILE A 153 -4.863 2.505 -0.666 1.00 0.00 C ATOM 1642 C ILE A 153 -3.374 2.414 -0.982 1.00 0.00 C ATOM 1643 O ILE A 153 -2.530 2.536 -0.089 1.00 0.00 O ATOM 1644 CB ILE A 153 -5.299 3.989 -0.586 1.00 0.00 C ATOM 1645 CG1 ILE A 153 -5.193 4.651 -1.961 1.00 0.00 C ATOM 1646 CG2 ILE A 153 -4.462 4.749 0.437 1.00 0.00 C ATOM 1647 CD1 ILE A 153 -5.729 6.065 -1.998 1.00 0.00 C ATOM 0 H ILE A 153 -4.585 2.070 1.365 1.00 0.00 H new ATOM 0 HA ILE A 153 -5.428 2.029 -1.467 1.00 0.00 H new ATOM 0 HB ILE A 153 -6.339 4.020 -0.263 1.00 0.00 H new ATOM 0 HG12 ILE A 153 -4.148 4.660 -2.271 1.00 0.00 H new ATOM 0 HG13 ILE A 153 -5.736 4.047 -2.688 1.00 0.00 H new ATOM 0 HG21 ILE A 153 -4.788 5.788 0.474 1.00 0.00 H new ATOM 0 HG22 ILE A 153 -4.587 4.294 1.420 1.00 0.00 H new ATOM 0 HG23 ILE A 153 -3.411 4.708 0.150 1.00 0.00 H new ATOM 0 HD11 ILE A 153 -5.620 6.469 -3.004 1.00 0.00 H new ATOM 0 HD12 ILE A 153 -6.783 6.062 -1.720 1.00 0.00 H new ATOM 0 HD13 ILE A 153 -5.170 6.684 -1.296 1.00 0.00 H new ATOM 1659 N ALA A 154 -3.055 2.158 -2.242 1.00 0.00 N ATOM 1660 CA ALA A 154 -1.673 2.144 -2.689 1.00 0.00 C ATOM 1661 C ALA A 154 -1.076 3.543 -2.575 1.00 0.00 C ATOM 1662 O ALA A 154 -1.607 4.501 -3.140 1.00 0.00 O ATOM 1663 CB ALA A 154 -1.591 1.646 -4.124 1.00 0.00 C ATOM 0 H ALA A 154 -3.737 1.957 -2.973 1.00 0.00 H new ATOM 0 HA ALA A 154 -1.101 1.466 -2.055 1.00 0.00 H new ATOM 0 HB1 ALA A 154 -0.550 1.640 -4.448 1.00 0.00 H new ATOM 0 HB2 ALA A 154 -1.995 0.635 -4.182 1.00 0.00 H new ATOM 0 HB3 ALA A 154 -2.169 2.305 -4.772 1.00 0.00 H new ATOM 1669 N LEU A 155 0.027 3.653 -1.834 1.00 0.00 N ATOM 1670 CA LEU A 155 0.664 4.947 -1.570 1.00 0.00 C ATOM 1671 C LEU A 155 1.063 5.630 -2.881 1.00 0.00 C ATOM 1672 O LEU A 155 1.076 6.856 -2.970 1.00 0.00 O ATOM 1673 CB LEU A 155 1.882 4.760 -0.643 1.00 0.00 C ATOM 1674 CG LEU A 155 2.372 6.014 0.102 1.00 0.00 C ATOM 1675 CD1 LEU A 155 3.254 5.612 1.271 1.00 0.00 C ATOM 1676 CD2 LEU A 155 3.141 6.957 -0.814 1.00 0.00 C ATOM 0 H LEU A 155 0.501 2.859 -1.404 1.00 0.00 H new ATOM 0 HA LEU A 155 -0.052 5.595 -1.064 1.00 0.00 H new ATOM 0 HB2 LEU A 155 1.635 3.998 0.096 1.00 0.00 H new ATOM 0 HB3 LEU A 155 2.708 4.371 -1.238 1.00 0.00 H new ATOM 0 HG LEU A 155 1.491 6.543 0.465 1.00 0.00 H new ATOM 0 HD11 LEU A 155 3.596 6.506 1.793 1.00 0.00 H new ATOM 0 HD12 LEU A 155 2.684 4.986 1.958 1.00 0.00 H new ATOM 0 HD13 LEU A 155 4.115 5.055 0.902 1.00 0.00 H new ATOM 0 HD21 LEU A 155 3.468 7.829 -0.247 1.00 0.00 H new ATOM 0 HD22 LEU A 155 4.011 6.441 -1.220 1.00 0.00 H new ATOM 0 HD23 LEU A 155 2.495 7.277 -1.631 1.00 0.00 H new ATOM 1688 N GLY A 156 1.344 4.833 -3.908 1.00 0.00 N ATOM 1689 CA GLY A 156 1.723 5.388 -5.194 1.00 0.00 C ATOM 1690 C GLY A 156 0.593 6.163 -5.855 1.00 0.00 C ATOM 1691 O GLY A 156 0.827 6.942 -6.773 1.00 0.00 O ATOM 0 H GLY A 156 1.316 3.814 -3.872 1.00 0.00 H new ATOM 0 HA2 GLY A 156 2.581 6.047 -5.062 1.00 0.00 H new ATOM 0 HA3 GLY A 156 2.039 4.581 -5.855 1.00 0.00 H new ATOM 1695 N SER A 157 -0.637 5.952 -5.391 1.00 0.00 N ATOM 1696 CA SER A 157 -1.787 6.643 -5.959 1.00 0.00 C ATOM 1697 C SER A 157 -1.921 8.061 -5.401 1.00 0.00 C ATOM 1698 O SER A 157 -2.425 8.959 -6.080 1.00 0.00 O ATOM 1699 CB SER A 157 -3.064 5.849 -5.678 1.00 0.00 C ATOM 1700 OG SER A 157 -2.923 4.506 -6.106 1.00 0.00 O ATOM 0 H SER A 157 -0.860 5.312 -4.628 1.00 0.00 H new ATOM 0 HA SER A 157 -1.634 6.719 -7.036 1.00 0.00 H new ATOM 0 HB2 SER A 157 -3.287 5.874 -4.611 1.00 0.00 H new ATOM 0 HB3 SER A 157 -3.907 6.313 -6.191 1.00 0.00 H new ATOM 0 HG SER A 157 -2.476 4.486 -6.978 1.00 0.00 H new ATOM 1706 N ILE A 158 -1.469 8.265 -4.168 1.00 0.00 N ATOM 1707 CA ILE A 158 -1.548 9.586 -3.550 1.00 0.00 C ATOM 1708 C ILE A 158 -0.242 10.349 -3.738 1.00 0.00 C ATOM 1709 O ILE A 158 -0.178 11.547 -3.450 1.00 0.00 O ATOM 1710 CB ILE A 158 -1.893 9.524 -2.040 1.00 0.00 C ATOM 1711 CG1 ILE A 158 -0.794 8.807 -1.243 1.00 0.00 C ATOM 1712 CG2 ILE A 158 -3.236 8.838 -1.835 1.00 0.00 C ATOM 1713 CD1 ILE A 158 -1.010 8.836 0.256 1.00 0.00 C ATOM 0 H ILE A 158 -1.049 7.543 -3.582 1.00 0.00 H new ATOM 0 HA ILE A 158 -2.360 10.110 -4.054 1.00 0.00 H new ATOM 0 HB ILE A 158 -1.958 10.546 -1.667 1.00 0.00 H new ATOM 0 HG12 ILE A 158 -0.737 7.770 -1.573 1.00 0.00 H new ATOM 0 HG13 ILE A 158 0.167 9.268 -1.471 1.00 0.00 H new ATOM 0 HG21 ILE A 158 -3.467 8.801 -0.770 1.00 0.00 H new ATOM 0 HG22 ILE A 158 -4.013 9.397 -2.356 1.00 0.00 H new ATOM 0 HG23 ILE A 158 -3.191 7.824 -2.232 1.00 0.00 H new ATOM 0 HD11 ILE A 158 -0.194 8.310 0.751 1.00 0.00 H new ATOM 0 HD12 ILE A 158 -1.037 9.870 0.600 1.00 0.00 H new ATOM 0 HD13 ILE A 158 -1.955 8.349 0.497 1.00 0.00 H new ATOM 1725 N LEU A 159 0.778 9.639 -4.233 1.00 0.00 N ATOM 1726 CA LEU A 159 2.100 10.212 -4.492 1.00 0.00 C ATOM 1727 C LEU A 159 2.620 10.977 -3.280 1.00 0.00 C ATOM 1728 O LEU A 159 3.206 10.341 -2.384 1.00 0.00 O ATOM 1729 CB LEU A 159 2.052 11.118 -5.725 1.00 0.00 C ATOM 1730 CG LEU A 159 1.743 10.404 -7.046 1.00 0.00 C ATOM 1731 CD1 LEU A 159 1.425 11.416 -8.134 1.00 0.00 C ATOM 1732 CD2 LEU A 159 2.912 9.525 -7.473 1.00 0.00 C ATOM 1733 OXT LEU A 159 2.433 12.213 -3.219 1.00 0.00 O1- ATOM 0 H LEU A 159 0.708 8.648 -4.465 1.00 0.00 H new ATOM 0 HA LEU A 159 2.792 9.393 -4.686 1.00 0.00 H new ATOM 0 HB2 LEU A 159 1.298 11.888 -5.561 1.00 0.00 H new ATOM 0 HB3 LEU A 159 3.011 11.626 -5.821 1.00 0.00 H new ATOM 0 HG LEU A 159 0.872 9.768 -6.892 1.00 0.00 H new ATOM 0 HD11 LEU A 159 1.208 10.893 -9.065 1.00 0.00 H new ATOM 0 HD12 LEU A 159 0.558 12.007 -7.839 1.00 0.00 H new ATOM 0 HD13 LEU A 159 2.281 12.075 -8.279 1.00 0.00 H new ATOM 0 HD21 LEU A 159 2.670 9.029 -8.413 1.00 0.00 H new ATOM 0 HD22 LEU A 159 3.801 10.142 -7.607 1.00 0.00 H new ATOM 0 HD23 LEU A 159 3.103 8.775 -6.705 1.00 0.00 H new TER 1745 LEU A 159