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 111 GLN : amide:sc= 0.806 K(o=3,f=-3.6) USER MOD Set 1.2: A 126 LYS NZ :NH3+ 175:sc= 2.24 (180deg=1.24) USER MOD Set 2.1: A 63 SER OG : rot -75:sc= 1.7 USER MOD Set 2.2: A 107 LYS NZ :NH3+ -165:sc= 0.346 (180deg=-0.302) USER MOD Set 3.1: A 66 ASN : amide:sc= -0.031 K(o=-1.7,f=-2.7) USER MOD Set 3.2: A 104 GLN : amide:sc= -1.67 X(o=-1.7,f=-1.7) USER MOD Set 4.1: A 87 LYS NZ :NH3+ -162:sc= 0.961 (180deg=0) USER MOD Set 4.2: A 94 SER OG : rot 45:sc= 0.899 USER MOD Set 5.1: A 48 THR OG1 : rot -96:sc= 0.45 USER MOD Set 5.2: A 51 GLN : amide:sc= 0.0158 K(o=0.47,f=-0.73) USER MOD Single : A 50 LYS NZ :NH3+ 170:sc= 1.08 (180deg=1.04) USER MOD Single : A 53 THR OG1 : rot 94:sc= 1.25 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 GLN : amide:sc= 1.38 K(o=1.4,f=-0.086) USER MOD Single : A 61 GLN : amide:sc= 0.0589 K(o=0.059,f=-0.52) USER MOD Single : A 67 LYS NZ :NH3+ -167:sc= -0.0576 (180deg=-0.357) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 TYR OH : rot 130:sc= 0.239 USER MOD Single : A 75 THR OG1 : rot 180:sc= 0.0135 USER MOD Single : A 85 THR OG1 : rot -80:sc= 0.664 USER MOD Single : A 88 ASN : amide:sc= 0.471 K(o=0.47,f=-0.032) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= 1.23 K(o=1.2,f=-0.12) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 120 GLN : amide:sc=-0.00773 K(o=-0.0077,f=-1) USER MOD Single : A 124 ASN : amide:sc= 0.393 K(o=0.39,f=-5.7!) USER MOD Single : A 125 GLN :FLIP amide:sc= -0.105 F(o=-1.5!,f=-0.1) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 GLN : amide:sc= 0.0487 K(o=0.049,f=-8.4!) USER MOD Single : A 130 ASN : amide:sc= -0.618 K(o=-0.62,f=-1.4) USER MOD Single : A 135 GLN : amide:sc= -2.53 K(o=-2.5,f=-4.6!) USER MOD Single : A 136 ASN : amide:sc= -0.133 K(o=-0.13,f=-0.85) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 142 SER OG : rot -46:sc= 0.621 USER MOD Single : A 144 SER OG : rot -54:sc= 0.468 USER MOD Single : A 157 SER OG : rot -41:sc= 0.674 USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 39 1.121 -4.172 -8.508 1.00 0.00 N ATOM 2 CA VAL A 39 0.975 -2.831 -7.967 1.00 0.00 C ATOM 3 C VAL A 39 0.865 -1.807 -9.100 1.00 0.00 C ATOM 4 O VAL A 39 1.774 -1.660 -9.920 1.00 0.00 O ATOM 5 CB VAL A 39 2.146 -2.476 -7.016 1.00 0.00 C ATOM 6 CG1 VAL A 39 3.494 -2.544 -7.723 1.00 0.00 C ATOM 7 CG2 VAL A 39 1.936 -1.109 -6.391 1.00 0.00 C ATOM 0 HA VAL A 39 0.055 -2.802 -7.382 1.00 0.00 H new ATOM 0 HB VAL A 39 2.157 -3.223 -6.222 1.00 0.00 H new ATOM 0 HG11 VAL A 39 4.287 -2.288 -7.020 1.00 0.00 H new ATOM 0 HG12 VAL A 39 3.656 -3.553 -8.101 1.00 0.00 H new ATOM 0 HG13 VAL A 39 3.505 -1.839 -8.554 1.00 0.00 H new ATOM 0 HG21 VAL A 39 2.770 -0.880 -5.727 1.00 0.00 H new ATOM 0 HG22 VAL A 39 1.880 -0.355 -7.176 1.00 0.00 H new ATOM 0 HG23 VAL A 39 1.007 -1.109 -5.820 1.00 0.00 H new ATOM 17 N ARG A 40 -0.276 -1.131 -9.169 1.00 0.00 N ATOM 18 CA ARG A 40 -0.510 -0.135 -10.215 1.00 0.00 C ATOM 19 C ARG A 40 0.238 1.169 -9.921 1.00 0.00 C ATOM 20 O ARG A 40 0.627 1.891 -10.835 1.00 0.00 O ATOM 21 CB ARG A 40 -2.014 0.142 -10.374 1.00 0.00 C ATOM 22 CG ARG A 40 -2.343 1.157 -11.466 1.00 0.00 C ATOM 23 CD ARG A 40 -3.831 1.474 -11.499 1.00 0.00 C ATOM 24 NE ARG A 40 -4.102 2.681 -12.275 1.00 0.00 N ATOM 25 CZ ARG A 40 -5.320 3.145 -12.542 1.00 0.00 C ATOM 26 NH1 ARG A 40 -6.395 2.509 -12.090 1.00 0.00 N1+ ATOM 27 NH2 ARG A 40 -5.459 4.256 -13.252 1.00 0.00 N ATOM 0 H ARG A 40 -1.052 -1.251 -8.518 1.00 0.00 H new ATOM 0 HA ARG A 40 -0.126 -0.543 -11.150 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -2.525 -0.795 -10.596 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -2.410 0.503 -9.425 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -1.778 2.073 -11.295 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -2.031 0.766 -12.434 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -4.374 0.633 -11.930 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -4.200 1.604 -10.481 1.00 0.00 H new ATOM 0 HE ARG A 40 -3.304 3.203 -12.637 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -6.289 1.660 -11.535 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -7.326 2.870 -12.298 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -4.634 4.751 -13.591 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -6.391 4.616 -13.459 1.00 0.00 H new ATOM 41 N PHE A 41 0.449 1.462 -8.645 1.00 0.00 N ATOM 42 CA PHE A 41 1.148 2.679 -8.243 1.00 0.00 C ATOM 43 C PHE A 41 2.331 2.337 -7.343 1.00 0.00 C ATOM 44 O PHE A 41 2.172 2.220 -6.125 1.00 0.00 O ATOM 45 CB PHE A 41 0.205 3.643 -7.515 1.00 0.00 C ATOM 46 CG PHE A 41 -0.748 4.384 -8.417 1.00 0.00 C ATOM 47 CD1 PHE A 41 -0.439 5.659 -8.867 1.00 0.00 C ATOM 48 CD2 PHE A 41 -1.951 3.815 -8.807 1.00 0.00 C ATOM 49 CE1 PHE A 41 -1.312 6.350 -9.685 1.00 0.00 C ATOM 50 CE2 PHE A 41 -2.826 4.503 -9.625 1.00 0.00 C ATOM 51 CZ PHE A 41 -2.504 5.770 -10.065 1.00 0.00 C ATOM 0 H PHE A 41 0.146 0.874 -7.868 1.00 0.00 H new ATOM 0 HA PHE A 41 1.512 3.169 -9.146 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -0.372 3.081 -6.780 1.00 0.00 H new ATOM 0 HB3 PHE A 41 0.803 4.369 -6.964 1.00 0.00 H new ATOM 0 HD1 PHE A 41 0.494 6.117 -8.575 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -2.207 2.822 -8.467 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -1.061 7.343 -10.026 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -3.761 4.050 -9.920 1.00 0.00 H new ATOM 0 HZ PHE A 41 -3.186 6.308 -10.707 1.00 0.00 H new ATOM 61 N PRO A 42 3.526 2.148 -7.926 1.00 0.00 N ATOM 62 CA PRO A 42 4.723 1.784 -7.163 1.00 0.00 C ATOM 63 C PRO A 42 5.208 2.913 -6.256 1.00 0.00 C ATOM 64 O PRO A 42 5.011 4.094 -6.548 1.00 0.00 O ATOM 65 CB PRO A 42 5.765 1.476 -8.242 1.00 0.00 C ATOM 66 CG PRO A 42 5.312 2.232 -9.442 1.00 0.00 C ATOM 67 CD PRO A 42 3.808 2.275 -9.372 1.00 0.00 C ATOM 0 HA PRO A 42 4.530 0.947 -6.491 1.00 0.00 H new ATOM 0 HB2 PRO A 42 6.761 1.791 -7.930 1.00 0.00 H new ATOM 0 HB3 PRO A 42 5.818 0.407 -8.446 1.00 0.00 H new ATOM 0 HG2 PRO A 42 5.730 3.239 -9.448 1.00 0.00 H new ATOM 0 HG3 PRO A 42 5.645 1.743 -10.358 1.00 0.00 H new ATOM 0 HD2 PRO A 42 3.414 3.207 -9.777 1.00 0.00 H new ATOM 0 HD3 PRO A 42 3.356 1.463 -9.942 1.00 0.00 H new ATOM 75 N VAL A 43 5.835 2.538 -5.154 1.00 0.00 N ATOM 76 CA VAL A 43 6.385 3.498 -4.212 1.00 0.00 C ATOM 77 C VAL A 43 7.848 3.774 -4.552 1.00 0.00 C ATOM 78 O VAL A 43 8.599 2.842 -4.846 1.00 0.00 O ATOM 79 CB VAL A 43 6.276 2.959 -2.766 1.00 0.00 C ATOM 80 CG1 VAL A 43 6.843 3.945 -1.752 1.00 0.00 C ATOM 81 CG2 VAL A 43 4.830 2.632 -2.439 1.00 0.00 C ATOM 0 H VAL A 43 5.977 1.564 -4.888 1.00 0.00 H new ATOM 0 HA VAL A 43 5.816 4.425 -4.283 1.00 0.00 H new ATOM 0 HB VAL A 43 6.871 2.048 -2.703 1.00 0.00 H new ATOM 0 HG11 VAL A 43 6.748 3.530 -0.749 1.00 0.00 H new ATOM 0 HG12 VAL A 43 7.895 4.128 -1.971 1.00 0.00 H new ATOM 0 HG13 VAL A 43 6.292 4.884 -1.810 1.00 0.00 H new ATOM 0 HG21 VAL A 43 4.764 2.253 -1.419 1.00 0.00 H new ATOM 0 HG22 VAL A 43 4.223 3.533 -2.531 1.00 0.00 H new ATOM 0 HG23 VAL A 43 4.463 1.875 -3.131 1.00 0.00 H new ATOM 91 N PRO A 44 8.252 5.059 -4.582 1.00 0.00 N ATOM 92 CA PRO A 44 9.655 5.447 -4.795 1.00 0.00 C ATOM 93 C PRO A 44 10.610 4.729 -3.839 1.00 0.00 C ATOM 94 O PRO A 44 10.348 4.630 -2.638 1.00 0.00 O ATOM 95 CB PRO A 44 9.651 6.952 -4.516 1.00 0.00 C ATOM 96 CG PRO A 44 8.261 7.390 -4.818 1.00 0.00 C ATOM 97 CD PRO A 44 7.369 6.236 -4.453 1.00 0.00 C ATOM 0 HA PRO A 44 10.004 5.184 -5.794 1.00 0.00 H new ATOM 0 HB2 PRO A 44 9.916 7.163 -3.480 1.00 0.00 H new ATOM 0 HB3 PRO A 44 10.375 7.473 -5.143 1.00 0.00 H new ATOM 0 HG2 PRO A 44 8.000 8.280 -4.245 1.00 0.00 H new ATOM 0 HG3 PRO A 44 8.154 7.647 -5.872 1.00 0.00 H new ATOM 0 HD2 PRO A 44 6.979 6.336 -3.440 1.00 0.00 H new ATOM 0 HD3 PRO A 44 6.510 6.167 -5.120 1.00 0.00 H new ATOM 105 N ASP A 45 11.732 4.255 -4.379 1.00 0.00 N ATOM 106 CA ASP A 45 12.692 3.453 -3.614 1.00 0.00 C ATOM 107 C ASP A 45 13.424 4.279 -2.562 1.00 0.00 C ATOM 108 O ASP A 45 14.111 3.728 -1.704 1.00 0.00 O ATOM 109 CB ASP A 45 13.723 2.802 -4.547 1.00 0.00 C ATOM 110 CG ASP A 45 13.189 1.584 -5.273 1.00 0.00 C ATOM 111 OD1 ASP A 45 13.564 0.452 -4.896 1.00 0.00 O ATOM 112 OD2 ASP A 45 12.395 1.748 -6.228 1.00 0.00 O1- ATOM 0 H ASP A 45 12.002 4.413 -5.350 1.00 0.00 H new ATOM 0 HA ASP A 45 12.115 2.681 -3.104 1.00 0.00 H new ATOM 0 HB2 ASP A 45 14.054 3.537 -5.280 1.00 0.00 H new ATOM 0 HB3 ASP A 45 14.599 2.515 -3.965 1.00 0.00 H new ATOM 117 N ASP A 46 13.290 5.594 -2.637 1.00 0.00 N ATOM 118 CA ASP A 46 13.961 6.487 -1.699 1.00 0.00 C ATOM 119 C ASP A 46 13.143 6.690 -0.430 1.00 0.00 C ATOM 120 O ASP A 46 13.528 7.462 0.449 1.00 0.00 O ATOM 121 CB ASP A 46 14.242 7.843 -2.345 1.00 0.00 C ATOM 122 CG ASP A 46 15.407 7.801 -3.307 1.00 0.00 C ATOM 123 OD1 ASP A 46 15.171 7.712 -4.531 1.00 0.00 O ATOM 124 OD2 ASP A 46 16.563 7.861 -2.847 1.00 0.00 O1- ATOM 0 H ASP A 46 12.722 6.069 -3.338 1.00 0.00 H new ATOM 0 HA ASP A 46 14.905 6.013 -1.429 1.00 0.00 H new ATOM 0 HB2 ASP A 46 13.351 8.180 -2.875 1.00 0.00 H new ATOM 0 HB3 ASP A 46 14.446 8.577 -1.565 1.00 0.00 H new ATOM 129 N ILE A 47 12.016 6.003 -0.330 1.00 0.00 N ATOM 130 CA ILE A 47 11.165 6.117 0.842 1.00 0.00 C ATOM 131 C ILE A 47 11.532 5.052 1.866 1.00 0.00 C ATOM 132 O ILE A 47 11.562 3.860 1.559 1.00 0.00 O ATOM 133 CB ILE A 47 9.671 5.985 0.471 1.00 0.00 C ATOM 134 CG1 ILE A 47 9.256 7.111 -0.487 1.00 0.00 C ATOM 135 CG2 ILE A 47 8.806 6.010 1.725 1.00 0.00 C ATOM 136 CD1 ILE A 47 9.285 8.490 0.140 1.00 0.00 C ATOM 0 H ILE A 47 11.671 5.362 -1.045 1.00 0.00 H new ATOM 0 HA ILE A 47 11.326 7.106 1.271 1.00 0.00 H new ATOM 0 HB ILE A 47 9.523 5.029 -0.032 1.00 0.00 H new ATOM 0 HG12 ILE A 47 9.919 7.102 -1.352 1.00 0.00 H new ATOM 0 HG13 ILE A 47 8.250 6.910 -0.854 1.00 0.00 H new ATOM 0 HG21 ILE A 47 7.757 5.916 1.445 1.00 0.00 H new ATOM 0 HG22 ILE A 47 9.084 5.181 2.375 1.00 0.00 H new ATOM 0 HG23 ILE A 47 8.958 6.951 2.253 1.00 0.00 H new ATOM 0 HD11 ILE A 47 8.980 9.232 -0.598 1.00 0.00 H new ATOM 0 HD12 ILE A 47 8.601 8.519 0.988 1.00 0.00 H new ATOM 0 HD13 ILE A 47 10.296 8.713 0.482 1.00 0.00 H new ATOM 148 N THR A 48 11.848 5.489 3.073 1.00 0.00 N ATOM 149 CA THR A 48 12.122 4.566 4.155 1.00 0.00 C ATOM 150 C THR A 48 10.821 4.054 4.754 1.00 0.00 C ATOM 151 O THR A 48 9.769 4.666 4.556 1.00 0.00 O ATOM 152 CB THR A 48 12.980 5.215 5.261 1.00 0.00 C ATOM 153 OG1 THR A 48 12.257 6.278 5.893 1.00 0.00 O ATOM 154 CG2 THR A 48 14.274 5.759 4.683 1.00 0.00 C ATOM 0 H THR A 48 11.920 6.475 3.326 1.00 0.00 H new ATOM 0 HA THR A 48 12.686 3.733 3.735 1.00 0.00 H new ATOM 0 HB THR A 48 13.215 4.449 6.000 1.00 0.00 H new ATOM 0 HG1 THR A 48 12.512 7.133 5.488 1.00 0.00 H new ATOM 0 HG21 THR A 48 14.865 6.213 5.478 1.00 0.00 H new ATOM 0 HG22 THR A 48 14.840 4.946 4.229 1.00 0.00 H new ATOM 0 HG23 THR A 48 14.047 6.510 3.926 1.00 0.00 H new ATOM 162 N VAL A 49 10.875 2.935 5.469 1.00 0.00 N ATOM 163 CA VAL A 49 9.680 2.392 6.105 1.00 0.00 C ATOM 164 C VAL A 49 9.041 3.443 7.003 1.00 0.00 C ATOM 165 O VAL A 49 7.821 3.606 7.007 1.00 0.00 O ATOM 166 CB VAL A 49 9.983 1.116 6.924 1.00 0.00 C ATOM 167 CG1 VAL A 49 8.712 0.564 7.552 1.00 0.00 C ATOM 168 CG2 VAL A 49 10.635 0.060 6.048 1.00 0.00 C ATOM 0 H VAL A 49 11.724 2.391 5.622 1.00 0.00 H new ATOM 0 HA VAL A 49 8.987 2.116 5.310 1.00 0.00 H new ATOM 0 HB VAL A 49 10.676 1.384 7.722 1.00 0.00 H new ATOM 0 HG11 VAL A 49 8.949 -0.334 8.123 1.00 0.00 H new ATOM 0 HG12 VAL A 49 8.279 1.313 8.215 1.00 0.00 H new ATOM 0 HG13 VAL A 49 7.996 0.317 6.768 1.00 0.00 H new ATOM 0 HG21 VAL A 49 10.840 -0.830 6.643 1.00 0.00 H new ATOM 0 HG22 VAL A 49 9.964 -0.198 5.229 1.00 0.00 H new ATOM 0 HG23 VAL A 49 11.569 0.449 5.643 1.00 0.00 H new ATOM 178 N LYS A 50 9.872 4.187 7.727 1.00 0.00 N ATOM 179 CA LYS A 50 9.362 5.233 8.603 1.00 0.00 C ATOM 180 C LYS A 50 8.701 6.344 7.795 1.00 0.00 C ATOM 181 O LYS A 50 7.585 6.737 8.104 1.00 0.00 O ATOM 182 CB LYS A 50 10.464 5.823 9.490 1.00 0.00 C ATOM 183 CG LYS A 50 9.960 6.964 10.365 1.00 0.00 C ATOM 184 CD LYS A 50 11.015 7.453 11.337 1.00 0.00 C ATOM 185 CE LYS A 50 10.536 8.685 12.092 1.00 0.00 C ATOM 186 NZ LYS A 50 9.270 8.433 12.838 1.00 0.00 N1+ ATOM 0 H LYS A 50 10.887 4.087 7.725 1.00 0.00 H new ATOM 0 HA LYS A 50 8.618 4.770 9.250 1.00 0.00 H new ATOM 0 HB2 LYS A 50 10.875 5.037 10.124 1.00 0.00 H new ATOM 0 HB3 LYS A 50 11.278 6.184 8.861 1.00 0.00 H new ATOM 0 HG2 LYS A 50 9.642 7.792 9.731 1.00 0.00 H new ATOM 0 HG3 LYS A 50 9.083 6.633 10.921 1.00 0.00 H new ATOM 0 HD2 LYS A 50 11.257 6.660 12.045 1.00 0.00 H new ATOM 0 HD3 LYS A 50 11.932 7.688 10.796 1.00 0.00 H new ATOM 0 HE2 LYS A 50 11.310 9.004 12.790 1.00 0.00 H new ATOM 0 HE3 LYS A 50 10.384 9.504 11.389 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 9.072 9.237 13.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 8.486 8.320 12.164 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 9.367 7.566 13.404 1.00 0.00 H new ATOM 200 N GLN A 51 9.366 6.818 6.740 1.00 0.00 N ATOM 201 CA GLN A 51 8.825 7.903 5.917 1.00 0.00 C ATOM 202 C GLN A 51 7.485 7.504 5.314 1.00 0.00 C ATOM 203 O GLN A 51 6.534 8.287 5.313 1.00 0.00 O ATOM 204 CB GLN A 51 9.802 8.292 4.802 1.00 0.00 C ATOM 205 CG GLN A 51 10.939 9.195 5.262 1.00 0.00 C ATOM 206 CD GLN A 51 11.989 9.412 4.184 1.00 0.00 C ATOM 207 OE1 GLN A 51 12.950 8.650 4.076 1.00 0.00 O ATOM 208 NE2 GLN A 51 11.819 10.445 3.376 1.00 0.00 N ATOM 0 H GLN A 51 10.275 6.470 6.436 1.00 0.00 H new ATOM 0 HA GLN A 51 8.679 8.767 6.565 1.00 0.00 H new ATOM 0 HB2 GLN A 51 10.224 7.385 4.370 1.00 0.00 H new ATOM 0 HB3 GLN A 51 9.250 8.796 4.009 1.00 0.00 H new ATOM 0 HG2 GLN A 51 10.531 10.159 5.566 1.00 0.00 H new ATOM 0 HG3 GLN A 51 11.412 8.758 6.141 1.00 0.00 H new ATOM 0 HE21 GLN A 51 11.011 11.057 3.493 1.00 0.00 H new ATOM 0 HE22 GLN A 51 12.496 10.630 2.635 1.00 0.00 H new ATOM 217 N ALA A 52 7.417 6.278 4.819 1.00 0.00 N ATOM 218 CA ALA A 52 6.186 5.746 4.265 1.00 0.00 C ATOM 219 C ALA A 52 5.097 5.685 5.330 1.00 0.00 C ATOM 220 O ALA A 52 3.941 6.020 5.074 1.00 0.00 O ATOM 221 CB ALA A 52 6.449 4.370 3.680 1.00 0.00 C ATOM 0 H ALA A 52 8.205 5.631 4.791 1.00 0.00 H new ATOM 0 HA ALA A 52 5.836 6.407 3.472 1.00 0.00 H new ATOM 0 HB1 ALA A 52 5.525 3.969 3.263 1.00 0.00 H new ATOM 0 HB2 ALA A 52 7.199 4.447 2.893 1.00 0.00 H new ATOM 0 HB3 ALA A 52 6.812 3.705 4.463 1.00 0.00 H new ATOM 227 N THR A 53 5.476 5.264 6.528 1.00 0.00 N ATOM 228 CA THR A 53 4.542 5.191 7.640 1.00 0.00 C ATOM 229 C THR A 53 4.113 6.585 8.112 1.00 0.00 C ATOM 230 O THR A 53 2.946 6.797 8.443 1.00 0.00 O ATOM 231 CB THR A 53 5.138 4.405 8.822 1.00 0.00 C ATOM 232 OG1 THR A 53 5.610 3.128 8.372 1.00 0.00 O ATOM 233 CG2 THR A 53 4.097 4.197 9.915 1.00 0.00 C ATOM 0 H THR A 53 6.425 4.968 6.754 1.00 0.00 H new ATOM 0 HA THR A 53 3.661 4.663 7.275 1.00 0.00 H new ATOM 0 HB THR A 53 5.967 4.983 9.230 1.00 0.00 H new ATOM 0 HG1 THR A 53 6.565 3.189 8.159 1.00 0.00 H new ATOM 0 HG21 THR A 53 4.541 3.639 10.739 1.00 0.00 H new ATOM 0 HG22 THR A 53 3.751 5.165 10.277 1.00 0.00 H new ATOM 0 HG23 THR A 53 3.253 3.637 9.512 1.00 0.00 H new ATOM 241 N GLU A 54 5.056 7.531 8.132 1.00 0.00 N ATOM 242 CA GLU A 54 4.772 8.907 8.552 1.00 0.00 C ATOM 243 C GLU A 54 3.704 9.533 7.664 1.00 0.00 C ATOM 244 O GLU A 54 2.910 10.363 8.113 1.00 0.00 O ATOM 245 CB GLU A 54 6.034 9.775 8.503 1.00 0.00 C ATOM 246 CG GLU A 54 7.137 9.347 9.462 1.00 0.00 C ATOM 247 CD GLU A 54 6.681 9.273 10.903 1.00 0.00 C ATOM 248 OE1 GLU A 54 6.089 10.253 11.398 1.00 0.00 O ATOM 249 OE2 GLU A 54 6.944 8.245 11.561 1.00 0.00 O1- ATOM 0 H GLU A 54 6.026 7.369 7.861 1.00 0.00 H new ATOM 0 HA GLU A 54 4.411 8.863 9.580 1.00 0.00 H new ATOM 0 HB2 GLU A 54 6.429 9.762 7.487 1.00 0.00 H new ATOM 0 HB3 GLU A 54 5.758 10.806 8.724 1.00 0.00 H new ATOM 0 HG2 GLU A 54 7.516 8.371 9.157 1.00 0.00 H new ATOM 0 HG3 GLU A 54 7.967 10.049 9.386 1.00 0.00 H new ATOM 256 N LYS A 55 3.694 9.125 6.400 1.00 0.00 N ATOM 257 CA LYS A 55 2.692 9.588 5.443 1.00 0.00 C ATOM 258 C LYS A 55 1.293 9.194 5.916 1.00 0.00 C ATOM 259 O LYS A 55 0.321 9.920 5.712 1.00 0.00 O ATOM 260 CB LYS A 55 2.975 8.978 4.060 1.00 0.00 C ATOM 261 CG LYS A 55 1.951 9.347 2.980 1.00 0.00 C ATOM 262 CD LYS A 55 1.979 10.833 2.637 1.00 0.00 C ATOM 263 CE LYS A 55 0.922 11.190 1.597 1.00 0.00 C ATOM 264 NZ LYS A 55 0.964 12.629 1.234 1.00 0.00 N1+ ATOM 0 H LYS A 55 4.373 8.470 6.011 1.00 0.00 H new ATOM 0 HA LYS A 55 2.743 10.674 5.370 1.00 0.00 H new ATOM 0 HB2 LYS A 55 3.963 9.299 3.731 1.00 0.00 H new ATOM 0 HB3 LYS A 55 3.008 7.893 4.156 1.00 0.00 H new ATOM 0 HG2 LYS A 55 2.150 8.765 2.080 1.00 0.00 H new ATOM 0 HG3 LYS A 55 0.952 9.074 3.321 1.00 0.00 H new ATOM 0 HD2 LYS A 55 1.813 11.419 3.541 1.00 0.00 H new ATOM 0 HD3 LYS A 55 2.966 11.101 2.260 1.00 0.00 H new ATOM 0 HE2 LYS A 55 1.074 10.586 0.703 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -0.066 10.942 1.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 0.230 12.830 0.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 0.793 13.206 2.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 1.898 12.861 0.840 1.00 0.00 H new ATOM 278 N CYS A 56 1.213 8.049 6.571 1.00 0.00 N ATOM 279 CA CYS A 56 -0.051 7.519 7.058 1.00 0.00 C ATOM 280 C CYS A 56 -0.239 7.785 8.551 1.00 0.00 C ATOM 281 O CYS A 56 -1.177 7.270 9.162 1.00 0.00 O ATOM 282 CB CYS A 56 -0.099 6.016 6.800 1.00 0.00 C ATOM 283 SG CYS A 56 0.047 5.563 5.046 1.00 0.00 S ATOM 0 H CYS A 56 2.020 7.461 6.780 1.00 0.00 H new ATOM 0 HA CYS A 56 -0.857 8.023 6.524 1.00 0.00 H new ATOM 0 HB2 CYS A 56 0.706 5.536 7.357 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -1.037 5.620 7.190 1.00 0.00 H new ATOM 288 N GLY A 57 0.637 8.601 9.129 1.00 0.00 N ATOM 289 CA GLY A 57 0.644 8.790 10.570 1.00 0.00 C ATOM 290 C GLY A 57 -0.527 9.611 11.077 1.00 0.00 C ATOM 291 O GLY A 57 -0.382 10.808 11.338 1.00 0.00 O ATOM 0 H GLY A 57 1.344 9.136 8.625 1.00 0.00 H new ATOM 0 HA2 GLY A 57 0.632 7.815 11.057 1.00 0.00 H new ATOM 0 HA3 GLY A 57 1.574 9.279 10.860 1.00 0.00 H new ATOM 295 N ASP A 58 -1.683 8.964 11.212 1.00 0.00 N ATOM 296 CA ASP A 58 -2.879 9.602 11.754 1.00 0.00 C ATOM 297 C ASP A 58 -4.031 8.606 11.848 1.00 0.00 C ATOM 298 O ASP A 58 -4.399 8.164 12.936 1.00 0.00 O ATOM 299 CB ASP A 58 -3.299 10.805 10.898 1.00 0.00 C ATOM 300 CG ASP A 58 -4.609 11.420 11.347 1.00 0.00 C ATOM 301 OD1 ASP A 58 -4.816 11.575 12.568 1.00 0.00 O ATOM 302 OD2 ASP A 58 -5.430 11.773 10.475 1.00 0.00 O1- ATOM 0 H ASP A 58 -1.816 7.987 10.950 1.00 0.00 H new ATOM 0 HA ASP A 58 -2.637 9.956 12.756 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -2.516 11.562 10.936 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -3.389 10.491 9.858 1.00 0.00 H new ATOM 307 N GLN A 59 -4.583 8.250 10.698 1.00 0.00 N ATOM 308 CA GLN A 59 -5.755 7.376 10.635 1.00 0.00 C ATOM 309 C GLN A 59 -5.437 6.068 9.921 1.00 0.00 C ATOM 310 O GLN A 59 -6.340 5.312 9.568 1.00 0.00 O ATOM 311 CB GLN A 59 -6.895 8.087 9.898 1.00 0.00 C ATOM 312 CG GLN A 59 -7.500 9.256 10.655 1.00 0.00 C ATOM 313 CD GLN A 59 -8.364 10.125 9.762 1.00 0.00 C ATOM 314 OE1 GLN A 59 -9.556 9.873 9.595 1.00 0.00 O ATOM 315 NE2 GLN A 59 -7.767 11.162 9.195 1.00 0.00 N ATOM 0 H GLN A 59 -4.238 8.553 9.787 1.00 0.00 H new ATOM 0 HA GLN A 59 -6.055 7.147 11.658 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -6.523 8.445 8.938 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -7.681 7.362 9.685 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -8.099 8.880 11.484 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -6.702 9.860 11.087 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -6.775 11.333 9.361 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -8.299 11.790 8.592 1.00 0.00 H new ATOM 324 N ALA A 60 -4.160 5.797 9.713 1.00 0.00 N ATOM 325 CA ALA A 60 -3.762 4.670 8.894 1.00 0.00 C ATOM 326 C ALA A 60 -2.441 4.086 9.353 1.00 0.00 C ATOM 327 O ALA A 60 -1.701 4.710 10.111 1.00 0.00 O ATOM 328 CB ALA A 60 -3.661 5.107 7.444 1.00 0.00 C ATOM 0 H ALA A 60 -3.387 6.339 10.098 1.00 0.00 H new ATOM 0 HA ALA A 60 -4.520 3.893 8.994 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -3.362 4.259 6.828 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -4.630 5.476 7.107 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -2.919 5.900 7.354 1.00 0.00 H new ATOM 334 N GLN A 61 -2.159 2.879 8.898 1.00 0.00 N ATOM 335 CA GLN A 61 -0.875 2.252 9.145 1.00 0.00 C ATOM 336 C GLN A 61 -0.364 1.634 7.853 1.00 0.00 C ATOM 337 O GLN A 61 -1.149 1.120 7.051 1.00 0.00 O ATOM 338 CB GLN A 61 -0.977 1.181 10.231 1.00 0.00 C ATOM 339 CG GLN A 61 0.383 0.794 10.809 1.00 0.00 C ATOM 340 CD GLN A 61 0.310 -0.353 11.803 1.00 0.00 C ATOM 341 OE1 GLN A 61 -0.716 -0.569 12.446 1.00 0.00 O ATOM 342 NE2 GLN A 61 1.410 -1.084 11.957 1.00 0.00 N ATOM 0 H GLN A 61 -2.807 2.311 8.352 1.00 0.00 H new ATOM 0 HA GLN A 61 -0.179 3.014 9.495 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -1.618 1.544 11.034 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -1.456 0.294 9.817 1.00 0.00 H new ATOM 0 HG2 GLN A 61 1.051 0.517 9.993 1.00 0.00 H new ATOM 0 HG3 GLN A 61 0.822 1.663 11.299 1.00 0.00 H new ATOM 0 HE21 GLN A 61 2.242 -0.875 11.406 1.00 0.00 H new ATOM 0 HE22 GLN A 61 1.421 -1.854 12.626 1.00 0.00 H new ATOM 351 N LEU A 62 0.945 1.705 7.647 1.00 0.00 N ATOM 352 CA LEU A 62 1.564 1.190 6.439 1.00 0.00 C ATOM 353 C LEU A 62 1.446 -0.333 6.398 1.00 0.00 C ATOM 354 O LEU A 62 1.693 -1.006 7.402 1.00 0.00 O ATOM 355 CB LEU A 62 3.033 1.610 6.399 1.00 0.00 C ATOM 356 CG LEU A 62 3.760 1.344 5.081 1.00 0.00 C ATOM 357 CD1 LEU A 62 3.197 2.220 3.973 1.00 0.00 C ATOM 358 CD2 LEU A 62 5.253 1.583 5.242 1.00 0.00 C ATOM 0 H LEU A 62 1.601 2.119 8.309 1.00 0.00 H new ATOM 0 HA LEU A 62 1.053 1.600 5.568 1.00 0.00 H new ATOM 0 HB2 LEU A 62 3.094 2.676 6.618 1.00 0.00 H new ATOM 0 HB3 LEU A 62 3.563 1.090 7.197 1.00 0.00 H new ATOM 0 HG LEU A 62 3.604 0.301 4.806 1.00 0.00 H new ATOM 0 HD11 LEU A 62 3.727 2.016 3.043 1.00 0.00 H new ATOM 0 HD12 LEU A 62 2.137 2.003 3.841 1.00 0.00 H new ATOM 0 HD13 LEU A 62 3.323 3.269 4.240 1.00 0.00 H new ATOM 0 HD21 LEU A 62 5.757 1.389 4.295 1.00 0.00 H new ATOM 0 HD22 LEU A 62 5.426 2.617 5.540 1.00 0.00 H new ATOM 0 HD23 LEU A 62 5.648 0.914 6.006 1.00 0.00 H new ATOM 370 N SER A 63 1.065 -0.872 5.249 1.00 0.00 N ATOM 371 CA SER A 63 0.831 -2.297 5.129 1.00 0.00 C ATOM 372 C SER A 63 1.373 -2.815 3.795 1.00 0.00 C ATOM 373 O SER A 63 1.360 -2.105 2.790 1.00 0.00 O ATOM 374 CB SER A 63 -0.675 -2.576 5.246 1.00 0.00 C ATOM 375 OG SER A 63 -0.932 -3.869 5.769 1.00 0.00 O ATOM 0 H SER A 63 0.913 -0.343 4.391 1.00 0.00 H new ATOM 0 HA SER A 63 1.354 -2.818 5.931 1.00 0.00 H new ATOM 0 HB2 SER A 63 -1.135 -1.826 5.889 1.00 0.00 H new ATOM 0 HB3 SER A 63 -1.139 -2.482 4.264 1.00 0.00 H new ATOM 0 HG SER A 63 -0.764 -4.541 5.076 1.00 0.00 H new ATOM 381 N CYS A 64 1.868 -4.042 3.806 1.00 0.00 N ATOM 382 CA CYS A 64 2.350 -4.690 2.596 1.00 0.00 C ATOM 383 C CYS A 64 1.460 -5.876 2.259 1.00 0.00 C ATOM 384 O CYS A 64 1.319 -6.803 3.059 1.00 0.00 O ATOM 385 CB CYS A 64 3.805 -5.141 2.762 1.00 0.00 C ATOM 386 SG CYS A 64 5.018 -3.801 2.573 1.00 0.00 S ATOM 0 H CYS A 64 1.947 -4.614 4.647 1.00 0.00 H new ATOM 0 HA CYS A 64 2.312 -3.973 1.776 1.00 0.00 H new ATOM 0 HB2 CYS A 64 3.925 -5.590 3.748 1.00 0.00 H new ATOM 0 HB3 CYS A 64 4.020 -5.918 2.029 1.00 0.00 H new ATOM 391 N CYS A 65 0.858 -5.846 1.080 1.00 0.00 N ATOM 392 CA CYS A 65 -0.126 -6.847 0.706 1.00 0.00 C ATOM 393 C CYS A 65 0.390 -7.664 -0.472 1.00 0.00 C ATOM 394 O CYS A 65 1.100 -7.144 -1.326 1.00 0.00 O ATOM 395 CB CYS A 65 -1.446 -6.160 0.327 1.00 0.00 C ATOM 396 SG CYS A 65 -2.007 -4.854 1.485 1.00 0.00 S ATOM 0 H CYS A 65 1.034 -5.139 0.366 1.00 0.00 H new ATOM 0 HA CYS A 65 -0.299 -7.513 1.552 1.00 0.00 H new ATOM 0 HB2 CYS A 65 -1.337 -5.721 -0.665 1.00 0.00 H new ATOM 0 HB3 CYS A 65 -2.225 -6.919 0.256 1.00 0.00 H new ATOM 401 N ASN A 66 0.066 -8.954 -0.498 1.00 0.00 N ATOM 402 CA ASN A 66 0.515 -9.818 -1.584 1.00 0.00 C ATOM 403 C ASN A 66 -0.501 -9.827 -2.730 1.00 0.00 C ATOM 404 O ASN A 66 -0.142 -10.047 -3.887 1.00 0.00 O ATOM 405 CB ASN A 66 0.765 -11.241 -1.069 1.00 0.00 C ATOM 406 CG ASN A 66 1.445 -12.123 -2.102 1.00 0.00 C ATOM 407 OD1 ASN A 66 2.148 -11.635 -2.985 1.00 0.00 O ATOM 408 ND2 ASN A 66 1.270 -13.431 -1.984 1.00 0.00 N ATOM 0 H ASN A 66 -0.499 -9.419 0.212 1.00 0.00 H new ATOM 0 HA ASN A 66 1.454 -9.421 -1.970 1.00 0.00 H new ATOM 0 HB2 ASN A 66 1.382 -11.196 -0.172 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -0.185 -11.691 -0.780 1.00 0.00 H new ATOM 0 HD21 ASN A 66 1.726 -14.068 -2.638 1.00 0.00 H new ATOM 0 HD22 ASN A 66 0.680 -13.801 -1.239 1.00 0.00 H new ATOM 415 N LYS A 67 -1.767 -9.571 -2.412 1.00 0.00 N ATOM 416 CA LYS A 67 -2.814 -9.511 -3.425 1.00 0.00 C ATOM 417 C LYS A 67 -3.547 -8.174 -3.353 1.00 0.00 C ATOM 418 O LYS A 67 -3.724 -7.616 -2.268 1.00 0.00 O ATOM 419 CB LYS A 67 -3.804 -10.667 -3.251 1.00 0.00 C ATOM 420 CG LYS A 67 -3.186 -12.041 -3.475 1.00 0.00 C ATOM 421 CD LYS A 67 -4.231 -13.150 -3.451 1.00 0.00 C ATOM 422 CE LYS A 67 -3.601 -14.520 -3.686 1.00 0.00 C ATOM 423 NZ LYS A 67 -2.786 -14.558 -4.931 1.00 0.00 N1+ ATOM 0 H LYS A 67 -2.092 -9.402 -1.460 1.00 0.00 H new ATOM 0 HA LYS A 67 -2.346 -9.603 -4.405 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -4.223 -10.626 -2.246 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -4.632 -10.533 -3.947 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -2.667 -12.053 -4.434 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -2.438 -12.232 -2.705 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -4.745 -13.145 -2.490 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -4.983 -12.959 -4.216 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -2.972 -14.780 -2.834 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -4.386 -15.274 -3.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -2.561 -15.545 -5.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -3.323 -14.128 -5.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -1.903 -14.028 -4.784 1.00 0.00 H new ATOM 437 N ALA A 68 -3.964 -7.664 -4.506 1.00 0.00 N ATOM 438 CA ALA A 68 -4.620 -6.366 -4.578 1.00 0.00 C ATOM 439 C ALA A 68 -5.864 -6.413 -5.461 1.00 0.00 C ATOM 440 O ALA A 68 -5.806 -6.881 -6.601 1.00 0.00 O ATOM 441 CB ALA A 68 -3.655 -5.321 -5.119 1.00 0.00 C ATOM 0 H ALA A 68 -3.858 -8.132 -5.406 1.00 0.00 H new ATOM 0 HA ALA A 68 -4.928 -6.097 -3.568 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -4.156 -4.354 -5.169 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -2.790 -5.248 -4.459 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -3.327 -5.611 -6.117 1.00 0.00 H new ATOM 447 N THR A 69 -6.985 -5.937 -4.935 1.00 0.00 N ATOM 448 CA THR A 69 -8.188 -5.767 -5.731 1.00 0.00 C ATOM 449 C THR A 69 -8.605 -4.301 -5.714 1.00 0.00 C ATOM 450 O THR A 69 -8.958 -3.759 -4.667 1.00 0.00 O ATOM 451 CB THR A 69 -9.344 -6.635 -5.197 1.00 0.00 C ATOM 452 OG1 THR A 69 -8.917 -7.997 -5.086 1.00 0.00 O ATOM 453 CG2 THR A 69 -10.554 -6.556 -6.117 1.00 0.00 C ATOM 0 H THR A 69 -7.084 -5.662 -3.958 1.00 0.00 H new ATOM 0 HA THR A 69 -7.968 -6.084 -6.750 1.00 0.00 H new ATOM 0 HB THR A 69 -9.629 -6.257 -4.215 1.00 0.00 H new ATOM 0 HG1 THR A 69 -9.655 -8.544 -4.745 1.00 0.00 H new ATOM 0 HG21 THR A 69 -11.356 -7.177 -5.718 1.00 0.00 H new ATOM 0 HG22 THR A 69 -10.894 -5.523 -6.183 1.00 0.00 H new ATOM 0 HG23 THR A 69 -10.280 -6.912 -7.110 1.00 0.00 H new ATOM 461 N TYR A 70 -8.558 -3.662 -6.869 1.00 0.00 N ATOM 462 CA TYR A 70 -8.900 -2.252 -6.957 1.00 0.00 C ATOM 463 C TYR A 70 -10.383 -2.098 -7.277 1.00 0.00 C ATOM 464 O TYR A 70 -10.925 -2.808 -8.125 1.00 0.00 O ATOM 465 CB TYR A 70 -8.033 -1.551 -8.011 1.00 0.00 C ATOM 466 CG TYR A 70 -6.539 -1.660 -7.748 1.00 0.00 C ATOM 467 CD1 TYR A 70 -5.947 -0.991 -6.680 1.00 0.00 C ATOM 468 CD2 TYR A 70 -5.719 -2.424 -8.574 1.00 0.00 C ATOM 469 CE1 TYR A 70 -4.587 -1.078 -6.447 1.00 0.00 C ATOM 470 CE2 TYR A 70 -4.360 -2.516 -8.344 1.00 0.00 C ATOM 471 CZ TYR A 70 -3.799 -1.842 -7.280 1.00 0.00 C ATOM 472 OH TYR A 70 -2.441 -1.925 -7.052 1.00 0.00 O ATOM 0 H TYR A 70 -8.289 -4.092 -7.754 1.00 0.00 H new ATOM 0 HA TYR A 70 -8.702 -1.778 -5.996 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -8.252 -1.977 -8.990 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -8.309 -0.497 -8.053 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -6.561 -0.394 -6.022 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -6.153 -2.954 -9.409 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -4.144 -0.549 -5.616 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -3.739 -3.114 -8.995 1.00 0.00 H new ATOM 0 HH TYR A 70 -2.167 -2.866 -7.050 1.00 0.00 H new ATOM 482 N ALA A 71 -11.028 -1.164 -6.581 1.00 0.00 N ATOM 483 CA ALA A 71 -12.479 -1.022 -6.609 1.00 0.00 C ATOM 484 C ALA A 71 -13.006 -0.685 -7.996 1.00 0.00 C ATOM 485 O ALA A 71 -14.145 -1.001 -8.323 1.00 0.00 O ATOM 486 CB ALA A 71 -12.912 0.042 -5.617 1.00 0.00 C ATOM 0 H ALA A 71 -10.558 -0.485 -5.982 1.00 0.00 H new ATOM 0 HA ALA A 71 -12.904 -1.986 -6.330 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -13.997 0.143 -5.643 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -12.598 -0.247 -4.614 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -12.452 0.994 -5.881 1.00 0.00 H new ATOM 492 N GLY A 72 -12.182 -0.035 -8.802 1.00 0.00 N ATOM 493 CA GLY A 72 -12.588 0.318 -10.151 1.00 0.00 C ATOM 494 C GLY A 72 -12.628 -0.874 -11.085 1.00 0.00 C ATOM 495 O GLY A 72 -13.160 -0.783 -12.192 1.00 0.00 O ATOM 0 H GLY A 72 -11.238 0.256 -8.549 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -13.574 0.781 -10.119 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -11.899 1.063 -10.549 1.00 0.00 H new ATOM 499 N ASP A 73 -12.064 -1.995 -10.648 1.00 0.00 N ATOM 500 CA ASP A 73 -12.030 -3.198 -11.471 1.00 0.00 C ATOM 501 C ASP A 73 -13.157 -4.154 -11.103 1.00 0.00 C ATOM 502 O ASP A 73 -13.495 -5.056 -11.873 1.00 0.00 O ATOM 503 CB ASP A 73 -10.686 -3.917 -11.323 1.00 0.00 C ATOM 504 CG ASP A 73 -9.545 -3.171 -11.976 1.00 0.00 C ATOM 505 OD1 ASP A 73 -9.330 -3.352 -13.189 1.00 0.00 O ATOM 506 OD2 ASP A 73 -8.841 -2.405 -11.280 1.00 0.00 O1- ATOM 0 H ASP A 73 -11.626 -2.095 -9.732 1.00 0.00 H new ATOM 0 HA ASP A 73 -12.161 -2.886 -12.507 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -10.466 -4.052 -10.264 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -10.762 -4.912 -11.762 1.00 0.00 H new ATOM 511 N VAL A 74 -13.739 -3.959 -9.929 1.00 0.00 N ATOM 512 CA VAL A 74 -14.794 -4.831 -9.450 1.00 0.00 C ATOM 513 C VAL A 74 -16.076 -4.046 -9.181 1.00 0.00 C ATOM 514 O VAL A 74 -16.083 -3.064 -8.442 1.00 0.00 O ATOM 515 CB VAL A 74 -14.357 -5.590 -8.183 1.00 0.00 C ATOM 516 CG1 VAL A 74 -13.342 -6.664 -8.533 1.00 0.00 C ATOM 517 CG2 VAL A 74 -13.782 -4.636 -7.152 1.00 0.00 C ATOM 0 H VAL A 74 -13.496 -3.201 -9.291 1.00 0.00 H new ATOM 0 HA VAL A 74 -14.995 -5.561 -10.234 1.00 0.00 H new ATOM 0 HB VAL A 74 -15.237 -6.067 -7.752 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -13.043 -7.191 -7.627 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -13.787 -7.370 -9.234 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -12.467 -6.202 -8.990 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -13.481 -5.196 -6.267 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -12.915 -4.126 -7.572 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -14.537 -3.900 -6.876 1.00 0.00 H new ATOM 527 N THR A 75 -17.160 -4.494 -9.787 1.00 0.00 N ATOM 528 CA THR A 75 -18.435 -3.795 -9.705 1.00 0.00 C ATOM 529 C THR A 75 -19.239 -4.214 -8.474 1.00 0.00 C ATOM 530 O THR A 75 -20.284 -3.635 -8.174 1.00 0.00 O ATOM 531 CB THR A 75 -19.267 -4.055 -10.972 1.00 0.00 C ATOM 532 OG1 THR A 75 -19.330 -5.466 -11.231 1.00 0.00 O ATOM 533 CG2 THR A 75 -18.657 -3.345 -12.170 1.00 0.00 C ATOM 0 H THR A 75 -17.185 -5.346 -10.347 1.00 0.00 H new ATOM 0 HA THR A 75 -18.214 -2.731 -9.619 1.00 0.00 H new ATOM 0 HB THR A 75 -20.273 -3.667 -10.810 1.00 0.00 H new ATOM 0 HG1 THR A 75 -19.862 -5.627 -12.038 1.00 0.00 H new ATOM 0 HG21 THR A 75 -19.261 -3.542 -13.056 1.00 0.00 H new ATOM 0 HG22 THR A 75 -18.629 -2.272 -11.981 1.00 0.00 H new ATOM 0 HG23 THR A 75 -17.643 -3.712 -12.333 1.00 0.00 H new ATOM 541 N ASP A 76 -18.744 -5.215 -7.761 1.00 0.00 N ATOM 542 CA ASP A 76 -19.424 -5.729 -6.574 1.00 0.00 C ATOM 543 C ASP A 76 -19.101 -4.889 -5.341 1.00 0.00 C ATOM 544 O ASP A 76 -19.618 -5.138 -4.253 1.00 0.00 O ATOM 545 CB ASP A 76 -19.039 -7.193 -6.325 1.00 0.00 C ATOM 546 CG ASP A 76 -17.548 -7.385 -6.123 1.00 0.00 C ATOM 547 OD1 ASP A 76 -16.791 -7.273 -7.111 1.00 0.00 O ATOM 548 OD2 ASP A 76 -17.125 -7.670 -4.981 1.00 0.00 O1- ATOM 0 H ASP A 76 -17.870 -5.692 -7.983 1.00 0.00 H new ATOM 0 HA ASP A 76 -20.497 -5.669 -6.756 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -19.570 -7.558 -5.446 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -19.367 -7.798 -7.170 1.00 0.00 H new ATOM 553 N ILE A 77 -18.250 -3.892 -5.520 1.00 0.00 N ATOM 554 CA ILE A 77 -17.861 -3.008 -4.433 1.00 0.00 C ATOM 555 C ILE A 77 -18.442 -1.616 -4.645 1.00 0.00 C ATOM 556 O ILE A 77 -18.543 -1.142 -5.780 1.00 0.00 O ATOM 557 CB ILE A 77 -16.323 -2.901 -4.323 1.00 0.00 C ATOM 558 CG1 ILE A 77 -15.701 -4.265 -4.013 1.00 0.00 C ATOM 559 CG2 ILE A 77 -15.919 -1.881 -3.271 1.00 0.00 C ATOM 560 CD1 ILE A 77 -14.205 -4.205 -3.811 1.00 0.00 C ATOM 0 H ILE A 77 -17.812 -3.673 -6.415 1.00 0.00 H new ATOM 0 HA ILE A 77 -18.253 -3.433 -3.509 1.00 0.00 H new ATOM 0 HB ILE A 77 -15.945 -2.562 -5.288 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -16.166 -4.674 -3.116 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -15.924 -4.953 -4.829 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -14.832 -1.827 -3.215 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -16.318 -0.903 -3.540 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -16.317 -2.181 -2.302 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -13.827 -5.204 -3.595 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -13.731 -3.825 -4.716 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -13.977 -3.542 -2.976 1.00 0.00 H new ATOM 572 N ASP A 78 -18.844 -0.973 -3.559 1.00 0.00 N ATOM 573 CA ASP A 78 -19.275 0.410 -3.618 1.00 0.00 C ATOM 574 C ASP A 78 -18.063 1.311 -3.438 1.00 0.00 C ATOM 575 O ASP A 78 -17.589 1.532 -2.319 1.00 0.00 O ATOM 576 CB ASP A 78 -20.323 0.713 -2.548 1.00 0.00 C ATOM 577 CG ASP A 78 -20.929 2.097 -2.710 1.00 0.00 C ATOM 578 OD1 ASP A 78 -20.223 3.099 -2.476 1.00 0.00 O ATOM 579 OD2 ASP A 78 -22.124 2.187 -3.071 1.00 0.00 O1- ATOM 0 H ASP A 78 -18.880 -1.389 -2.628 1.00 0.00 H new ATOM 0 HA ASP A 78 -19.736 0.594 -4.588 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -21.114 -0.035 -2.595 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -19.866 0.632 -1.562 1.00 0.00 H new ATOM 584 N GLU A 79 -17.556 1.808 -4.552 1.00 0.00 N ATOM 585 CA GLU A 79 -16.346 2.621 -4.564 1.00 0.00 C ATOM 586 C GLU A 79 -16.550 3.930 -3.802 1.00 0.00 C ATOM 587 O GLU A 79 -15.604 4.489 -3.252 1.00 0.00 O ATOM 588 CB GLU A 79 -15.937 2.901 -6.016 1.00 0.00 C ATOM 589 CG GLU A 79 -14.642 3.679 -6.167 1.00 0.00 C ATOM 590 CD GLU A 79 -14.289 3.929 -7.619 1.00 0.00 C ATOM 591 OE1 GLU A 79 -14.053 2.949 -8.359 1.00 0.00 O ATOM 592 OE2 GLU A 79 -14.233 5.110 -8.024 1.00 0.00 O1- ATOM 0 H GLU A 79 -17.968 1.662 -5.474 1.00 0.00 H new ATOM 0 HA GLU A 79 -15.550 2.071 -4.062 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -15.839 1.951 -6.542 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -16.738 3.455 -6.505 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -14.731 4.633 -5.647 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -13.832 3.129 -5.688 1.00 0.00 H new ATOM 599 N GLY A 80 -17.793 4.394 -3.746 1.00 0.00 N ATOM 600 CA GLY A 80 -18.088 5.659 -3.099 1.00 0.00 C ATOM 601 C GLY A 80 -17.856 5.610 -1.605 1.00 0.00 C ATOM 602 O GLY A 80 -17.288 6.539 -1.028 1.00 0.00 O ATOM 0 H GLY A 80 -18.604 3.915 -4.138 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -17.466 6.441 -3.535 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -19.125 5.931 -3.294 1.00 0.00 H new ATOM 606 N ILE A 81 -18.281 4.521 -0.980 1.00 0.00 N ATOM 607 CA ILE A 81 -18.102 4.346 0.455 1.00 0.00 C ATOM 608 C ILE A 81 -16.619 4.244 0.799 1.00 0.00 C ATOM 609 O ILE A 81 -16.142 4.875 1.747 1.00 0.00 O ATOM 610 CB ILE A 81 -18.841 3.092 0.966 1.00 0.00 C ATOM 611 CG1 ILE A 81 -20.355 3.249 0.784 1.00 0.00 C ATOM 612 CG2 ILE A 81 -18.504 2.839 2.428 1.00 0.00 C ATOM 613 CD1 ILE A 81 -21.153 2.038 1.217 1.00 0.00 C ATOM 0 H ILE A 81 -18.753 3.745 -1.444 1.00 0.00 H new ATOM 0 HA ILE A 81 -18.528 5.220 0.948 1.00 0.00 H new ATOM 0 HB ILE A 81 -18.512 2.234 0.380 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -20.692 4.116 1.352 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -20.566 3.455 -0.266 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -19.033 1.951 2.775 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -17.430 2.686 2.533 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -18.808 3.699 3.025 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -22.215 2.226 1.058 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -20.846 1.171 0.631 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -20.974 1.843 2.274 1.00 0.00 H new ATOM 625 N LEU A 82 -15.893 3.460 0.016 1.00 0.00 N ATOM 626 CA LEU A 82 -14.454 3.316 0.211 1.00 0.00 C ATOM 627 C LEU A 82 -13.746 4.647 -0.001 1.00 0.00 C ATOM 628 O LEU A 82 -12.824 4.999 0.733 1.00 0.00 O ATOM 629 CB LEU A 82 -13.866 2.274 -0.739 1.00 0.00 C ATOM 630 CG LEU A 82 -14.279 0.826 -0.478 1.00 0.00 C ATOM 631 CD1 LEU A 82 -13.579 -0.094 -1.460 1.00 0.00 C ATOM 632 CD2 LEU A 82 -13.955 0.416 0.952 1.00 0.00 C ATOM 0 H LEU A 82 -16.273 2.915 -0.758 1.00 0.00 H new ATOM 0 HA LEU A 82 -14.298 2.982 1.237 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -14.153 2.536 -1.757 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -12.779 2.336 -0.688 1.00 0.00 H new ATOM 0 HG LEU A 82 -15.357 0.744 -0.616 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -13.877 -1.125 -1.269 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -13.856 0.181 -2.478 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -12.500 -0.001 -1.340 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -14.259 -0.619 1.112 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -12.883 0.510 1.123 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -14.491 1.063 1.646 1.00 0.00 H new ATOM 644 N ALA A 83 -14.187 5.383 -1.010 1.00 0.00 N ATOM 645 CA ALA A 83 -13.604 6.678 -1.311 1.00 0.00 C ATOM 646 C ALA A 83 -13.874 7.661 -0.187 1.00 0.00 C ATOM 647 O ALA A 83 -12.991 8.410 0.210 1.00 0.00 O ATOM 648 CB ALA A 83 -14.143 7.214 -2.627 1.00 0.00 C ATOM 0 H ALA A 83 -14.946 5.105 -1.632 1.00 0.00 H new ATOM 0 HA ALA A 83 -12.525 6.553 -1.406 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -13.694 8.185 -2.835 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -13.896 6.520 -3.431 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -15.226 7.321 -2.560 1.00 0.00 H new ATOM 654 N GLY A 84 -15.095 7.634 0.332 1.00 0.00 N ATOM 655 CA GLY A 84 -15.467 8.524 1.419 1.00 0.00 C ATOM 656 C GLY A 84 -14.658 8.280 2.677 1.00 0.00 C ATOM 657 O GLY A 84 -14.233 9.225 3.345 1.00 0.00 O ATOM 0 H GLY A 84 -15.838 7.009 0.019 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -15.332 9.557 1.100 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -16.526 8.395 1.642 1.00 0.00 H new ATOM 661 N THR A 85 -14.430 7.014 2.996 1.00 0.00 N ATOM 662 CA THR A 85 -13.699 6.653 4.196 1.00 0.00 C ATOM 663 C THR A 85 -12.210 6.961 4.059 1.00 0.00 C ATOM 664 O THR A 85 -11.595 7.516 4.973 1.00 0.00 O ATOM 665 CB THR A 85 -13.900 5.165 4.537 1.00 0.00 C ATOM 666 OG1 THR A 85 -13.808 4.371 3.349 1.00 0.00 O ATOM 667 CG2 THR A 85 -15.251 4.935 5.195 1.00 0.00 C ATOM 0 H THR A 85 -14.743 6.220 2.437 1.00 0.00 H new ATOM 0 HA THR A 85 -14.098 7.257 5.011 1.00 0.00 H new ATOM 0 HB THR A 85 -13.116 4.871 5.235 1.00 0.00 H new ATOM 0 HG1 THR A 85 -14.656 4.416 2.859 1.00 0.00 H new ATOM 0 HG21 THR A 85 -15.368 3.876 5.426 1.00 0.00 H new ATOM 0 HG22 THR A 85 -15.311 5.516 6.116 1.00 0.00 H new ATOM 0 HG23 THR A 85 -16.044 5.248 4.516 1.00 0.00 H new ATOM 675 N LEU A 86 -11.638 6.622 2.911 1.00 0.00 N ATOM 676 CA LEU A 86 -10.213 6.843 2.678 1.00 0.00 C ATOM 677 C LEU A 86 -9.923 8.329 2.453 1.00 0.00 C ATOM 678 O LEU A 86 -8.830 8.810 2.748 1.00 0.00 O ATOM 679 CB LEU A 86 -9.724 6.015 1.481 1.00 0.00 C ATOM 680 CG LEU A 86 -8.526 5.089 1.748 1.00 0.00 C ATOM 681 CD1 LEU A 86 -7.353 5.860 2.338 1.00 0.00 C ATOM 682 CD2 LEU A 86 -8.925 3.939 2.661 1.00 0.00 C ATOM 0 H LEU A 86 -12.134 6.195 2.129 1.00 0.00 H new ATOM 0 HA LEU A 86 -9.671 6.518 3.566 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -10.554 5.408 1.121 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -9.457 6.699 0.676 1.00 0.00 H new ATOM 0 HG LEU A 86 -8.207 4.674 0.792 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -6.522 5.178 2.516 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -7.042 6.638 1.641 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -7.655 6.317 3.280 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -8.062 3.297 2.836 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -9.281 4.336 3.612 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -9.719 3.359 2.190 1.00 0.00 H new ATOM 694 N LYS A 87 -10.919 9.048 1.945 1.00 0.00 N ATOM 695 CA LYS A 87 -10.790 10.481 1.670 1.00 0.00 C ATOM 696 C LYS A 87 -10.414 11.249 2.932 1.00 0.00 C ATOM 697 O LYS A 87 -9.697 12.245 2.875 1.00 0.00 O ATOM 698 CB LYS A 87 -12.111 11.027 1.123 1.00 0.00 C ATOM 699 CG LYS A 87 -12.031 12.448 0.593 1.00 0.00 C ATOM 700 CD LYS A 87 -13.415 13.056 0.405 1.00 0.00 C ATOM 701 CE LYS A 87 -14.335 12.161 -0.414 1.00 0.00 C ATOM 702 NZ LYS A 87 -13.890 12.027 -1.825 1.00 0.00 N1+ ATOM 0 H LYS A 87 -11.833 8.660 1.713 1.00 0.00 H new ATOM 0 HA LYS A 87 -9.999 10.613 0.931 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -12.457 10.373 0.323 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -12.861 10.989 1.913 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -11.454 13.063 1.284 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -11.499 12.453 -0.358 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -13.864 13.238 1.381 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -13.320 14.023 -0.088 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -14.379 11.173 0.045 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -15.346 12.568 -0.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -14.679 11.678 -2.406 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -13.581 12.954 -2.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -13.098 11.355 -1.877 1.00 0.00 H new ATOM 716 N ASN A 88 -10.895 10.764 4.071 1.00 0.00 N ATOM 717 CA ASN A 88 -10.675 11.431 5.349 1.00 0.00 C ATOM 718 C ASN A 88 -9.202 11.354 5.748 1.00 0.00 C ATOM 719 O ASN A 88 -8.714 12.168 6.526 1.00 0.00 O ATOM 720 CB ASN A 88 -11.555 10.791 6.430 1.00 0.00 C ATOM 721 CG ASN A 88 -11.920 11.748 7.557 1.00 0.00 C ATOM 722 OD1 ASN A 88 -12.988 11.624 8.158 1.00 0.00 O ATOM 723 ND2 ASN A 88 -11.053 12.701 7.859 1.00 0.00 N ATOM 0 H ASN A 88 -11.443 9.906 4.135 1.00 0.00 H new ATOM 0 HA ASN A 88 -10.947 12.482 5.247 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -12.470 10.418 5.970 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -11.035 9.930 6.849 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -11.261 13.360 8.609 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -10.177 12.776 7.342 1.00 0.00 H new ATOM 730 N LEU A 89 -8.499 10.371 5.200 1.00 0.00 N ATOM 731 CA LEU A 89 -7.073 10.210 5.457 1.00 0.00 C ATOM 732 C LEU A 89 -6.270 11.176 4.596 1.00 0.00 C ATOM 733 O LEU A 89 -5.226 11.682 5.009 1.00 0.00 O ATOM 734 CB LEU A 89 -6.640 8.771 5.157 1.00 0.00 C ATOM 735 CG LEU A 89 -5.145 8.497 5.296 1.00 0.00 C ATOM 736 CD1 LEU A 89 -4.703 8.658 6.741 1.00 0.00 C ATOM 737 CD2 LEU A 89 -4.815 7.108 4.777 1.00 0.00 C ATOM 0 H LEU A 89 -8.895 9.671 4.573 1.00 0.00 H new ATOM 0 HA LEU A 89 -6.884 10.428 6.508 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -7.179 8.100 5.826 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -6.945 8.522 4.141 1.00 0.00 H new ATOM 0 HG LEU A 89 -4.599 9.225 4.696 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -3.634 8.458 6.819 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -4.907 9.676 7.073 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -5.250 7.955 7.369 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -3.746 6.925 4.882 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -5.368 6.364 5.351 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -5.094 7.037 3.726 1.00 0.00 H new ATOM 749 N ILE A 90 -6.775 11.428 3.403 1.00 0.00 N ATOM 750 CA ILE A 90 -6.083 12.253 2.431 1.00 0.00 C ATOM 751 C ILE A 90 -6.380 13.732 2.659 1.00 0.00 C ATOM 752 O ILE A 90 -5.469 14.561 2.703 1.00 0.00 O ATOM 753 CB ILE A 90 -6.486 11.850 0.997 1.00 0.00 C ATOM 754 CG1 ILE A 90 -6.192 10.366 0.768 1.00 0.00 C ATOM 755 CG2 ILE A 90 -5.749 12.702 -0.024 1.00 0.00 C ATOM 756 CD1 ILE A 90 -6.779 9.822 -0.512 1.00 0.00 C ATOM 0 H ILE A 90 -7.673 11.068 3.081 1.00 0.00 H new ATOM 0 HA ILE A 90 -5.012 12.093 2.557 1.00 0.00 H new ATOM 0 HB ILE A 90 -7.556 12.019 0.874 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -5.112 10.216 0.755 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -6.583 9.793 1.609 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -6.046 12.403 -1.029 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -5.997 13.752 0.131 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -4.674 12.562 0.093 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -6.530 8.765 -0.606 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -7.863 9.939 -0.494 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -6.369 10.369 -1.361 1.00 0.00 H new ATOM 768 N GLY A 91 -7.651 14.050 2.834 1.00 0.00 N ATOM 769 CA GLY A 91 -8.055 15.421 3.024 1.00 0.00 C ATOM 770 C GLY A 91 -9.288 15.762 2.214 1.00 0.00 C ATOM 771 O GLY A 91 -10.404 15.404 2.592 1.00 0.00 O ATOM 0 H GLY A 91 -8.415 13.375 2.848 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -8.254 15.598 4.081 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -7.238 16.083 2.738 1.00 0.00 H new ATOM 775 N GLY A 92 -9.085 16.423 1.086 1.00 0.00 N ATOM 776 CA GLY A 92 -10.197 16.830 0.252 1.00 0.00 C ATOM 777 C GLY A 92 -10.239 16.079 -1.061 1.00 0.00 C ATOM 778 O GLY A 92 -10.961 16.461 -1.984 1.00 0.00 O ATOM 0 H GLY A 92 -8.166 16.686 0.731 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -11.130 16.667 0.791 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -10.126 17.899 0.054 1.00 0.00 H new ATOM 782 N GLY A 93 -9.460 15.011 -1.151 1.00 0.00 N ATOM 783 CA GLY A 93 -9.441 14.208 -2.356 1.00 0.00 C ATOM 784 C GLY A 93 -9.355 12.731 -2.045 1.00 0.00 C ATOM 785 O GLY A 93 -9.149 12.347 -0.893 1.00 0.00 O ATOM 0 H GLY A 93 -8.840 14.686 -0.410 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -10.341 14.405 -2.938 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -8.592 14.499 -2.974 1.00 0.00 H new ATOM 789 N SER A 94 -9.514 11.901 -3.064 1.00 0.00 N ATOM 790 CA SER A 94 -9.450 10.461 -2.891 1.00 0.00 C ATOM 791 C SER A 94 -9.111 9.770 -4.207 1.00 0.00 C ATOM 792 O SER A 94 -9.964 9.637 -5.086 1.00 0.00 O ATOM 793 CB SER A 94 -10.777 9.937 -2.328 1.00 0.00 C ATOM 794 OG SER A 94 -11.883 10.516 -3.004 1.00 0.00 O ATOM 0 H SER A 94 -9.689 12.203 -4.022 1.00 0.00 H new ATOM 0 HA SER A 94 -8.656 10.233 -2.180 1.00 0.00 H new ATOM 0 HB2 SER A 94 -10.814 8.852 -2.426 1.00 0.00 H new ATOM 0 HB3 SER A 94 -10.839 10.163 -1.263 1.00 0.00 H new ATOM 0 HG SER A 94 -11.717 10.508 -3.970 1.00 0.00 H new ATOM 800 N GLY A 95 -7.856 9.361 -4.345 1.00 0.00 N ATOM 801 CA GLY A 95 -7.420 8.664 -5.537 1.00 0.00 C ATOM 802 C GLY A 95 -7.940 7.243 -5.591 1.00 0.00 C ATOM 803 O GLY A 95 -7.254 6.305 -5.187 1.00 0.00 O ATOM 0 H GLY A 95 -7.128 9.502 -3.645 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -7.760 9.207 -6.419 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -6.331 8.652 -5.571 1.00 0.00 H new ATOM 807 N THR A 96 -9.152 7.087 -6.104 1.00 0.00 N ATOM 808 CA THR A 96 -9.812 5.792 -6.167 1.00 0.00 C ATOM 809 C THR A 96 -9.103 4.842 -7.132 1.00 0.00 C ATOM 810 O THR A 96 -9.410 3.651 -7.184 1.00 0.00 O ATOM 811 CB THR A 96 -11.282 5.950 -6.592 1.00 0.00 C ATOM 812 OG1 THR A 96 -11.364 6.643 -7.844 1.00 0.00 O ATOM 813 CG2 THR A 96 -12.063 6.716 -5.536 1.00 0.00 C ATOM 0 H THR A 96 -9.704 7.854 -6.488 1.00 0.00 H new ATOM 0 HA THR A 96 -9.768 5.362 -5.166 1.00 0.00 H new ATOM 0 HB THR A 96 -11.715 4.955 -6.701 1.00 0.00 H new ATOM 0 HG1 THR A 96 -12.304 6.736 -8.105 1.00 0.00 H new ATOM 0 HG21 THR A 96 -13.101 6.818 -5.854 1.00 0.00 H new ATOM 0 HG22 THR A 96 -12.024 6.174 -4.591 1.00 0.00 H new ATOM 0 HG23 THR A 96 -11.624 7.705 -5.405 1.00 0.00 H new ATOM 821 N GLU A 97 -8.148 5.384 -7.880 1.00 0.00 N ATOM 822 CA GLU A 97 -7.380 4.616 -8.858 1.00 0.00 C ATOM 823 C GLU A 97 -6.575 3.508 -8.182 1.00 0.00 C ATOM 824 O GLU A 97 -6.348 2.447 -8.769 1.00 0.00 O ATOM 825 CB GLU A 97 -6.438 5.549 -9.631 1.00 0.00 C ATOM 826 CG GLU A 97 -7.157 6.584 -10.486 1.00 0.00 C ATOM 827 CD GLU A 97 -6.226 7.665 -10.991 1.00 0.00 C ATOM 828 OE1 GLU A 97 -6.089 8.704 -10.305 1.00 0.00 O ATOM 829 OE2 GLU A 97 -5.629 7.489 -12.072 1.00 0.00 O1- ATOM 0 H GLU A 97 -7.883 6.368 -7.827 1.00 0.00 H new ATOM 0 HA GLU A 97 -8.081 4.151 -9.551 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -5.791 6.065 -8.921 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -5.793 4.948 -10.272 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -7.626 6.087 -11.335 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -7.956 7.041 -9.903 1.00 0.00 H new ATOM 836 N GLY A 98 -6.153 3.755 -6.949 1.00 0.00 N ATOM 837 CA GLY A 98 -5.386 2.765 -6.211 1.00 0.00 C ATOM 838 C GLY A 98 -6.110 2.311 -4.960 1.00 0.00 C ATOM 839 O GLY A 98 -5.491 1.829 -4.013 1.00 0.00 O ATOM 0 H GLY A 98 -6.327 4.624 -6.444 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -5.192 1.904 -6.851 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -4.418 3.185 -5.939 1.00 0.00 H new ATOM 843 N LEU A 99 -7.426 2.468 -4.967 1.00 0.00 N ATOM 844 CA LEU A 99 -8.252 2.172 -3.808 1.00 0.00 C ATOM 845 C LEU A 99 -9.018 0.866 -4.003 1.00 0.00 C ATOM 846 O LEU A 99 -9.439 0.549 -5.118 1.00 0.00 O ATOM 847 CB LEU A 99 -9.233 3.326 -3.604 1.00 0.00 C ATOM 848 CG LEU A 99 -10.282 3.144 -2.506 1.00 0.00 C ATOM 849 CD1 LEU A 99 -9.655 3.243 -1.124 1.00 0.00 C ATOM 850 CD2 LEU A 99 -11.379 4.177 -2.667 1.00 0.00 C ATOM 0 H LEU A 99 -7.949 2.804 -5.776 1.00 0.00 H new ATOM 0 HA LEU A 99 -7.615 2.058 -2.931 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -8.660 4.226 -3.382 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -9.752 3.503 -4.546 1.00 0.00 H new ATOM 0 HG LEU A 99 -10.713 2.147 -2.603 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -10.425 3.110 -0.365 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -8.897 2.468 -1.012 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -9.193 4.223 -1.004 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -12.123 4.043 -1.882 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -10.951 5.177 -2.594 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -11.853 4.056 -3.641 1.00 0.00 H new ATOM 862 N GLY A 100 -9.197 0.111 -2.926 1.00 0.00 N ATOM 863 CA GLY A 100 -9.993 -1.099 -3.001 1.00 0.00 C ATOM 864 C GLY A 100 -9.777 -2.019 -1.818 1.00 0.00 C ATOM 865 O GLY A 100 -9.483 -1.561 -0.712 1.00 0.00 O ATOM 0 H GLY A 100 -8.807 0.314 -2.006 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -11.048 -0.831 -3.059 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -9.749 -1.633 -3.920 1.00 0.00 H new ATOM 869 N LEU A 101 -9.919 -3.317 -2.055 1.00 0.00 N ATOM 870 CA LEU A 101 -9.759 -4.316 -1.012 1.00 0.00 C ATOM 871 C LEU A 101 -8.463 -5.077 -1.227 1.00 0.00 C ATOM 872 O LEU A 101 -8.159 -5.506 -2.342 1.00 0.00 O ATOM 873 CB LEU A 101 -10.941 -5.298 -1.001 1.00 0.00 C ATOM 874 CG LEU A 101 -12.307 -4.700 -0.631 1.00 0.00 C ATOM 875 CD1 LEU A 101 -13.387 -5.769 -0.682 1.00 0.00 C ATOM 876 CD2 LEU A 101 -12.276 -4.056 0.747 1.00 0.00 C ATOM 0 H LEU A 101 -10.147 -3.703 -2.971 1.00 0.00 H new ATOM 0 HA LEU A 101 -9.730 -3.805 -0.050 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -11.020 -5.752 -1.989 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -10.715 -6.100 -0.299 1.00 0.00 H new ATOM 0 HG LEU A 101 -12.538 -3.925 -1.362 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -14.348 -5.328 -0.417 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -13.443 -6.182 -1.689 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -13.146 -6.564 0.024 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -13.258 -3.643 0.978 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -12.013 -4.806 1.493 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -11.534 -3.257 0.759 1.00 0.00 H new ATOM 888 N PHE A 102 -7.695 -5.237 -0.167 1.00 0.00 N ATOM 889 CA PHE A 102 -6.417 -5.925 -0.258 1.00 0.00 C ATOM 890 C PHE A 102 -6.462 -7.211 0.556 1.00 0.00 C ATOM 891 O PHE A 102 -7.101 -7.261 1.607 1.00 0.00 O ATOM 892 CB PHE A 102 -5.285 -4.998 0.215 1.00 0.00 C ATOM 893 CG PHE A 102 -4.955 -3.892 -0.767 1.00 0.00 C ATOM 894 CD1 PHE A 102 -5.858 -2.867 -1.015 1.00 0.00 C ATOM 895 CD2 PHE A 102 -3.744 -3.879 -1.442 1.00 0.00 C ATOM 896 CE1 PHE A 102 -5.560 -1.861 -1.913 1.00 0.00 C ATOM 897 CE2 PHE A 102 -3.443 -2.871 -2.341 1.00 0.00 C ATOM 898 CZ PHE A 102 -4.353 -1.863 -2.575 1.00 0.00 C ATOM 0 H PHE A 102 -7.931 -4.901 0.767 1.00 0.00 H new ATOM 0 HA PHE A 102 -6.219 -6.191 -1.297 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -5.566 -4.553 1.169 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -4.390 -5.594 0.393 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -6.806 -2.856 -0.499 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -3.026 -4.666 -1.264 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -6.274 -1.072 -2.096 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -2.495 -2.874 -2.859 1.00 0.00 H new ATOM 0 HZ PHE A 102 -4.120 -1.076 -3.277 1.00 0.00 H new ATOM 908 N ASN A 103 -5.813 -8.261 0.059 1.00 0.00 N ATOM 909 CA ASN A 103 -5.830 -9.555 0.734 1.00 0.00 C ATOM 910 C ASN A 103 -4.412 -10.047 0.977 1.00 0.00 C ATOM 911 O ASN A 103 -3.492 -9.691 0.233 1.00 0.00 O ATOM 912 CB ASN A 103 -6.592 -10.598 -0.097 1.00 0.00 C ATOM 913 CG ASN A 103 -8.077 -10.309 -0.217 1.00 0.00 C ATOM 914 OD1 ASN A 103 -8.512 -9.594 -1.123 1.00 0.00 O ATOM 915 ND2 ASN A 103 -8.871 -10.880 0.680 1.00 0.00 N ATOM 0 H ASN A 103 -5.271 -8.241 -0.805 1.00 0.00 H new ATOM 0 HA ASN A 103 -6.338 -9.424 1.690 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -6.157 -10.644 -1.095 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -6.457 -11.581 0.355 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -9.879 -10.734 0.635 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -8.473 -11.465 1.415 1.00 0.00 H new ATOM 922 N GLN A 104 -4.245 -10.867 2.018 1.00 0.00 N ATOM 923 CA GLN A 104 -2.938 -11.423 2.372 1.00 0.00 C ATOM 924 C GLN A 104 -1.955 -10.293 2.630 1.00 0.00 C ATOM 925 O GLN A 104 -0.916 -10.176 1.971 1.00 0.00 O ATOM 926 CB GLN A 104 -2.415 -12.357 1.268 1.00 0.00 C ATOM 927 CG GLN A 104 -3.264 -13.606 1.069 1.00 0.00 C ATOM 928 CD GLN A 104 -2.680 -14.573 0.053 1.00 0.00 C ATOM 929 OE1 GLN A 104 -3.415 -15.290 -0.624 1.00 0.00 O ATOM 930 NE2 GLN A 104 -1.358 -14.609 -0.062 1.00 0.00 N ATOM 0 H GLN A 104 -5.004 -11.161 2.633 1.00 0.00 H new ATOM 0 HA GLN A 104 -3.046 -12.016 3.280 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -2.370 -11.805 0.329 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -1.395 -12.656 1.511 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -3.375 -14.118 2.025 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -4.263 -13.311 0.747 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -0.779 -14.000 0.516 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -0.921 -15.246 -0.728 1.00 0.00 H new ATOM 939 N CYS A 105 -2.304 -9.447 3.581 1.00 0.00 N ATOM 940 CA CYS A 105 -1.545 -8.246 3.846 1.00 0.00 C ATOM 941 C CYS A 105 -1.023 -8.240 5.276 1.00 0.00 C ATOM 942 O CYS A 105 -1.688 -8.719 6.196 1.00 0.00 O ATOM 943 CB CYS A 105 -2.417 -7.013 3.590 1.00 0.00 C ATOM 944 SG CYS A 105 -1.472 -5.483 3.341 1.00 0.00 S ATOM 0 H CYS A 105 -3.116 -9.574 4.186 1.00 0.00 H new ATOM 0 HA CYS A 105 -0.687 -8.221 3.174 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -3.035 -7.194 2.711 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -3.094 -6.877 4.434 1.00 0.00 H new ATOM 949 N SER A 106 0.171 -7.701 5.452 1.00 0.00 N ATOM 950 CA SER A 106 0.801 -7.636 6.756 1.00 0.00 C ATOM 951 C SER A 106 1.198 -6.197 7.056 1.00 0.00 C ATOM 952 O SER A 106 1.647 -5.472 6.166 1.00 0.00 O ATOM 953 CB SER A 106 2.029 -8.554 6.791 1.00 0.00 C ATOM 954 OG SER A 106 2.552 -8.667 8.103 1.00 0.00 O ATOM 0 H SER A 106 0.727 -7.298 4.698 1.00 0.00 H new ATOM 0 HA SER A 106 0.098 -7.974 7.518 1.00 0.00 H new ATOM 0 HB2 SER A 106 1.757 -9.542 6.419 1.00 0.00 H new ATOM 0 HB3 SER A 106 2.797 -8.163 6.124 1.00 0.00 H new ATOM 0 HG SER A 106 3.333 -9.259 8.094 1.00 0.00 H new ATOM 960 N LYS A 107 1.019 -5.785 8.300 1.00 0.00 N ATOM 961 CA LYS A 107 1.317 -4.417 8.703 1.00 0.00 C ATOM 962 C LYS A 107 2.810 -4.232 8.913 1.00 0.00 C ATOM 963 O LYS A 107 3.511 -5.158 9.329 1.00 0.00 O ATOM 964 CB LYS A 107 0.554 -4.063 9.982 1.00 0.00 C ATOM 965 CG LYS A 107 -0.945 -3.869 9.768 1.00 0.00 C ATOM 966 CD LYS A 107 -1.228 -2.624 8.932 1.00 0.00 C ATOM 967 CE LYS A 107 -2.709 -2.483 8.597 1.00 0.00 C ATOM 968 NZ LYS A 107 -3.215 -3.637 7.805 1.00 0.00 N1+ ATOM 0 H LYS A 107 0.668 -6.379 9.051 1.00 0.00 H new ATOM 0 HA LYS A 107 0.997 -3.747 7.905 1.00 0.00 H new ATOM 0 HB2 LYS A 107 0.708 -4.853 10.717 1.00 0.00 H new ATOM 0 HB3 LYS A 107 0.973 -3.149 10.404 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -1.360 -4.746 9.271 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -1.444 -3.783 10.733 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -0.894 -1.740 9.475 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -0.650 -2.669 8.009 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -3.283 -2.398 9.520 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -2.868 -1.562 8.037 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -4.135 -3.393 7.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -2.538 -3.862 7.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -3.327 -4.463 8.427 1.00 0.00 H new ATOM 982 N LEU A 108 3.291 -3.033 8.622 1.00 0.00 N ATOM 983 CA LEU A 108 4.706 -2.731 8.748 1.00 0.00 C ATOM 984 C LEU A 108 4.972 -1.936 10.015 1.00 0.00 C ATOM 985 O LEU A 108 4.173 -1.079 10.404 1.00 0.00 O ATOM 986 CB LEU A 108 5.219 -1.958 7.528 1.00 0.00 C ATOM 987 CG LEU A 108 5.257 -2.746 6.214 1.00 0.00 C ATOM 988 CD1 LEU A 108 5.839 -1.892 5.103 1.00 0.00 C ATOM 989 CD2 LEU A 108 6.071 -4.026 6.367 1.00 0.00 C ATOM 0 H LEU A 108 2.720 -2.253 8.297 1.00 0.00 H new ATOM 0 HA LEU A 108 5.243 -3.678 8.804 1.00 0.00 H new ATOM 0 HB2 LEU A 108 4.590 -1.079 7.386 1.00 0.00 H new ATOM 0 HB3 LEU A 108 6.225 -1.598 7.745 1.00 0.00 H new ATOM 0 HG LEU A 108 4.234 -3.018 5.955 1.00 0.00 H new ATOM 0 HD11 LEU A 108 5.860 -2.465 4.176 1.00 0.00 H new ATOM 0 HD12 LEU A 108 5.223 -1.003 4.966 1.00 0.00 H new ATOM 0 HD13 LEU A 108 6.853 -1.593 5.367 1.00 0.00 H new ATOM 0 HD21 LEU A 108 6.082 -4.566 5.420 1.00 0.00 H new ATOM 0 HD22 LEU A 108 7.092 -3.776 6.653 1.00 0.00 H new ATOM 0 HD23 LEU A 108 5.622 -4.653 7.137 1.00 0.00 H new ATOM 1001 N ASP A 109 6.082 -2.244 10.662 1.00 0.00 N ATOM 1002 CA ASP A 109 6.502 -1.525 11.852 1.00 0.00 C ATOM 1003 C ASP A 109 7.575 -0.518 11.473 1.00 0.00 C ATOM 1004 O ASP A 109 8.574 -0.880 10.849 1.00 0.00 O ATOM 1005 CB ASP A 109 7.045 -2.496 12.910 1.00 0.00 C ATOM 1006 CG ASP A 109 6.046 -3.571 13.296 1.00 0.00 C ATOM 1007 OD1 ASP A 109 5.231 -3.331 14.211 1.00 0.00 O ATOM 1008 OD2 ASP A 109 6.079 -4.665 12.690 1.00 0.00 O1- ATOM 0 H ASP A 109 6.714 -2.994 10.380 1.00 0.00 H new ATOM 0 HA ASP A 109 5.642 -1.006 12.276 1.00 0.00 H new ATOM 0 HB2 ASP A 109 7.951 -2.969 12.530 1.00 0.00 H new ATOM 0 HB3 ASP A 109 7.328 -1.934 13.800 1.00 0.00 H new ATOM 1013 N LEU A 110 7.363 0.739 11.828 1.00 0.00 N ATOM 1014 CA LEU A 110 8.306 1.791 11.474 1.00 0.00 C ATOM 1015 C LEU A 110 9.515 1.752 12.402 1.00 0.00 C ATOM 1016 O LEU A 110 9.380 1.570 13.616 1.00 0.00 O ATOM 1017 CB LEU A 110 7.621 3.175 11.492 1.00 0.00 C ATOM 1018 CG LEU A 110 7.299 3.778 12.869 1.00 0.00 C ATOM 1019 CD1 LEU A 110 8.463 4.612 13.390 1.00 0.00 C ATOM 1020 CD2 LEU A 110 6.039 4.625 12.800 1.00 0.00 C ATOM 0 H LEU A 110 6.551 1.056 12.358 1.00 0.00 H new ATOM 0 HA LEU A 110 8.657 1.616 10.457 1.00 0.00 H new ATOM 0 HB2 LEU A 110 8.261 3.876 10.957 1.00 0.00 H new ATOM 0 HB3 LEU A 110 6.690 3.099 10.930 1.00 0.00 H new ATOM 0 HG LEU A 110 7.132 2.954 13.562 1.00 0.00 H new ATOM 0 HD11 LEU A 110 8.206 5.026 14.365 1.00 0.00 H new ATOM 0 HD12 LEU A 110 9.348 3.983 13.484 1.00 0.00 H new ATOM 0 HD13 LEU A 110 8.668 5.425 12.694 1.00 0.00 H new ATOM 0 HD21 LEU A 110 5.827 5.043 13.784 1.00 0.00 H new ATOM 0 HD22 LEU A 110 6.184 5.435 12.085 1.00 0.00 H new ATOM 0 HD23 LEU A 110 5.201 4.005 12.481 1.00 0.00 H new ATOM 1032 N GLN A 111 10.694 1.892 11.816 1.00 0.00 N ATOM 1033 CA GLN A 111 11.932 1.926 12.576 1.00 0.00 C ATOM 1034 C GLN A 111 12.073 3.258 13.300 1.00 0.00 C ATOM 1035 O GLN A 111 11.974 4.325 12.689 1.00 0.00 O ATOM 1036 CB GLN A 111 13.141 1.690 11.662 1.00 0.00 C ATOM 1037 CG GLN A 111 13.395 0.225 11.313 1.00 0.00 C ATOM 1038 CD GLN A 111 12.239 -0.434 10.583 1.00 0.00 C ATOM 1039 OE1 GLN A 111 12.173 -0.419 9.353 1.00 0.00 O ATOM 1040 NE2 GLN A 111 11.330 -1.033 11.336 1.00 0.00 N ATOM 0 H GLN A 111 10.819 1.985 10.808 1.00 0.00 H new ATOM 0 HA GLN A 111 11.899 1.125 13.315 1.00 0.00 H new ATOM 0 HB2 GLN A 111 12.997 2.251 10.738 1.00 0.00 H new ATOM 0 HB3 GLN A 111 14.030 2.095 12.145 1.00 0.00 H new ATOM 0 HG2 GLN A 111 14.290 0.157 10.695 1.00 0.00 H new ATOM 0 HG3 GLN A 111 13.598 -0.329 12.230 1.00 0.00 H new ATOM 0 HE21 GLN A 111 11.422 -1.022 12.352 1.00 0.00 H new ATOM 0 HE22 GLN A 111 10.538 -1.505 10.900 1.00 0.00 H new ATOM 1049 N ILE A 112 12.285 3.184 14.602 1.00 0.00 N ATOM 1050 CA ILE A 112 12.434 4.369 15.427 1.00 0.00 C ATOM 1051 C ILE A 112 13.913 4.641 15.693 1.00 0.00 C ATOM 1052 O ILE A 112 14.586 3.841 16.344 1.00 0.00 O ATOM 1053 CB ILE A 112 11.702 4.213 16.779 1.00 0.00 C ATOM 1054 CG1 ILE A 112 10.217 3.903 16.560 1.00 0.00 C ATOM 1055 CG2 ILE A 112 11.863 5.473 17.619 1.00 0.00 C ATOM 1056 CD1 ILE A 112 9.440 3.710 17.845 1.00 0.00 C ATOM 0 H ILE A 112 12.358 2.305 15.115 1.00 0.00 H new ATOM 0 HA ILE A 112 11.991 5.204 14.884 1.00 0.00 H new ATOM 0 HB ILE A 112 12.150 3.377 17.316 1.00 0.00 H new ATOM 0 HG12 ILE A 112 9.765 4.716 15.991 1.00 0.00 H new ATOM 0 HG13 ILE A 112 10.129 3.002 15.953 1.00 0.00 H new ATOM 0 HG21 ILE A 112 11.342 5.347 18.568 1.00 0.00 H new ATOM 0 HG22 ILE A 112 12.922 5.652 17.808 1.00 0.00 H new ATOM 0 HG23 ILE A 112 11.441 6.324 17.084 1.00 0.00 H new ATOM 0 HD11 ILE A 112 8.398 3.494 17.611 1.00 0.00 H new ATOM 0 HD12 ILE A 112 9.866 2.878 18.406 1.00 0.00 H new ATOM 0 HD13 ILE A 112 9.497 4.619 18.444 1.00 0.00 H new ATOM 1068 N PRO A 113 14.446 5.758 15.177 1.00 0.00 N ATOM 1069 CA PRO A 113 15.831 6.139 15.423 1.00 0.00 C ATOM 1070 C PRO A 113 16.005 6.748 16.812 1.00 0.00 C ATOM 1071 O PRO A 113 15.986 7.970 16.983 1.00 0.00 O ATOM 1072 CB PRO A 113 16.118 7.166 14.327 1.00 0.00 C ATOM 1073 CG PRO A 113 14.793 7.775 14.012 1.00 0.00 C ATOM 1074 CD PRO A 113 13.746 6.728 14.311 1.00 0.00 C ATOM 0 HA PRO A 113 16.513 5.289 15.397 1.00 0.00 H new ATOM 0 HB2 PRO A 113 16.828 7.920 14.668 1.00 0.00 H new ATOM 0 HB3 PRO A 113 16.554 6.693 13.447 1.00 0.00 H new ATOM 0 HG2 PRO A 113 14.627 8.670 14.612 1.00 0.00 H new ATOM 0 HG3 PRO A 113 14.747 8.080 12.966 1.00 0.00 H new ATOM 0 HD2 PRO A 113 12.881 7.161 14.814 1.00 0.00 H new ATOM 0 HD3 PRO A 113 13.381 6.257 13.398 1.00 0.00 H new ATOM 1082 N ILE A 114 16.165 5.882 17.801 1.00 0.00 N ATOM 1083 CA ILE A 114 16.221 6.308 19.191 1.00 0.00 C ATOM 1084 C ILE A 114 17.582 6.910 19.542 1.00 0.00 C ATOM 1085 O ILE A 114 17.739 8.132 19.558 1.00 0.00 O ATOM 1086 CB ILE A 114 15.917 5.142 20.158 1.00 0.00 C ATOM 1087 CG1 ILE A 114 14.707 4.343 19.668 1.00 0.00 C ATOM 1088 CG2 ILE A 114 15.660 5.675 21.559 1.00 0.00 C ATOM 1089 CD1 ILE A 114 14.450 3.084 20.467 1.00 0.00 C ATOM 0 H ILE A 114 16.259 4.875 17.666 1.00 0.00 H new ATOM 0 HA ILE A 114 15.454 7.074 19.308 1.00 0.00 H new ATOM 0 HB ILE A 114 16.783 4.480 20.186 1.00 0.00 H new ATOM 0 HG12 ILE A 114 13.822 4.977 19.710 1.00 0.00 H new ATOM 0 HG13 ILE A 114 14.858 4.075 18.622 1.00 0.00 H new ATOM 0 HG21 ILE A 114 15.447 4.844 22.231 1.00 0.00 H new ATOM 0 HG22 ILE A 114 16.541 6.210 21.912 1.00 0.00 H new ATOM 0 HG23 ILE A 114 14.807 6.353 21.539 1.00 0.00 H new ATOM 0 HD11 ILE A 114 13.578 2.569 20.064 1.00 0.00 H new ATOM 0 HD12 ILE A 114 15.319 2.430 20.404 1.00 0.00 H new ATOM 0 HD13 ILE A 114 14.267 3.345 21.509 1.00 0.00 H new ATOM 1101 N ILE A 115 18.567 6.057 19.806 1.00 0.00 N ATOM 1102 CA ILE A 115 19.871 6.520 20.252 1.00 0.00 C ATOM 1103 C ILE A 115 20.936 6.265 19.193 1.00 0.00 C ATOM 1104 O ILE A 115 21.517 5.180 19.124 1.00 0.00 O ATOM 1105 CB ILE A 115 20.294 5.838 21.574 1.00 0.00 C ATOM 1106 CG1 ILE A 115 19.237 6.065 22.662 1.00 0.00 C ATOM 1107 CG2 ILE A 115 21.651 6.351 22.041 1.00 0.00 C ATOM 1108 CD1 ILE A 115 18.964 7.524 22.961 1.00 0.00 C ATOM 0 H ILE A 115 18.485 5.044 19.718 1.00 0.00 H new ATOM 0 HA ILE A 115 19.783 7.593 20.422 1.00 0.00 H new ATOM 0 HB ILE A 115 20.378 4.767 21.388 1.00 0.00 H new ATOM 0 HG12 ILE A 115 18.306 5.587 22.355 1.00 0.00 H new ATOM 0 HG13 ILE A 115 19.562 5.572 23.578 1.00 0.00 H new ATOM 0 HG21 ILE A 115 21.926 5.856 22.972 1.00 0.00 H new ATOM 0 HG22 ILE A 115 22.402 6.137 21.281 1.00 0.00 H new ATOM 0 HG23 ILE A 115 21.597 7.427 22.204 1.00 0.00 H new ATOM 0 HD11 ILE A 115 18.206 7.600 23.740 1.00 0.00 H new ATOM 0 HD12 ILE A 115 19.882 8.004 23.300 1.00 0.00 H new ATOM 0 HD13 ILE A 115 18.607 8.020 22.058 1.00 0.00 H new ATOM 1120 N GLY A 116 21.171 7.271 18.362 1.00 0.00 N ATOM 1121 CA GLY A 116 22.234 7.198 17.378 1.00 0.00 C ATOM 1122 C GLY A 116 22.013 6.115 16.344 1.00 0.00 C ATOM 1123 O GLY A 116 22.904 5.308 16.085 1.00 0.00 O ATOM 0 H GLY A 116 20.641 8.142 18.352 1.00 0.00 H new ATOM 0 HA2 GLY A 116 22.321 8.161 16.874 1.00 0.00 H new ATOM 0 HA3 GLY A 116 23.181 7.018 17.887 1.00 0.00 H new ATOM 1127 N ILE A 117 20.828 6.089 15.760 1.00 0.00 N ATOM 1128 CA ILE A 117 20.523 5.138 14.705 1.00 0.00 C ATOM 1129 C ILE A 117 20.352 5.869 13.376 1.00 0.00 C ATOM 1130 O ILE A 117 19.246 6.277 13.021 1.00 0.00 O ATOM 1131 CB ILE A 117 19.244 4.328 15.010 1.00 0.00 C ATOM 1132 CG1 ILE A 117 19.351 3.646 16.376 1.00 0.00 C ATOM 1133 CG2 ILE A 117 18.996 3.292 13.917 1.00 0.00 C ATOM 1134 CD1 ILE A 117 18.151 2.790 16.723 1.00 0.00 C ATOM 0 H ILE A 117 20.060 6.716 15.999 1.00 0.00 H new ATOM 0 HA ILE A 117 21.359 4.441 14.644 1.00 0.00 H new ATOM 0 HB ILE A 117 18.399 5.017 15.034 1.00 0.00 H new ATOM 0 HG12 ILE A 117 20.247 3.025 16.393 1.00 0.00 H new ATOM 0 HG13 ILE A 117 19.477 4.409 17.144 1.00 0.00 H new ATOM 0 HG21 ILE A 117 18.091 2.730 14.147 1.00 0.00 H new ATOM 0 HG22 ILE A 117 18.876 3.796 12.958 1.00 0.00 H new ATOM 0 HG23 ILE A 117 19.844 2.609 13.864 1.00 0.00 H new ATOM 0 HD11 ILE A 117 18.298 2.339 17.704 1.00 0.00 H new ATOM 0 HD12 ILE A 117 17.254 3.410 16.739 1.00 0.00 H new ATOM 0 HD13 ILE A 117 18.036 2.005 15.976 1.00 0.00 H new ATOM 1146 N PRO A 118 21.446 6.055 12.624 1.00 0.00 N ATOM 1147 CA PRO A 118 21.410 6.728 11.336 1.00 0.00 C ATOM 1148 C PRO A 118 21.150 5.753 10.192 1.00 0.00 C ATOM 1149 O PRO A 118 21.742 5.861 9.118 1.00 0.00 O ATOM 1150 CB PRO A 118 22.812 7.325 11.228 1.00 0.00 C ATOM 1151 CG PRO A 118 23.695 6.406 12.015 1.00 0.00 C ATOM 1152 CD PRO A 118 22.812 5.632 12.970 1.00 0.00 C ATOM 0 HA PRO A 118 20.610 7.465 11.268 1.00 0.00 H new ATOM 0 HB2 PRO A 118 23.135 7.386 10.189 1.00 0.00 H new ATOM 0 HB3 PRO A 118 22.840 8.338 11.630 1.00 0.00 H new ATOM 0 HG2 PRO A 118 24.229 5.726 11.351 1.00 0.00 H new ATOM 0 HG3 PRO A 118 24.447 6.973 12.563 1.00 0.00 H new ATOM 0 HD2 PRO A 118 22.939 4.556 12.846 1.00 0.00 H new ATOM 0 HD3 PRO A 118 23.049 5.864 14.008 1.00 0.00 H new ATOM 1160 N ILE A 119 20.267 4.796 10.430 1.00 0.00 N ATOM 1161 CA ILE A 119 19.957 3.783 9.440 1.00 0.00 C ATOM 1162 C ILE A 119 18.615 4.072 8.785 1.00 0.00 C ATOM 1163 O ILE A 119 17.584 4.143 9.453 1.00 0.00 O ATOM 1164 CB ILE A 119 19.931 2.371 10.060 1.00 0.00 C ATOM 1165 CG1 ILE A 119 21.295 2.022 10.673 1.00 0.00 C ATOM 1166 CG2 ILE A 119 19.531 1.335 9.016 1.00 0.00 C ATOM 1167 CD1 ILE A 119 22.434 1.994 9.672 1.00 0.00 C ATOM 0 H ILE A 119 19.752 4.702 11.305 1.00 0.00 H new ATOM 0 HA ILE A 119 20.745 3.814 8.688 1.00 0.00 H new ATOM 0 HB ILE A 119 19.187 2.361 10.856 1.00 0.00 H new ATOM 0 HG12 ILE A 119 21.528 2.748 11.452 1.00 0.00 H new ATOM 0 HG13 ILE A 119 21.226 1.047 11.156 1.00 0.00 H new ATOM 0 HG21 ILE A 119 19.518 0.345 9.472 1.00 0.00 H new ATOM 0 HG22 ILE A 119 18.539 1.570 8.632 1.00 0.00 H new ATOM 0 HG23 ILE A 119 20.250 1.348 8.197 1.00 0.00 H new ATOM 0 HD11 ILE A 119 23.362 1.740 10.184 1.00 0.00 H new ATOM 0 HD12 ILE A 119 22.226 1.247 8.905 1.00 0.00 H new ATOM 0 HD13 ILE A 119 22.533 2.974 9.206 1.00 0.00 H new ATOM 1179 N GLN A 120 18.641 4.237 7.474 1.00 0.00 N ATOM 1180 CA GLN A 120 17.436 4.522 6.714 1.00 0.00 C ATOM 1181 C GLN A 120 16.937 3.264 6.024 1.00 0.00 C ATOM 1182 O GLN A 120 17.275 3.008 4.868 1.00 0.00 O ATOM 1183 CB GLN A 120 17.686 5.616 5.671 1.00 0.00 C ATOM 1184 CG GLN A 120 17.899 7.001 6.257 1.00 0.00 C ATOM 1185 CD GLN A 120 17.951 8.076 5.187 1.00 0.00 C ATOM 1186 OE1 GLN A 120 17.315 7.956 4.136 1.00 0.00 O ATOM 1187 NE2 GLN A 120 18.692 9.141 5.447 1.00 0.00 N ATOM 0 H GLN A 120 19.489 4.178 6.910 1.00 0.00 H new ATOM 0 HA GLN A 120 16.678 4.876 7.413 1.00 0.00 H new ATOM 0 HB2 GLN A 120 18.561 5.346 5.080 1.00 0.00 H new ATOM 0 HB3 GLN A 120 16.838 5.650 4.987 1.00 0.00 H new ATOM 0 HG2 GLN A 120 17.093 7.225 6.956 1.00 0.00 H new ATOM 0 HG3 GLN A 120 18.828 7.013 6.827 1.00 0.00 H new ATOM 0 HE21 GLN A 120 19.203 9.204 6.327 1.00 0.00 H new ATOM 0 HE22 GLN A 120 18.752 9.899 4.767 1.00 0.00 H new ATOM 1196 N ASP A 121 16.151 2.475 6.744 1.00 0.00 N ATOM 1197 CA ASP A 121 15.565 1.260 6.188 1.00 0.00 C ATOM 1198 C ASP A 121 14.592 1.599 5.066 1.00 0.00 C ATOM 1199 O ASP A 121 13.471 2.039 5.321 1.00 0.00 O ATOM 1200 CB ASP A 121 14.830 0.465 7.273 1.00 0.00 C ATOM 1201 CG ASP A 121 15.759 -0.265 8.219 1.00 0.00 C ATOM 1202 OD1 ASP A 121 15.951 -1.488 8.042 1.00 0.00 O ATOM 1203 OD2 ASP A 121 16.281 0.370 9.157 1.00 0.00 O1- ATOM 0 H ASP A 121 15.903 2.654 7.717 1.00 0.00 H new ATOM 0 HA ASP A 121 16.377 0.652 5.789 1.00 0.00 H new ATOM 0 HB2 ASP A 121 14.200 1.145 7.847 1.00 0.00 H new ATOM 0 HB3 ASP A 121 14.167 -0.258 6.797 1.00 0.00 H new ATOM 1208 N LEU A 122 15.023 1.391 3.829 1.00 0.00 N ATOM 1209 CA LEU A 122 14.185 1.668 2.667 1.00 0.00 C ATOM 1210 C LEU A 122 13.049 0.655 2.582 1.00 0.00 C ATOM 1211 O LEU A 122 13.264 -0.554 2.700 1.00 0.00 O ATOM 1212 CB LEU A 122 15.025 1.646 1.388 1.00 0.00 C ATOM 1213 CG LEU A 122 16.116 2.718 1.317 1.00 0.00 C ATOM 1214 CD1 LEU A 122 16.946 2.553 0.058 1.00 0.00 C ATOM 1215 CD2 LEU A 122 15.513 4.111 1.361 1.00 0.00 C ATOM 0 H LEU A 122 15.950 1.031 3.603 1.00 0.00 H new ATOM 0 HA LEU A 122 13.752 2.662 2.776 1.00 0.00 H new ATOM 0 HB2 LEU A 122 15.492 0.666 1.294 1.00 0.00 H new ATOM 0 HB3 LEU A 122 14.361 1.766 0.532 1.00 0.00 H new ATOM 0 HG LEU A 122 16.763 2.593 2.185 1.00 0.00 H new ATOM 0 HD11 LEU A 122 17.716 3.324 0.026 1.00 0.00 H new ATOM 0 HD12 LEU A 122 17.417 1.570 0.059 1.00 0.00 H new ATOM 0 HD13 LEU A 122 16.303 2.646 -0.817 1.00 0.00 H new ATOM 0 HD21 LEU A 122 16.309 4.854 1.309 1.00 0.00 H new ATOM 0 HD22 LEU A 122 14.838 4.242 0.515 1.00 0.00 H new ATOM 0 HD23 LEU A 122 14.958 4.238 2.291 1.00 0.00 H new ATOM 1227 N VAL A 123 11.834 1.164 2.387 1.00 0.00 N ATOM 1228 CA VAL A 123 10.633 0.340 2.433 1.00 0.00 C ATOM 1229 C VAL A 123 10.595 -0.660 1.277 1.00 0.00 C ATOM 1230 O VAL A 123 10.158 -1.797 1.450 1.00 0.00 O ATOM 1231 CB VAL A 123 9.349 1.212 2.458 1.00 0.00 C ATOM 1232 CG1 VAL A 123 9.143 1.961 1.149 1.00 0.00 C ATOM 1233 CG2 VAL A 123 8.131 0.368 2.799 1.00 0.00 C ATOM 0 H VAL A 123 11.657 2.150 2.195 1.00 0.00 H new ATOM 0 HA VAL A 123 10.667 -0.230 3.362 1.00 0.00 H new ATOM 0 HB VAL A 123 9.480 1.961 3.239 1.00 0.00 H new ATOM 0 HG11 VAL A 123 8.233 2.558 1.211 1.00 0.00 H new ATOM 0 HG12 VAL A 123 9.995 2.616 0.966 1.00 0.00 H new ATOM 0 HG13 VAL A 123 9.053 1.246 0.331 1.00 0.00 H new ATOM 0 HG21 VAL A 123 7.243 0.999 2.811 1.00 0.00 H new ATOM 0 HG22 VAL A 123 8.010 -0.415 2.050 1.00 0.00 H new ATOM 0 HG23 VAL A 123 8.266 -0.086 3.780 1.00 0.00 H new ATOM 1243 N ASN A 124 11.090 -0.248 0.113 1.00 0.00 N ATOM 1244 CA ASN A 124 11.144 -1.127 -1.057 1.00 0.00 C ATOM 1245 C ASN A 124 12.193 -2.215 -0.874 1.00 0.00 C ATOM 1246 O ASN A 124 12.195 -3.217 -1.587 1.00 0.00 O ATOM 1247 CB ASN A 124 11.474 -0.344 -2.332 1.00 0.00 C ATOM 1248 CG ASN A 124 10.384 0.629 -2.747 1.00 0.00 C ATOM 1249 OD1 ASN A 124 9.674 1.184 -1.913 1.00 0.00 O ATOM 1250 ND2 ASN A 124 10.242 0.838 -4.047 1.00 0.00 N ATOM 0 H ASN A 124 11.460 0.689 -0.048 1.00 0.00 H new ATOM 0 HA ASN A 124 10.157 -1.578 -1.156 1.00 0.00 H new ATOM 0 HB2 ASN A 124 12.402 0.207 -2.180 1.00 0.00 H new ATOM 0 HB3 ASN A 124 11.650 -1.048 -3.145 1.00 0.00 H new ATOM 0 HD21 ASN A 124 9.524 1.478 -4.385 1.00 0.00 H new ATOM 0 HD22 ASN A 124 10.851 0.359 -4.710 1.00 0.00 H new ATOM 1257 N GLN A 125 13.083 -2.013 0.086 1.00 0.00 N ATOM 1258 CA GLN A 125 14.216 -2.905 0.273 1.00 0.00 C ATOM 1259 C GLN A 125 13.810 -4.117 1.102 1.00 0.00 C ATOM 1260 O GLN A 125 14.366 -5.202 0.941 1.00 0.00 O ATOM 1261 CB GLN A 125 15.352 -2.150 0.972 1.00 0.00 C ATOM 1262 CG GLN A 125 16.669 -2.909 1.059 1.00 0.00 C ATOM 1263 CD GLN A 125 17.650 -2.257 2.021 1.00 0.00 C ATOM 1264 OE1 GLN A 125 17.139 -1.665 3.094 1.00 0.00 O flip ATOM 1265 NE2 GLN A 125 18.864 -2.301 1.813 1.00 0.00 N flip ATOM 0 H GLN A 125 13.042 -1.238 0.748 1.00 0.00 H new ATOM 0 HA GLN A 125 14.557 -3.252 -0.702 1.00 0.00 H new ATOM 0 HB2 GLN A 125 15.524 -1.212 0.444 1.00 0.00 H new ATOM 0 HB3 GLN A 125 15.030 -1.893 1.981 1.00 0.00 H new ATOM 0 HG2 GLN A 125 16.475 -3.932 1.380 1.00 0.00 H new ATOM 0 HG3 GLN A 125 17.119 -2.966 0.068 1.00 0.00 H new ATOM 0 HE21 GLN A 125 19.222 -2.764 0.978 1.00 0.00 H new ATOM 0 HE22 GLN A 125 19.511 -1.874 2.476 1.00 0.00 H new ATOM 1274 N LYS A 126 12.816 -3.941 1.967 1.00 0.00 N ATOM 1275 CA LYS A 126 12.391 -5.032 2.837 1.00 0.00 C ATOM 1276 C LYS A 126 10.970 -5.493 2.517 1.00 0.00 C ATOM 1277 O LYS A 126 10.548 -6.566 2.942 1.00 0.00 O ATOM 1278 CB LYS A 126 12.498 -4.609 4.308 1.00 0.00 C ATOM 1279 CG LYS A 126 13.915 -4.224 4.714 1.00 0.00 C ATOM 1280 CD LYS A 126 14.068 -4.068 6.220 1.00 0.00 C ATOM 1281 CE LYS A 126 13.213 -2.941 6.769 1.00 0.00 C ATOM 1282 NZ LYS A 126 13.492 -2.689 8.208 1.00 0.00 N1+ ATOM 0 H LYS A 126 12.298 -3.070 2.084 1.00 0.00 H new ATOM 0 HA LYS A 126 13.057 -5.876 2.658 1.00 0.00 H new ATOM 0 HB2 LYS A 126 11.832 -3.765 4.487 1.00 0.00 H new ATOM 0 HB3 LYS A 126 12.154 -5.426 4.942 1.00 0.00 H new ATOM 0 HG2 LYS A 126 14.611 -4.984 4.358 1.00 0.00 H new ATOM 0 HG3 LYS A 126 14.188 -3.289 4.226 1.00 0.00 H new ATOM 0 HD2 LYS A 126 13.793 -5.002 6.710 1.00 0.00 H new ATOM 0 HD3 LYS A 126 15.114 -3.878 6.460 1.00 0.00 H new ATOM 0 HE2 LYS A 126 13.399 -2.032 6.198 1.00 0.00 H new ATOM 0 HE3 LYS A 126 12.159 -3.188 6.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 12.952 -1.859 8.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 13.211 -3.520 8.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 14.508 -2.512 8.339 1.00 0.00 H new ATOM 1296 N CYS A 127 10.239 -4.694 1.760 1.00 0.00 N ATOM 1297 CA CYS A 127 8.924 -5.098 1.298 1.00 0.00 C ATOM 1298 C CYS A 127 8.961 -5.394 -0.198 1.00 0.00 C ATOM 1299 O CYS A 127 9.241 -4.508 -1.006 1.00 0.00 O ATOM 1300 CB CYS A 127 7.883 -4.016 1.602 1.00 0.00 C ATOM 1301 SG CYS A 127 6.200 -4.442 1.055 1.00 0.00 S ATOM 0 H CYS A 127 10.532 -3.766 1.454 1.00 0.00 H new ATOM 0 HA CYS A 127 8.636 -6.005 1.830 1.00 0.00 H new ATOM 0 HB2 CYS A 127 7.870 -3.829 2.676 1.00 0.00 H new ATOM 0 HB3 CYS A 127 8.187 -3.087 1.121 1.00 0.00 H new ATOM 1306 N LYS A 128 8.695 -6.642 -0.564 1.00 0.00 N ATOM 1307 CA LYS A 128 8.658 -7.035 -1.969 1.00 0.00 C ATOM 1308 C LYS A 128 7.214 -7.106 -2.458 1.00 0.00 C ATOM 1309 O LYS A 128 6.946 -7.342 -3.635 1.00 0.00 O ATOM 1310 CB LYS A 128 9.350 -8.388 -2.163 1.00 0.00 C ATOM 1311 CG LYS A 128 8.726 -9.520 -1.352 1.00 0.00 C ATOM 1312 CD LYS A 128 9.463 -10.835 -1.557 1.00 0.00 C ATOM 1313 CE LYS A 128 10.869 -10.788 -0.980 1.00 0.00 C ATOM 1314 NZ LYS A 128 11.585 -12.075 -1.172 1.00 0.00 N1+ ATOM 0 H LYS A 128 8.502 -7.399 0.091 1.00 0.00 H new ATOM 0 HA LYS A 128 9.190 -6.285 -2.554 1.00 0.00 H new ATOM 0 HB2 LYS A 128 9.321 -8.652 -3.220 1.00 0.00 H new ATOM 0 HB3 LYS A 128 10.400 -8.292 -1.887 1.00 0.00 H new ATOM 0 HG2 LYS A 128 8.737 -9.258 -0.294 1.00 0.00 H new ATOM 0 HG3 LYS A 128 7.681 -9.640 -1.639 1.00 0.00 H new ATOM 0 HD2 LYS A 128 8.903 -11.643 -1.086 1.00 0.00 H new ATOM 0 HD3 LYS A 128 9.514 -11.061 -2.622 1.00 0.00 H new ATOM 0 HE2 LYS A 128 11.431 -9.984 -1.456 1.00 0.00 H new ATOM 0 HE3 LYS A 128 10.818 -10.555 0.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 12.540 -12.005 -0.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 11.062 -12.838 -0.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 11.655 -12.285 -2.188 1.00 0.00 H new ATOM 1328 N GLN A 129 6.298 -6.900 -1.529 1.00 0.00 N ATOM 1329 CA GLN A 129 4.871 -6.925 -1.807 1.00 0.00 C ATOM 1330 C GLN A 129 4.401 -5.516 -2.148 1.00 0.00 C ATOM 1331 O GLN A 129 5.154 -4.556 -1.974 1.00 0.00 O ATOM 1332 CB GLN A 129 4.099 -7.462 -0.591 1.00 0.00 C ATOM 1333 CG GLN A 129 4.475 -8.881 -0.175 1.00 0.00 C ATOM 1334 CD GLN A 129 5.631 -8.945 0.816 1.00 0.00 C ATOM 1335 OE1 GLN A 129 6.515 -8.086 0.834 1.00 0.00 O ATOM 1336 NE2 GLN A 129 5.634 -9.972 1.649 1.00 0.00 N ATOM 0 H GLN A 129 6.524 -6.709 -0.553 1.00 0.00 H new ATOM 0 HA GLN A 129 4.681 -7.586 -2.653 1.00 0.00 H new ATOM 0 HB2 GLN A 129 4.267 -6.794 0.253 1.00 0.00 H new ATOM 0 HB3 GLN A 129 3.032 -7.433 -0.813 1.00 0.00 H new ATOM 0 HG2 GLN A 129 3.603 -9.363 0.267 1.00 0.00 H new ATOM 0 HG3 GLN A 129 4.739 -9.453 -1.065 1.00 0.00 H new ATOM 0 HE21 GLN A 129 4.887 -10.665 1.607 1.00 0.00 H new ATOM 0 HE22 GLN A 129 6.384 -10.071 2.334 1.00 0.00 H new ATOM 1345 N ASN A 130 3.181 -5.378 -2.661 1.00 0.00 N ATOM 1346 CA ASN A 130 2.663 -4.048 -2.967 1.00 0.00 C ATOM 1347 C ASN A 130 2.395 -3.291 -1.667 1.00 0.00 C ATOM 1348 O ASN A 130 1.803 -3.830 -0.730 1.00 0.00 O ATOM 1349 CB ASN A 130 1.405 -4.086 -3.861 1.00 0.00 C ATOM 1350 CG ASN A 130 0.190 -4.730 -3.212 1.00 0.00 C ATOM 1351 OD1 ASN A 130 -0.556 -4.080 -2.486 1.00 0.00 O ATOM 1352 ND2 ASN A 130 -0.048 -5.999 -3.510 1.00 0.00 N ATOM 0 H ASN A 130 2.547 -6.149 -2.869 1.00 0.00 H new ATOM 0 HA ASN A 130 3.424 -3.521 -3.543 1.00 0.00 H new ATOM 0 HB2 ASN A 130 1.149 -3.067 -4.150 1.00 0.00 H new ATOM 0 HB3 ASN A 130 1.642 -4.627 -4.777 1.00 0.00 H new ATOM 0 HD21 ASN A 130 -0.873 -6.465 -3.132 1.00 0.00 H new ATOM 0 HD22 ASN A 130 0.594 -6.509 -4.117 1.00 0.00 H new ATOM 1359 N ILE A 131 2.876 -2.057 -1.608 1.00 0.00 N ATOM 1360 CA ILE A 131 2.798 -1.255 -0.394 1.00 0.00 C ATOM 1361 C ILE A 131 1.551 -0.377 -0.411 1.00 0.00 C ATOM 1362 O ILE A 131 1.324 0.377 -1.366 1.00 0.00 O ATOM 1363 CB ILE A 131 4.049 -0.360 -0.247 1.00 0.00 C ATOM 1364 CG1 ILE A 131 5.327 -1.179 -0.462 1.00 0.00 C ATOM 1365 CG2 ILE A 131 4.070 0.295 1.126 1.00 0.00 C ATOM 1366 CD1 ILE A 131 6.594 -0.351 -0.425 1.00 0.00 C ATOM 0 H ILE A 131 3.327 -1.587 -2.392 1.00 0.00 H new ATOM 0 HA ILE A 131 2.747 -1.939 0.453 1.00 0.00 H new ATOM 0 HB ILE A 131 4.006 0.419 -1.008 1.00 0.00 H new ATOM 0 HG12 ILE A 131 5.386 -1.952 0.305 1.00 0.00 H new ATOM 0 HG13 ILE A 131 5.264 -1.688 -1.424 1.00 0.00 H new ATOM 0 HG21 ILE A 131 4.957 0.923 1.216 1.00 0.00 H new ATOM 0 HG22 ILE A 131 3.177 0.908 1.250 1.00 0.00 H new ATOM 0 HG23 ILE A 131 4.091 -0.476 1.897 1.00 0.00 H new ATOM 0 HD11 ILE A 131 7.456 -0.998 -0.584 1.00 0.00 H new ATOM 0 HD12 ILE A 131 6.558 0.405 -1.209 1.00 0.00 H new ATOM 0 HD13 ILE A 131 6.681 0.137 0.546 1.00 0.00 H new ATOM 1378 N ALA A 132 0.753 -0.459 0.641 1.00 0.00 N ATOM 1379 CA ALA A 132 -0.497 0.272 0.699 1.00 0.00 C ATOM 1380 C ALA A 132 -0.694 0.945 2.056 1.00 0.00 C ATOM 1381 O ALA A 132 -0.085 0.561 3.056 1.00 0.00 O ATOM 1382 CB ALA A 132 -1.654 -0.664 0.390 1.00 0.00 C ATOM 0 H ALA A 132 0.951 -1.026 1.466 1.00 0.00 H new ATOM 0 HA ALA A 132 -0.465 1.062 -0.051 1.00 0.00 H new ATOM 0 HB1 ALA A 132 -2.592 -0.110 0.435 1.00 0.00 H new ATOM 0 HB2 ALA A 132 -1.527 -1.082 -0.608 1.00 0.00 H new ATOM 0 HB3 ALA A 132 -1.674 -1.472 1.122 1.00 0.00 H new ATOM 1388 N CYS A 133 -1.538 1.962 2.063 1.00 0.00 N ATOM 1389 CA CYS A 133 -1.877 2.696 3.267 1.00 0.00 C ATOM 1390 C CYS A 133 -3.319 2.379 3.641 1.00 0.00 C ATOM 1391 O CYS A 133 -4.242 2.712 2.892 1.00 0.00 O ATOM 1392 CB CYS A 133 -1.711 4.196 3.011 1.00 0.00 C ATOM 1393 SG CYS A 133 -1.874 5.234 4.491 1.00 0.00 S ATOM 0 H CYS A 133 -2.010 2.303 1.226 1.00 0.00 H new ATOM 0 HA CYS A 133 -1.218 2.407 4.086 1.00 0.00 H new ATOM 0 HB2 CYS A 133 -0.731 4.370 2.567 1.00 0.00 H new ATOM 0 HB3 CYS A 133 -2.454 4.511 2.278 1.00 0.00 H new ATOM 1398 N CYS A 134 -3.528 1.734 4.782 1.00 0.00 N ATOM 1399 CA CYS A 134 -4.850 1.208 5.099 1.00 0.00 C ATOM 1400 C CYS A 134 -5.477 1.984 6.245 1.00 0.00 C ATOM 1401 O CYS A 134 -4.806 2.317 7.220 1.00 0.00 O ATOM 1402 CB CYS A 134 -4.762 -0.274 5.489 1.00 0.00 C ATOM 1403 SG CYS A 134 -3.903 -1.350 4.289 1.00 0.00 S ATOM 0 H CYS A 134 -2.815 1.565 5.491 1.00 0.00 H new ATOM 0 HA CYS A 134 -5.471 1.314 4.209 1.00 0.00 H new ATOM 0 HB2 CYS A 134 -4.252 -0.350 6.449 1.00 0.00 H new ATOM 0 HB3 CYS A 134 -5.773 -0.655 5.634 1.00 0.00 H new ATOM 1408 N GLN A 135 -6.775 2.246 6.123 1.00 0.00 N ATOM 1409 CA GLN A 135 -7.515 2.986 7.136 1.00 0.00 C ATOM 1410 C GLN A 135 -7.689 2.122 8.374 1.00 0.00 C ATOM 1411 O GLN A 135 -7.950 0.920 8.267 1.00 0.00 O ATOM 1412 CB GLN A 135 -8.888 3.413 6.585 1.00 0.00 C ATOM 1413 CG GLN A 135 -9.739 4.204 7.570 1.00 0.00 C ATOM 1414 CD GLN A 135 -9.130 5.540 7.960 1.00 0.00 C ATOM 1415 OE1 GLN A 135 -9.303 6.006 9.084 1.00 0.00 O ATOM 1416 NE2 GLN A 135 -8.432 6.178 7.032 1.00 0.00 N ATOM 0 H GLN A 135 -7.339 1.953 5.325 1.00 0.00 H new ATOM 0 HA GLN A 135 -6.956 3.883 7.404 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -8.736 4.015 5.689 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -9.438 2.522 6.281 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -10.722 4.376 7.132 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -9.890 3.606 8.469 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -8.309 5.761 6.109 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -8.018 7.087 7.240 1.00 0.00 H new ATOM 1425 N ASN A 136 -7.540 2.733 9.543 1.00 0.00 N ATOM 1426 CA ASN A 136 -7.643 2.010 10.805 1.00 0.00 C ATOM 1427 C ASN A 136 -9.106 1.757 11.160 1.00 0.00 C ATOM 1428 O ASN A 136 -9.631 2.286 12.143 1.00 0.00 O ATOM 1429 CB ASN A 136 -6.937 2.778 11.930 1.00 0.00 C ATOM 1430 CG ASN A 136 -6.944 2.023 13.252 1.00 0.00 C ATOM 1431 OD1 ASN A 136 -6.977 0.793 13.281 1.00 0.00 O ATOM 1432 ND2 ASN A 136 -6.910 2.753 14.357 1.00 0.00 N ATOM 0 H ASN A 136 -7.347 3.730 9.644 1.00 0.00 H new ATOM 0 HA ASN A 136 -7.147 1.046 10.689 1.00 0.00 H new ATOM 0 HB2 ASN A 136 -5.907 2.978 11.636 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -7.423 3.744 12.066 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -6.911 2.297 15.270 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -6.883 3.771 14.295 1.00 0.00 H new ATOM 1439 N SER A 137 -9.764 0.978 10.325 1.00 0.00 N ATOM 1440 CA SER A 137 -11.115 0.520 10.593 1.00 0.00 C ATOM 1441 C SER A 137 -11.080 -0.952 11.005 1.00 0.00 C ATOM 1442 O SER A 137 -11.109 -1.839 10.150 1.00 0.00 O ATOM 1443 CB SER A 137 -11.986 0.700 9.348 1.00 0.00 C ATOM 1444 OG SER A 137 -11.906 2.028 8.857 1.00 0.00 O ATOM 0 H SER A 137 -9.379 0.644 9.442 1.00 0.00 H new ATOM 0 HA SER A 137 -11.543 1.109 11.404 1.00 0.00 H new ATOM 0 HB2 SER A 137 -11.667 0.003 8.573 1.00 0.00 H new ATOM 0 HB3 SER A 137 -13.022 0.459 9.587 1.00 0.00 H new ATOM 0 HG SER A 137 -12.470 2.117 8.060 1.00 0.00 H new ATOM 1450 N PRO A 138 -11.010 -1.238 12.318 1.00 0.00 N ATOM 1451 CA PRO A 138 -10.852 -2.608 12.820 1.00 0.00 C ATOM 1452 C PRO A 138 -12.152 -3.405 12.787 1.00 0.00 C ATOM 1453 O PRO A 138 -12.553 -4.018 13.780 1.00 0.00 O ATOM 1454 CB PRO A 138 -10.382 -2.393 14.259 1.00 0.00 C ATOM 1455 CG PRO A 138 -10.995 -1.098 14.667 1.00 0.00 C ATOM 1456 CD PRO A 138 -11.091 -0.256 13.420 1.00 0.00 C ATOM 0 HA PRO A 138 -10.162 -3.191 12.210 1.00 0.00 H new ATOM 0 HB2 PRO A 138 -10.707 -3.207 14.907 1.00 0.00 H new ATOM 0 HB3 PRO A 138 -9.294 -2.353 14.319 1.00 0.00 H new ATOM 0 HG2 PRO A 138 -11.981 -1.257 15.104 1.00 0.00 H new ATOM 0 HG3 PRO A 138 -10.387 -0.602 15.423 1.00 0.00 H new ATOM 0 HD2 PRO A 138 -12.026 0.304 13.388 1.00 0.00 H new ATOM 0 HD3 PRO A 138 -10.281 0.472 13.366 1.00 0.00 H new ATOM 1464 N SER A 139 -12.797 -3.395 11.636 1.00 0.00 N ATOM 1465 CA SER A 139 -14.036 -4.118 11.434 1.00 0.00 C ATOM 1466 C SER A 139 -14.343 -4.190 9.946 1.00 0.00 C ATOM 1467 O SER A 139 -14.188 -3.202 9.223 1.00 0.00 O ATOM 1468 CB SER A 139 -15.185 -3.425 12.171 1.00 0.00 C ATOM 1469 OG SER A 139 -16.392 -4.157 12.049 1.00 0.00 O ATOM 0 H SER A 139 -12.475 -2.884 10.814 1.00 0.00 H new ATOM 0 HA SER A 139 -13.928 -5.127 11.833 1.00 0.00 H new ATOM 0 HB2 SER A 139 -14.929 -3.314 13.225 1.00 0.00 H new ATOM 0 HB3 SER A 139 -15.324 -2.421 11.770 1.00 0.00 H new ATOM 0 HG SER A 139 -17.107 -3.691 12.531 1.00 0.00 H new ATOM 1475 N ASP A 140 -14.765 -5.362 9.489 1.00 0.00 N ATOM 1476 CA ASP A 140 -15.105 -5.558 8.086 1.00 0.00 C ATOM 1477 C ASP A 140 -16.478 -4.971 7.788 1.00 0.00 C ATOM 1478 O ASP A 140 -16.866 -4.806 6.631 1.00 0.00 O ATOM 1479 CB ASP A 140 -15.069 -7.045 7.713 1.00 0.00 C ATOM 1480 CG ASP A 140 -16.082 -7.873 8.474 1.00 0.00 C ATOM 1481 OD1 ASP A 140 -17.126 -8.233 7.886 1.00 0.00 O ATOM 1482 OD2 ASP A 140 -15.840 -8.176 9.665 1.00 0.00 O1- ATOM 0 H ASP A 140 -14.880 -6.192 10.070 1.00 0.00 H new ATOM 0 HA ASP A 140 -14.361 -5.039 7.481 1.00 0.00 H new ATOM 0 HB2 ASP A 140 -15.253 -7.150 6.644 1.00 0.00 H new ATOM 0 HB3 ASP A 140 -14.070 -7.437 7.905 1.00 0.00 H new ATOM 1487 N ALA A 141 -17.203 -4.641 8.844 1.00 0.00 N ATOM 1488 CA ALA A 141 -18.485 -3.978 8.712 1.00 0.00 C ATOM 1489 C ALA A 141 -18.296 -2.467 8.783 1.00 0.00 C ATOM 1490 O ALA A 141 -18.909 -1.782 9.605 1.00 0.00 O ATOM 1491 CB ALA A 141 -19.443 -4.456 9.789 1.00 0.00 C ATOM 0 H ALA A 141 -16.921 -4.824 9.807 1.00 0.00 H new ATOM 0 HA ALA A 141 -18.917 -4.229 7.743 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -20.401 -3.948 9.675 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -19.589 -5.532 9.694 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -19.028 -4.231 10.771 1.00 0.00 H new ATOM 1497 N SER A 142 -17.422 -1.958 7.930 1.00 0.00 N ATOM 1498 CA SER A 142 -17.142 -0.534 7.872 1.00 0.00 C ATOM 1499 C SER A 142 -17.097 -0.070 6.416 1.00 0.00 C ATOM 1500 O SER A 142 -16.335 0.827 6.051 1.00 0.00 O ATOM 1501 CB SER A 142 -15.814 -0.234 8.582 1.00 0.00 C ATOM 1502 OG SER A 142 -15.551 1.161 8.632 1.00 0.00 O ATOM 0 H SER A 142 -16.890 -2.517 7.263 1.00 0.00 H new ATOM 0 HA SER A 142 -17.936 0.011 8.382 1.00 0.00 H new ATOM 0 HB2 SER A 142 -15.843 -0.636 9.595 1.00 0.00 H new ATOM 0 HB3 SER A 142 -15.000 -0.740 8.062 1.00 0.00 H new ATOM 0 HG SER A 142 -15.725 1.558 7.753 1.00 0.00 H new ATOM 1508 N GLY A 143 -17.925 -0.688 5.586 1.00 0.00 N ATOM 1509 CA GLY A 143 -17.964 -0.340 4.182 1.00 0.00 C ATOM 1510 C GLY A 143 -18.944 -1.194 3.408 1.00 0.00 C ATOM 1511 O GLY A 143 -18.596 -1.757 2.371 1.00 0.00 O ATOM 0 H GLY A 143 -18.572 -1.427 5.862 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -18.238 0.710 4.077 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -16.968 -0.454 3.754 1.00 0.00 H new ATOM 1515 N SER A 144 -20.165 -1.290 3.926 1.00 0.00 N ATOM 1516 CA SER A 144 -21.217 -2.098 3.309 1.00 0.00 C ATOM 1517 C SER A 144 -20.844 -3.583 3.355 1.00 0.00 C ATOM 1518 O SER A 144 -21.014 -4.311 2.375 1.00 0.00 O ATOM 1519 CB SER A 144 -21.471 -1.637 1.866 1.00 0.00 C ATOM 1520 OG SER A 144 -22.547 -2.340 1.268 1.00 0.00 O ATOM 0 H SER A 144 -20.454 -0.814 4.780 1.00 0.00 H new ATOM 0 HA SER A 144 -22.140 -1.963 3.873 1.00 0.00 H new ATOM 0 HB2 SER A 144 -21.687 -0.569 1.859 1.00 0.00 H new ATOM 0 HB3 SER A 144 -20.568 -1.784 1.274 1.00 0.00 H new ATOM 0 HG SER A 144 -22.385 -3.304 1.335 1.00 0.00 H new ATOM 1526 N LEU A 145 -20.335 -4.015 4.512 1.00 0.00 N ATOM 1527 CA LEU A 145 -19.957 -5.413 4.742 1.00 0.00 C ATOM 1528 C LEU A 145 -18.900 -5.873 3.742 1.00 0.00 C ATOM 1529 O LEU A 145 -19.216 -6.453 2.701 1.00 0.00 O ATOM 1530 CB LEU A 145 -21.191 -6.312 4.671 1.00 0.00 C ATOM 1531 CG LEU A 145 -22.217 -6.087 5.783 1.00 0.00 C ATOM 1532 CD1 LEU A 145 -23.491 -6.864 5.496 1.00 0.00 C ATOM 1533 CD2 LEU A 145 -21.642 -6.495 7.132 1.00 0.00 C ATOM 0 H LEU A 145 -20.173 -3.407 5.315 1.00 0.00 H new ATOM 0 HA LEU A 145 -19.524 -5.487 5.740 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -21.680 -6.158 3.709 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -20.867 -7.352 4.701 1.00 0.00 H new ATOM 0 HG LEU A 145 -22.458 -5.025 5.817 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -24.210 -6.693 6.297 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -23.916 -6.530 4.549 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -23.262 -7.928 5.435 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -22.386 -6.328 7.910 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -21.373 -7.551 7.108 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -20.755 -5.899 7.345 1.00 0.00 H new ATOM 1545 N ILE A 146 -17.644 -5.619 4.072 1.00 0.00 N ATOM 1546 CA ILE A 146 -16.540 -5.960 3.190 1.00 0.00 C ATOM 1547 C ILE A 146 -15.548 -6.888 3.878 1.00 0.00 C ATOM 1548 O ILE A 146 -14.375 -6.560 4.044 1.00 0.00 O ATOM 1549 CB ILE A 146 -15.801 -4.707 2.668 1.00 0.00 C ATOM 1550 CG1 ILE A 146 -15.503 -3.729 3.813 1.00 0.00 C ATOM 1551 CG2 ILE A 146 -16.615 -4.031 1.574 1.00 0.00 C ATOM 1552 CD1 ILE A 146 -14.679 -2.529 3.395 1.00 0.00 C ATOM 0 H ILE A 146 -17.363 -5.176 4.947 1.00 0.00 H new ATOM 0 HA ILE A 146 -16.978 -6.476 2.336 1.00 0.00 H new ATOM 0 HB ILE A 146 -14.848 -5.022 2.243 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -16.446 -3.381 4.235 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -14.976 -4.261 4.605 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -16.082 -3.150 1.216 1.00 0.00 H new ATOM 0 HG22 ILE A 146 -16.763 -4.727 0.748 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -17.584 -3.732 1.974 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -14.510 -1.885 4.258 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -13.720 -2.866 3.000 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -15.213 -1.972 2.625 1.00 0.00 H new ATOM 1564 N GLY A 147 -16.024 -8.066 4.261 1.00 0.00 N ATOM 1565 CA GLY A 147 -15.149 -9.070 4.847 1.00 0.00 C ATOM 1566 C GLY A 147 -14.344 -9.797 3.792 1.00 0.00 C ATOM 1567 O GLY A 147 -13.750 -10.843 4.047 1.00 0.00 O ATOM 0 H GLY A 147 -17.001 -8.347 4.177 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -14.472 -8.593 5.556 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -15.745 -9.789 5.409 1.00 0.00 H new ATOM 1571 N LEU A 148 -14.323 -9.225 2.600 1.00 0.00 N ATOM 1572 CA LEU A 148 -13.628 -9.810 1.468 1.00 0.00 C ATOM 1573 C LEU A 148 -12.178 -9.352 1.450 1.00 0.00 C ATOM 1574 O LEU A 148 -11.361 -9.864 0.694 1.00 0.00 O ATOM 1575 CB LEU A 148 -14.323 -9.394 0.175 1.00 0.00 C ATOM 1576 CG LEU A 148 -15.835 -9.630 0.152 1.00 0.00 C ATOM 1577 CD1 LEU A 148 -16.447 -9.020 -1.094 1.00 0.00 C ATOM 1578 CD2 LEU A 148 -16.149 -11.118 0.230 1.00 0.00 C ATOM 0 H LEU A 148 -14.788 -8.342 2.391 1.00 0.00 H new ATOM 0 HA LEU A 148 -13.649 -10.896 1.556 1.00 0.00 H new ATOM 0 HB2 LEU A 148 -14.133 -8.335 0.002 1.00 0.00 H new ATOM 0 HB3 LEU A 148 -13.872 -9.939 -0.654 1.00 0.00 H new ATOM 0 HG LEU A 148 -16.272 -9.144 1.025 1.00 0.00 H new ATOM 0 HD11 LEU A 148 -17.523 -9.197 -1.095 1.00 0.00 H new ATOM 0 HD12 LEU A 148 -16.256 -7.947 -1.106 1.00 0.00 H new ATOM 0 HD13 LEU A 148 -16.003 -9.477 -1.978 1.00 0.00 H new ATOM 0 HD21 LEU A 148 -17.229 -11.263 0.212 1.00 0.00 H new ATOM 0 HD22 LEU A 148 -15.700 -11.630 -0.621 1.00 0.00 H new ATOM 0 HD23 LEU A 148 -15.743 -11.528 1.155 1.00 0.00 H new ATOM 1590 N GLY A 149 -11.880 -8.377 2.295 1.00 0.00 N ATOM 1591 CA GLY A 149 -10.547 -7.828 2.380 1.00 0.00 C ATOM 1592 C GLY A 149 -10.548 -6.524 3.139 1.00 0.00 C ATOM 1593 O GLY A 149 -11.613 -6.005 3.474 1.00 0.00 O ATOM 0 H GLY A 149 -12.552 -7.951 2.933 1.00 0.00 H new ATOM 0 HA2 GLY A 149 -9.887 -8.541 2.875 1.00 0.00 H new ATOM 0 HA3 GLY A 149 -10.150 -7.669 1.377 1.00 0.00 H new ATOM 1597 N LEU A 150 -9.375 -5.986 3.407 1.00 0.00 N ATOM 1598 CA LEU A 150 -9.278 -4.745 4.163 1.00 0.00 C ATOM 1599 C LEU A 150 -9.182 -3.553 3.222 1.00 0.00 C ATOM 1600 O LEU A 150 -8.440 -3.588 2.239 1.00 0.00 O ATOM 1601 CB LEU A 150 -8.085 -4.761 5.136 1.00 0.00 C ATOM 1602 CG LEU A 150 -6.710 -5.093 4.535 1.00 0.00 C ATOM 1603 CD1 LEU A 150 -5.606 -4.431 5.347 1.00 0.00 C ATOM 1604 CD2 LEU A 150 -6.489 -6.600 4.512 1.00 0.00 C ATOM 0 H LEU A 150 -8.481 -6.381 3.117 1.00 0.00 H new ATOM 0 HA LEU A 150 -10.186 -4.652 4.758 1.00 0.00 H new ATOM 0 HB2 LEU A 150 -8.021 -3.783 5.612 1.00 0.00 H new ATOM 0 HB3 LEU A 150 -8.297 -5.485 5.922 1.00 0.00 H new ATOM 0 HG LEU A 150 -6.683 -4.713 3.514 1.00 0.00 H new ATOM 0 HD11 LEU A 150 -4.637 -4.674 4.910 1.00 0.00 H new ATOM 0 HD12 LEU A 150 -5.746 -3.350 5.339 1.00 0.00 H new ATOM 0 HD13 LEU A 150 -5.642 -4.794 6.374 1.00 0.00 H new ATOM 0 HD21 LEU A 150 -5.511 -6.818 4.083 1.00 0.00 H new ATOM 0 HD22 LEU A 150 -6.535 -6.990 5.529 1.00 0.00 H new ATOM 0 HD23 LEU A 150 -7.263 -7.072 3.907 1.00 0.00 H new ATOM 1616 N PRO A 151 -9.961 -2.489 3.497 1.00 0.00 N ATOM 1617 CA PRO A 151 -9.938 -1.269 2.695 1.00 0.00 C ATOM 1618 C PRO A 151 -8.596 -0.564 2.806 1.00 0.00 C ATOM 1619 O PRO A 151 -8.139 -0.229 3.907 1.00 0.00 O ATOM 1620 CB PRO A 151 -11.054 -0.406 3.299 1.00 0.00 C ATOM 1621 CG PRO A 151 -11.247 -0.934 4.678 1.00 0.00 C ATOM 1622 CD PRO A 151 -10.922 -2.401 4.611 1.00 0.00 C ATOM 0 HA PRO A 151 -10.084 -1.468 1.633 1.00 0.00 H new ATOM 0 HB2 PRO A 151 -10.773 0.647 3.315 1.00 0.00 H new ATOM 0 HB3 PRO A 151 -11.971 -0.482 2.715 1.00 0.00 H new ATOM 0 HG2 PRO A 151 -10.595 -0.422 5.386 1.00 0.00 H new ATOM 0 HG3 PRO A 151 -12.271 -0.777 5.016 1.00 0.00 H new ATOM 0 HD2 PRO A 151 -10.488 -2.759 5.545 1.00 0.00 H new ATOM 0 HD3 PRO A 151 -11.812 -3.001 4.422 1.00 0.00 H new ATOM 1630 N CYS A 152 -7.968 -0.337 1.669 1.00 0.00 N ATOM 1631 CA CYS A 152 -6.637 0.222 1.645 1.00 0.00 C ATOM 1632 C CYS A 152 -6.411 0.964 0.334 1.00 0.00 C ATOM 1633 O CYS A 152 -7.171 0.788 -0.623 1.00 0.00 O ATOM 1634 CB CYS A 152 -5.609 -0.901 1.805 1.00 0.00 C ATOM 1635 SG CYS A 152 -4.025 -0.369 2.516 1.00 0.00 S ATOM 0 H CYS A 152 -8.362 -0.533 0.749 1.00 0.00 H new ATOM 0 HA CYS A 152 -6.523 0.927 2.468 1.00 0.00 H new ATOM 0 HB2 CYS A 152 -6.035 -1.680 2.438 1.00 0.00 H new ATOM 0 HB3 CYS A 152 -5.423 -1.349 0.829 1.00 0.00 H new ATOM 1640 N ILE A 153 -5.383 1.797 0.298 1.00 0.00 N ATOM 1641 CA ILE A 153 -5.022 2.509 -0.916 1.00 0.00 C ATOM 1642 C ILE A 153 -3.522 2.389 -1.162 1.00 0.00 C ATOM 1643 O ILE A 153 -2.719 2.541 -0.240 1.00 0.00 O ATOM 1644 CB ILE A 153 -5.437 4.000 -0.842 1.00 0.00 C ATOM 1645 CG1 ILE A 153 -5.231 4.683 -2.196 1.00 0.00 C ATOM 1646 CG2 ILE A 153 -4.666 4.734 0.249 1.00 0.00 C ATOM 1647 CD1 ILE A 153 -5.783 6.091 -2.256 1.00 0.00 C ATOM 0 H ILE A 153 -4.783 1.997 1.098 1.00 0.00 H new ATOM 0 HA ILE A 153 -5.561 2.055 -1.748 1.00 0.00 H new ATOM 0 HB ILE A 153 -6.497 4.040 -0.589 1.00 0.00 H new ATOM 0 HG12 ILE A 153 -4.165 4.710 -2.421 1.00 0.00 H new ATOM 0 HG13 ILE A 153 -5.706 4.083 -2.972 1.00 0.00 H new ATOM 0 HG21 ILE A 153 -4.979 5.778 0.276 1.00 0.00 H new ATOM 0 HG22 ILE A 153 -4.869 4.269 1.214 1.00 0.00 H new ATOM 0 HG23 ILE A 153 -3.598 4.681 0.038 1.00 0.00 H new ATOM 0 HD11 ILE A 153 -5.601 6.511 -3.245 1.00 0.00 H new ATOM 0 HD12 ILE A 153 -6.856 6.070 -2.063 1.00 0.00 H new ATOM 0 HD13 ILE A 153 -5.291 6.707 -1.503 1.00 0.00 H new ATOM 1659 N ALA A 154 -3.151 2.068 -2.396 1.00 0.00 N ATOM 1660 CA ALA A 154 -1.748 1.959 -2.777 1.00 0.00 C ATOM 1661 C ALA A 154 -0.994 3.234 -2.413 1.00 0.00 C ATOM 1662 O ALA A 154 -1.430 4.339 -2.743 1.00 0.00 O ATOM 1663 CB ALA A 154 -1.635 1.683 -4.268 1.00 0.00 C ATOM 0 H ALA A 154 -3.807 1.878 -3.154 1.00 0.00 H new ATOM 0 HA ALA A 154 -1.300 1.129 -2.230 1.00 0.00 H new ATOM 0 HB1 ALA A 154 -0.584 1.603 -4.545 1.00 0.00 H new ATOM 0 HB2 ALA A 154 -2.145 0.749 -4.505 1.00 0.00 H new ATOM 0 HB3 ALA A 154 -2.096 2.499 -4.825 1.00 0.00 H new ATOM 1669 N LEU A 155 0.139 3.074 -1.735 1.00 0.00 N ATOM 1670 CA LEU A 155 0.877 4.213 -1.192 1.00 0.00 C ATOM 1671 C LEU A 155 1.406 5.116 -2.308 1.00 0.00 C ATOM 1672 O LEU A 155 1.630 6.308 -2.097 1.00 0.00 O ATOM 1673 CB LEU A 155 2.030 3.741 -0.298 1.00 0.00 C ATOM 1674 CG LEU A 155 2.826 4.861 0.382 1.00 0.00 C ATOM 1675 CD1 LEU A 155 1.977 5.577 1.422 1.00 0.00 C ATOM 1676 CD2 LEU A 155 4.093 4.309 1.013 1.00 0.00 C ATOM 0 H LEU A 155 0.567 2.167 -1.548 1.00 0.00 H new ATOM 0 HA LEU A 155 0.183 4.795 -0.586 1.00 0.00 H new ATOM 0 HB2 LEU A 155 1.626 3.084 0.472 1.00 0.00 H new ATOM 0 HB3 LEU A 155 2.715 3.144 -0.900 1.00 0.00 H new ATOM 0 HG LEU A 155 3.109 5.586 -0.381 1.00 0.00 H new ATOM 0 HD11 LEU A 155 2.564 6.367 1.890 1.00 0.00 H new ATOM 0 HD12 LEU A 155 1.102 6.013 0.940 1.00 0.00 H new ATOM 0 HD13 LEU A 155 1.656 4.865 2.182 1.00 0.00 H new ATOM 0 HD21 LEU A 155 4.644 5.119 1.491 1.00 0.00 H new ATOM 0 HD22 LEU A 155 3.831 3.559 1.759 1.00 0.00 H new ATOM 0 HD23 LEU A 155 4.714 3.852 0.242 1.00 0.00 H new ATOM 1688 N GLY A 156 1.591 4.548 -3.498 1.00 0.00 N ATOM 1689 CA GLY A 156 2.043 5.330 -4.631 1.00 0.00 C ATOM 1690 C GLY A 156 0.960 6.249 -5.176 1.00 0.00 C ATOM 1691 O GLY A 156 1.251 7.165 -5.943 1.00 0.00 O ATOM 0 H GLY A 156 1.435 3.559 -3.695 1.00 0.00 H new ATOM 0 HA2 GLY A 156 2.906 5.927 -4.335 1.00 0.00 H new ATOM 0 HA3 GLY A 156 2.376 4.658 -5.422 1.00 0.00 H new ATOM 1695 N SER A 157 -0.290 6.006 -4.790 1.00 0.00 N ATOM 1696 CA SER A 157 -1.401 6.822 -5.264 1.00 0.00 C ATOM 1697 C SER A 157 -1.507 8.129 -4.475 1.00 0.00 C ATOM 1698 O SER A 157 -1.952 9.147 -5.008 1.00 0.00 O ATOM 1699 CB SER A 157 -2.715 6.040 -5.152 1.00 0.00 C ATOM 1700 OG SER A 157 -2.606 4.775 -5.785 1.00 0.00 O ATOM 0 H SER A 157 -0.557 5.255 -4.154 1.00 0.00 H new ATOM 0 HA SER A 157 -1.213 7.069 -6.309 1.00 0.00 H new ATOM 0 HB2 SER A 157 -2.974 5.905 -4.102 1.00 0.00 H new ATOM 0 HB3 SER A 157 -3.523 6.611 -5.609 1.00 0.00 H new ATOM 0 HG SER A 157 -2.114 4.872 -6.627 1.00 0.00 H new ATOM 1706 N ILE A 158 -1.090 8.108 -3.213 1.00 0.00 N ATOM 1707 CA ILE A 158 -1.181 9.304 -2.377 1.00 0.00 C ATOM 1708 C ILE A 158 0.161 10.024 -2.270 1.00 0.00 C ATOM 1709 O ILE A 158 0.215 11.148 -1.775 1.00 0.00 O ATOM 1710 CB ILE A 158 -1.723 8.997 -0.958 1.00 0.00 C ATOM 1711 CG1 ILE A 158 -0.821 8.002 -0.211 1.00 0.00 C ATOM 1712 CG2 ILE A 158 -3.147 8.464 -1.047 1.00 0.00 C ATOM 1713 CD1 ILE A 158 -1.305 7.674 1.187 1.00 0.00 C ATOM 0 H ILE A 158 -0.692 7.291 -2.751 1.00 0.00 H new ATOM 0 HA ILE A 158 -1.894 9.960 -2.876 1.00 0.00 H new ATOM 0 HB ILE A 158 -1.725 9.927 -0.390 1.00 0.00 H new ATOM 0 HG12 ILE A 158 -0.755 7.080 -0.789 1.00 0.00 H new ATOM 0 HG13 ILE A 158 0.187 8.413 -0.150 1.00 0.00 H new ATOM 0 HG21 ILE A 158 -3.519 8.251 -0.045 1.00 0.00 H new ATOM 0 HG22 ILE A 158 -3.786 9.210 -1.521 1.00 0.00 H new ATOM 0 HG23 ILE A 158 -3.157 7.549 -1.639 1.00 0.00 H new ATOM 0 HD11 ILE A 158 -0.619 6.966 1.653 1.00 0.00 H new ATOM 0 HD12 ILE A 158 -1.344 8.587 1.782 1.00 0.00 H new ATOM 0 HD13 ILE A 158 -2.300 7.233 1.133 1.00 0.00 H new ATOM 1725 N LEU A 159 1.223 9.374 -2.762 1.00 0.00 N ATOM 1726 CA LEU A 159 2.579 9.941 -2.780 1.00 0.00 C ATOM 1727 C LEU A 159 2.927 10.661 -1.475 1.00 0.00 C ATOM 1728 O LEU A 159 2.960 11.910 -1.464 1.00 0.00 O ATOM 1729 CB LEU A 159 2.731 10.889 -3.973 1.00 0.00 C ATOM 1730 CG LEU A 159 2.726 10.215 -5.350 1.00 0.00 C ATOM 1731 CD1 LEU A 159 2.549 11.248 -6.448 1.00 0.00 C ATOM 1732 CD2 LEU A 159 4.016 9.434 -5.570 1.00 0.00 C ATOM 1733 OXT LEU A 159 3.162 9.970 -0.465 1.00 0.00 O1- ATOM 0 H LEU A 159 1.167 8.437 -3.160 1.00 0.00 H new ATOM 0 HA LEU A 159 3.280 9.113 -2.881 1.00 0.00 H new ATOM 0 HB2 LEU A 159 1.922 11.619 -3.941 1.00 0.00 H new ATOM 0 HB3 LEU A 159 3.664 11.441 -3.861 1.00 0.00 H new ATOM 0 HG LEU A 159 1.887 9.520 -5.385 1.00 0.00 H new ATOM 0 HD11 LEU A 159 2.548 10.751 -7.418 1.00 0.00 H new ATOM 0 HD12 LEU A 159 1.603 11.771 -6.307 1.00 0.00 H new ATOM 0 HD13 LEU A 159 3.369 11.965 -6.409 1.00 0.00 H new ATOM 0 HD21 LEU A 159 3.993 8.963 -6.553 1.00 0.00 H new ATOM 0 HD22 LEU A 159 4.867 10.113 -5.513 1.00 0.00 H new ATOM 0 HD23 LEU A 159 4.112 8.666 -4.802 1.00 0.00 H new TER 1745 LEU A 159