USER MOD reduce.3.24.130724 H: found=0, std=0, add=1043, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1043 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 102 GLN : amide:sc= -0.247 K(o=-0.5,f=-3.3) USER MOD Set 1.2: A 103 ASN : amide:sc= -0.256 K(o=-0.5,f=-1.7) USER MOD Set 2.1: A 79 TYR OH : rot 50:sc= 0.0571 USER MOD Set 2.2: A 88 SER OG : rot 60:sc= 1.32 USER MOD Set 3.1: A 37 THR OG1 : rot -172:sc= 2.35 USER MOD Set 3.2: A 48 THR OG1 : rot 95:sc= 1.25 USER MOD Set 4.1: A 20 THR OG1 : rot -71:sc= 0.423 USER MOD Set 4.2: A 39 THR OG1 : rot 180:sc= 0.391 USER MOD Single : A 1 MET CE :methyl 162:sc= -0.0694 (180deg=-0.466) USER MOD Single : A 1 MET N :NH3+ -126:sc= 0.0944 (180deg=-0.216) USER MOD Single : A 3 MET CE :methyl 153:sc= -0.229 (180deg=-1.22) USER MOD Single : A 5 SER OG : rot -43:sc= 0.0334 USER MOD Single : A 7 CYS SG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0 K(o=0,f=-0.72) USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 10 GLN : amide:sc= -0.0259 K(o=-0.026,f=-1.1) USER MOD Single : A 11 LYS NZ :NH3+ -165:sc= -0.0544 (180deg=-0.307) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 TYR OH : rot 180:sc= -0.0398 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ -176:sc= 1.22 (180deg=1.18) USER MOD Single : A 35 SER OG : rot -15:sc= 0.748 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 64 TYR OH : rot 28:sc= 0.571 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 SER OG : rot 120:sc= 0.0732 USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 42:sc= 1.08 USER MOD Single : A 78 GLN : amide:sc= -0.819 X(o=-0.82,f=-0.32) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 161:sc= 1.24 (180deg=1.07) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ -159:sc= 1.21 (180deg=0.876) USER MOD Single : A 95 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 THR OG1 : rot 180:sc= -0.696 USER MOD Single : A 105 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 LYS NZ :NH3+ -173:sc= 0.515 (180deg=0.485) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 MET CE :methyl -152:sc= -1.3 (180deg=-3.25!) USER MOD Single : A 110 THR OG1 : rot 132:sc= 1.3 USER MOD Single : A 114 SER OG : rot 180:sc= 0.0487 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 180:sc= -0.0997 USER MOD Single : A 121 LYS NZ :NH3+ 176:sc= 1.17 (180deg=1.15) USER MOD Single : A 124 LYS NZ :NH3+ -165:sc= -0.0471 (180deg=-0.333) USER MOD Single : A 125 SER OG : rot 180:sc= 0.114 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 130 HIS : no HD1:sc= -0.0195 X(o=-0.02,f=0) USER MOD Single : A 131 HIS : no HE2:sc= 0.783 K(o=0.78,f=-3.5!) USER MOD Single : A 132 HIS : no HD1:sc= 0 X(o=0,f=-0.0085) USER MOD Single : A 133 HIS : no HD1:sc= 0 X(o=0,f=-0.0029) USER MOD Single : A 134 HIS : no HD1:sc= -0.0766 X(o=-0.077,f=0) USER MOD Single : A 135 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 29.238 39.319 -6.286 1.00 0.00 N ATOM 2 CA MET A 1 28.436 39.470 -5.052 1.00 0.00 C ATOM 3 C MET A 1 26.950 39.382 -5.381 1.00 0.00 C ATOM 4 O MET A 1 26.575 39.382 -6.554 1.00 0.00 O ATOM 5 CB MET A 1 28.752 40.804 -4.364 1.00 0.00 C ATOM 6 CG MET A 1 30.195 40.919 -3.891 1.00 0.00 C ATOM 7 SD MET A 1 30.560 42.516 -3.132 1.00 0.00 S ATOM 8 CE MET A 1 29.505 42.450 -1.687 1.00 0.00 C ATOM 0 H1 MET A 1 29.932 38.555 -6.158 1.00 0.00 H new ATOM 0 H2 MET A 1 28.610 39.086 -7.082 1.00 0.00 H new ATOM 0 H3 MET A 1 29.736 40.209 -6.487 1.00 0.00 H new ATOM 0 HA MET A 1 28.694 38.662 -4.367 1.00 0.00 H new ATOM 0 HB2 MET A 1 28.539 41.619 -5.055 1.00 0.00 H new ATOM 0 HB3 MET A 1 28.087 40.929 -3.509 1.00 0.00 H new ATOM 0 HG2 MET A 1 30.401 40.125 -3.173 1.00 0.00 H new ATOM 0 HG3 MET A 1 30.863 40.764 -4.738 1.00 0.00 H new ATOM 0 HE1 MET A 1 29.837 43.191 -0.960 1.00 0.00 H new ATOM 0 HE2 MET A 1 28.476 42.663 -1.978 1.00 0.00 H new ATOM 0 HE3 MET A 1 29.558 41.456 -1.243 1.00 0.00 H new ATOM 20 N ILE A 2 26.127 39.301 -4.338 1.00 0.00 N ATOM 21 CA ILE A 2 24.672 39.206 -4.470 1.00 0.00 C ATOM 22 C ILE A 2 24.254 37.870 -5.079 1.00 0.00 C ATOM 23 O ILE A 2 24.272 37.682 -6.297 1.00 0.00 O ATOM 24 CB ILE A 2 24.069 40.368 -5.302 1.00 0.00 C ATOM 25 CG1 ILE A 2 24.405 41.715 -4.657 1.00 0.00 C ATOM 26 CG2 ILE A 2 22.557 40.205 -5.423 1.00 0.00 C ATOM 27 CD1 ILE A 2 23.891 42.911 -5.434 1.00 0.00 C ATOM 0 H ILE A 2 26.451 39.299 -3.371 1.00 0.00 H new ATOM 0 HA ILE A 2 24.275 39.279 -3.457 1.00 0.00 H new ATOM 0 HB ILE A 2 24.504 40.341 -6.301 1.00 0.00 H new ATOM 0 HG12 ILE A 2 23.986 41.740 -3.651 1.00 0.00 H new ATOM 0 HG13 ILE A 2 25.487 41.798 -4.554 1.00 0.00 H new ATOM 0 HG21 ILE A 2 22.148 41.028 -6.009 1.00 0.00 H new ATOM 0 HG22 ILE A 2 22.331 39.260 -5.917 1.00 0.00 H new ATOM 0 HG23 ILE A 2 22.110 40.211 -4.429 1.00 0.00 H new ATOM 0 HD11 ILE A 2 24.168 43.829 -4.915 1.00 0.00 H new ATOM 0 HD12 ILE A 2 24.329 42.912 -6.432 1.00 0.00 H new ATOM 0 HD13 ILE A 2 22.806 42.853 -5.515 1.00 0.00 H new ATOM 39 N MET A 3 23.901 36.931 -4.216 1.00 0.00 N ATOM 40 CA MET A 3 23.402 35.638 -4.654 1.00 0.00 C ATOM 41 C MET A 3 22.125 35.288 -3.902 1.00 0.00 C ATOM 42 O MET A 3 22.126 35.210 -2.672 1.00 0.00 O ATOM 43 CB MET A 3 24.453 34.543 -4.444 1.00 0.00 C ATOM 44 CG MET A 3 25.739 34.764 -5.225 1.00 0.00 C ATOM 45 SD MET A 3 26.815 33.315 -5.194 1.00 0.00 S ATOM 46 CE MET A 3 25.771 32.116 -6.025 1.00 0.00 C ATOM 0 H MET A 3 23.951 37.041 -3.203 1.00 0.00 H new ATOM 0 HA MET A 3 23.184 35.701 -5.720 1.00 0.00 H new ATOM 0 HB2 MET A 3 24.691 34.480 -3.382 1.00 0.00 H new ATOM 0 HB3 MET A 3 24.025 33.583 -4.732 1.00 0.00 H new ATOM 0 HG2 MET A 3 25.496 35.012 -6.258 1.00 0.00 H new ATOM 0 HG3 MET A 3 26.272 35.619 -4.809 1.00 0.00 H new ATOM 0 HE1 MET A 3 26.394 31.365 -6.510 1.00 0.00 H new ATOM 0 HE2 MET A 3 25.121 31.632 -5.296 1.00 0.00 H new ATOM 0 HE3 MET A 3 25.162 32.621 -6.775 1.00 0.00 H new ATOM 56 N VAL A 4 21.042 35.091 -4.638 1.00 0.00 N ATOM 57 CA VAL A 4 19.752 34.788 -4.031 1.00 0.00 C ATOM 58 C VAL A 4 19.435 33.304 -4.170 1.00 0.00 C ATOM 59 O VAL A 4 19.772 32.681 -5.177 1.00 0.00 O ATOM 60 CB VAL A 4 18.610 35.625 -4.657 1.00 0.00 C ATOM 61 CG1 VAL A 4 18.857 37.111 -4.440 1.00 0.00 C ATOM 62 CG2 VAL A 4 18.455 35.317 -6.139 1.00 0.00 C ATOM 0 H VAL A 4 21.029 35.135 -5.657 1.00 0.00 H new ATOM 0 HA VAL A 4 19.822 35.049 -2.975 1.00 0.00 H new ATOM 0 HB VAL A 4 17.679 35.353 -4.159 1.00 0.00 H new ATOM 0 HG11 VAL A 4 18.044 37.684 -4.887 1.00 0.00 H new ATOM 0 HG12 VAL A 4 18.904 37.320 -3.371 1.00 0.00 H new ATOM 0 HG13 VAL A 4 19.800 37.395 -4.907 1.00 0.00 H new ATOM 0 HG21 VAL A 4 17.646 35.919 -6.553 1.00 0.00 H new ATOM 0 HG22 VAL A 4 19.384 35.551 -6.658 1.00 0.00 H new ATOM 0 HG23 VAL A 4 18.224 34.260 -6.269 1.00 0.00 H new ATOM 72 N SER A 5 18.808 32.733 -3.155 1.00 0.00 N ATOM 73 CA SER A 5 18.453 31.322 -3.183 1.00 0.00 C ATOM 74 C SER A 5 16.965 31.147 -3.493 1.00 0.00 C ATOM 75 O SER A 5 16.464 30.026 -3.566 1.00 0.00 O ATOM 76 CB SER A 5 18.811 30.662 -1.847 1.00 0.00 C ATOM 77 OG SER A 5 18.928 29.255 -1.981 1.00 0.00 O ATOM 0 H SER A 5 18.534 33.222 -2.303 1.00 0.00 H new ATOM 0 HA SER A 5 19.022 30.834 -3.974 1.00 0.00 H new ATOM 0 HB2 SER A 5 19.750 31.073 -1.476 1.00 0.00 H new ATOM 0 HB3 SER A 5 18.046 30.896 -1.107 1.00 0.00 H new ATOM 0 HG SER A 5 18.195 28.917 -2.537 1.00 0.00 H new ATOM 83 N GLY A 6 16.268 32.264 -3.692 1.00 0.00 N ATOM 84 CA GLY A 6 14.859 32.213 -4.055 1.00 0.00 C ATOM 85 C GLY A 6 14.676 31.901 -5.527 1.00 0.00 C ATOM 86 O GLY A 6 14.178 32.728 -6.296 1.00 0.00 O ATOM 0 H GLY A 6 16.653 33.205 -3.608 1.00 0.00 H new ATOM 0 HA2 GLY A 6 14.355 31.455 -3.456 1.00 0.00 H new ATOM 0 HA3 GLY A 6 14.388 33.168 -3.823 1.00 0.00 H new ATOM 90 N CYS A 7 15.090 30.705 -5.917 1.00 0.00 N ATOM 91 CA CYS A 7 15.094 30.301 -7.312 1.00 0.00 C ATOM 92 C CYS A 7 13.737 29.756 -7.734 1.00 0.00 C ATOM 93 O CYS A 7 12.993 29.213 -6.917 1.00 0.00 O ATOM 94 CB CYS A 7 16.169 29.239 -7.540 1.00 0.00 C ATOM 95 SG CYS A 7 17.808 29.707 -6.933 1.00 0.00 S ATOM 0 H CYS A 7 15.432 29.989 -5.276 1.00 0.00 H new ATOM 0 HA CYS A 7 15.311 31.181 -7.918 1.00 0.00 H new ATOM 0 HB2 CYS A 7 15.862 28.315 -7.050 1.00 0.00 H new ATOM 0 HB3 CYS A 7 16.235 29.027 -8.607 1.00 0.00 H new ATOM 0 HG CYS A 7 18.649 28.744 -7.169 1.00 0.00 H new ATOM 101 N GLN A 8 13.427 29.906 -9.012 1.00 0.00 N ATOM 102 CA GLN A 8 12.190 29.384 -9.575 1.00 0.00 C ATOM 103 C GLN A 8 12.488 28.137 -10.402 1.00 0.00 C ATOM 104 O GLN A 8 13.290 27.296 -9.992 1.00 0.00 O ATOM 105 CB GLN A 8 11.522 30.441 -10.453 1.00 0.00 C ATOM 106 CG GLN A 8 11.127 31.705 -9.710 1.00 0.00 C ATOM 107 CD GLN A 8 10.473 32.721 -10.619 1.00 0.00 C ATOM 108 OE1 GLN A 8 10.764 32.779 -11.814 1.00 0.00 O ATOM 109 NE2 GLN A 8 9.587 33.532 -10.062 1.00 0.00 N ATOM 0 H GLN A 8 14.021 30.390 -9.685 1.00 0.00 H new ATOM 0 HA GLN A 8 11.513 29.124 -8.761 1.00 0.00 H new ATOM 0 HB2 GLN A 8 12.201 30.706 -11.264 1.00 0.00 H new ATOM 0 HB3 GLN A 8 10.632 30.008 -10.911 1.00 0.00 H new ATOM 0 HG2 GLN A 8 10.442 31.450 -8.901 1.00 0.00 H new ATOM 0 HG3 GLN A 8 12.012 32.147 -9.252 1.00 0.00 H new ATOM 0 HE21 GLN A 8 9.375 33.450 -9.068 1.00 0.00 H new ATOM 0 HE22 GLN A 8 9.116 34.239 -10.627 1.00 0.00 H new ATOM 118 N GLN A 9 11.832 28.026 -11.561 1.00 0.00 N ATOM 119 CA GLN A 9 12.094 26.948 -12.517 1.00 0.00 C ATOM 120 C GLN A 9 11.605 25.608 -11.986 1.00 0.00 C ATOM 121 O GLN A 9 12.218 24.566 -12.234 1.00 0.00 O ATOM 122 CB GLN A 9 13.585 26.876 -12.863 1.00 0.00 C ATOM 123 CG GLN A 9 14.104 28.116 -13.571 1.00 0.00 C ATOM 124 CD GLN A 9 15.580 28.030 -13.889 1.00 0.00 C ATOM 125 OE1 GLN A 9 15.968 27.546 -14.949 1.00 0.00 O ATOM 126 NE2 GLN A 9 16.414 28.513 -12.982 1.00 0.00 N ATOM 0 H GLN A 9 11.108 28.678 -11.861 1.00 0.00 H new ATOM 0 HA GLN A 9 11.539 27.173 -13.428 1.00 0.00 H new ATOM 0 HB2 GLN A 9 14.156 26.725 -11.947 1.00 0.00 H new ATOM 0 HB3 GLN A 9 13.761 26.006 -13.495 1.00 0.00 H new ATOM 0 HG2 GLN A 9 13.545 28.263 -14.495 1.00 0.00 H new ATOM 0 HG3 GLN A 9 13.921 28.990 -12.946 1.00 0.00 H new ATOM 0 HE21 GLN A 9 16.051 28.907 -12.114 1.00 0.00 H new ATOM 0 HE22 GLN A 9 17.420 28.492 -13.151 1.00 0.00 H new ATOM 135 N GLN A 10 10.488 25.640 -11.269 1.00 0.00 N ATOM 136 CA GLN A 10 9.857 24.422 -10.798 1.00 0.00 C ATOM 137 C GLN A 10 9.389 23.597 -11.994 1.00 0.00 C ATOM 138 O GLN A 10 8.633 24.073 -12.844 1.00 0.00 O ATOM 139 CB GLN A 10 8.703 24.738 -9.843 1.00 0.00 C ATOM 140 CG GLN A 10 7.688 25.726 -10.391 1.00 0.00 C ATOM 141 CD GLN A 10 6.714 26.196 -9.333 1.00 0.00 C ATOM 142 OE1 GLN A 10 7.052 26.283 -8.149 1.00 0.00 O ATOM 143 NE2 GLN A 10 5.496 26.497 -9.747 1.00 0.00 N ATOM 0 H GLN A 10 10.004 26.498 -11.003 1.00 0.00 H new ATOM 0 HA GLN A 10 10.583 23.835 -10.236 1.00 0.00 H new ATOM 0 HB2 GLN A 10 8.190 23.809 -9.593 1.00 0.00 H new ATOM 0 HB3 GLN A 10 9.114 25.135 -8.915 1.00 0.00 H new ATOM 0 HG2 GLN A 10 8.211 26.587 -10.808 1.00 0.00 H new ATOM 0 HG3 GLN A 10 7.137 25.261 -11.208 1.00 0.00 H new ATOM 0 HE21 GLN A 10 5.257 26.411 -10.735 1.00 0.00 H new ATOM 0 HE22 GLN A 10 4.794 26.815 -9.079 1.00 0.00 H new ATOM 152 N LYS A 11 9.872 22.372 -12.063 1.00 0.00 N ATOM 153 CA LYS A 11 9.709 21.546 -13.250 1.00 0.00 C ATOM 154 C LYS A 11 8.360 20.834 -13.283 1.00 0.00 C ATOM 155 O LYS A 11 7.795 20.628 -14.359 1.00 0.00 O ATOM 156 CB LYS A 11 10.850 20.525 -13.322 1.00 0.00 C ATOM 157 CG LYS A 11 10.964 19.655 -12.077 1.00 0.00 C ATOM 158 CD LYS A 11 12.191 18.756 -12.113 1.00 0.00 C ATOM 159 CE LYS A 11 12.285 17.907 -10.852 1.00 0.00 C ATOM 160 NZ LYS A 11 12.386 18.742 -9.624 1.00 0.00 N ATOM 0 H LYS A 11 10.385 21.921 -11.306 1.00 0.00 H new ATOM 0 HA LYS A 11 9.741 22.203 -14.119 1.00 0.00 H new ATOM 0 HB2 LYS A 11 10.700 19.884 -14.191 1.00 0.00 H new ATOM 0 HB3 LYS A 11 11.791 21.053 -13.474 1.00 0.00 H new ATOM 0 HG2 LYS A 11 11.009 20.292 -11.194 1.00 0.00 H new ATOM 0 HG3 LYS A 11 10.069 19.041 -11.982 1.00 0.00 H new ATOM 0 HD2 LYS A 11 12.146 18.109 -12.989 1.00 0.00 H new ATOM 0 HD3 LYS A 11 13.089 19.365 -12.213 1.00 0.00 H new ATOM 0 HE2 LYS A 11 11.408 17.264 -10.782 1.00 0.00 H new ATOM 0 HE3 LYS A 11 13.155 17.254 -10.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 12.700 18.151 -8.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 13.073 19.507 -9.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 11.456 19.152 -9.406 1.00 0.00 H new ATOM 174 N GLU A 12 7.849 20.482 -12.106 1.00 0.00 N ATOM 175 CA GLU A 12 6.669 19.629 -11.995 1.00 0.00 C ATOM 176 C GLU A 12 6.879 18.343 -12.790 1.00 0.00 C ATOM 177 O GLU A 12 6.163 18.043 -13.746 1.00 0.00 O ATOM 178 CB GLU A 12 5.401 20.368 -12.439 1.00 0.00 C ATOM 179 CG GLU A 12 4.647 21.027 -11.293 1.00 0.00 C ATOM 180 CD GLU A 12 5.488 22.021 -10.508 1.00 0.00 C ATOM 181 OE1 GLU A 12 6.308 21.583 -9.669 1.00 0.00 O ATOM 182 OE2 GLU A 12 5.312 23.241 -10.709 1.00 0.00 O ATOM 0 H GLU A 12 8.237 20.777 -11.210 1.00 0.00 H new ATOM 0 HA GLU A 12 6.529 19.365 -10.947 1.00 0.00 H new ATOM 0 HB2 GLU A 12 5.672 21.130 -13.170 1.00 0.00 H new ATOM 0 HB3 GLU A 12 4.738 19.664 -12.942 1.00 0.00 H new ATOM 0 HG2 GLU A 12 3.771 21.539 -11.691 1.00 0.00 H new ATOM 0 HG3 GLU A 12 4.284 20.254 -10.615 1.00 0.00 H new ATOM 189 N GLU A 13 7.891 17.601 -12.369 1.00 0.00 N ATOM 190 CA GLU A 13 8.326 16.392 -13.050 1.00 0.00 C ATOM 191 C GLU A 13 8.487 15.270 -12.021 1.00 0.00 C ATOM 192 O GLU A 13 8.387 15.524 -10.815 1.00 0.00 O ATOM 193 CB GLU A 13 9.652 16.686 -13.778 1.00 0.00 C ATOM 194 CG GLU A 13 10.249 15.516 -14.547 1.00 0.00 C ATOM 195 CD GLU A 13 9.349 15.012 -15.651 1.00 0.00 C ATOM 196 OE1 GLU A 13 8.493 14.146 -15.373 1.00 0.00 O ATOM 197 OE2 GLU A 13 9.508 15.465 -16.804 1.00 0.00 O ATOM 0 H GLU A 13 8.438 17.823 -11.537 1.00 0.00 H new ATOM 0 HA GLU A 13 7.590 16.073 -13.788 1.00 0.00 H new ATOM 0 HB2 GLU A 13 9.490 17.510 -14.473 1.00 0.00 H new ATOM 0 HB3 GLU A 13 10.382 17.026 -13.044 1.00 0.00 H new ATOM 0 HG2 GLU A 13 11.204 15.820 -14.975 1.00 0.00 H new ATOM 0 HG3 GLU A 13 10.455 14.701 -13.854 1.00 0.00 H new ATOM 204 N THR A 14 8.733 14.052 -12.500 1.00 0.00 N ATOM 205 CA THR A 14 8.926 12.891 -11.653 1.00 0.00 C ATOM 206 C THR A 14 7.611 12.422 -11.019 1.00 0.00 C ATOM 207 O THR A 14 6.904 13.195 -10.365 1.00 0.00 O ATOM 208 CB THR A 14 9.975 13.207 -10.583 1.00 0.00 C ATOM 209 OG1 THR A 14 11.278 13.260 -11.178 1.00 0.00 O ATOM 210 CG2 THR A 14 9.968 12.201 -9.440 1.00 0.00 C ATOM 0 H THR A 14 8.803 13.848 -13.497 1.00 0.00 H new ATOM 0 HA THR A 14 9.285 12.069 -12.272 1.00 0.00 H new ATOM 0 HB THR A 14 9.718 14.178 -10.158 1.00 0.00 H new ATOM 0 HG1 THR A 14 11.944 13.464 -10.489 1.00 0.00 H new ATOM 0 HG21 THR A 14 10.731 12.474 -8.711 1.00 0.00 H new ATOM 0 HG22 THR A 14 8.990 12.203 -8.960 1.00 0.00 H new ATOM 0 HG23 THR A 14 10.178 11.205 -9.830 1.00 0.00 H new ATOM 218 N PRO A 15 7.265 11.140 -11.236 1.00 0.00 N ATOM 219 CA PRO A 15 6.042 10.526 -10.708 1.00 0.00 C ATOM 220 C PRO A 15 5.852 10.780 -9.215 1.00 0.00 C ATOM 221 O PRO A 15 6.680 10.381 -8.396 1.00 0.00 O ATOM 222 CB PRO A 15 6.237 9.024 -10.970 1.00 0.00 C ATOM 223 CG PRO A 15 7.647 8.865 -11.435 1.00 0.00 C ATOM 224 CD PRO A 15 8.045 10.184 -12.028 1.00 0.00 C ATOM 0 HA PRO A 15 5.154 10.942 -11.184 1.00 0.00 H new ATOM 0 HB2 PRO A 15 6.057 8.444 -10.065 1.00 0.00 H new ATOM 0 HB3 PRO A 15 5.535 8.665 -11.723 1.00 0.00 H new ATOM 0 HG2 PRO A 15 8.302 8.598 -10.606 1.00 0.00 H new ATOM 0 HG3 PRO A 15 7.725 8.067 -12.173 1.00 0.00 H new ATOM 0 HD2 PRO A 15 9.117 10.362 -11.938 1.00 0.00 H new ATOM 0 HD3 PRO A 15 7.801 10.242 -13.089 1.00 0.00 H new ATOM 232 N PHE A 16 4.742 11.427 -8.870 1.00 0.00 N ATOM 233 CA PHE A 16 4.462 11.806 -7.484 1.00 0.00 C ATOM 234 C PHE A 16 4.167 10.583 -6.619 1.00 0.00 C ATOM 235 O PHE A 16 4.163 10.670 -5.396 1.00 0.00 O ATOM 236 CB PHE A 16 3.284 12.792 -7.422 1.00 0.00 C ATOM 237 CG PHE A 16 1.952 12.187 -7.775 1.00 0.00 C ATOM 238 CD1 PHE A 16 1.594 11.978 -9.095 1.00 0.00 C ATOM 239 CD2 PHE A 16 1.058 11.828 -6.778 1.00 0.00 C ATOM 240 CE1 PHE A 16 0.370 11.420 -9.414 1.00 0.00 C ATOM 241 CE2 PHE A 16 -0.167 11.271 -7.091 1.00 0.00 C ATOM 242 CZ PHE A 16 -0.511 11.064 -8.411 1.00 0.00 C ATOM 0 H PHE A 16 4.017 11.702 -9.533 1.00 0.00 H new ATOM 0 HA PHE A 16 5.354 12.292 -7.089 1.00 0.00 H new ATOM 0 HB2 PHE A 16 3.226 13.208 -6.416 1.00 0.00 H new ATOM 0 HB3 PHE A 16 3.484 13.622 -8.099 1.00 0.00 H new ATOM 0 HD1 PHE A 16 2.278 12.254 -9.884 1.00 0.00 H new ATOM 0 HD2 PHE A 16 1.323 11.986 -5.743 1.00 0.00 H new ATOM 0 HE1 PHE A 16 0.102 11.262 -10.448 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -0.854 10.998 -6.304 1.00 0.00 H new ATOM 0 HZ PHE A 16 -1.466 10.625 -8.659 1.00 0.00 H new ATOM 252 N TYR A 17 3.918 9.451 -7.261 1.00 0.00 N ATOM 253 CA TYR A 17 3.574 8.227 -6.556 1.00 0.00 C ATOM 254 C TYR A 17 4.790 7.319 -6.385 1.00 0.00 C ATOM 255 O TYR A 17 4.747 6.350 -5.627 1.00 0.00 O ATOM 256 CB TYR A 17 2.473 7.485 -7.323 1.00 0.00 C ATOM 257 CG TYR A 17 2.838 7.158 -8.759 1.00 0.00 C ATOM 258 CD1 TYR A 17 2.583 8.061 -9.785 1.00 0.00 C ATOM 259 CD2 TYR A 17 3.439 5.948 -9.086 1.00 0.00 C ATOM 260 CE1 TYR A 17 2.917 7.767 -11.094 1.00 0.00 C ATOM 261 CE2 TYR A 17 3.774 5.647 -10.391 1.00 0.00 C ATOM 262 CZ TYR A 17 3.513 6.559 -11.391 1.00 0.00 C ATOM 263 OH TYR A 17 3.848 6.265 -12.692 1.00 0.00 O ATOM 0 H TYR A 17 3.948 9.356 -8.276 1.00 0.00 H new ATOM 0 HA TYR A 17 3.216 8.496 -5.562 1.00 0.00 H new ATOM 0 HB2 TYR A 17 2.239 6.559 -6.798 1.00 0.00 H new ATOM 0 HB3 TYR A 17 1.568 8.092 -7.318 1.00 0.00 H new ATOM 0 HD1 TYR A 17 2.116 9.008 -9.556 1.00 0.00 H new ATOM 0 HD2 TYR A 17 3.647 5.231 -8.306 1.00 0.00 H new ATOM 0 HE1 TYR A 17 2.712 8.479 -11.880 1.00 0.00 H new ATOM 0 HE2 TYR A 17 4.239 4.701 -10.627 1.00 0.00 H new ATOM 0 HH TYR A 17 4.260 5.377 -12.731 1.00 0.00 H new ATOM 273 N TYR A 18 5.873 7.638 -7.078 1.00 0.00 N ATOM 274 CA TYR A 18 7.040 6.770 -7.094 1.00 0.00 C ATOM 275 C TYR A 18 7.951 7.064 -5.912 1.00 0.00 C ATOM 276 O TYR A 18 8.215 8.223 -5.593 1.00 0.00 O ATOM 277 CB TYR A 18 7.807 6.937 -8.408 1.00 0.00 C ATOM 278 CG TYR A 18 8.928 5.935 -8.600 1.00 0.00 C ATOM 279 CD1 TYR A 18 8.675 4.687 -9.155 1.00 0.00 C ATOM 280 CD2 TYR A 18 10.234 6.234 -8.232 1.00 0.00 C ATOM 281 CE1 TYR A 18 9.690 3.766 -9.335 1.00 0.00 C ATOM 282 CE2 TYR A 18 11.255 5.318 -8.410 1.00 0.00 C ATOM 283 CZ TYR A 18 10.977 4.087 -8.960 1.00 0.00 C ATOM 284 OH TYR A 18 11.989 3.172 -9.139 1.00 0.00 O ATOM 0 H TYR A 18 5.968 8.488 -7.634 1.00 0.00 H new ATOM 0 HA TYR A 18 6.698 5.738 -7.013 1.00 0.00 H new ATOM 0 HB2 TYR A 18 7.107 6.847 -9.239 1.00 0.00 H new ATOM 0 HB3 TYR A 18 8.223 7.944 -8.449 1.00 0.00 H new ATOM 0 HD1 TYR A 18 7.668 4.432 -9.451 1.00 0.00 H new ATOM 0 HD2 TYR A 18 10.456 7.198 -7.799 1.00 0.00 H new ATOM 0 HE1 TYR A 18 9.476 2.800 -9.767 1.00 0.00 H new ATOM 0 HE2 TYR A 18 12.265 5.567 -8.119 1.00 0.00 H new ATOM 0 HH TYR A 18 12.835 3.554 -8.824 1.00 0.00 H new ATOM 294 N GLY A 19 8.424 6.007 -5.269 1.00 0.00 N ATOM 295 CA GLY A 19 9.315 6.160 -4.142 1.00 0.00 C ATOM 296 C GLY A 19 8.888 5.314 -2.964 1.00 0.00 C ATOM 297 O GLY A 19 8.032 4.438 -3.101 1.00 0.00 O ATOM 0 H GLY A 19 8.204 5.041 -5.511 1.00 0.00 H new ATOM 0 HA2 GLY A 19 10.327 5.883 -4.439 1.00 0.00 H new ATOM 0 HA3 GLY A 19 9.346 7.208 -3.844 1.00 0.00 H new ATOM 301 N THR A 20 9.493 5.565 -1.814 1.00 0.00 N ATOM 302 CA THR A 20 9.145 4.865 -0.593 1.00 0.00 C ATOM 303 C THR A 20 8.311 5.771 0.305 1.00 0.00 C ATOM 304 O THR A 20 8.679 6.922 0.554 1.00 0.00 O ATOM 305 CB THR A 20 10.407 4.405 0.167 1.00 0.00 C ATOM 306 OG1 THR A 20 11.253 3.657 -0.717 1.00 0.00 O ATOM 307 CG2 THR A 20 10.042 3.541 1.368 1.00 0.00 C ATOM 0 H THR A 20 10.235 6.256 -1.703 1.00 0.00 H new ATOM 0 HA THR A 20 8.566 3.982 -0.864 1.00 0.00 H new ATOM 0 HB THR A 20 10.931 5.291 0.526 1.00 0.00 H new ATOM 0 HG1 THR A 20 10.840 2.789 -0.908 1.00 0.00 H new ATOM 0 HG21 THR A 20 10.951 3.232 1.884 1.00 0.00 H new ATOM 0 HG22 THR A 20 9.414 4.114 2.051 1.00 0.00 H new ATOM 0 HG23 THR A 20 9.499 2.659 1.030 1.00 0.00 H new ATOM 315 N TRP A 21 7.187 5.257 0.777 1.00 0.00 N ATOM 316 CA TRP A 21 6.277 6.037 1.597 1.00 0.00 C ATOM 317 C TRP A 21 6.086 5.395 2.963 1.00 0.00 C ATOM 318 O TRP A 21 5.936 4.176 3.077 1.00 0.00 O ATOM 319 CB TRP A 21 4.925 6.181 0.894 1.00 0.00 C ATOM 320 CG TRP A 21 5.039 6.728 -0.500 1.00 0.00 C ATOM 321 CD1 TRP A 21 5.106 6.007 -1.658 1.00 0.00 C ATOM 322 CD2 TRP A 21 5.110 8.106 -0.882 1.00 0.00 C ATOM 323 NE1 TRP A 21 5.210 6.852 -2.735 1.00 0.00 N ATOM 324 CE2 TRP A 21 5.214 8.146 -2.284 1.00 0.00 C ATOM 325 CE3 TRP A 21 5.093 9.314 -0.175 1.00 0.00 C ATOM 326 CZ2 TRP A 21 5.303 9.342 -2.991 1.00 0.00 C ATOM 327 CZ3 TRP A 21 5.180 10.500 -0.880 1.00 0.00 C ATOM 328 CH2 TRP A 21 5.285 10.506 -2.273 1.00 0.00 C ATOM 0 H TRP A 21 6.883 4.299 0.605 1.00 0.00 H new ATOM 0 HA TRP A 21 6.714 7.025 1.741 1.00 0.00 H new ATOM 0 HB2 TRP A 21 4.437 5.207 0.857 1.00 0.00 H new ATOM 0 HB3 TRP A 21 4.284 6.837 1.483 1.00 0.00 H new ATOM 0 HD1 TRP A 21 5.081 4.929 -1.718 1.00 0.00 H new ATOM 0 HE1 TRP A 21 5.274 6.564 -3.711 1.00 0.00 H new ATOM 0 HE3 TRP A 21 5.013 9.319 0.902 1.00 0.00 H new ATOM 0 HZ2 TRP A 21 5.383 9.350 -4.068 1.00 0.00 H new ATOM 0 HZ3 TRP A 21 5.167 11.438 -0.345 1.00 0.00 H new ATOM 0 HH2 TRP A 21 5.353 11.450 -2.794 1.00 0.00 H new ATOM 339 N ASP A 22 6.124 6.225 3.989 1.00 0.00 N ATOM 340 CA ASP A 22 5.836 5.806 5.355 1.00 0.00 C ATOM 341 C ASP A 22 4.372 6.082 5.660 1.00 0.00 C ATOM 342 O ASP A 22 3.858 7.119 5.256 1.00 0.00 O ATOM 343 CB ASP A 22 6.747 6.565 6.335 1.00 0.00 C ATOM 344 CG ASP A 22 6.106 6.804 7.690 1.00 0.00 C ATOM 345 OD1 ASP A 22 5.909 5.832 8.445 1.00 0.00 O ATOM 346 OD2 ASP A 22 5.793 7.973 8.000 1.00 0.00 O ATOM 0 H ASP A 22 6.356 7.214 3.901 1.00 0.00 H new ATOM 0 HA ASP A 22 6.028 4.739 5.465 1.00 0.00 H new ATOM 0 HB2 ASP A 22 7.670 6.002 6.472 1.00 0.00 H new ATOM 0 HB3 ASP A 22 7.021 7.524 5.896 1.00 0.00 H new ATOM 351 N GLU A 23 3.700 5.160 6.352 1.00 0.00 N ATOM 352 CA GLU A 23 2.275 5.318 6.654 1.00 0.00 C ATOM 353 C GLU A 23 1.976 6.682 7.262 1.00 0.00 C ATOM 354 O GLU A 23 0.993 7.323 6.896 1.00 0.00 O ATOM 355 CB GLU A 23 1.780 4.229 7.601 1.00 0.00 C ATOM 356 CG GLU A 23 1.658 2.865 6.952 1.00 0.00 C ATOM 357 CD GLU A 23 0.917 1.886 7.835 1.00 0.00 C ATOM 358 OE1 GLU A 23 1.562 1.262 8.702 1.00 0.00 O ATOM 359 OE2 GLU A 23 -0.318 1.755 7.672 1.00 0.00 O ATOM 0 H GLU A 23 4.116 4.301 6.712 1.00 0.00 H new ATOM 0 HA GLU A 23 1.748 5.232 5.704 1.00 0.00 H new ATOM 0 HB2 GLU A 23 2.463 4.159 8.448 1.00 0.00 H new ATOM 0 HB3 GLU A 23 0.808 4.520 7.999 1.00 0.00 H new ATOM 0 HG2 GLU A 23 1.137 2.961 5.999 1.00 0.00 H new ATOM 0 HG3 GLU A 23 2.653 2.476 6.734 1.00 0.00 H new ATOM 366 N GLY A 24 2.819 7.107 8.198 1.00 0.00 N ATOM 367 CA GLY A 24 2.692 8.431 8.782 1.00 0.00 C ATOM 368 C GLY A 24 1.548 8.540 9.771 1.00 0.00 C ATOM 369 O GLY A 24 1.751 8.902 10.930 1.00 0.00 O ATOM 0 H GLY A 24 3.593 6.554 8.565 1.00 0.00 H new ATOM 0 HA2 GLY A 24 3.624 8.690 9.284 1.00 0.00 H new ATOM 0 HA3 GLY A 24 2.546 9.160 7.985 1.00 0.00 H new ATOM 373 N ARG A 25 0.352 8.224 9.311 1.00 0.00 N ATOM 374 CA ARG A 25 -0.838 8.345 10.121 1.00 0.00 C ATOM 375 C ARG A 25 -1.311 6.966 10.562 1.00 0.00 C ATOM 376 O ARG A 25 -1.270 6.005 9.785 1.00 0.00 O ATOM 377 CB ARG A 25 -1.925 9.055 9.308 1.00 0.00 C ATOM 378 CG ARG A 25 -3.239 9.286 10.045 1.00 0.00 C ATOM 379 CD ARG A 25 -3.099 10.299 11.172 1.00 0.00 C ATOM 380 NE ARG A 25 -4.401 10.674 11.723 1.00 0.00 N ATOM 381 CZ ARG A 25 -4.926 10.146 12.830 1.00 0.00 C ATOM 382 NH1 ARG A 25 -4.225 9.289 13.563 1.00 0.00 N ATOM 383 NH2 ARG A 25 -6.142 10.505 13.218 1.00 0.00 N ATOM 0 H ARG A 25 0.182 7.877 8.367 1.00 0.00 H new ATOM 0 HA ARG A 25 -0.619 8.930 11.014 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -1.538 10.019 8.977 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -2.128 8.468 8.412 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -3.993 9.634 9.339 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -3.596 8.340 10.452 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -2.475 9.881 11.962 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -2.590 11.189 10.801 1.00 0.00 H new ATOM 0 HE ARG A 25 -4.942 11.384 11.230 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -3.279 9.031 13.281 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -4.632 8.889 14.408 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -6.673 11.183 12.671 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -6.547 10.103 14.064 1.00 0.00 H new ATOM 397 N ALA A 26 -1.773 6.912 11.804 1.00 0.00 N ATOM 398 CA ALA A 26 -2.266 5.690 12.451 1.00 0.00 C ATOM 399 C ALA A 26 -1.154 4.658 12.653 1.00 0.00 C ATOM 400 O ALA A 26 -0.268 4.497 11.811 1.00 0.00 O ATOM 401 CB ALA A 26 -3.425 5.091 11.665 1.00 0.00 C ATOM 0 H ALA A 26 -1.819 7.732 12.409 1.00 0.00 H new ATOM 0 HA ALA A 26 -2.627 5.972 13.440 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -3.774 4.186 12.163 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -4.240 5.813 11.611 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -3.092 4.844 10.657 1.00 0.00 H new ATOM 407 N PRO A 27 -1.188 3.935 13.784 1.00 0.00 N ATOM 408 CA PRO A 27 -0.192 2.917 14.115 1.00 0.00 C ATOM 409 C PRO A 27 -0.467 1.583 13.427 1.00 0.00 C ATOM 410 O PRO A 27 -1.518 1.394 12.809 1.00 0.00 O ATOM 411 CB PRO A 27 -0.318 2.763 15.640 1.00 0.00 C ATOM 412 CG PRO A 27 -1.363 3.745 16.074 1.00 0.00 C ATOM 413 CD PRO A 27 -2.176 4.066 14.855 1.00 0.00 C ATOM 0 HA PRO A 27 0.804 3.211 13.783 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -0.605 1.746 15.906 1.00 0.00 H new ATOM 0 HB3 PRO A 27 0.634 2.964 16.132 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -1.990 3.323 16.859 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -0.904 4.645 16.483 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -3.009 3.375 14.727 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -2.598 5.070 14.899 1.00 0.00 H new ATOM 421 N GLY A 28 0.487 0.671 13.531 1.00 0.00 N ATOM 422 CA GLY A 28 0.322 -0.646 12.958 1.00 0.00 C ATOM 423 C GLY A 28 -0.309 -1.622 13.931 1.00 0.00 C ATOM 424 O GLY A 28 -1.021 -1.212 14.849 1.00 0.00 O ATOM 0 H GLY A 28 1.377 0.822 14.005 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -0.298 -0.576 12.064 1.00 0.00 H new ATOM 0 HA3 GLY A 28 1.293 -1.027 12.643 1.00 0.00 H new ATOM 428 N PRO A 29 -0.058 -2.925 13.748 1.00 0.00 N ATOM 429 CA PRO A 29 -0.630 -3.982 14.590 1.00 0.00 C ATOM 430 C PRO A 29 -0.216 -3.887 16.054 1.00 0.00 C ATOM 431 O PRO A 29 -0.962 -4.290 16.945 1.00 0.00 O ATOM 432 CB PRO A 29 -0.075 -5.275 13.980 1.00 0.00 C ATOM 433 CG PRO A 29 1.101 -4.855 13.169 1.00 0.00 C ATOM 434 CD PRO A 29 0.784 -3.475 12.675 1.00 0.00 C ATOM 0 HA PRO A 29 -1.718 -3.918 14.602 1.00 0.00 H new ATOM 0 HB2 PRO A 29 0.215 -5.983 14.756 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -0.823 -5.770 13.361 1.00 0.00 H new ATOM 0 HG2 PRO A 29 2.011 -4.856 13.769 1.00 0.00 H new ATOM 0 HG3 PRO A 29 1.267 -5.540 12.337 1.00 0.00 H new ATOM 0 HD2 PRO A 29 1.687 -2.882 12.526 1.00 0.00 H new ATOM 0 HD3 PRO A 29 0.258 -3.499 11.721 1.00 0.00 H new ATOM 442 N THR A 30 0.986 -3.376 16.285 1.00 0.00 N ATOM 443 CA THR A 30 1.558 -3.270 17.630 1.00 0.00 C ATOM 444 C THR A 30 2.049 -4.635 18.151 1.00 0.00 C ATOM 445 O THR A 30 2.903 -4.694 19.043 1.00 0.00 O ATOM 446 CB THR A 30 0.547 -2.638 18.623 1.00 0.00 C ATOM 447 OG1 THR A 30 0.238 -1.300 18.207 1.00 0.00 O ATOM 448 CG2 THR A 30 1.088 -2.610 20.046 1.00 0.00 C ATOM 0 H THR A 30 1.596 -3.022 15.548 1.00 0.00 H new ATOM 0 HA THR A 30 2.423 -2.611 17.558 1.00 0.00 H new ATOM 0 HB THR A 30 -0.352 -3.255 18.618 1.00 0.00 H new ATOM 0 HG1 THR A 30 -0.402 -0.902 18.834 1.00 0.00 H new ATOM 0 HG21 THR A 30 0.348 -2.160 20.708 1.00 0.00 H new ATOM 0 HG22 THR A 30 1.298 -3.628 20.376 1.00 0.00 H new ATOM 0 HG23 THR A 30 2.006 -2.023 20.075 1.00 0.00 H new ATOM 456 N ASP A 31 1.524 -5.718 17.573 1.00 0.00 N ATOM 457 CA ASP A 31 1.955 -7.076 17.915 1.00 0.00 C ATOM 458 C ASP A 31 3.473 -7.187 17.837 1.00 0.00 C ATOM 459 O ASP A 31 4.139 -7.602 18.785 1.00 0.00 O ATOM 460 CB ASP A 31 1.335 -8.105 16.957 1.00 0.00 C ATOM 461 CG ASP A 31 -0.177 -8.163 17.017 1.00 0.00 C ATOM 462 OD1 ASP A 31 -0.716 -8.924 17.845 1.00 0.00 O ATOM 463 OD2 ASP A 31 -0.835 -7.467 16.213 1.00 0.00 O ATOM 0 H ASP A 31 0.795 -5.680 16.861 1.00 0.00 H new ATOM 0 HA ASP A 31 1.621 -7.282 18.932 1.00 0.00 H new ATOM 0 HB2 ASP A 31 1.640 -7.868 15.938 1.00 0.00 H new ATOM 0 HB3 ASP A 31 1.737 -9.091 17.189 1.00 0.00 H new ATOM 468 N GLY A 32 4.000 -6.821 16.685 1.00 0.00 N ATOM 469 CA GLY A 32 5.431 -6.793 16.476 1.00 0.00 C ATOM 470 C GLY A 32 5.817 -5.688 15.523 1.00 0.00 C ATOM 471 O GLY A 32 6.792 -4.972 15.746 1.00 0.00 O ATOM 0 H GLY A 32 3.451 -6.537 15.874 1.00 0.00 H new ATOM 0 HA2 GLY A 32 5.939 -6.649 17.430 1.00 0.00 H new ATOM 0 HA3 GLY A 32 5.763 -7.753 16.080 1.00 0.00 H new ATOM 475 N VAL A 33 5.043 -5.552 14.453 1.00 0.00 N ATOM 476 CA VAL A 33 5.227 -4.457 13.518 1.00 0.00 C ATOM 477 C VAL A 33 4.640 -3.182 14.109 1.00 0.00 C ATOM 478 O VAL A 33 3.529 -3.189 14.645 1.00 0.00 O ATOM 479 CB VAL A 33 4.541 -4.737 12.161 1.00 0.00 C ATOM 480 CG1 VAL A 33 4.980 -3.744 11.104 1.00 0.00 C ATOM 481 CG2 VAL A 33 4.802 -6.159 11.697 1.00 0.00 C ATOM 0 H VAL A 33 4.283 -6.188 14.214 1.00 0.00 H new ATOM 0 HA VAL A 33 6.298 -4.347 13.345 1.00 0.00 H new ATOM 0 HB VAL A 33 3.468 -4.618 12.310 1.00 0.00 H new ATOM 0 HG11 VAL A 33 4.479 -3.969 10.163 1.00 0.00 H new ATOM 0 HG12 VAL A 33 4.718 -2.735 11.422 1.00 0.00 H new ATOM 0 HG13 VAL A 33 6.059 -3.812 10.966 1.00 0.00 H new ATOM 0 HG21 VAL A 33 4.307 -6.326 10.740 1.00 0.00 H new ATOM 0 HG22 VAL A 33 5.875 -6.313 11.582 1.00 0.00 H new ATOM 0 HG23 VAL A 33 4.412 -6.860 12.435 1.00 0.00 H new ATOM 491 N LYS A 34 5.385 -2.097 14.021 1.00 0.00 N ATOM 492 CA LYS A 34 4.930 -0.824 14.541 1.00 0.00 C ATOM 493 C LYS A 34 4.233 -0.030 13.453 1.00 0.00 C ATOM 494 O LYS A 34 3.283 0.709 13.710 1.00 0.00 O ATOM 495 CB LYS A 34 6.113 -0.031 15.080 1.00 0.00 C ATOM 496 CG LYS A 34 6.916 -0.779 16.128 1.00 0.00 C ATOM 497 CD LYS A 34 8.083 0.050 16.632 1.00 0.00 C ATOM 498 CE LYS A 34 8.937 -0.741 17.606 1.00 0.00 C ATOM 499 NZ LYS A 34 10.034 0.080 18.177 1.00 0.00 N ATOM 0 H LYS A 34 6.310 -2.073 13.593 1.00 0.00 H new ATOM 0 HA LYS A 34 4.223 -1.009 15.350 1.00 0.00 H new ATOM 0 HB2 LYS A 34 6.770 0.235 14.252 1.00 0.00 H new ATOM 0 HB3 LYS A 34 5.749 0.902 15.510 1.00 0.00 H new ATOM 0 HG2 LYS A 34 6.268 -1.043 16.964 1.00 0.00 H new ATOM 0 HG3 LYS A 34 7.287 -1.713 15.705 1.00 0.00 H new ATOM 0 HD2 LYS A 34 8.693 0.374 15.789 1.00 0.00 H new ATOM 0 HD3 LYS A 34 7.709 0.950 17.120 1.00 0.00 H new ATOM 0 HE2 LYS A 34 8.310 -1.120 18.413 1.00 0.00 H new ATOM 0 HE3 LYS A 34 9.360 -1.607 17.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 10.633 -0.515 18.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 10.608 0.477 17.406 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 9.630 0.854 18.742 1.00 0.00 H new ATOM 513 N SER A 35 4.705 -0.222 12.233 1.00 0.00 N ATOM 514 CA SER A 35 4.244 0.528 11.070 1.00 0.00 C ATOM 515 C SER A 35 4.767 -0.145 9.809 1.00 0.00 C ATOM 516 O SER A 35 5.674 -0.981 9.877 1.00 0.00 O ATOM 517 CB SER A 35 4.736 1.987 11.103 1.00 0.00 C ATOM 518 OG SER A 35 4.324 2.661 12.284 1.00 0.00 O ATOM 0 H SER A 35 5.427 -0.910 12.017 1.00 0.00 H new ATOM 0 HA SER A 35 3.154 0.538 11.081 1.00 0.00 H new ATOM 0 HB2 SER A 35 5.824 2.004 11.036 1.00 0.00 H new ATOM 0 HB3 SER A 35 4.355 2.518 10.231 1.00 0.00 H new ATOM 0 HG SER A 35 3.615 2.147 12.724 1.00 0.00 H new ATOM 524 N ALA A 36 4.211 0.218 8.672 1.00 0.00 N ATOM 525 CA ALA A 36 4.661 -0.327 7.406 1.00 0.00 C ATOM 526 C ALA A 36 5.114 0.779 6.465 1.00 0.00 C ATOM 527 O ALA A 36 4.605 1.900 6.509 1.00 0.00 O ATOM 528 CB ALA A 36 3.553 -1.147 6.766 1.00 0.00 C ATOM 0 H ALA A 36 3.446 0.889 8.597 1.00 0.00 H new ATOM 0 HA ALA A 36 5.515 -0.976 7.598 1.00 0.00 H new ATOM 0 HB1 ALA A 36 3.902 -1.551 5.816 1.00 0.00 H new ATOM 0 HB2 ALA A 36 3.277 -1.966 7.430 1.00 0.00 H new ATOM 0 HB3 ALA A 36 2.684 -0.512 6.593 1.00 0.00 H new ATOM 534 N THR A 37 6.088 0.464 5.634 1.00 0.00 N ATOM 535 CA THR A 37 6.538 1.372 4.599 1.00 0.00 C ATOM 536 C THR A 37 6.304 0.729 3.240 1.00 0.00 C ATOM 537 O THR A 37 6.500 -0.473 3.076 1.00 0.00 O ATOM 538 CB THR A 37 8.031 1.736 4.772 1.00 0.00 C ATOM 539 OG1 THR A 37 8.797 0.556 5.063 1.00 0.00 O ATOM 540 CG2 THR A 37 8.215 2.755 5.886 1.00 0.00 C ATOM 0 H THR A 37 6.588 -0.425 5.657 1.00 0.00 H new ATOM 0 HA THR A 37 5.968 2.298 4.675 1.00 0.00 H new ATOM 0 HB THR A 37 8.384 2.175 3.839 1.00 0.00 H new ATOM 0 HG1 THR A 37 9.717 0.810 5.287 1.00 0.00 H new ATOM 0 HG21 THR A 37 9.273 2.995 5.988 1.00 0.00 H new ATOM 0 HG22 THR A 37 7.659 3.661 5.646 1.00 0.00 H new ATOM 0 HG23 THR A 37 7.845 2.340 6.823 1.00 0.00 H new ATOM 548 N VAL A 38 5.857 1.508 2.275 1.00 0.00 N ATOM 549 CA VAL A 38 5.511 0.953 0.979 1.00 0.00 C ATOM 550 C VAL A 38 6.294 1.637 -0.142 1.00 0.00 C ATOM 551 O VAL A 38 6.485 2.849 -0.135 1.00 0.00 O ATOM 552 CB VAL A 38 3.990 1.058 0.720 1.00 0.00 C ATOM 553 CG1 VAL A 38 3.538 2.510 0.673 1.00 0.00 C ATOM 554 CG2 VAL A 38 3.601 0.322 -0.554 1.00 0.00 C ATOM 0 H VAL A 38 5.725 2.516 2.360 1.00 0.00 H new ATOM 0 HA VAL A 38 5.785 -0.102 0.988 1.00 0.00 H new ATOM 0 HB VAL A 38 3.477 0.579 1.554 1.00 0.00 H new ATOM 0 HG11 VAL A 38 2.464 2.551 0.489 1.00 0.00 H new ATOM 0 HG12 VAL A 38 3.762 2.992 1.625 1.00 0.00 H new ATOM 0 HG13 VAL A 38 4.063 3.029 -0.129 1.00 0.00 H new ATOM 0 HG21 VAL A 38 2.526 0.412 -0.712 1.00 0.00 H new ATOM 0 HG22 VAL A 38 4.130 0.757 -1.402 1.00 0.00 H new ATOM 0 HG23 VAL A 38 3.867 -0.731 -0.462 1.00 0.00 H new ATOM 564 N THR A 39 6.779 0.846 -1.083 1.00 0.00 N ATOM 565 CA THR A 39 7.482 1.374 -2.237 1.00 0.00 C ATOM 566 C THR A 39 6.745 0.986 -3.517 1.00 0.00 C ATOM 567 O THR A 39 6.443 -0.190 -3.735 1.00 0.00 O ATOM 568 CB THR A 39 8.934 0.858 -2.287 1.00 0.00 C ATOM 569 OG1 THR A 39 9.596 1.172 -1.052 1.00 0.00 O ATOM 570 CG2 THR A 39 9.698 1.480 -3.449 1.00 0.00 C ATOM 0 H THR A 39 6.698 -0.171 -1.069 1.00 0.00 H new ATOM 0 HA THR A 39 7.511 2.460 -2.151 1.00 0.00 H new ATOM 0 HB THR A 39 8.911 -0.222 -2.433 1.00 0.00 H new ATOM 0 HG1 THR A 39 10.519 0.843 -1.083 1.00 0.00 H new ATOM 0 HG21 THR A 39 10.719 1.098 -3.459 1.00 0.00 H new ATOM 0 HG22 THR A 39 9.205 1.224 -4.387 1.00 0.00 H new ATOM 0 HG23 THR A 39 9.717 2.564 -3.333 1.00 0.00 H new ATOM 578 N PHE A 40 6.456 1.971 -4.356 1.00 0.00 N ATOM 579 CA PHE A 40 5.677 1.737 -5.563 1.00 0.00 C ATOM 580 C PHE A 40 6.567 1.669 -6.794 1.00 0.00 C ATOM 581 O PHE A 40 7.365 2.571 -7.057 1.00 0.00 O ATOM 582 CB PHE A 40 4.627 2.834 -5.752 1.00 0.00 C ATOM 583 CG PHE A 40 3.521 2.801 -4.734 1.00 0.00 C ATOM 584 CD1 PHE A 40 2.437 1.952 -4.898 1.00 0.00 C ATOM 585 CD2 PHE A 40 3.563 3.620 -3.616 1.00 0.00 C ATOM 586 CE1 PHE A 40 1.417 1.922 -3.964 1.00 0.00 C ATOM 587 CE2 PHE A 40 2.547 3.593 -2.682 1.00 0.00 C ATOM 588 CZ PHE A 40 1.472 2.742 -2.855 1.00 0.00 C ATOM 0 H PHE A 40 6.749 2.939 -4.223 1.00 0.00 H new ATOM 0 HA PHE A 40 5.176 0.776 -5.443 1.00 0.00 H new ATOM 0 HB2 PHE A 40 5.119 3.806 -5.708 1.00 0.00 H new ATOM 0 HB3 PHE A 40 4.194 2.741 -6.748 1.00 0.00 H new ATOM 0 HD1 PHE A 40 2.389 1.308 -5.763 1.00 0.00 H new ATOM 0 HD2 PHE A 40 4.401 4.287 -3.474 1.00 0.00 H new ATOM 0 HE1 PHE A 40 0.577 1.257 -4.103 1.00 0.00 H new ATOM 0 HE2 PHE A 40 2.592 4.237 -1.816 1.00 0.00 H new ATOM 0 HZ PHE A 40 0.677 2.719 -2.124 1.00 0.00 H new ATOM 598 N THR A 41 6.432 0.576 -7.525 1.00 0.00 N ATOM 599 CA THR A 41 7.112 0.394 -8.793 1.00 0.00 C ATOM 600 C THR A 41 6.112 0.665 -9.923 1.00 0.00 C ATOM 601 O THR A 41 4.947 0.949 -9.649 1.00 0.00 O ATOM 602 CB THR A 41 7.672 -1.042 -8.891 1.00 0.00 C ATOM 603 OG1 THR A 41 8.039 -1.493 -7.578 1.00 0.00 O ATOM 604 CG2 THR A 41 8.896 -1.110 -9.803 1.00 0.00 C ATOM 0 H THR A 41 5.845 -0.213 -7.253 1.00 0.00 H new ATOM 0 HA THR A 41 7.950 1.087 -8.874 1.00 0.00 H new ATOM 0 HB THR A 41 6.897 -1.680 -9.316 1.00 0.00 H new ATOM 0 HG1 THR A 41 8.394 -2.405 -7.633 1.00 0.00 H new ATOM 0 HG21 THR A 41 9.261 -2.136 -9.846 1.00 0.00 H new ATOM 0 HG22 THR A 41 8.622 -0.780 -10.805 1.00 0.00 H new ATOM 0 HG23 THR A 41 9.680 -0.463 -9.409 1.00 0.00 H new ATOM 612 N GLU A 42 6.551 0.570 -11.176 1.00 0.00 N ATOM 613 CA GLU A 42 5.708 0.890 -12.315 1.00 0.00 C ATOM 614 C GLU A 42 4.397 0.093 -12.308 1.00 0.00 C ATOM 615 O GLU A 42 3.334 0.642 -12.591 1.00 0.00 O ATOM 616 CB GLU A 42 6.491 0.648 -13.601 1.00 0.00 C ATOM 617 CG GLU A 42 7.735 1.513 -13.714 1.00 0.00 C ATOM 618 CD GLU A 42 8.344 1.490 -15.102 1.00 0.00 C ATOM 619 OE1 GLU A 42 7.722 2.042 -16.031 1.00 0.00 O ATOM 620 OE2 GLU A 42 9.445 0.929 -15.274 1.00 0.00 O ATOM 0 H GLU A 42 7.494 0.271 -11.425 1.00 0.00 H new ATOM 0 HA GLU A 42 5.428 1.941 -12.251 1.00 0.00 H new ATOM 0 HB2 GLU A 42 6.780 -0.402 -13.651 1.00 0.00 H new ATOM 0 HB3 GLU A 42 5.843 0.841 -14.456 1.00 0.00 H new ATOM 0 HG2 GLU A 42 7.483 2.540 -13.450 1.00 0.00 H new ATOM 0 HG3 GLU A 42 8.476 1.171 -12.992 1.00 0.00 H new ATOM 627 N ASP A 43 4.470 -1.193 -11.980 1.00 0.00 N ATOM 628 CA ASP A 43 3.262 -2.009 -11.856 1.00 0.00 C ATOM 629 C ASP A 43 3.380 -2.978 -10.683 1.00 0.00 C ATOM 630 O ASP A 43 2.636 -3.956 -10.591 1.00 0.00 O ATOM 631 CB ASP A 43 2.983 -2.778 -13.156 1.00 0.00 C ATOM 632 CG ASP A 43 3.978 -3.890 -13.424 1.00 0.00 C ATOM 633 OD1 ASP A 43 5.127 -3.590 -13.803 1.00 0.00 O ATOM 634 OD2 ASP A 43 3.604 -5.074 -13.278 1.00 0.00 O ATOM 0 H ASP A 43 5.341 -1.690 -11.797 1.00 0.00 H new ATOM 0 HA ASP A 43 2.424 -1.338 -11.667 1.00 0.00 H new ATOM 0 HB2 ASP A 43 1.980 -3.202 -13.110 1.00 0.00 H new ATOM 0 HB3 ASP A 43 2.996 -2.079 -13.993 1.00 0.00 H new ATOM 639 N GLU A 44 4.291 -2.675 -9.766 1.00 0.00 N ATOM 640 CA GLU A 44 4.555 -3.550 -8.627 1.00 0.00 C ATOM 641 C GLU A 44 4.509 -2.775 -7.315 1.00 0.00 C ATOM 642 O GLU A 44 4.887 -1.607 -7.259 1.00 0.00 O ATOM 643 CB GLU A 44 5.927 -4.205 -8.780 1.00 0.00 C ATOM 644 CG GLU A 44 6.072 -5.012 -10.053 1.00 0.00 C ATOM 645 CD GLU A 44 7.511 -5.362 -10.360 1.00 0.00 C ATOM 646 OE1 GLU A 44 8.208 -4.526 -10.974 1.00 0.00 O ATOM 647 OE2 GLU A 44 7.952 -6.470 -9.990 1.00 0.00 O ATOM 0 H GLU A 44 4.861 -1.829 -9.788 1.00 0.00 H new ATOM 0 HA GLU A 44 3.780 -4.316 -8.605 1.00 0.00 H new ATOM 0 HB2 GLU A 44 6.695 -3.431 -8.760 1.00 0.00 H new ATOM 0 HB3 GLU A 44 6.108 -4.855 -7.924 1.00 0.00 H new ATOM 0 HG2 GLU A 44 5.490 -5.929 -9.965 1.00 0.00 H new ATOM 0 HG3 GLU A 44 5.654 -4.447 -10.886 1.00 0.00 H new ATOM 654 N VAL A 45 4.029 -3.426 -6.271 1.00 0.00 N ATOM 655 CA VAL A 45 4.020 -2.840 -4.933 1.00 0.00 C ATOM 656 C VAL A 45 4.892 -3.659 -3.985 1.00 0.00 C ATOM 657 O VAL A 45 4.667 -4.853 -3.803 1.00 0.00 O ATOM 658 CB VAL A 45 2.590 -2.761 -4.349 1.00 0.00 C ATOM 659 CG1 VAL A 45 2.613 -2.250 -2.914 1.00 0.00 C ATOM 660 CG2 VAL A 45 1.711 -1.864 -5.203 1.00 0.00 C ATOM 0 H VAL A 45 3.637 -4.366 -6.320 1.00 0.00 H new ATOM 0 HA VAL A 45 4.416 -1.829 -5.027 1.00 0.00 H new ATOM 0 HB VAL A 45 2.174 -3.769 -4.351 1.00 0.00 H new ATOM 0 HG11 VAL A 45 1.595 -2.204 -2.528 1.00 0.00 H new ATOM 0 HG12 VAL A 45 3.205 -2.925 -2.297 1.00 0.00 H new ATOM 0 HG13 VAL A 45 3.055 -1.254 -2.889 1.00 0.00 H new ATOM 0 HG21 VAL A 45 0.709 -1.822 -4.775 1.00 0.00 H new ATOM 0 HG22 VAL A 45 2.135 -0.860 -5.233 1.00 0.00 H new ATOM 0 HG23 VAL A 45 1.656 -2.265 -6.215 1.00 0.00 H new ATOM 670 N VAL A 46 5.898 -3.025 -3.402 1.00 0.00 N ATOM 671 CA VAL A 46 6.717 -3.677 -2.390 1.00 0.00 C ATOM 672 C VAL A 46 6.403 -3.089 -1.022 1.00 0.00 C ATOM 673 O VAL A 46 6.491 -1.876 -0.826 1.00 0.00 O ATOM 674 CB VAL A 46 8.231 -3.526 -2.677 1.00 0.00 C ATOM 675 CG1 VAL A 46 9.067 -4.119 -1.545 1.00 0.00 C ATOM 676 CG2 VAL A 46 8.601 -4.182 -4.002 1.00 0.00 C ATOM 0 H VAL A 46 6.167 -2.063 -3.611 1.00 0.00 H new ATOM 0 HA VAL A 46 6.478 -4.740 -2.411 1.00 0.00 H new ATOM 0 HB VAL A 46 8.449 -2.460 -2.744 1.00 0.00 H new ATOM 0 HG11 VAL A 46 10.126 -3.999 -1.773 1.00 0.00 H new ATOM 0 HG12 VAL A 46 8.836 -3.603 -0.613 1.00 0.00 H new ATOM 0 HG13 VAL A 46 8.837 -5.179 -1.439 1.00 0.00 H new ATOM 0 HG21 VAL A 46 9.669 -4.063 -4.181 1.00 0.00 H new ATOM 0 HG22 VAL A 46 8.356 -5.243 -3.963 1.00 0.00 H new ATOM 0 HG23 VAL A 46 8.043 -3.710 -4.810 1.00 0.00 H new ATOM 686 N GLU A 47 6.026 -3.942 -0.083 1.00 0.00 N ATOM 687 CA GLU A 47 5.703 -3.490 1.258 1.00 0.00 C ATOM 688 C GLU A 47 6.744 -3.988 2.244 1.00 0.00 C ATOM 689 O GLU A 47 7.082 -5.175 2.267 1.00 0.00 O ATOM 690 CB GLU A 47 4.308 -3.966 1.672 1.00 0.00 C ATOM 691 CG GLU A 47 3.834 -3.404 3.005 1.00 0.00 C ATOM 692 CD GLU A 47 2.473 -3.931 3.410 1.00 0.00 C ATOM 693 OE1 GLU A 47 1.455 -3.423 2.894 1.00 0.00 O ATOM 694 OE2 GLU A 47 2.407 -4.850 4.250 1.00 0.00 O ATOM 0 H GLU A 47 5.937 -4.948 -0.225 1.00 0.00 H new ATOM 0 HA GLU A 47 5.706 -2.400 1.262 1.00 0.00 H new ATOM 0 HB2 GLU A 47 3.595 -3.686 0.897 1.00 0.00 H new ATOM 0 HB3 GLU A 47 4.308 -5.055 1.727 1.00 0.00 H new ATOM 0 HG2 GLU A 47 4.560 -3.653 3.779 1.00 0.00 H new ATOM 0 HG3 GLU A 47 3.794 -2.316 2.943 1.00 0.00 H new ATOM 701 N THR A 48 7.269 -3.073 3.029 1.00 0.00 N ATOM 702 CA THR A 48 8.228 -3.402 4.057 1.00 0.00 C ATOM 703 C THR A 48 7.621 -3.192 5.440 1.00 0.00 C ATOM 704 O THR A 48 7.124 -2.110 5.753 1.00 0.00 O ATOM 705 CB THR A 48 9.502 -2.551 3.911 1.00 0.00 C ATOM 706 OG1 THR A 48 9.203 -1.324 3.233 1.00 0.00 O ATOM 707 CG2 THR A 48 10.581 -3.299 3.150 1.00 0.00 C ATOM 0 H THR A 48 7.042 -2.080 2.972 1.00 0.00 H new ATOM 0 HA THR A 48 8.496 -4.452 3.943 1.00 0.00 H new ATOM 0 HB THR A 48 9.873 -2.335 4.913 1.00 0.00 H new ATOM 0 HG1 THR A 48 9.032 -0.619 3.892 1.00 0.00 H new ATOM 0 HG21 THR A 48 11.468 -2.671 3.064 1.00 0.00 H new ATOM 0 HG22 THR A 48 10.835 -4.214 3.685 1.00 0.00 H new ATOM 0 HG23 THR A 48 10.216 -3.550 2.154 1.00 0.00 H new ATOM 715 N GLU A 49 7.657 -4.228 6.263 1.00 0.00 N ATOM 716 CA GLU A 49 7.081 -4.154 7.597 1.00 0.00 C ATOM 717 C GLU A 49 8.182 -3.896 8.613 1.00 0.00 C ATOM 718 O GLU A 49 9.192 -4.598 8.632 1.00 0.00 O ATOM 719 CB GLU A 49 6.350 -5.454 7.943 1.00 0.00 C ATOM 720 CG GLU A 49 5.345 -5.888 6.890 1.00 0.00 C ATOM 721 CD GLU A 49 4.649 -7.185 7.246 1.00 0.00 C ATOM 722 OE1 GLU A 49 5.293 -8.253 7.167 1.00 0.00 O ATOM 723 OE2 GLU A 49 3.447 -7.146 7.596 1.00 0.00 O ATOM 0 H GLU A 49 8.078 -5.128 6.032 1.00 0.00 H new ATOM 0 HA GLU A 49 6.361 -3.336 7.622 1.00 0.00 H new ATOM 0 HB2 GLU A 49 7.084 -6.248 8.081 1.00 0.00 H new ATOM 0 HB3 GLU A 49 5.834 -5.328 8.895 1.00 0.00 H new ATOM 0 HG2 GLU A 49 4.599 -5.104 6.760 1.00 0.00 H new ATOM 0 HG3 GLU A 49 5.854 -6.004 5.933 1.00 0.00 H new ATOM 730 N VAL A 50 7.991 -2.879 9.442 1.00 0.00 N ATOM 731 CA VAL A 50 8.995 -2.509 10.431 1.00 0.00 C ATOM 732 C VAL A 50 8.722 -3.214 11.752 1.00 0.00 C ATOM 733 O VAL A 50 7.733 -2.932 12.433 1.00 0.00 O ATOM 734 CB VAL A 50 9.027 -0.982 10.662 1.00 0.00 C ATOM 735 CG1 VAL A 50 10.145 -0.603 11.621 1.00 0.00 C ATOM 736 CG2 VAL A 50 9.171 -0.238 9.341 1.00 0.00 C ATOM 0 H VAL A 50 7.153 -2.297 9.450 1.00 0.00 H new ATOM 0 HA VAL A 50 9.965 -2.820 10.043 1.00 0.00 H new ATOM 0 HB VAL A 50 8.080 -0.688 11.114 1.00 0.00 H new ATOM 0 HG11 VAL A 50 10.148 0.477 11.768 1.00 0.00 H new ATOM 0 HG12 VAL A 50 9.987 -1.099 12.579 1.00 0.00 H new ATOM 0 HG13 VAL A 50 11.103 -0.915 11.205 1.00 0.00 H new ATOM 0 HG21 VAL A 50 9.191 0.836 9.528 1.00 0.00 H new ATOM 0 HG22 VAL A 50 10.098 -0.539 8.853 1.00 0.00 H new ATOM 0 HG23 VAL A 50 8.327 -0.478 8.695 1.00 0.00 H new ATOM 746 N MET A 51 9.617 -4.119 12.106 1.00 0.00 N ATOM 747 CA MET A 51 9.474 -4.931 13.298 1.00 0.00 C ATOM 748 C MET A 51 10.537 -4.562 14.323 1.00 0.00 C ATOM 749 O MET A 51 11.556 -3.959 13.975 1.00 0.00 O ATOM 750 CB MET A 51 9.605 -6.401 12.915 1.00 0.00 C ATOM 751 CG MET A 51 8.479 -6.904 12.029 1.00 0.00 C ATOM 752 SD MET A 51 8.711 -8.616 11.513 1.00 0.00 S ATOM 753 CE MET A 51 7.312 -8.816 10.412 1.00 0.00 C ATOM 0 H MET A 51 10.465 -4.311 11.573 1.00 0.00 H new ATOM 0 HA MET A 51 8.495 -4.752 13.742 1.00 0.00 H new ATOM 0 HB2 MET A 51 10.554 -6.550 12.401 1.00 0.00 H new ATOM 0 HB3 MET A 51 9.637 -7.003 13.823 1.00 0.00 H new ATOM 0 HG2 MET A 51 7.534 -6.815 12.564 1.00 0.00 H new ATOM 0 HG3 MET A 51 8.406 -6.269 11.146 1.00 0.00 H new ATOM 0 HE1 MET A 51 7.310 -9.828 10.006 1.00 0.00 H new ATOM 0 HE2 MET A 51 6.388 -8.645 10.964 1.00 0.00 H new ATOM 0 HE3 MET A 51 7.386 -8.097 9.596 1.00 0.00 H new ATOM 763 N GLU A 52 10.309 -4.936 15.575 1.00 0.00 N ATOM 764 CA GLU A 52 11.219 -4.580 16.655 1.00 0.00 C ATOM 765 C GLU A 52 12.472 -5.446 16.613 1.00 0.00 C ATOM 766 O GLU A 52 12.390 -6.675 16.615 1.00 0.00 O ATOM 767 CB GLU A 52 10.528 -4.740 18.010 1.00 0.00 C ATOM 768 CG GLU A 52 11.384 -4.301 19.188 1.00 0.00 C ATOM 769 CD GLU A 52 11.694 -2.819 19.159 1.00 0.00 C ATOM 770 OE1 GLU A 52 10.862 -2.028 19.649 1.00 0.00 O ATOM 771 OE2 GLU A 52 12.767 -2.439 18.646 1.00 0.00 O ATOM 0 H GLU A 52 9.501 -5.486 15.868 1.00 0.00 H new ATOM 0 HA GLU A 52 11.508 -3.537 16.522 1.00 0.00 H new ATOM 0 HB2 GLU A 52 9.604 -4.161 18.008 1.00 0.00 H new ATOM 0 HB3 GLU A 52 10.249 -5.785 18.144 1.00 0.00 H new ATOM 0 HG2 GLU A 52 10.869 -4.543 20.118 1.00 0.00 H new ATOM 0 HG3 GLU A 52 12.317 -4.864 19.185 1.00 0.00 H new ATOM 778 N GLY A 53 13.628 -4.797 16.544 1.00 0.00 N ATOM 779 CA GLY A 53 14.890 -5.512 16.563 1.00 0.00 C ATOM 780 C GLY A 53 15.256 -6.082 15.209 1.00 0.00 C ATOM 781 O GLY A 53 16.372 -6.552 15.004 1.00 0.00 O ATOM 0 H GLY A 53 13.714 -3.783 16.475 1.00 0.00 H new ATOM 0 HA2 GLY A 53 15.680 -4.839 16.895 1.00 0.00 H new ATOM 0 HA3 GLY A 53 14.834 -6.321 17.291 1.00 0.00 H new ATOM 785 N ARG A 54 14.307 -6.052 14.289 1.00 0.00 N ATOM 786 CA ARG A 54 14.519 -6.577 12.952 1.00 0.00 C ATOM 787 C ARG A 54 14.846 -5.451 11.987 1.00 0.00 C ATOM 788 O ARG A 54 15.964 -5.333 11.489 1.00 0.00 O ATOM 789 CB ARG A 54 13.252 -7.275 12.474 1.00 0.00 C ATOM 790 CG ARG A 54 12.647 -8.203 13.502 1.00 0.00 C ATOM 791 CD ARG A 54 13.392 -9.523 13.576 1.00 0.00 C ATOM 792 NE ARG A 54 12.773 -10.442 14.528 1.00 0.00 N ATOM 793 CZ ARG A 54 12.766 -11.765 14.386 1.00 0.00 C ATOM 794 NH1 ARG A 54 13.351 -12.325 13.329 1.00 0.00 N ATOM 795 NH2 ARG A 54 12.165 -12.525 15.296 1.00 0.00 N ATOM 0 H ARG A 54 13.376 -5.666 14.446 1.00 0.00 H new ATOM 0 HA ARG A 54 15.351 -7.281 12.983 1.00 0.00 H new ATOM 0 HB2 ARG A 54 12.514 -6.521 12.198 1.00 0.00 H new ATOM 0 HB3 ARG A 54 13.479 -7.844 11.572 1.00 0.00 H new ATOM 0 HG2 ARG A 54 12.662 -7.722 14.480 1.00 0.00 H new ATOM 0 HG3 ARG A 54 11.602 -8.389 13.254 1.00 0.00 H new ATOM 0 HD2 ARG A 54 13.415 -9.984 12.588 1.00 0.00 H new ATOM 0 HD3 ARG A 54 14.427 -9.341 13.867 1.00 0.00 H new ATOM 0 HE ARG A 54 12.319 -10.046 15.351 1.00 0.00 H new ATOM 0 HH11 ARG A 54 13.805 -11.740 12.628 1.00 0.00 H new ATOM 0 HH12 ARG A 54 13.345 -13.339 13.221 1.00 0.00 H new ATOM 0 HH21 ARG A 54 11.711 -12.094 16.101 1.00 0.00 H new ATOM 0 HH22 ARG A 54 12.158 -13.539 15.189 1.00 0.00 H new ATOM 809 N GLY A 55 13.847 -4.623 11.744 1.00 0.00 N ATOM 810 CA GLY A 55 13.969 -3.560 10.776 1.00 0.00 C ATOM 811 C GLY A 55 12.857 -3.638 9.758 1.00 0.00 C ATOM 812 O GLY A 55 11.726 -3.983 10.108 1.00 0.00 O ATOM 0 H GLY A 55 12.940 -4.670 12.208 1.00 0.00 H new ATOM 0 HA2 GLY A 55 13.939 -2.595 11.282 1.00 0.00 H new ATOM 0 HA3 GLY A 55 14.934 -3.627 10.274 1.00 0.00 H new ATOM 816 N GLU A 56 13.167 -3.335 8.507 1.00 0.00 N ATOM 817 CA GLU A 56 12.194 -3.428 7.439 1.00 0.00 C ATOM 818 C GLU A 56 12.312 -4.761 6.722 1.00 0.00 C ATOM 819 O GLU A 56 13.359 -5.099 6.168 1.00 0.00 O ATOM 820 CB GLU A 56 12.393 -2.286 6.451 1.00 0.00 C ATOM 821 CG GLU A 56 12.209 -0.915 7.068 1.00 0.00 C ATOM 822 CD GLU A 56 12.404 0.199 6.065 1.00 0.00 C ATOM 823 OE1 GLU A 56 13.543 0.377 5.584 1.00 0.00 O ATOM 824 OE2 GLU A 56 11.419 0.894 5.736 1.00 0.00 O ATOM 0 H GLU A 56 14.091 -3.021 8.209 1.00 0.00 H new ATOM 0 HA GLU A 56 11.197 -3.356 7.873 1.00 0.00 H new ATOM 0 HB2 GLU A 56 13.395 -2.353 6.027 1.00 0.00 H new ATOM 0 HB3 GLU A 56 11.689 -2.402 5.627 1.00 0.00 H new ATOM 0 HG2 GLU A 56 11.209 -0.844 7.496 1.00 0.00 H new ATOM 0 HG3 GLU A 56 12.917 -0.790 7.888 1.00 0.00 H new ATOM 831 N VAL A 57 11.224 -5.502 6.741 1.00 0.00 N ATOM 832 CA VAL A 57 11.155 -6.804 6.100 1.00 0.00 C ATOM 833 C VAL A 57 10.354 -6.698 4.805 1.00 0.00 C ATOM 834 O VAL A 57 9.219 -6.225 4.813 1.00 0.00 O ATOM 835 CB VAL A 57 10.501 -7.831 7.047 1.00 0.00 C ATOM 836 CG1 VAL A 57 10.280 -9.166 6.352 1.00 0.00 C ATOM 837 CG2 VAL A 57 11.345 -8.016 8.301 1.00 0.00 C ATOM 0 H VAL A 57 10.359 -5.220 7.202 1.00 0.00 H new ATOM 0 HA VAL A 57 12.166 -7.140 5.868 1.00 0.00 H new ATOM 0 HB VAL A 57 9.525 -7.441 7.337 1.00 0.00 H new ATOM 0 HG11 VAL A 57 9.818 -9.866 7.048 1.00 0.00 H new ATOM 0 HG12 VAL A 57 9.626 -9.024 5.492 1.00 0.00 H new ATOM 0 HG13 VAL A 57 11.238 -9.565 6.018 1.00 0.00 H new ATOM 0 HG21 VAL A 57 10.868 -8.744 8.957 1.00 0.00 H new ATOM 0 HG22 VAL A 57 12.336 -8.373 8.023 1.00 0.00 H new ATOM 0 HG23 VAL A 57 11.436 -7.063 8.822 1.00 0.00 H new ATOM 847 N GLN A 58 10.952 -7.122 3.696 1.00 0.00 N ATOM 848 CA GLN A 58 10.353 -6.936 2.390 1.00 0.00 C ATOM 849 C GLN A 58 9.429 -8.090 2.027 1.00 0.00 C ATOM 850 O GLN A 58 9.859 -9.240 1.940 1.00 0.00 O ATOM 851 CB GLN A 58 11.441 -6.822 1.327 1.00 0.00 C ATOM 852 CG GLN A 58 12.567 -5.869 1.685 1.00 0.00 C ATOM 853 CD GLN A 58 13.413 -5.492 0.482 1.00 0.00 C ATOM 854 OE1 GLN A 58 13.168 -4.478 -0.171 1.00 0.00 O ATOM 855 NE2 GLN A 58 14.394 -6.319 0.160 1.00 0.00 N ATOM 0 H GLN A 58 11.854 -7.598 3.682 1.00 0.00 H new ATOM 0 HA GLN A 58 9.766 -6.019 2.428 1.00 0.00 H new ATOM 0 HB2 GLN A 58 11.862 -7.811 1.147 1.00 0.00 H new ATOM 0 HB3 GLN A 58 10.986 -6.494 0.392 1.00 0.00 H new ATOM 0 HG2 GLN A 58 12.147 -4.966 2.128 1.00 0.00 H new ATOM 0 HG3 GLN A 58 13.202 -6.330 2.442 1.00 0.00 H new ATOM 0 HE21 GLN A 58 14.567 -7.150 0.726 1.00 0.00 H new ATOM 0 HE22 GLN A 58 14.978 -6.126 -0.654 1.00 0.00 H new ATOM 864 N LEU A 59 8.166 -7.774 1.811 1.00 0.00 N ATOM 865 CA LEU A 59 7.209 -8.750 1.321 1.00 0.00 C ATOM 866 C LEU A 59 7.346 -8.894 -0.194 1.00 0.00 C ATOM 867 O LEU A 59 7.971 -8.050 -0.842 1.00 0.00 O ATOM 868 CB LEU A 59 5.786 -8.323 1.690 1.00 0.00 C ATOM 869 CG LEU A 59 5.468 -8.370 3.182 1.00 0.00 C ATOM 870 CD1 LEU A 59 4.069 -7.841 3.445 1.00 0.00 C ATOM 871 CD2 LEU A 59 5.604 -9.787 3.714 1.00 0.00 C ATOM 0 H LEU A 59 7.777 -6.844 1.968 1.00 0.00 H new ATOM 0 HA LEU A 59 7.413 -9.715 1.786 1.00 0.00 H new ATOM 0 HB2 LEU A 59 5.622 -7.307 1.330 1.00 0.00 H new ATOM 0 HB3 LEU A 59 5.081 -8.966 1.163 1.00 0.00 H new ATOM 0 HG LEU A 59 6.184 -7.735 3.704 1.00 0.00 H new ATOM 0 HD11 LEU A 59 3.859 -7.882 4.514 1.00 0.00 H new ATOM 0 HD12 LEU A 59 4.000 -6.809 3.101 1.00 0.00 H new ATOM 0 HD13 LEU A 59 3.342 -8.452 2.909 1.00 0.00 H new ATOM 0 HD21 LEU A 59 5.373 -9.799 4.779 1.00 0.00 H new ATOM 0 HD22 LEU A 59 4.912 -10.442 3.185 1.00 0.00 H new ATOM 0 HD23 LEU A 59 6.625 -10.137 3.560 1.00 0.00 H new ATOM 883 N PRO A 60 6.794 -9.970 -0.775 1.00 0.00 N ATOM 884 CA PRO A 60 6.848 -10.191 -2.223 1.00 0.00 C ATOM 885 C PRO A 60 6.127 -9.087 -2.992 1.00 0.00 C ATOM 886 O PRO A 60 5.135 -8.531 -2.512 1.00 0.00 O ATOM 887 CB PRO A 60 6.146 -11.543 -2.420 1.00 0.00 C ATOM 888 CG PRO A 60 5.348 -11.759 -1.179 1.00 0.00 C ATOM 889 CD PRO A 60 6.082 -11.050 -0.076 1.00 0.00 C ATOM 0 HA PRO A 60 7.871 -10.184 -2.600 1.00 0.00 H new ATOM 0 HB2 PRO A 60 5.505 -11.528 -3.302 1.00 0.00 H new ATOM 0 HB3 PRO A 60 6.870 -12.344 -2.566 1.00 0.00 H new ATOM 0 HG2 PRO A 60 4.339 -11.363 -1.292 1.00 0.00 H new ATOM 0 HG3 PRO A 60 5.250 -12.822 -0.960 1.00 0.00 H new ATOM 0 HD2 PRO A 60 5.396 -10.658 0.675 1.00 0.00 H new ATOM 0 HD3 PRO A 60 6.772 -11.717 0.440 1.00 0.00 H new ATOM 897 N PHE A 61 6.638 -8.765 -4.177 1.00 0.00 N ATOM 898 CA PHE A 61 6.080 -7.686 -4.983 1.00 0.00 C ATOM 899 C PHE A 61 4.656 -8.004 -5.412 1.00 0.00 C ATOM 900 O PHE A 61 4.358 -9.098 -5.897 1.00 0.00 O ATOM 901 CB PHE A 61 6.961 -7.390 -6.208 1.00 0.00 C ATOM 902 CG PHE A 61 7.234 -8.582 -7.091 1.00 0.00 C ATOM 903 CD1 PHE A 61 8.295 -9.434 -6.820 1.00 0.00 C ATOM 904 CD2 PHE A 61 6.437 -8.844 -8.194 1.00 0.00 C ATOM 905 CE1 PHE A 61 8.554 -10.524 -7.630 1.00 0.00 C ATOM 906 CE2 PHE A 61 6.690 -9.935 -9.007 1.00 0.00 C ATOM 907 CZ PHE A 61 7.750 -10.775 -8.724 1.00 0.00 C ATOM 0 H PHE A 61 7.438 -9.237 -4.600 1.00 0.00 H new ATOM 0 HA PHE A 61 6.057 -6.791 -4.361 1.00 0.00 H new ATOM 0 HB2 PHE A 61 6.481 -6.615 -6.805 1.00 0.00 H new ATOM 0 HB3 PHE A 61 7.912 -6.984 -5.865 1.00 0.00 H new ATOM 0 HD1 PHE A 61 8.927 -9.243 -5.965 1.00 0.00 H new ATOM 0 HD2 PHE A 61 5.609 -8.189 -8.422 1.00 0.00 H new ATOM 0 HE1 PHE A 61 9.384 -11.178 -7.407 1.00 0.00 H new ATOM 0 HE2 PHE A 61 6.059 -10.130 -9.862 1.00 0.00 H new ATOM 0 HZ PHE A 61 7.949 -11.627 -9.358 1.00 0.00 H new ATOM 917 N MET A 62 3.778 -7.041 -5.203 1.00 0.00 N ATOM 918 CA MET A 62 2.376 -7.190 -5.552 1.00 0.00 C ATOM 919 C MET A 62 2.110 -6.549 -6.906 1.00 0.00 C ATOM 920 O MET A 62 2.301 -5.347 -7.075 1.00 0.00 O ATOM 921 CB MET A 62 1.495 -6.533 -4.483 1.00 0.00 C ATOM 922 CG MET A 62 1.791 -7.013 -3.071 1.00 0.00 C ATOM 923 SD MET A 62 0.830 -6.138 -1.814 1.00 0.00 S ATOM 924 CE MET A 62 1.481 -6.878 -0.314 1.00 0.00 C ATOM 0 H MET A 62 4.013 -6.139 -4.789 1.00 0.00 H new ATOM 0 HA MET A 62 2.135 -8.252 -5.605 1.00 0.00 H new ATOM 0 HB2 MET A 62 1.631 -5.452 -4.526 1.00 0.00 H new ATOM 0 HB3 MET A 62 0.449 -6.732 -4.714 1.00 0.00 H new ATOM 0 HG2 MET A 62 1.581 -8.080 -3.004 1.00 0.00 H new ATOM 0 HG3 MET A 62 2.853 -6.884 -2.864 1.00 0.00 H new ATOM 0 HE1 MET A 62 0.985 -6.440 0.552 1.00 0.00 H new ATOM 0 HE2 MET A 62 1.301 -7.953 -0.331 1.00 0.00 H new ATOM 0 HE3 MET A 62 2.553 -6.691 -0.252 1.00 0.00 H new ATOM 934 N ALA A 63 1.682 -7.349 -7.867 1.00 0.00 N ATOM 935 CA ALA A 63 1.382 -6.842 -9.197 1.00 0.00 C ATOM 936 C ALA A 63 0.000 -6.208 -9.219 1.00 0.00 C ATOM 937 O ALA A 63 -0.977 -6.828 -8.795 1.00 0.00 O ATOM 938 CB ALA A 63 1.475 -7.958 -10.225 1.00 0.00 C ATOM 0 H ALA A 63 1.534 -8.352 -7.753 1.00 0.00 H new ATOM 0 HA ALA A 63 2.117 -6.079 -9.453 1.00 0.00 H new ATOM 0 HB1 ALA A 63 1.248 -7.561 -11.214 1.00 0.00 H new ATOM 0 HB2 ALA A 63 2.484 -8.372 -10.223 1.00 0.00 H new ATOM 0 HB3 ALA A 63 0.761 -8.743 -9.976 1.00 0.00 H new ATOM 944 N TYR A 64 -0.081 -4.976 -9.699 1.00 0.00 N ATOM 945 CA TYR A 64 -1.354 -4.266 -9.743 1.00 0.00 C ATOM 946 C TYR A 64 -1.620 -3.689 -11.130 1.00 0.00 C ATOM 947 O TYR A 64 -0.752 -3.714 -12.004 1.00 0.00 O ATOM 948 CB TYR A 64 -1.401 -3.155 -8.681 1.00 0.00 C ATOM 949 CG TYR A 64 -0.474 -1.980 -8.935 1.00 0.00 C ATOM 950 CD1 TYR A 64 0.831 -1.974 -8.458 1.00 0.00 C ATOM 951 CD2 TYR A 64 -0.915 -0.861 -9.632 1.00 0.00 C ATOM 952 CE1 TYR A 64 1.664 -0.891 -8.669 1.00 0.00 C ATOM 953 CE2 TYR A 64 -0.085 0.220 -9.850 1.00 0.00 C ATOM 954 CZ TYR A 64 1.202 0.202 -9.366 1.00 0.00 C ATOM 955 OH TYR A 64 2.026 1.281 -9.573 1.00 0.00 O ATOM 0 H TYR A 64 0.713 -4.449 -10.062 1.00 0.00 H new ATOM 0 HA TYR A 64 -2.140 -4.988 -9.521 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -2.423 -2.783 -8.612 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -1.154 -3.589 -7.712 1.00 0.00 H new ATOM 0 HD1 TYR A 64 1.201 -2.830 -7.913 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -1.926 -0.837 -10.010 1.00 0.00 H new ATOM 0 HE1 TYR A 64 2.674 -0.903 -8.288 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -0.445 1.077 -10.399 1.00 0.00 H new ATOM 0 HH TYR A 64 2.959 0.982 -9.586 1.00 0.00 H new ATOM 965 N LYS A 65 -2.830 -3.171 -11.316 1.00 0.00 N ATOM 966 CA LYS A 65 -3.234 -2.545 -12.565 1.00 0.00 C ATOM 967 C LYS A 65 -3.636 -1.108 -12.324 1.00 0.00 C ATOM 968 O LYS A 65 -3.967 -0.713 -11.208 1.00 0.00 O ATOM 969 CB LYS A 65 -4.439 -3.248 -13.190 1.00 0.00 C ATOM 970 CG LYS A 65 -4.210 -4.680 -13.617 1.00 0.00 C ATOM 971 CD LYS A 65 -5.513 -5.275 -14.133 1.00 0.00 C ATOM 972 CE LYS A 65 -5.399 -6.749 -14.472 1.00 0.00 C ATOM 973 NZ LYS A 65 -6.703 -7.295 -14.944 1.00 0.00 N ATOM 0 H LYS A 65 -3.558 -3.175 -10.602 1.00 0.00 H new ATOM 0 HA LYS A 65 -2.378 -2.612 -13.237 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -5.260 -3.228 -12.474 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -4.760 -2.675 -14.060 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -3.447 -4.720 -14.395 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -3.839 -5.266 -12.776 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -6.290 -5.140 -13.381 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -5.830 -4.727 -15.021 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -4.642 -6.890 -15.243 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -5.066 -7.302 -13.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -6.596 -8.305 -15.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -7.418 -7.181 -14.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -7.007 -6.781 -15.796 1.00 0.00 H new ATOM 987 N VAL A 66 -3.614 -0.347 -13.388 1.00 0.00 N ATOM 988 CA VAL A 66 -4.050 1.034 -13.358 1.00 0.00 C ATOM 989 C VAL A 66 -5.430 1.153 -13.993 1.00 0.00 C ATOM 990 O VAL A 66 -5.624 0.775 -15.149 1.00 0.00 O ATOM 991 CB VAL A 66 -3.046 1.945 -14.089 1.00 0.00 C ATOM 992 CG1 VAL A 66 -3.559 3.376 -14.158 1.00 0.00 C ATOM 993 CG2 VAL A 66 -1.690 1.904 -13.402 1.00 0.00 C ATOM 0 H VAL A 66 -3.294 -0.664 -14.303 1.00 0.00 H new ATOM 0 HA VAL A 66 -4.104 1.357 -12.318 1.00 0.00 H new ATOM 0 HB VAL A 66 -2.934 1.573 -15.107 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -2.832 3.999 -14.679 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -4.506 3.397 -14.696 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -3.707 3.759 -13.148 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.994 2.554 -13.932 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -1.793 2.246 -12.372 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -1.310 0.882 -13.408 1.00 0.00 H new ATOM 1003 N ILE A 67 -6.390 1.644 -13.226 1.00 0.00 N ATOM 1004 CA ILE A 67 -7.743 1.823 -13.725 1.00 0.00 C ATOM 1005 C ILE A 67 -7.872 3.181 -14.383 1.00 0.00 C ATOM 1006 O ILE A 67 -8.267 3.293 -15.543 1.00 0.00 O ATOM 1007 CB ILE A 67 -8.793 1.734 -12.600 1.00 0.00 C ATOM 1008 CG1 ILE A 67 -8.537 0.515 -11.716 1.00 0.00 C ATOM 1009 CG2 ILE A 67 -10.198 1.679 -13.188 1.00 0.00 C ATOM 1010 CD1 ILE A 67 -9.533 0.375 -10.584 1.00 0.00 C ATOM 0 H ILE A 67 -6.257 1.926 -12.255 1.00 0.00 H new ATOM 0 HA ILE A 67 -7.927 1.021 -14.440 1.00 0.00 H new ATOM 0 HB ILE A 67 -8.709 2.628 -11.982 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -8.568 -0.384 -12.331 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -7.532 0.582 -11.300 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -10.928 1.616 -12.381 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -10.382 2.579 -13.775 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -10.290 0.802 -13.829 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -9.293 -0.511 -9.996 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -9.486 1.258 -9.946 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -10.538 0.277 -10.994 1.00 0.00 H new ATOM 1022 N SER A 68 -7.506 4.206 -13.629 1.00 0.00 N ATOM 1023 CA SER A 68 -7.676 5.581 -14.068 1.00 0.00 C ATOM 1024 C SER A 68 -6.428 6.393 -13.745 1.00 0.00 C ATOM 1025 O SER A 68 -5.702 6.077 -12.801 1.00 0.00 O ATOM 1026 CB SER A 68 -8.880 6.203 -13.366 1.00 0.00 C ATOM 1027 OG SER A 68 -9.910 5.243 -13.161 1.00 0.00 O ATOM 0 H SER A 68 -7.087 4.109 -12.704 1.00 0.00 H new ATOM 0 HA SER A 68 -7.839 5.587 -15.146 1.00 0.00 H new ATOM 0 HB2 SER A 68 -8.570 6.618 -12.407 1.00 0.00 H new ATOM 0 HB3 SER A 68 -9.264 7.031 -13.962 1.00 0.00 H new ATOM 0 HG SER A 68 -10.095 5.161 -12.202 1.00 0.00 H new ATOM 1033 N GLN A 69 -6.190 7.438 -14.519 1.00 0.00 N ATOM 1034 CA GLN A 69 -5.031 8.292 -14.306 1.00 0.00 C ATOM 1035 C GLN A 69 -5.332 9.731 -14.691 1.00 0.00 C ATOM 1036 O GLN A 69 -5.736 10.024 -15.817 1.00 0.00 O ATOM 1037 CB GLN A 69 -3.828 7.789 -15.100 1.00 0.00 C ATOM 1038 CG GLN A 69 -2.573 8.634 -14.920 1.00 0.00 C ATOM 1039 CD GLN A 69 -1.411 8.151 -15.768 1.00 0.00 C ATOM 1040 OE1 GLN A 69 -1.244 8.568 -16.914 1.00 0.00 O ATOM 1041 NE2 GLN A 69 -0.598 7.269 -15.209 1.00 0.00 N ATOM 0 H GLN A 69 -6.783 7.717 -15.301 1.00 0.00 H new ATOM 0 HA GLN A 69 -4.792 8.257 -13.243 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -3.610 6.764 -14.800 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -4.088 7.763 -16.158 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -2.798 9.669 -15.176 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -2.280 8.622 -13.870 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -0.771 6.948 -14.256 1.00 0.00 H new ATOM 0 HE22 GLN A 69 0.202 6.910 -15.731 1.00 0.00 H new ATOM 1050 N SER A 70 -5.120 10.618 -13.746 1.00 0.00 N ATOM 1051 CA SER A 70 -5.301 12.040 -13.969 1.00 0.00 C ATOM 1052 C SER A 70 -3.951 12.741 -14.000 1.00 0.00 C ATOM 1053 O SER A 70 -3.820 13.830 -14.558 1.00 0.00 O ATOM 1054 CB SER A 70 -6.179 12.633 -12.866 1.00 0.00 C ATOM 1055 OG SER A 70 -6.433 14.011 -13.077 1.00 0.00 O ATOM 0 H SER A 70 -4.818 10.378 -12.802 1.00 0.00 H new ATOM 0 HA SER A 70 -5.794 12.188 -14.930 1.00 0.00 H new ATOM 0 HB2 SER A 70 -7.124 12.092 -12.824 1.00 0.00 H new ATOM 0 HB3 SER A 70 -5.691 12.497 -11.901 1.00 0.00 H new ATOM 0 HG SER A 70 -6.998 14.354 -12.353 1.00 0.00 H new ATOM 1061 N THR A 71 -2.957 12.101 -13.382 1.00 0.00 N ATOM 1062 CA THR A 71 -1.593 12.628 -13.305 1.00 0.00 C ATOM 1063 C THR A 71 -1.487 13.792 -12.317 1.00 0.00 C ATOM 1064 O THR A 71 -0.512 13.899 -11.576 1.00 0.00 O ATOM 1065 CB THR A 71 -1.079 13.066 -14.691 1.00 0.00 C ATOM 1066 OG1 THR A 71 -1.265 12.007 -15.640 1.00 0.00 O ATOM 1067 CG2 THR A 71 0.394 13.448 -14.641 1.00 0.00 C ATOM 0 H THR A 71 -3.075 11.200 -12.919 1.00 0.00 H new ATOM 0 HA THR A 71 -0.965 11.815 -12.942 1.00 0.00 H new ATOM 0 HB THR A 71 -1.651 13.942 -14.997 1.00 0.00 H new ATOM 0 HG1 THR A 71 -0.938 12.293 -16.518 1.00 0.00 H new ATOM 0 HG21 THR A 71 0.725 13.752 -15.634 1.00 0.00 H new ATOM 0 HG22 THR A 71 0.532 14.274 -13.944 1.00 0.00 H new ATOM 0 HG23 THR A 71 0.981 12.592 -14.309 1.00 0.00 H new ATOM 1075 N ASP A 72 -2.500 14.641 -12.294 1.00 0.00 N ATOM 1076 CA ASP A 72 -2.488 15.820 -11.435 1.00 0.00 C ATOM 1077 C ASP A 72 -3.271 15.582 -10.154 1.00 0.00 C ATOM 1078 O ASP A 72 -2.725 15.680 -9.055 1.00 0.00 O ATOM 1079 CB ASP A 72 -3.058 17.026 -12.182 1.00 0.00 C ATOM 1080 CG ASP A 72 -3.218 18.247 -11.293 1.00 0.00 C ATOM 1081 OD1 ASP A 72 -2.193 18.821 -10.867 1.00 0.00 O ATOM 1082 OD2 ASP A 72 -4.372 18.653 -11.037 1.00 0.00 O ATOM 0 H ASP A 72 -3.343 14.539 -12.859 1.00 0.00 H new ATOM 0 HA ASP A 72 -1.452 16.023 -11.164 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -2.402 17.274 -13.017 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -4.027 16.761 -12.605 1.00 0.00 H new ATOM 1087 N GLY A 73 -4.547 15.270 -10.305 1.00 0.00 N ATOM 1088 CA GLY A 73 -5.406 15.092 -9.153 1.00 0.00 C ATOM 1089 C GLY A 73 -5.211 13.758 -8.465 1.00 0.00 C ATOM 1090 O GLY A 73 -4.839 13.710 -7.289 1.00 0.00 O ATOM 0 H GLY A 73 -5.005 15.136 -11.206 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -5.216 15.893 -8.439 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -6.446 15.184 -9.466 1.00 0.00 H new ATOM 1094 N SER A 74 -5.449 12.672 -9.187 1.00 0.00 N ATOM 1095 CA SER A 74 -5.402 11.349 -8.587 1.00 0.00 C ATOM 1096 C SER A 74 -5.071 10.277 -9.618 1.00 0.00 C ATOM 1097 O SER A 74 -5.123 10.511 -10.828 1.00 0.00 O ATOM 1098 CB SER A 74 -6.751 11.037 -7.919 1.00 0.00 C ATOM 1099 OG SER A 74 -6.719 9.802 -7.225 1.00 0.00 O ATOM 0 H SER A 74 -5.675 12.681 -10.182 1.00 0.00 H new ATOM 0 HA SER A 74 -4.610 11.345 -7.838 1.00 0.00 H new ATOM 0 HB2 SER A 74 -7.007 11.838 -7.225 1.00 0.00 H new ATOM 0 HB3 SER A 74 -7.534 11.009 -8.677 1.00 0.00 H new ATOM 0 HG SER A 74 -5.869 9.718 -6.745 1.00 0.00 H new ATOM 1105 N ILE A 75 -4.703 9.110 -9.108 1.00 0.00 N ATOM 1106 CA ILE A 75 -4.508 7.911 -9.912 1.00 0.00 C ATOM 1107 C ILE A 75 -5.207 6.746 -9.219 1.00 0.00 C ATOM 1108 O ILE A 75 -5.115 6.607 -8.000 1.00 0.00 O ATOM 1109 CB ILE A 75 -3.010 7.563 -10.101 1.00 0.00 C ATOM 1110 CG1 ILE A 75 -2.252 8.757 -10.692 1.00 0.00 C ATOM 1111 CG2 ILE A 75 -2.855 6.334 -10.990 1.00 0.00 C ATOM 1112 CD1 ILE A 75 -0.818 8.452 -11.063 1.00 0.00 C ATOM 0 H ILE A 75 -4.529 8.967 -8.113 1.00 0.00 H new ATOM 0 HA ILE A 75 -4.927 8.096 -10.901 1.00 0.00 H new ATOM 0 HB ILE A 75 -2.583 7.335 -9.125 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -2.780 9.106 -11.579 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -2.264 9.575 -9.971 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -1.796 6.104 -11.112 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -3.360 5.485 -10.529 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -3.298 6.533 -11.966 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -0.350 9.347 -11.474 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -0.273 8.132 -10.175 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -0.796 7.657 -11.808 1.00 0.00 H new ATOM 1124 N GLU A 76 -5.913 5.928 -9.980 1.00 0.00 N ATOM 1125 CA GLU A 76 -6.666 4.822 -9.406 1.00 0.00 C ATOM 1126 C GLU A 76 -6.098 3.493 -9.879 1.00 0.00 C ATOM 1127 O GLU A 76 -5.883 3.290 -11.075 1.00 0.00 O ATOM 1128 CB GLU A 76 -8.142 4.936 -9.779 1.00 0.00 C ATOM 1129 CG GLU A 76 -9.036 3.955 -9.039 1.00 0.00 C ATOM 1130 CD GLU A 76 -10.499 4.326 -9.127 1.00 0.00 C ATOM 1131 OE1 GLU A 76 -11.012 4.485 -10.254 1.00 0.00 O ATOM 1132 OE2 GLU A 76 -11.145 4.454 -8.064 1.00 0.00 O ATOM 0 H GLU A 76 -5.982 6.007 -10.995 1.00 0.00 H new ATOM 0 HA GLU A 76 -6.579 4.867 -8.320 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -8.482 5.951 -9.573 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -8.250 4.775 -10.852 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -8.892 2.956 -9.450 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -8.737 3.915 -7.992 1.00 0.00 H new ATOM 1139 N ILE A 77 -5.865 2.595 -8.933 1.00 0.00 N ATOM 1140 CA ILE A 77 -5.222 1.319 -9.219 1.00 0.00 C ATOM 1141 C ILE A 77 -5.996 0.161 -8.596 1.00 0.00 C ATOM 1142 O ILE A 77 -6.769 0.353 -7.660 1.00 0.00 O ATOM 1143 CB ILE A 77 -3.767 1.289 -8.699 1.00 0.00 C ATOM 1144 CG1 ILE A 77 -3.723 1.549 -7.188 1.00 0.00 C ATOM 1145 CG2 ILE A 77 -2.918 2.314 -9.440 1.00 0.00 C ATOM 1146 CD1 ILE A 77 -2.334 1.455 -6.584 1.00 0.00 C ATOM 0 H ILE A 77 -6.114 2.728 -7.953 1.00 0.00 H new ATOM 0 HA ILE A 77 -5.214 1.207 -10.303 1.00 0.00 H new ATOM 0 HB ILE A 77 -3.358 0.296 -8.886 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -4.128 2.541 -6.989 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -4.375 0.833 -6.688 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -1.896 2.281 -9.063 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -2.919 2.085 -10.506 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -3.331 3.310 -9.283 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -2.389 1.652 -5.513 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -1.932 0.455 -6.749 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -1.682 2.190 -7.055 1.00 0.00 H new ATOM 1158 N GLN A 78 -5.798 -1.033 -9.129 1.00 0.00 N ATOM 1159 CA GLN A 78 -6.441 -2.227 -8.599 1.00 0.00 C ATOM 1160 C GLN A 78 -5.407 -3.331 -8.427 1.00 0.00 C ATOM 1161 O GLN A 78 -4.521 -3.483 -9.263 1.00 0.00 O ATOM 1162 CB GLN A 78 -7.559 -2.690 -9.534 1.00 0.00 C ATOM 1163 CG GLN A 78 -8.344 -3.871 -8.996 1.00 0.00 C ATOM 1164 CD GLN A 78 -9.556 -4.203 -9.842 1.00 0.00 C ATOM 1165 OE1 GLN A 78 -9.553 -4.008 -11.061 1.00 0.00 O ATOM 1166 NE2 GLN A 78 -10.607 -4.695 -9.199 1.00 0.00 N ATOM 0 H GLN A 78 -5.194 -1.203 -9.933 1.00 0.00 H new ATOM 0 HA GLN A 78 -6.879 -1.993 -7.629 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -8.242 -1.859 -9.711 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -7.128 -2.959 -10.498 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -7.692 -4.743 -8.946 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -8.666 -3.654 -7.977 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -10.566 -4.840 -8.190 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -11.456 -4.928 -9.713 1.00 0.00 H new ATOM 1175 N TYR A 79 -5.515 -4.092 -7.347 1.00 0.00 N ATOM 1176 CA TYR A 79 -4.537 -5.132 -7.053 1.00 0.00 C ATOM 1177 C TYR A 79 -4.899 -6.435 -7.753 1.00 0.00 C ATOM 1178 O TYR A 79 -5.906 -6.517 -8.458 1.00 0.00 O ATOM 1179 CB TYR A 79 -4.436 -5.362 -5.544 1.00 0.00 C ATOM 1180 CG TYR A 79 -4.043 -4.126 -4.767 1.00 0.00 C ATOM 1181 CD1 TYR A 79 -2.803 -3.529 -4.959 1.00 0.00 C ATOM 1182 CD2 TYR A 79 -4.909 -3.556 -3.847 1.00 0.00 C ATOM 1183 CE1 TYR A 79 -2.438 -2.399 -4.253 1.00 0.00 C ATOM 1184 CE2 TYR A 79 -4.553 -2.426 -3.136 1.00 0.00 C ATOM 1185 CZ TYR A 79 -3.315 -1.851 -3.342 1.00 0.00 C ATOM 1186 OH TYR A 79 -2.957 -0.726 -2.634 1.00 0.00 O ATOM 0 H TYR A 79 -6.266 -4.010 -6.662 1.00 0.00 H new ATOM 0 HA TYR A 79 -3.570 -4.796 -7.426 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -5.396 -5.723 -5.175 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -3.706 -6.148 -5.353 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -2.113 -3.956 -5.672 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -5.879 -4.003 -3.683 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -1.470 -1.947 -4.414 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -5.240 -1.995 -2.423 1.00 0.00 H new ATOM 0 HH TYR A 79 -2.620 -0.044 -3.252 1.00 0.00 H new ATOM 1196 N LEU A 80 -4.065 -7.446 -7.561 1.00 0.00 N ATOM 1197 CA LEU A 80 -4.293 -8.757 -8.144 1.00 0.00 C ATOM 1198 C LEU A 80 -4.050 -9.846 -7.108 1.00 0.00 C ATOM 1199 O LEU A 80 -3.779 -9.553 -5.941 1.00 0.00 O ATOM 1200 CB LEU A 80 -3.399 -8.962 -9.370 1.00 0.00 C ATOM 1201 CG LEU A 80 -3.772 -8.109 -10.585 1.00 0.00 C ATOM 1202 CD1 LEU A 80 -2.720 -8.248 -11.674 1.00 0.00 C ATOM 1203 CD2 LEU A 80 -5.141 -8.515 -11.110 1.00 0.00 C ATOM 0 H LEU A 80 -3.216 -7.380 -7.000 1.00 0.00 H new ATOM 0 HA LEU A 80 -5.332 -8.818 -8.468 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -2.368 -8.742 -9.092 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -3.434 -10.013 -9.657 1.00 0.00 H new ATOM 0 HG LEU A 80 -3.813 -7.063 -10.280 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -3.000 -7.635 -12.531 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -1.754 -7.917 -11.291 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -2.650 -9.291 -11.981 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -5.396 -7.902 -11.974 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -5.122 -9.565 -11.403 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -5.888 -8.370 -10.329 1.00 0.00 H new ATOM 1215 N GLY A 81 -4.148 -11.099 -7.530 1.00 0.00 N ATOM 1216 CA GLY A 81 -4.053 -12.195 -6.594 1.00 0.00 C ATOM 1217 C GLY A 81 -5.387 -12.431 -5.926 1.00 0.00 C ATOM 1218 O GLY A 81 -6.419 -12.119 -6.510 1.00 0.00 O ATOM 0 H GLY A 81 -4.291 -11.373 -8.502 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -3.734 -13.099 -7.113 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -3.296 -11.975 -5.842 1.00 0.00 H new ATOM 1222 N PRO A 82 -5.414 -12.974 -4.705 1.00 0.00 N ATOM 1223 CA PRO A 82 -6.662 -13.137 -3.948 1.00 0.00 C ATOM 1224 C PRO A 82 -7.287 -11.791 -3.574 1.00 0.00 C ATOM 1225 O PRO A 82 -8.407 -11.731 -3.070 1.00 0.00 O ATOM 1226 CB PRO A 82 -6.231 -13.899 -2.691 1.00 0.00 C ATOM 1227 CG PRO A 82 -4.763 -13.666 -2.573 1.00 0.00 C ATOM 1228 CD PRO A 82 -4.247 -13.490 -3.973 1.00 0.00 C ATOM 0 HA PRO A 82 -7.424 -13.657 -4.528 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -6.759 -13.535 -1.810 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -6.455 -14.962 -2.780 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -4.557 -12.782 -1.969 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -4.274 -14.508 -2.082 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -3.410 -12.792 -4.008 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -3.894 -14.432 -4.392 1.00 0.00 H new ATOM 1236 N TYR A 83 -6.553 -10.718 -3.844 1.00 0.00 N ATOM 1237 CA TYR A 83 -6.994 -9.367 -3.521 1.00 0.00 C ATOM 1238 C TYR A 83 -7.226 -8.568 -4.806 1.00 0.00 C ATOM 1239 O TYR A 83 -7.027 -7.357 -4.836 1.00 0.00 O ATOM 1240 CB TYR A 83 -5.934 -8.656 -2.663 1.00 0.00 C ATOM 1241 CG TYR A 83 -5.414 -9.479 -1.505 1.00 0.00 C ATOM 1242 CD1 TYR A 83 -6.064 -9.484 -0.278 1.00 0.00 C ATOM 1243 CD2 TYR A 83 -4.264 -10.246 -1.643 1.00 0.00 C ATOM 1244 CE1 TYR A 83 -5.584 -10.236 0.778 1.00 0.00 C ATOM 1245 CE2 TYR A 83 -3.780 -11.001 -0.595 1.00 0.00 C ATOM 1246 CZ TYR A 83 -4.441 -10.995 0.614 1.00 0.00 C ATOM 1247 OH TYR A 83 -3.958 -11.750 1.660 1.00 0.00 O ATOM 0 H TYR A 83 -5.638 -10.760 -4.292 1.00 0.00 H new ATOM 0 HA TYR A 83 -7.928 -9.431 -2.962 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -5.095 -8.377 -3.301 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -6.360 -7.731 -2.274 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -6.958 -8.892 -0.147 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -3.740 -10.251 -2.587 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -6.100 -10.230 1.727 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -2.887 -11.594 -0.722 1.00 0.00 H new ATOM 0 HH TYR A 83 -3.149 -12.223 1.375 1.00 0.00 H new ATOM 1257 N TYR A 84 -7.701 -9.242 -5.848 1.00 0.00 N ATOM 1258 CA TYR A 84 -7.769 -8.648 -7.170 1.00 0.00 C ATOM 1259 C TYR A 84 -9.037 -7.827 -7.408 1.00 0.00 C ATOM 1260 O TYR A 84 -9.003 -6.916 -8.228 1.00 0.00 O ATOM 1261 CB TYR A 84 -7.615 -9.719 -8.264 1.00 0.00 C ATOM 1262 CG TYR A 84 -8.822 -10.615 -8.455 1.00 0.00 C ATOM 1263 CD1 TYR A 84 -9.116 -11.631 -7.554 1.00 0.00 C ATOM 1264 CD2 TYR A 84 -9.663 -10.448 -9.548 1.00 0.00 C ATOM 1265 CE1 TYR A 84 -10.215 -12.448 -7.733 1.00 0.00 C ATOM 1266 CE2 TYR A 84 -10.762 -11.262 -9.734 1.00 0.00 C ATOM 1267 CZ TYR A 84 -11.032 -12.261 -8.825 1.00 0.00 C ATOM 1268 OH TYR A 84 -12.123 -13.076 -9.007 1.00 0.00 O ATOM 0 H TYR A 84 -8.044 -10.201 -5.798 1.00 0.00 H new ATOM 0 HA TYR A 84 -6.933 -7.951 -7.225 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -7.396 -9.223 -9.209 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -6.753 -10.342 -8.024 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -8.474 -11.784 -6.699 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -9.453 -9.668 -10.265 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -10.432 -13.230 -7.020 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -11.407 -11.116 -10.588 1.00 0.00 H new ATOM 0 HH TYR A 84 -12.596 -12.812 -9.824 1.00 0.00 H new ATOM 1278 N PRO A 85 -10.189 -8.099 -6.749 1.00 0.00 N ATOM 1279 CA PRO A 85 -11.372 -7.326 -7.038 1.00 0.00 C ATOM 1280 C PRO A 85 -11.422 -6.007 -6.272 1.00 0.00 C ATOM 1281 O PRO A 85 -12.319 -5.193 -6.475 1.00 0.00 O ATOM 1282 CB PRO A 85 -12.509 -8.246 -6.627 1.00 0.00 C ATOM 1283 CG PRO A 85 -11.953 -9.040 -5.494 1.00 0.00 C ATOM 1284 CD PRO A 85 -10.466 -9.151 -5.741 1.00 0.00 C ATOM 0 HA PRO A 85 -11.414 -7.028 -8.085 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -13.388 -7.679 -6.321 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -12.816 -8.890 -7.451 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -12.153 -8.550 -4.541 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -12.414 -10.027 -5.448 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -9.896 -8.987 -4.826 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -10.196 -10.140 -6.112 1.00 0.00 H new ATOM 1292 N LEU A 86 -10.450 -5.797 -5.401 1.00 0.00 N ATOM 1293 CA LEU A 86 -10.419 -4.598 -4.580 1.00 0.00 C ATOM 1294 C LEU A 86 -9.453 -3.578 -5.169 1.00 0.00 C ATOM 1295 O LEU A 86 -8.328 -3.918 -5.541 1.00 0.00 O ATOM 1296 CB LEU A 86 -10.010 -4.947 -3.149 1.00 0.00 C ATOM 1297 CG LEU A 86 -10.059 -3.784 -2.154 1.00 0.00 C ATOM 1298 CD1 LEU A 86 -11.474 -3.233 -2.042 1.00 0.00 C ATOM 1299 CD2 LEU A 86 -9.551 -4.228 -0.791 1.00 0.00 C ATOM 0 H LEU A 86 -9.673 -6.439 -5.244 1.00 0.00 H new ATOM 0 HA LEU A 86 -11.418 -4.163 -4.563 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -10.661 -5.742 -2.786 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -8.996 -5.347 -3.165 1.00 0.00 H new ATOM 0 HG LEU A 86 -9.410 -2.990 -2.523 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -11.488 -2.408 -1.330 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -11.804 -2.876 -3.018 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -12.145 -4.020 -1.698 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -9.593 -3.389 -0.096 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -10.175 -5.040 -0.417 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -8.521 -4.573 -0.881 1.00 0.00 H new ATOM 1311 N LYS A 87 -9.896 -2.331 -5.260 1.00 0.00 N ATOM 1312 CA LYS A 87 -9.074 -1.280 -5.833 1.00 0.00 C ATOM 1313 C LYS A 87 -8.647 -0.273 -4.770 1.00 0.00 C ATOM 1314 O LYS A 87 -9.162 -0.272 -3.650 1.00 0.00 O ATOM 1315 CB LYS A 87 -9.813 -0.571 -6.975 1.00 0.00 C ATOM 1316 CG LYS A 87 -11.059 0.197 -6.550 1.00 0.00 C ATOM 1317 CD LYS A 87 -11.727 0.852 -7.748 1.00 0.00 C ATOM 1318 CE LYS A 87 -12.956 1.654 -7.346 1.00 0.00 C ATOM 1319 NZ LYS A 87 -12.605 2.849 -6.535 1.00 0.00 N ATOM 0 H LYS A 87 -10.817 -2.026 -4.945 1.00 0.00 H new ATOM 0 HA LYS A 87 -8.176 -1.746 -6.239 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -9.125 0.121 -7.460 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -10.097 -1.313 -7.721 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -11.760 -0.481 -6.063 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -10.790 0.958 -5.817 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -11.014 1.507 -8.248 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -12.014 0.085 -8.468 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -13.491 1.969 -8.242 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -13.634 1.017 -6.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -13.395 3.526 -6.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -12.420 2.560 -5.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -11.754 3.299 -6.930 1.00 0.00 H new ATOM 1333 N SER A 88 -7.715 0.582 -5.143 1.00 0.00 N ATOM 1334 CA SER A 88 -7.159 1.578 -4.245 1.00 0.00 C ATOM 1335 C SER A 88 -6.946 2.885 -5.009 1.00 0.00 C ATOM 1336 O SER A 88 -6.837 2.882 -6.237 1.00 0.00 O ATOM 1337 CB SER A 88 -5.843 1.052 -3.654 1.00 0.00 C ATOM 1338 OG SER A 88 -5.196 2.019 -2.849 1.00 0.00 O ATOM 0 H SER A 88 -7.319 0.606 -6.083 1.00 0.00 H new ATOM 0 HA SER A 88 -7.847 1.773 -3.422 1.00 0.00 H new ATOM 0 HB2 SER A 88 -6.044 0.161 -3.059 1.00 0.00 H new ATOM 0 HB3 SER A 88 -5.178 0.751 -4.463 1.00 0.00 H new ATOM 0 HG SER A 88 -5.784 2.273 -2.107 1.00 0.00 H new ATOM 1344 N THR A 89 -6.911 4.000 -4.297 1.00 0.00 N ATOM 1345 CA THR A 89 -6.767 5.294 -4.937 1.00 0.00 C ATOM 1346 C THR A 89 -5.571 6.048 -4.371 1.00 0.00 C ATOM 1347 O THR A 89 -5.298 5.993 -3.173 1.00 0.00 O ATOM 1348 CB THR A 89 -8.026 6.149 -4.743 1.00 0.00 C ATOM 1349 OG1 THR A 89 -9.192 5.314 -4.788 1.00 0.00 O ATOM 1350 CG2 THR A 89 -8.132 7.218 -5.819 1.00 0.00 C ATOM 0 H THR A 89 -6.980 4.034 -3.280 1.00 0.00 H new ATOM 0 HA THR A 89 -6.615 5.112 -6.001 1.00 0.00 H new ATOM 0 HB THR A 89 -7.957 6.639 -3.772 1.00 0.00 H new ATOM 0 HG1 THR A 89 -9.993 5.864 -4.662 1.00 0.00 H new ATOM 0 HG21 THR A 89 -9.033 7.809 -5.657 1.00 0.00 H new ATOM 0 HG22 THR A 89 -7.258 7.868 -5.773 1.00 0.00 H new ATOM 0 HG23 THR A 89 -8.180 6.744 -6.799 1.00 0.00 H new ATOM 1358 N LEU A 90 -4.873 6.750 -5.239 1.00 0.00 N ATOM 1359 CA LEU A 90 -3.721 7.543 -4.843 1.00 0.00 C ATOM 1360 C LEU A 90 -3.961 9.003 -5.198 1.00 0.00 C ATOM 1361 O LEU A 90 -4.251 9.326 -6.349 1.00 0.00 O ATOM 1362 CB LEU A 90 -2.451 7.037 -5.538 1.00 0.00 C ATOM 1363 CG LEU A 90 -2.044 5.601 -5.200 1.00 0.00 C ATOM 1364 CD1 LEU A 90 -0.829 5.190 -6.018 1.00 0.00 C ATOM 1365 CD2 LEU A 90 -1.757 5.466 -3.712 1.00 0.00 C ATOM 0 H LEU A 90 -5.085 6.789 -6.236 1.00 0.00 H new ATOM 0 HA LEU A 90 -3.584 7.449 -3.766 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -2.593 7.112 -6.616 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -1.626 7.701 -5.278 1.00 0.00 H new ATOM 0 HG LEU A 90 -2.871 4.937 -5.452 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -0.551 4.166 -5.767 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -1.068 5.251 -7.080 1.00 0.00 H new ATOM 0 HD13 LEU A 90 0.003 5.857 -5.794 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -1.469 4.439 -3.489 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -0.945 6.139 -3.436 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -2.651 5.724 -3.144 1.00 0.00 H new ATOM 1377 N LYS A 91 -3.861 9.873 -4.209 1.00 0.00 N ATOM 1378 CA LYS A 91 -4.033 11.304 -4.427 1.00 0.00 C ATOM 1379 C LYS A 91 -2.815 12.063 -3.938 1.00 0.00 C ATOM 1380 O LYS A 91 -2.024 11.539 -3.158 1.00 0.00 O ATOM 1381 CB LYS A 91 -5.287 11.824 -3.721 1.00 0.00 C ATOM 1382 CG LYS A 91 -6.570 11.536 -4.478 1.00 0.00 C ATOM 1383 CD LYS A 91 -7.786 12.113 -3.772 1.00 0.00 C ATOM 1384 CE LYS A 91 -8.155 11.312 -2.534 1.00 0.00 C ATOM 1385 NZ LYS A 91 -8.650 9.953 -2.881 1.00 0.00 N ATOM 0 H LYS A 91 -3.661 9.615 -3.243 1.00 0.00 H new ATOM 0 HA LYS A 91 -4.150 11.466 -5.499 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -5.350 11.374 -2.730 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -5.193 12.900 -3.577 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -6.501 11.954 -5.482 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -6.692 10.459 -4.589 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -7.585 13.146 -3.489 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -8.632 12.129 -4.460 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -7.284 11.226 -1.884 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -8.922 11.845 -1.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -9.211 9.576 -2.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -9.244 10.007 -3.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -7.841 9.325 -3.062 1.00 0.00 H new ATOM 1399 N ARG A 92 -2.665 13.291 -4.402 1.00 0.00 N ATOM 1400 CA ARG A 92 -1.568 14.131 -3.969 1.00 0.00 C ATOM 1401 C ARG A 92 -1.871 14.739 -2.605 1.00 0.00 C ATOM 1402 O ARG A 92 -3.024 15.048 -2.288 1.00 0.00 O ATOM 1403 CB ARG A 92 -1.297 15.223 -4.997 1.00 0.00 C ATOM 1404 CG ARG A 92 -2.463 16.162 -5.205 1.00 0.00 C ATOM 1405 CD ARG A 92 -2.148 17.201 -6.266 1.00 0.00 C ATOM 1406 NE ARG A 92 -3.236 18.157 -6.455 1.00 0.00 N ATOM 1407 CZ ARG A 92 -3.104 19.298 -7.127 1.00 0.00 C ATOM 1408 NH1 ARG A 92 -1.929 19.629 -7.650 1.00 0.00 N ATOM 1409 NH2 ARG A 92 -4.143 20.106 -7.274 1.00 0.00 N ATOM 0 H ARG A 92 -3.291 13.727 -5.079 1.00 0.00 H new ATOM 0 HA ARG A 92 -0.673 13.516 -3.879 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -0.428 15.800 -4.681 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -1.041 14.758 -5.949 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -3.344 15.592 -5.500 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -2.705 16.659 -4.266 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -1.242 17.738 -5.986 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -1.942 16.699 -7.211 1.00 0.00 H new ATOM 0 HE ARG A 92 -4.146 17.938 -6.050 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -1.127 19.009 -7.537 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -1.828 20.504 -8.165 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -5.046 19.854 -6.872 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -4.040 20.980 -7.789 1.00 0.00 H new ATOM 1423 N GLY A 93 -0.836 14.889 -1.798 1.00 0.00 N ATOM 1424 CA GLY A 93 -1.000 15.397 -0.464 1.00 0.00 C ATOM 1425 C GLY A 93 -0.658 16.864 -0.358 1.00 0.00 C ATOM 1426 O GLY A 93 -0.097 17.458 -1.280 1.00 0.00 O ATOM 0 H GLY A 93 0.126 14.663 -2.052 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -2.031 15.243 -0.144 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -0.367 14.829 0.218 1.00 0.00 H new ATOM 1430 N GLU A 94 -0.963 17.427 0.793 1.00 0.00 N ATOM 1431 CA GLU A 94 -0.848 18.857 1.031 1.00 0.00 C ATOM 1432 C GLU A 94 0.606 19.294 1.188 1.00 0.00 C ATOM 1433 O GLU A 94 0.931 20.469 1.030 1.00 0.00 O ATOM 1434 CB GLU A 94 -1.620 19.207 2.297 1.00 0.00 C ATOM 1435 CG GLU A 94 -3.029 18.639 2.327 1.00 0.00 C ATOM 1436 CD GLU A 94 -3.680 18.790 3.685 1.00 0.00 C ATOM 1437 OE1 GLU A 94 -3.386 17.971 4.583 1.00 0.00 O ATOM 1438 OE2 GLU A 94 -4.491 19.722 3.863 1.00 0.00 O ATOM 0 H GLU A 94 -1.301 16.902 1.600 1.00 0.00 H new ATOM 0 HA GLU A 94 -1.259 19.381 0.168 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -1.070 18.837 3.162 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -1.672 20.292 2.392 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -3.638 19.143 1.577 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -2.999 17.584 2.056 1.00 0.00 H new ATOM 1445 N ASN A 95 1.472 18.346 1.495 1.00 0.00 N ATOM 1446 CA ASN A 95 2.862 18.657 1.805 1.00 0.00 C ATOM 1447 C ASN A 95 3.804 17.937 0.855 1.00 0.00 C ATOM 1448 O ASN A 95 4.940 17.625 1.214 1.00 0.00 O ATOM 1449 CB ASN A 95 3.181 18.251 3.247 1.00 0.00 C ATOM 1450 CG ASN A 95 2.189 18.816 4.243 1.00 0.00 C ATOM 1451 OD1 ASN A 95 1.188 18.176 4.563 1.00 0.00 O ATOM 1452 ND2 ASN A 95 2.442 20.023 4.723 1.00 0.00 N ATOM 0 H ASN A 95 1.241 17.353 1.537 1.00 0.00 H new ATOM 0 HA ASN A 95 3.003 19.731 1.688 1.00 0.00 H new ATOM 0 HB2 ASN A 95 3.186 17.164 3.322 1.00 0.00 H new ATOM 0 HB3 ASN A 95 4.183 18.593 3.504 1.00 0.00 H new ATOM 0 HD21 ASN A 95 1.796 20.455 5.383 1.00 0.00 H new ATOM 0 HD22 ASN A 95 3.283 20.521 4.433 1.00 0.00 H new ATOM 1459 N GLY A 96 3.339 17.693 -0.364 1.00 0.00 N ATOM 1460 CA GLY A 96 4.127 16.929 -1.316 1.00 0.00 C ATOM 1461 C GLY A 96 4.192 15.472 -0.919 1.00 0.00 C ATOM 1462 O GLY A 96 5.235 14.829 -1.020 1.00 0.00 O ATOM 0 H GLY A 96 2.433 18.009 -0.711 1.00 0.00 H new ATOM 0 HA2 GLY A 96 3.690 17.020 -2.311 1.00 0.00 H new ATOM 0 HA3 GLY A 96 5.135 17.340 -1.372 1.00 0.00 H new ATOM 1466 N THR A 97 3.064 14.971 -0.442 1.00 0.00 N ATOM 1467 CA THR A 97 2.959 13.608 0.039 1.00 0.00 C ATOM 1468 C THR A 97 1.979 12.814 -0.819 1.00 0.00 C ATOM 1469 O THR A 97 1.354 13.368 -1.724 1.00 0.00 O ATOM 1470 CB THR A 97 2.503 13.591 1.514 1.00 0.00 C ATOM 1471 OG1 THR A 97 1.341 14.415 1.684 1.00 0.00 O ATOM 1472 CG2 THR A 97 3.614 14.084 2.430 1.00 0.00 C ATOM 0 H THR A 97 2.195 15.501 -0.378 1.00 0.00 H new ATOM 0 HA THR A 97 3.942 13.143 -0.030 1.00 0.00 H new ATOM 0 HB THR A 97 2.259 12.562 1.780 1.00 0.00 H new ATOM 0 HG1 THR A 97 1.060 14.395 2.623 1.00 0.00 H new ATOM 0 HG21 THR A 97 3.269 14.063 3.464 1.00 0.00 H new ATOM 0 HG22 THR A 97 4.486 13.438 2.325 1.00 0.00 H new ATOM 0 HG23 THR A 97 3.884 15.104 2.158 1.00 0.00 H new ATOM 1480 N LEU A 98 1.861 11.522 -0.559 1.00 0.00 N ATOM 1481 CA LEU A 98 0.925 10.692 -1.296 1.00 0.00 C ATOM 1482 C LEU A 98 -0.185 10.208 -0.371 1.00 0.00 C ATOM 1483 O LEU A 98 0.077 9.734 0.741 1.00 0.00 O ATOM 1484 CB LEU A 98 1.641 9.501 -1.941 1.00 0.00 C ATOM 1485 CG LEU A 98 0.782 8.650 -2.881 1.00 0.00 C ATOM 1486 CD1 LEU A 98 0.312 9.470 -4.074 1.00 0.00 C ATOM 1487 CD2 LEU A 98 1.559 7.431 -3.348 1.00 0.00 C ATOM 0 H LEU A 98 2.399 11.028 0.153 1.00 0.00 H new ATOM 0 HA LEU A 98 0.485 11.293 -2.092 1.00 0.00 H new ATOM 0 HB2 LEU A 98 2.500 9.874 -2.499 1.00 0.00 H new ATOM 0 HB3 LEU A 98 2.029 8.859 -1.150 1.00 0.00 H new ATOM 0 HG LEU A 98 -0.097 8.314 -2.331 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -0.296 8.845 -4.728 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -0.282 10.314 -3.724 1.00 0.00 H new ATOM 0 HD13 LEU A 98 1.177 9.838 -4.626 1.00 0.00 H new ATOM 0 HD21 LEU A 98 0.936 6.836 -4.015 1.00 0.00 H new ATOM 0 HD22 LEU A 98 2.455 7.752 -3.879 1.00 0.00 H new ATOM 0 HD23 LEU A 98 1.845 6.829 -2.485 1.00 0.00 H new ATOM 1499 N ILE A 99 -1.420 10.354 -0.827 1.00 0.00 N ATOM 1500 CA ILE A 99 -2.580 9.911 -0.075 1.00 0.00 C ATOM 1501 C ILE A 99 -3.030 8.548 -0.575 1.00 0.00 C ATOM 1502 O ILE A 99 -3.515 8.417 -1.702 1.00 0.00 O ATOM 1503 CB ILE A 99 -3.746 10.911 -0.210 1.00 0.00 C ATOM 1504 CG1 ILE A 99 -3.273 12.323 0.147 1.00 0.00 C ATOM 1505 CG2 ILE A 99 -4.917 10.492 0.672 1.00 0.00 C ATOM 1506 CD1 ILE A 99 -2.868 12.498 1.598 1.00 0.00 C ATOM 0 H ILE A 99 -1.644 10.782 -1.726 1.00 0.00 H new ATOM 0 HA ILE A 99 -2.296 9.847 0.975 1.00 0.00 H new ATOM 0 HB ILE A 99 -4.088 10.912 -1.245 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -2.426 12.581 -0.488 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -4.070 13.030 -0.083 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -5.730 11.210 0.563 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -5.263 9.503 0.371 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -4.596 10.463 1.713 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -2.547 13.526 1.765 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -3.718 12.275 2.243 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -2.048 11.819 1.831 1.00 0.00 H new ATOM 1518 N TRP A 100 -2.858 7.543 0.264 1.00 0.00 N ATOM 1519 CA TRP A 100 -3.190 6.174 -0.093 1.00 0.00 C ATOM 1520 C TRP A 100 -4.573 5.824 0.435 1.00 0.00 C ATOM 1521 O TRP A 100 -4.788 5.760 1.644 1.00 0.00 O ATOM 1522 CB TRP A 100 -2.139 5.221 0.483 1.00 0.00 C ATOM 1523 CG TRP A 100 -2.260 3.806 0.001 1.00 0.00 C ATOM 1524 CD1 TRP A 100 -2.904 3.368 -1.121 1.00 0.00 C ATOM 1525 CD2 TRP A 100 -1.704 2.641 0.624 1.00 0.00 C ATOM 1526 NE1 TRP A 100 -2.789 2.007 -1.231 1.00 0.00 N ATOM 1527 CE2 TRP A 100 -2.054 1.535 -0.174 1.00 0.00 C ATOM 1528 CE3 TRP A 100 -0.943 2.425 1.778 1.00 0.00 C ATOM 1529 CZ2 TRP A 100 -1.671 0.235 0.146 1.00 0.00 C ATOM 1530 CZ3 TRP A 100 -0.563 1.133 2.095 1.00 0.00 C ATOM 1531 CH2 TRP A 100 -0.927 0.053 1.280 1.00 0.00 C ATOM 0 H TRP A 100 -2.486 7.651 1.208 1.00 0.00 H new ATOM 0 HA TRP A 100 -3.196 6.074 -1.178 1.00 0.00 H new ATOM 0 HB2 TRP A 100 -1.147 5.596 0.229 1.00 0.00 H new ATOM 0 HB3 TRP A 100 -2.214 5.230 1.570 1.00 0.00 H new ATOM 0 HD1 TRP A 100 -3.428 4.003 -1.820 1.00 0.00 H new ATOM 0 HE1 TRP A 100 -3.186 1.437 -1.978 1.00 0.00 H new ATOM 0 HE3 TRP A 100 -0.657 3.252 2.410 1.00 0.00 H new ATOM 0 HZ2 TRP A 100 -1.951 -0.600 -0.479 1.00 0.00 H new ATOM 0 HZ3 TRP A 100 0.023 0.954 2.984 1.00 0.00 H new ATOM 0 HH2 TRP A 100 -0.614 -0.944 1.552 1.00 0.00 H new ATOM 1542 N GLU A 101 -5.512 5.617 -0.471 1.00 0.00 N ATOM 1543 CA GLU A 101 -6.875 5.326 -0.095 1.00 0.00 C ATOM 1544 C GLU A 101 -7.220 3.892 -0.438 1.00 0.00 C ATOM 1545 O GLU A 101 -6.965 3.429 -1.549 1.00 0.00 O ATOM 1546 CB GLU A 101 -7.810 6.272 -0.830 1.00 0.00 C ATOM 1547 CG GLU A 101 -9.215 6.303 -0.276 1.00 0.00 C ATOM 1548 CD GLU A 101 -10.042 7.422 -0.876 1.00 0.00 C ATOM 1549 OE1 GLU A 101 -9.594 8.584 -0.827 1.00 0.00 O ATOM 1550 OE2 GLU A 101 -11.144 7.151 -1.393 1.00 0.00 O ATOM 0 H GLU A 101 -5.349 5.646 -1.477 1.00 0.00 H new ATOM 0 HA GLU A 101 -6.987 5.462 0.981 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -7.394 7.279 -0.793 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -7.851 5.982 -1.880 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -9.702 5.348 -0.472 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -9.174 6.424 0.807 1.00 0.00 H new ATOM 1557 N GLN A 102 -7.818 3.203 0.507 1.00 0.00 N ATOM 1558 CA GLN A 102 -8.175 1.807 0.320 1.00 0.00 C ATOM 1559 C GLN A 102 -9.404 1.466 1.150 1.00 0.00 C ATOM 1560 O GLN A 102 -9.454 1.770 2.342 1.00 0.00 O ATOM 1561 CB GLN A 102 -6.989 0.913 0.697 1.00 0.00 C ATOM 1562 CG GLN A 102 -7.111 -0.522 0.203 1.00 0.00 C ATOM 1563 CD GLN A 102 -7.409 -1.516 1.312 1.00 0.00 C ATOM 1564 OE1 GLN A 102 -8.041 -1.185 2.314 1.00 0.00 O ATOM 1565 NE2 GLN A 102 -6.946 -2.743 1.140 1.00 0.00 N ATOM 0 H GLN A 102 -8.070 3.585 1.419 1.00 0.00 H new ATOM 0 HA GLN A 102 -8.417 1.632 -0.728 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -6.076 1.349 0.292 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -6.884 0.905 1.782 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -7.902 -0.575 -0.545 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -6.183 -0.808 -0.293 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -6.426 -2.978 0.294 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -7.109 -3.454 1.853 1.00 0.00 H new ATOM 1574 N ASN A 103 -10.409 0.874 0.499 1.00 0.00 N ATOM 1575 CA ASN A 103 -11.647 0.458 1.172 1.00 0.00 C ATOM 1576 C ASN A 103 -12.394 1.655 1.754 1.00 0.00 C ATOM 1577 O ASN A 103 -13.276 1.507 2.601 1.00 0.00 O ATOM 1578 CB ASN A 103 -11.340 -0.566 2.271 1.00 0.00 C ATOM 1579 CG ASN A 103 -11.509 -1.997 1.800 1.00 0.00 C ATOM 1580 OD1 ASN A 103 -12.393 -2.298 0.999 1.00 0.00 O ATOM 1581 ND2 ASN A 103 -10.647 -2.882 2.273 1.00 0.00 N ATOM 0 H ASN A 103 -10.391 0.670 -0.500 1.00 0.00 H new ATOM 0 HA ASN A 103 -12.292 -0.007 0.426 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -10.318 -0.421 2.622 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -11.997 -0.388 3.122 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -10.701 -3.856 1.975 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -9.929 -2.590 2.936 1.00 0.00 H new ATOM 1588 N GLY A 104 -12.045 2.844 1.287 1.00 0.00 N ATOM 1589 CA GLY A 104 -12.700 4.043 1.764 1.00 0.00 C ATOM 1590 C GLY A 104 -11.909 4.746 2.850 1.00 0.00 C ATOM 1591 O GLY A 104 -12.241 5.866 3.241 1.00 0.00 O ATOM 0 H GLY A 104 -11.320 3.000 0.586 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -12.851 4.727 0.929 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -13.687 3.785 2.147 1.00 0.00 H new ATOM 1595 N GLN A 105 -10.867 4.092 3.344 1.00 0.00 N ATOM 1596 CA GLN A 105 -10.029 4.673 4.376 1.00 0.00 C ATOM 1597 C GLN A 105 -8.853 5.398 3.740 1.00 0.00 C ATOM 1598 O GLN A 105 -8.218 4.880 2.819 1.00 0.00 O ATOM 1599 CB GLN A 105 -9.535 3.572 5.313 1.00 0.00 C ATOM 1600 CG GLN A 105 -10.662 2.717 5.870 1.00 0.00 C ATOM 1601 CD GLN A 105 -10.175 1.619 6.794 1.00 0.00 C ATOM 1602 OE1 GLN A 105 -9.905 0.500 6.357 1.00 0.00 O ATOM 1603 NE2 GLN A 105 -10.050 1.927 8.076 1.00 0.00 N ATOM 0 H GLN A 105 -10.584 3.159 3.045 1.00 0.00 H new ATOM 0 HA GLN A 105 -10.609 5.393 4.953 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -8.833 2.934 4.776 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -8.987 4.024 6.139 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -11.361 3.355 6.411 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -11.213 2.270 5.043 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -10.284 2.865 8.400 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -9.720 1.226 8.739 1.00 0.00 H new ATOM 1612 N ARG A 106 -8.583 6.601 4.218 1.00 0.00 N ATOM 1613 CA ARG A 106 -7.497 7.404 3.703 1.00 0.00 C ATOM 1614 C ARG A 106 -6.279 7.359 4.612 1.00 0.00 C ATOM 1615 O ARG A 106 -6.367 7.663 5.802 1.00 0.00 O ATOM 1616 CB ARG A 106 -7.956 8.848 3.520 1.00 0.00 C ATOM 1617 CG ARG A 106 -8.829 9.058 2.296 1.00 0.00 C ATOM 1618 CD ARG A 106 -9.177 10.523 2.110 1.00 0.00 C ATOM 1619 NE ARG A 106 -9.870 10.766 0.848 1.00 0.00 N ATOM 1620 CZ ARG A 106 -10.211 11.978 0.409 1.00 0.00 C ATOM 1621 NH1 ARG A 106 -9.917 13.057 1.121 1.00 0.00 N ATOM 1622 NH2 ARG A 106 -10.832 12.116 -0.753 1.00 0.00 N ATOM 0 H ARG A 106 -9.110 7.043 4.971 1.00 0.00 H new ATOM 0 HA ARG A 106 -7.207 6.987 2.739 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -8.507 9.160 4.407 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -7.080 9.492 3.446 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -8.311 8.690 1.410 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -9.744 8.475 2.395 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -9.804 10.854 2.937 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -8.265 11.119 2.143 1.00 0.00 H new ATOM 0 HE ARG A 106 -10.107 9.961 0.268 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -9.427 12.963 2.011 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -10.181 13.981 0.779 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -11.051 11.293 -1.315 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -11.091 13.045 -1.086 1.00 0.00 H new ATOM 1636 N LYS A 107 -5.147 6.967 4.054 1.00 0.00 N ATOM 1637 CA LYS A 107 -3.877 7.085 4.745 1.00 0.00 C ATOM 1638 C LYS A 107 -3.058 8.207 4.135 1.00 0.00 C ATOM 1639 O LYS A 107 -2.827 8.235 2.926 1.00 0.00 O ATOM 1640 CB LYS A 107 -3.075 5.785 4.681 1.00 0.00 C ATOM 1641 CG LYS A 107 -3.439 4.778 5.754 1.00 0.00 C ATOM 1642 CD LYS A 107 -3.406 5.392 7.140 1.00 0.00 C ATOM 1643 CE LYS A 107 -3.543 4.329 8.216 1.00 0.00 C ATOM 1644 NZ LYS A 107 -2.265 3.599 8.464 1.00 0.00 N ATOM 0 H LYS A 107 -5.083 6.563 3.120 1.00 0.00 H new ATOM 0 HA LYS A 107 -4.092 7.303 5.791 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -3.224 5.327 3.703 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -2.014 6.021 4.765 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -4.435 4.381 5.556 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -2.747 3.937 5.713 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -2.471 5.934 7.278 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -4.213 6.118 7.238 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -3.877 4.796 9.143 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -4.314 3.616 7.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -2.438 2.809 9.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -1.896 3.230 7.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -1.570 4.249 8.883 1.00 0.00 H new ATOM 1658 N THR A 108 -2.630 9.133 4.966 1.00 0.00 N ATOM 1659 CA THR A 108 -1.749 10.193 4.512 1.00 0.00 C ATOM 1660 C THR A 108 -0.316 9.814 4.853 1.00 0.00 C ATOM 1661 O THR A 108 0.059 9.720 6.023 1.00 0.00 O ATOM 1662 CB THR A 108 -2.126 11.571 5.119 1.00 0.00 C ATOM 1663 OG1 THR A 108 -1.177 12.571 4.716 1.00 0.00 O ATOM 1664 CG2 THR A 108 -2.207 11.511 6.637 1.00 0.00 C ATOM 0 H THR A 108 -2.875 9.176 5.955 1.00 0.00 H new ATOM 0 HA THR A 108 -1.856 10.300 3.433 1.00 0.00 H new ATOM 0 HB THR A 108 -3.112 11.839 4.741 1.00 0.00 H new ATOM 0 HG1 THR A 108 -1.428 13.435 5.104 1.00 0.00 H new ATOM 0 HG21 THR A 108 -2.473 12.494 7.026 1.00 0.00 H new ATOM 0 HG22 THR A 108 -2.965 10.786 6.933 1.00 0.00 H new ATOM 0 HG23 THR A 108 -1.241 11.210 7.041 1.00 0.00 H new ATOM 1672 N MET A 109 0.477 9.574 3.825 1.00 0.00 N ATOM 1673 CA MET A 109 1.789 8.981 4.011 1.00 0.00 C ATOM 1674 C MET A 109 2.893 10.024 3.964 1.00 0.00 C ATOM 1675 O MET A 109 2.735 11.094 3.375 1.00 0.00 O ATOM 1676 CB MET A 109 2.037 7.905 2.950 1.00 0.00 C ATOM 1677 CG MET A 109 1.075 6.734 3.043 1.00 0.00 C ATOM 1678 SD MET A 109 1.410 5.449 1.822 1.00 0.00 S ATOM 1679 CE MET A 109 1.248 6.376 0.298 1.00 0.00 C ATOM 0 H MET A 109 0.237 9.780 2.855 1.00 0.00 H new ATOM 0 HA MET A 109 1.807 8.525 5.001 1.00 0.00 H new ATOM 0 HB2 MET A 109 1.955 8.355 1.961 1.00 0.00 H new ATOM 0 HB3 MET A 109 3.058 7.536 3.049 1.00 0.00 H new ATOM 0 HG2 MET A 109 1.132 6.302 4.042 1.00 0.00 H new ATOM 0 HG3 MET A 109 0.056 7.097 2.911 1.00 0.00 H new ATOM 0 HE1 MET A 109 0.933 5.707 -0.503 1.00 0.00 H new ATOM 0 HE2 MET A 109 0.505 7.163 0.428 1.00 0.00 H new ATOM 0 HE3 MET A 109 2.208 6.823 0.040 1.00 0.00 H new ATOM 1689 N THR A 110 4.006 9.701 4.600 1.00 0.00 N ATOM 1690 CA THR A 110 5.179 10.545 4.579 1.00 0.00 C ATOM 1691 C THR A 110 6.120 10.050 3.494 1.00 0.00 C ATOM 1692 O THR A 110 6.144 8.859 3.185 1.00 0.00 O ATOM 1693 CB THR A 110 5.924 10.509 5.924 1.00 0.00 C ATOM 1694 OG1 THR A 110 4.997 10.307 6.998 1.00 0.00 O ATOM 1695 CG2 THR A 110 6.689 11.803 6.158 1.00 0.00 C ATOM 0 H THR A 110 4.118 8.846 5.144 1.00 0.00 H new ATOM 0 HA THR A 110 4.858 11.569 4.387 1.00 0.00 H new ATOM 0 HB THR A 110 6.633 9.682 5.892 1.00 0.00 H new ATOM 0 HG1 THR A 110 5.331 9.601 7.590 1.00 0.00 H new ATOM 0 HG21 THR A 110 7.207 11.751 7.116 1.00 0.00 H new ATOM 0 HG22 THR A 110 7.417 11.945 5.359 1.00 0.00 H new ATOM 0 HG23 THR A 110 5.992 12.641 6.167 1.00 0.00 H new ATOM 1703 N ARG A 111 6.889 10.946 2.919 1.00 0.00 N ATOM 1704 CA ARG A 111 7.818 10.564 1.881 1.00 0.00 C ATOM 1705 C ARG A 111 9.189 10.338 2.495 1.00 0.00 C ATOM 1706 O ARG A 111 9.607 11.062 3.402 1.00 0.00 O ATOM 1707 CB ARG A 111 7.892 11.635 0.793 1.00 0.00 C ATOM 1708 CG ARG A 111 8.828 12.764 1.148 1.00 0.00 C ATOM 1709 CD ARG A 111 8.271 14.112 0.733 1.00 0.00 C ATOM 1710 NE ARG A 111 8.896 15.207 1.473 1.00 0.00 N ATOM 1711 CZ ARG A 111 8.652 16.494 1.243 1.00 0.00 C ATOM 1712 NH1 ARG A 111 7.859 16.860 0.238 1.00 0.00 N ATOM 1713 NH2 ARG A 111 9.207 17.413 2.020 1.00 0.00 N ATOM 0 H ARG A 111 6.890 11.939 3.151 1.00 0.00 H new ATOM 0 HA ARG A 111 7.470 9.641 1.417 1.00 0.00 H new ATOM 0 HB2 ARG A 111 8.220 11.177 -0.140 1.00 0.00 H new ATOM 0 HB3 ARG A 111 6.894 12.038 0.617 1.00 0.00 H new ATOM 0 HG2 ARG A 111 9.009 12.761 2.223 1.00 0.00 H new ATOM 0 HG3 ARG A 111 9.791 12.604 0.662 1.00 0.00 H new ATOM 0 HD2 ARG A 111 8.430 14.258 -0.335 1.00 0.00 H new ATOM 0 HD3 ARG A 111 7.194 14.128 0.900 1.00 0.00 H new ATOM 0 HE ARG A 111 9.559 14.970 2.210 1.00 0.00 H new ATOM 0 HH11 ARG A 111 7.435 16.152 -0.361 1.00 0.00 H new ATOM 0 HH12 ARG A 111 7.676 17.849 0.067 1.00 0.00 H new ATOM 0 HH21 ARG A 111 9.816 17.131 2.788 1.00 0.00 H new ATOM 0 HH22 ARG A 111 9.025 18.402 1.850 1.00 0.00 H new ATOM 1727 N ILE A 112 9.854 9.316 2.024 1.00 0.00 N ATOM 1728 CA ILE A 112 11.204 9.010 2.440 1.00 0.00 C ATOM 1729 C ILE A 112 12.176 9.609 1.435 1.00 0.00 C ATOM 1730 O ILE A 112 11.800 9.843 0.279 1.00 0.00 O ATOM 1731 CB ILE A 112 11.400 7.483 2.525 1.00 0.00 C ATOM 1732 CG1 ILE A 112 10.275 6.870 3.359 1.00 0.00 C ATOM 1733 CG2 ILE A 112 12.758 7.132 3.116 1.00 0.00 C ATOM 1734 CD1 ILE A 112 10.292 7.280 4.821 1.00 0.00 C ATOM 0 H ILE A 112 9.474 8.666 1.336 1.00 0.00 H new ATOM 0 HA ILE A 112 11.389 9.435 3.426 1.00 0.00 H new ATOM 0 HB ILE A 112 11.367 7.071 1.516 1.00 0.00 H new ATOM 0 HG12 ILE A 112 9.317 7.156 2.924 1.00 0.00 H new ATOM 0 HG13 ILE A 112 10.342 5.784 3.297 1.00 0.00 H new ATOM 0 HG21 ILE A 112 12.865 6.048 3.163 1.00 0.00 H new ATOM 0 HG22 ILE A 112 13.546 7.548 2.489 1.00 0.00 H new ATOM 0 HG23 ILE A 112 12.836 7.548 4.121 1.00 0.00 H new ATOM 0 HD11 ILE A 112 9.462 6.803 5.342 1.00 0.00 H new ATOM 0 HD12 ILE A 112 11.233 6.969 5.275 1.00 0.00 H new ATOM 0 HD13 ILE A 112 10.193 8.363 4.896 1.00 0.00 H new ATOM 1746 N GLU A 113 13.399 9.877 1.862 1.00 0.00 N ATOM 1747 CA GLU A 113 14.413 10.408 0.960 1.00 0.00 C ATOM 1748 C GLU A 113 14.834 9.333 -0.031 1.00 0.00 C ATOM 1749 O GLU A 113 15.795 8.591 0.182 1.00 0.00 O ATOM 1750 CB GLU A 113 15.632 10.932 1.714 1.00 0.00 C ATOM 1751 CG GLU A 113 15.405 12.252 2.444 1.00 0.00 C ATOM 1752 CD GLU A 113 14.517 12.133 3.668 1.00 0.00 C ATOM 1753 OE1 GLU A 113 15.010 11.687 4.724 1.00 0.00 O ATOM 1754 OE2 GLU A 113 13.326 12.498 3.587 1.00 0.00 O ATOM 0 H GLU A 113 13.715 9.737 2.822 1.00 0.00 H new ATOM 0 HA GLU A 113 13.974 11.250 0.426 1.00 0.00 H new ATOM 0 HB2 GLU A 113 15.946 10.180 2.438 1.00 0.00 H new ATOM 0 HB3 GLU A 113 16.453 11.058 1.009 1.00 0.00 H new ATOM 0 HG2 GLU A 113 16.370 12.660 2.746 1.00 0.00 H new ATOM 0 HG3 GLU A 113 14.959 12.967 1.752 1.00 0.00 H new ATOM 1761 N SER A 114 14.070 9.243 -1.091 1.00 0.00 N ATOM 1762 CA SER A 114 14.262 8.237 -2.115 1.00 0.00 C ATOM 1763 C SER A 114 15.006 8.829 -3.306 1.00 0.00 C ATOM 1764 O SER A 114 14.518 8.824 -4.438 1.00 0.00 O ATOM 1765 CB SER A 114 12.905 7.666 -2.532 1.00 0.00 C ATOM 1766 OG SER A 114 11.889 8.657 -2.442 1.00 0.00 O ATOM 0 H SER A 114 13.287 9.872 -1.273 1.00 0.00 H new ATOM 0 HA SER A 114 14.870 7.424 -1.718 1.00 0.00 H new ATOM 0 HB2 SER A 114 12.962 7.290 -3.553 1.00 0.00 H new ATOM 0 HB3 SER A 114 12.651 6.819 -1.894 1.00 0.00 H new ATOM 0 HG SER A 114 11.030 8.271 -2.714 1.00 0.00 H new ATOM 1772 N LYS A 115 16.186 9.351 -3.023 1.00 0.00 N ATOM 1773 CA LYS A 115 17.026 9.966 -4.030 1.00 0.00 C ATOM 1774 C LYS A 115 17.749 8.891 -4.839 1.00 0.00 C ATOM 1775 O LYS A 115 18.872 8.500 -4.518 1.00 0.00 O ATOM 1776 CB LYS A 115 18.021 10.910 -3.346 1.00 0.00 C ATOM 1777 CG LYS A 115 18.955 11.650 -4.288 1.00 0.00 C ATOM 1778 CD LYS A 115 19.915 12.535 -3.508 1.00 0.00 C ATOM 1779 CE LYS A 115 20.975 13.152 -4.403 1.00 0.00 C ATOM 1780 NZ LYS A 115 21.945 13.968 -3.623 1.00 0.00 N ATOM 0 H LYS A 115 16.588 9.359 -2.086 1.00 0.00 H new ATOM 0 HA LYS A 115 16.413 10.545 -4.721 1.00 0.00 H new ATOM 0 HB2 LYS A 115 17.462 11.642 -2.763 1.00 0.00 H new ATOM 0 HB3 LYS A 115 18.621 10.333 -2.642 1.00 0.00 H new ATOM 0 HG2 LYS A 115 19.518 10.934 -4.887 1.00 0.00 H new ATOM 0 HG3 LYS A 115 18.374 12.258 -4.981 1.00 0.00 H new ATOM 0 HD2 LYS A 115 19.355 13.327 -3.010 1.00 0.00 H new ATOM 0 HD3 LYS A 115 20.397 11.947 -2.727 1.00 0.00 H new ATOM 0 HE2 LYS A 115 21.507 12.363 -4.934 1.00 0.00 H new ATOM 0 HE3 LYS A 115 20.496 13.777 -5.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 22.654 14.374 -4.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 21.440 14.736 -3.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 22.420 13.366 -2.921 1.00 0.00 H new ATOM 1794 N THR A 116 17.090 8.399 -5.877 1.00 0.00 N ATOM 1795 CA THR A 116 17.644 7.343 -6.705 1.00 0.00 C ATOM 1796 C THR A 116 17.039 7.397 -8.111 1.00 0.00 C ATOM 1797 O THR A 116 16.200 8.254 -8.402 1.00 0.00 O ATOM 1798 CB THR A 116 17.398 5.952 -6.063 1.00 0.00 C ATOM 1799 OG1 THR A 116 18.124 4.934 -6.770 1.00 0.00 O ATOM 1800 CG2 THR A 116 15.915 5.604 -6.051 1.00 0.00 C ATOM 0 H THR A 116 16.165 8.718 -6.166 1.00 0.00 H new ATOM 0 HA THR A 116 18.720 7.497 -6.781 1.00 0.00 H new ATOM 0 HB THR A 116 17.753 5.999 -5.033 1.00 0.00 H new ATOM 0 HG1 THR A 116 17.959 4.064 -6.351 1.00 0.00 H new ATOM 0 HG21 THR A 116 15.775 4.624 -5.595 1.00 0.00 H new ATOM 0 HG22 THR A 116 15.370 6.353 -5.476 1.00 0.00 H new ATOM 0 HG23 THR A 116 15.537 5.586 -7.073 1.00 0.00 H new ATOM 1808 N GLY A 117 17.474 6.493 -8.980 1.00 0.00 N ATOM 1809 CA GLY A 117 16.960 6.446 -10.332 1.00 0.00 C ATOM 1810 C GLY A 117 16.032 5.269 -10.538 1.00 0.00 C ATOM 1811 O GLY A 117 16.060 4.312 -9.763 1.00 0.00 O ATOM 0 H GLY A 117 18.179 5.787 -8.768 1.00 0.00 H new ATOM 0 HA2 GLY A 117 16.428 7.372 -10.551 1.00 0.00 H new ATOM 0 HA3 GLY A 117 17.791 6.382 -11.035 1.00 0.00 H new ATOM 1815 N ARG A 118 15.215 5.329 -11.581 1.00 0.00 N ATOM 1816 CA ARG A 118 14.247 4.276 -11.847 1.00 0.00 C ATOM 1817 C ARG A 118 14.868 3.196 -12.720 1.00 0.00 C ATOM 1818 O ARG A 118 14.948 3.341 -13.941 1.00 0.00 O ATOM 1819 CB ARG A 118 12.996 4.838 -12.536 1.00 0.00 C ATOM 1820 CG ARG A 118 11.815 3.878 -12.525 1.00 0.00 C ATOM 1821 CD ARG A 118 10.649 4.398 -13.353 1.00 0.00 C ATOM 1822 NE ARG A 118 10.720 3.957 -14.747 1.00 0.00 N ATOM 1823 CZ ARG A 118 10.289 4.674 -15.787 1.00 0.00 C ATOM 1824 NH1 ARG A 118 9.833 5.909 -15.615 1.00 0.00 N ATOM 1825 NH2 ARG A 118 10.326 4.153 -17.007 1.00 0.00 N ATOM 0 H ARG A 118 15.204 6.095 -12.255 1.00 0.00 H new ATOM 0 HA ARG A 118 13.953 3.843 -10.891 1.00 0.00 H new ATOM 0 HB2 ARG A 118 12.705 5.766 -12.043 1.00 0.00 H new ATOM 0 HB3 ARG A 118 13.241 5.089 -13.568 1.00 0.00 H new ATOM 0 HG2 ARG A 118 12.131 2.910 -12.913 1.00 0.00 H new ATOM 0 HG3 ARG A 118 11.487 3.718 -11.498 1.00 0.00 H new ATOM 0 HD2 ARG A 118 9.712 4.056 -12.913 1.00 0.00 H new ATOM 0 HD3 ARG A 118 10.639 5.487 -13.319 1.00 0.00 H new ATOM 0 HE ARG A 118 11.126 3.041 -14.936 1.00 0.00 H new ATOM 0 HH11 ARG A 118 9.810 6.319 -14.681 1.00 0.00 H new ATOM 0 HH12 ARG A 118 9.506 6.448 -16.417 1.00 0.00 H new ATOM 0 HH21 ARG A 118 10.683 3.208 -17.147 1.00 0.00 H new ATOM 0 HH22 ARG A 118 9.998 4.698 -17.804 1.00 0.00 H new ATOM 1839 N GLU A 119 15.336 2.132 -12.090 1.00 0.00 N ATOM 1840 CA GLU A 119 15.867 0.994 -12.824 1.00 0.00 C ATOM 1841 C GLU A 119 14.722 0.132 -13.348 1.00 0.00 C ATOM 1842 O GLU A 119 13.636 0.109 -12.770 1.00 0.00 O ATOM 1843 CB GLU A 119 16.812 0.164 -11.952 1.00 0.00 C ATOM 1844 CG GLU A 119 18.023 0.943 -11.461 1.00 0.00 C ATOM 1845 CD GLU A 119 19.178 0.040 -11.084 1.00 0.00 C ATOM 1846 OE1 GLU A 119 19.193 -0.484 -9.950 1.00 0.00 O ATOM 1847 OE2 GLU A 119 20.076 -0.157 -11.932 1.00 0.00 O ATOM 0 H GLU A 119 15.360 2.031 -11.075 1.00 0.00 H new ATOM 0 HA GLU A 119 16.443 1.370 -13.670 1.00 0.00 H new ATOM 0 HB2 GLU A 119 16.261 -0.216 -11.092 1.00 0.00 H new ATOM 0 HB3 GLU A 119 17.152 -0.702 -12.520 1.00 0.00 H new ATOM 0 HG2 GLU A 119 18.346 1.635 -12.239 1.00 0.00 H new ATOM 0 HG3 GLU A 119 17.739 1.544 -10.597 1.00 0.00 H new ATOM 1854 N GLU A 120 14.969 -0.578 -14.438 1.00 0.00 N ATOM 1855 CA GLU A 120 13.919 -1.314 -15.126 1.00 0.00 C ATOM 1856 C GLU A 120 14.153 -2.820 -15.041 1.00 0.00 C ATOM 1857 O GLU A 120 15.163 -3.329 -15.531 1.00 0.00 O ATOM 1858 CB GLU A 120 13.868 -0.864 -16.585 1.00 0.00 C ATOM 1859 CG GLU A 120 12.784 -1.533 -17.407 1.00 0.00 C ATOM 1860 CD GLU A 120 12.824 -1.090 -18.851 1.00 0.00 C ATOM 1861 OE1 GLU A 120 13.627 -1.654 -19.623 1.00 0.00 O ATOM 1862 OE2 GLU A 120 12.072 -0.160 -19.217 1.00 0.00 O ATOM 0 H GLU A 120 15.891 -0.660 -14.867 1.00 0.00 H new ATOM 0 HA GLU A 120 12.965 -1.103 -14.642 1.00 0.00 H new ATOM 0 HB2 GLU A 120 13.717 0.215 -16.615 1.00 0.00 H new ATOM 0 HB3 GLU A 120 14.834 -1.063 -17.048 1.00 0.00 H new ATOM 0 HG2 GLU A 120 12.903 -2.615 -17.355 1.00 0.00 H new ATOM 0 HG3 GLU A 120 11.808 -1.299 -16.982 1.00 0.00 H new ATOM 1869 N LYS A 121 13.214 -3.520 -14.418 1.00 0.00 N ATOM 1870 CA LYS A 121 13.289 -4.968 -14.280 1.00 0.00 C ATOM 1871 C LYS A 121 12.619 -5.660 -15.458 1.00 0.00 C ATOM 1872 O LYS A 121 11.394 -5.644 -15.585 1.00 0.00 O ATOM 1873 CB LYS A 121 12.611 -5.415 -12.982 1.00 0.00 C ATOM 1874 CG LYS A 121 12.565 -6.926 -12.785 1.00 0.00 C ATOM 1875 CD LYS A 121 11.581 -7.303 -11.685 1.00 0.00 C ATOM 1876 CE LYS A 121 11.454 -8.810 -11.506 1.00 0.00 C ATOM 1877 NZ LYS A 121 12.664 -9.413 -10.889 1.00 0.00 N ATOM 0 H LYS A 121 12.384 -3.103 -13.997 1.00 0.00 H new ATOM 0 HA LYS A 121 14.342 -5.247 -14.256 1.00 0.00 H new ATOM 0 HB2 LYS A 121 13.136 -4.966 -12.139 1.00 0.00 H new ATOM 0 HB3 LYS A 121 11.592 -5.027 -12.966 1.00 0.00 H new ATOM 0 HG2 LYS A 121 12.276 -7.409 -13.718 1.00 0.00 H new ATOM 0 HG3 LYS A 121 13.559 -7.294 -12.530 1.00 0.00 H new ATOM 0 HD2 LYS A 121 11.903 -6.855 -10.745 1.00 0.00 H new ATOM 0 HD3 LYS A 121 10.602 -6.885 -11.919 1.00 0.00 H new ATOM 0 HE2 LYS A 121 10.586 -9.027 -10.883 1.00 0.00 H new ATOM 0 HE3 LYS A 121 11.275 -9.274 -12.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 12.502 -10.427 -10.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 13.477 -9.290 -11.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 12.861 -8.944 -9.982 1.00 0.00 H new ATOM 1891 N ASP A 122 13.419 -6.254 -16.322 1.00 0.00 N ATOM 1892 CA ASP A 122 12.885 -7.073 -17.400 1.00 0.00 C ATOM 1893 C ASP A 122 13.116 -8.526 -17.101 1.00 0.00 C ATOM 1894 O ASP A 122 14.209 -9.062 -17.287 1.00 0.00 O ATOM 1895 CB ASP A 122 13.495 -6.729 -18.740 1.00 0.00 C ATOM 1896 CG ASP A 122 13.061 -7.686 -19.839 1.00 0.00 C ATOM 1897 OD1 ASP A 122 11.949 -7.524 -20.374 1.00 0.00 O ATOM 1898 OD2 ASP A 122 13.835 -8.612 -20.171 1.00 0.00 O ATOM 0 H ASP A 122 14.437 -6.187 -16.302 1.00 0.00 H new ATOM 0 HA ASP A 122 11.816 -6.868 -17.462 1.00 0.00 H new ATOM 0 HB2 ASP A 122 13.212 -5.713 -19.015 1.00 0.00 H new ATOM 0 HB3 ASP A 122 14.582 -6.746 -18.656 1.00 0.00 H new ATOM 1903 N GLU A 123 12.072 -9.130 -16.612 1.00 0.00 N ATOM 1904 CA GLU A 123 12.076 -10.519 -16.192 1.00 0.00 C ATOM 1905 C GLU A 123 10.658 -11.061 -16.160 1.00 0.00 C ATOM 1906 O GLU A 123 9.698 -10.307 -15.990 1.00 0.00 O ATOM 1907 CB GLU A 123 12.676 -10.671 -14.791 1.00 0.00 C ATOM 1908 CG GLU A 123 14.183 -10.502 -14.717 1.00 0.00 C ATOM 1909 CD GLU A 123 14.726 -10.780 -13.334 1.00 0.00 C ATOM 1910 OE1 GLU A 123 14.669 -9.878 -12.476 1.00 0.00 O ATOM 1911 OE2 GLU A 123 15.210 -11.908 -13.101 1.00 0.00 O ATOM 0 H GLU A 123 11.171 -8.669 -16.488 1.00 0.00 H new ATOM 0 HA GLU A 123 12.680 -11.075 -16.909 1.00 0.00 H new ATOM 0 HB2 GLU A 123 12.210 -9.939 -14.131 1.00 0.00 H new ATOM 0 HB3 GLU A 123 12.417 -11.657 -14.406 1.00 0.00 H new ATOM 0 HG2 GLU A 123 14.657 -11.174 -15.432 1.00 0.00 H new ATOM 0 HG3 GLU A 123 14.447 -9.486 -15.011 1.00 0.00 H new ATOM 1918 N LYS A 124 10.531 -12.364 -16.325 1.00 0.00 N ATOM 1919 CA LYS A 124 9.272 -13.042 -16.092 1.00 0.00 C ATOM 1920 C LYS A 124 9.538 -14.288 -15.262 1.00 0.00 C ATOM 1921 O LYS A 124 9.600 -15.405 -15.778 1.00 0.00 O ATOM 1922 CB LYS A 124 8.562 -13.381 -17.408 1.00 0.00 C ATOM 1923 CG LYS A 124 7.147 -13.911 -17.214 1.00 0.00 C ATOM 1924 CD LYS A 124 6.378 -13.979 -18.528 1.00 0.00 C ATOM 1925 CE LYS A 124 6.132 -12.594 -19.113 1.00 0.00 C ATOM 1926 NZ LYS A 124 5.384 -11.709 -18.177 1.00 0.00 N ATOM 0 H LYS A 124 11.291 -12.977 -16.622 1.00 0.00 H new ATOM 0 HA LYS A 124 8.601 -12.380 -15.545 1.00 0.00 H new ATOM 0 HB2 LYS A 124 8.525 -12.488 -18.032 1.00 0.00 H new ATOM 0 HB3 LYS A 124 9.149 -14.124 -17.948 1.00 0.00 H new ATOM 0 HG2 LYS A 124 7.190 -14.904 -16.767 1.00 0.00 H new ATOM 0 HG3 LYS A 124 6.612 -13.269 -16.514 1.00 0.00 H new ATOM 0 HD2 LYS A 124 6.936 -14.582 -19.244 1.00 0.00 H new ATOM 0 HD3 LYS A 124 5.423 -14.479 -18.365 1.00 0.00 H new ATOM 0 HE2 LYS A 124 7.088 -12.132 -19.361 1.00 0.00 H new ATOM 0 HE3 LYS A 124 5.573 -12.689 -20.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 5.020 -10.884 -18.695 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 4.589 -12.235 -17.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 6.020 -11.389 -17.419 1.00 0.00 H new ATOM 1940 N SER A 125 9.751 -14.066 -13.977 1.00 0.00 N ATOM 1941 CA SER A 125 10.120 -15.123 -13.059 1.00 0.00 C ATOM 1942 C SER A 125 8.893 -15.867 -12.540 1.00 0.00 C ATOM 1943 O SER A 125 8.077 -15.314 -11.804 1.00 0.00 O ATOM 1944 CB SER A 125 10.924 -14.523 -11.908 1.00 0.00 C ATOM 1945 OG SER A 125 10.562 -13.165 -11.695 1.00 0.00 O ATOM 0 H SER A 125 9.672 -13.146 -13.543 1.00 0.00 H new ATOM 0 HA SER A 125 10.732 -15.854 -13.588 1.00 0.00 H new ATOM 0 HB2 SER A 125 10.750 -15.098 -10.998 1.00 0.00 H new ATOM 0 HB3 SER A 125 11.989 -14.590 -12.129 1.00 0.00 H new ATOM 0 HG SER A 125 11.087 -12.799 -10.953 1.00 0.00 H new ATOM 1951 N LYS A 126 8.769 -17.124 -12.940 1.00 0.00 N ATOM 1952 CA LYS A 126 7.640 -17.949 -12.537 1.00 0.00 C ATOM 1953 C LYS A 126 8.093 -19.089 -11.628 1.00 0.00 C ATOM 1954 O LYS A 126 8.682 -20.070 -12.078 1.00 0.00 O ATOM 1955 CB LYS A 126 6.916 -18.495 -13.776 1.00 0.00 C ATOM 1956 CG LYS A 126 7.843 -19.162 -14.782 1.00 0.00 C ATOM 1957 CD LYS A 126 7.104 -19.582 -16.035 1.00 0.00 C ATOM 1958 CE LYS A 126 8.041 -20.244 -17.031 1.00 0.00 C ATOM 1959 NZ LYS A 126 7.338 -20.594 -18.290 1.00 0.00 N ATOM 0 H LYS A 126 9.440 -17.596 -13.546 1.00 0.00 H new ATOM 0 HA LYS A 126 6.944 -17.329 -11.971 1.00 0.00 H new ATOM 0 HB2 LYS A 126 6.162 -19.215 -13.457 1.00 0.00 H new ATOM 0 HB3 LYS A 126 6.389 -17.677 -14.268 1.00 0.00 H new ATOM 0 HG2 LYS A 126 8.647 -18.475 -15.047 1.00 0.00 H new ATOM 0 HG3 LYS A 126 8.308 -20.035 -14.324 1.00 0.00 H new ATOM 0 HD2 LYS A 126 6.302 -20.272 -15.773 1.00 0.00 H new ATOM 0 HD3 LYS A 126 6.638 -18.710 -16.494 1.00 0.00 H new ATOM 0 HE2 LYS A 126 8.872 -19.574 -17.251 1.00 0.00 H new ATOM 0 HE3 LYS A 126 8.467 -21.145 -16.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 8.007 -21.044 -18.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 6.561 -21.253 -18.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 6.953 -19.731 -18.724 1.00 0.00 H new ATOM 1973 N SER A 127 7.836 -18.945 -10.338 1.00 0.00 N ATOM 1974 CA SER A 127 8.189 -19.976 -9.380 1.00 0.00 C ATOM 1975 C SER A 127 7.032 -20.952 -9.201 1.00 0.00 C ATOM 1976 O SER A 127 6.230 -20.827 -8.270 1.00 0.00 O ATOM 1977 CB SER A 127 8.580 -19.341 -8.046 1.00 0.00 C ATOM 1978 OG SER A 127 9.625 -18.398 -8.227 1.00 0.00 O ATOM 0 H SER A 127 7.385 -18.125 -9.932 1.00 0.00 H new ATOM 0 HA SER A 127 9.046 -20.533 -9.759 1.00 0.00 H new ATOM 0 HB2 SER A 127 7.713 -18.850 -7.603 1.00 0.00 H new ATOM 0 HB3 SER A 127 8.899 -20.115 -7.348 1.00 0.00 H new ATOM 0 HG SER A 127 9.861 -18.001 -7.363 1.00 0.00 H new ATOM 1984 N LEU A 128 6.935 -21.903 -10.122 1.00 0.00 N ATOM 1985 CA LEU A 128 5.855 -22.876 -10.109 1.00 0.00 C ATOM 1986 C LEU A 128 6.146 -23.998 -9.121 1.00 0.00 C ATOM 1987 O LEU A 128 6.822 -24.972 -9.447 1.00 0.00 O ATOM 1988 CB LEU A 128 5.639 -23.455 -11.510 1.00 0.00 C ATOM 1989 CG LEU A 128 5.262 -22.438 -12.589 1.00 0.00 C ATOM 1990 CD1 LEU A 128 5.158 -23.120 -13.944 1.00 0.00 C ATOM 1991 CD2 LEU A 128 3.952 -21.743 -12.238 1.00 0.00 C ATOM 0 H LEU A 128 7.596 -22.019 -10.890 1.00 0.00 H new ATOM 0 HA LEU A 128 4.945 -22.365 -9.793 1.00 0.00 H new ATOM 0 HB2 LEU A 128 6.551 -23.965 -11.818 1.00 0.00 H new ATOM 0 HB3 LEU A 128 4.854 -24.210 -11.456 1.00 0.00 H new ATOM 0 HG LEU A 128 6.046 -21.682 -12.640 1.00 0.00 H new ATOM 0 HD11 LEU A 128 4.889 -22.384 -14.702 1.00 0.00 H new ATOM 0 HD12 LEU A 128 6.117 -23.570 -14.199 1.00 0.00 H new ATOM 0 HD13 LEU A 128 4.393 -23.895 -13.903 1.00 0.00 H new ATOM 0 HD21 LEU A 128 3.701 -21.024 -13.018 1.00 0.00 H new ATOM 0 HD22 LEU A 128 3.157 -22.484 -12.159 1.00 0.00 H new ATOM 0 HD23 LEU A 128 4.060 -21.223 -11.286 1.00 0.00 H new ATOM 2003 N GLU A 129 5.651 -23.841 -7.905 1.00 0.00 N ATOM 2004 CA GLU A 129 5.835 -24.849 -6.878 1.00 0.00 C ATOM 2005 C GLU A 129 4.619 -25.751 -6.777 1.00 0.00 C ATOM 2006 O GLU A 129 3.519 -25.309 -6.453 1.00 0.00 O ATOM 2007 CB GLU A 129 6.147 -24.208 -5.527 1.00 0.00 C ATOM 2008 CG GLU A 129 7.636 -24.067 -5.265 1.00 0.00 C ATOM 2009 CD GLU A 129 8.317 -25.410 -5.065 1.00 0.00 C ATOM 2010 OE1 GLU A 129 8.254 -26.266 -5.975 1.00 0.00 O ATOM 2011 OE2 GLU A 129 8.905 -25.627 -3.984 1.00 0.00 O ATOM 0 H GLU A 129 5.118 -23.024 -7.606 1.00 0.00 H new ATOM 0 HA GLU A 129 6.689 -25.462 -7.165 1.00 0.00 H new ATOM 0 HB2 GLU A 129 5.681 -23.223 -5.482 1.00 0.00 H new ATOM 0 HB3 GLU A 129 5.700 -24.808 -4.735 1.00 0.00 H new ATOM 0 HG2 GLU A 129 8.102 -23.547 -6.102 1.00 0.00 H new ATOM 0 HG3 GLU A 129 7.790 -23.449 -4.380 1.00 0.00 H new ATOM 2018 N HIS A 130 4.839 -27.020 -7.069 1.00 0.00 N ATOM 2019 CA HIS A 130 3.780 -28.019 -7.037 1.00 0.00 C ATOM 2020 C HIS A 130 4.206 -29.198 -6.172 1.00 0.00 C ATOM 2021 O HIS A 130 3.799 -30.335 -6.394 1.00 0.00 O ATOM 2022 CB HIS A 130 3.416 -28.478 -8.462 1.00 0.00 C ATOM 2023 CG HIS A 130 4.580 -28.939 -9.291 1.00 0.00 C ATOM 2024 ND1 HIS A 130 4.843 -30.265 -9.558 1.00 0.00 N ATOM 2025 CD2 HIS A 130 5.544 -28.234 -9.928 1.00 0.00 C ATOM 2026 CE1 HIS A 130 5.917 -30.355 -10.320 1.00 0.00 C ATOM 2027 NE2 HIS A 130 6.360 -29.135 -10.560 1.00 0.00 N ATOM 0 H HIS A 130 5.752 -27.389 -7.334 1.00 0.00 H new ATOM 0 HA HIS A 130 2.888 -27.572 -6.598 1.00 0.00 H new ATOM 0 HB2 HIS A 130 2.692 -29.290 -8.393 1.00 0.00 H new ATOM 0 HB3 HIS A 130 2.923 -27.655 -8.979 1.00 0.00 H new ATOM 0 HD2 HIS A 130 5.650 -27.159 -9.937 1.00 0.00 H new ATOM 0 HE1 HIS A 130 6.358 -31.271 -10.685 1.00 0.00 H new ATOM 0 HE2 HIS A 130 7.177 -28.901 -11.124 1.00 0.00 H new ATOM 2036 N HIS A 131 5.035 -28.906 -5.177 1.00 0.00 N ATOM 2037 CA HIS A 131 5.452 -29.910 -4.209 1.00 0.00 C ATOM 2038 C HIS A 131 4.490 -29.908 -3.034 1.00 0.00 C ATOM 2039 O HIS A 131 3.960 -28.859 -2.670 1.00 0.00 O ATOM 2040 CB HIS A 131 6.872 -29.634 -3.714 1.00 0.00 C ATOM 2041 CG HIS A 131 7.929 -29.854 -4.746 1.00 0.00 C ATOM 2042 ND1 HIS A 131 8.663 -28.834 -5.309 1.00 0.00 N ATOM 2043 CD2 HIS A 131 8.382 -30.996 -5.310 1.00 0.00 C ATOM 2044 CE1 HIS A 131 9.521 -29.340 -6.172 1.00 0.00 C ATOM 2045 NE2 HIS A 131 9.371 -30.649 -6.193 1.00 0.00 N ATOM 0 H HIS A 131 5.432 -27.980 -5.020 1.00 0.00 H new ATOM 0 HA HIS A 131 5.442 -30.886 -4.694 1.00 0.00 H new ATOM 0 HB2 HIS A 131 6.930 -28.603 -3.364 1.00 0.00 H new ATOM 0 HB3 HIS A 131 7.078 -30.274 -2.856 1.00 0.00 H new ATOM 0 HD1 HIS A 131 8.559 -27.843 -5.092 1.00 0.00 H new ATOM 0 HD2 HIS A 131 8.030 -31.996 -5.103 1.00 0.00 H new ATOM 0 HE1 HIS A 131 10.228 -28.777 -6.763 1.00 0.00 H new ATOM 2054 N HIS A 132 4.254 -31.067 -2.440 1.00 0.00 N ATOM 2055 CA HIS A 132 3.314 -31.151 -1.334 1.00 0.00 C ATOM 2056 C HIS A 132 3.992 -30.774 -0.024 1.00 0.00 C ATOM 2057 O HIS A 132 4.902 -31.465 0.438 1.00 0.00 O ATOM 2058 CB HIS A 132 2.710 -32.551 -1.228 1.00 0.00 C ATOM 2059 CG HIS A 132 1.609 -32.634 -0.220 1.00 0.00 C ATOM 2060 ND1 HIS A 132 1.699 -33.373 0.939 1.00 0.00 N ATOM 2061 CD2 HIS A 132 0.387 -32.052 -0.197 1.00 0.00 C ATOM 2062 CE1 HIS A 132 0.584 -33.243 1.631 1.00 0.00 C ATOM 2063 NE2 HIS A 132 -0.227 -32.446 0.963 1.00 0.00 N ATOM 0 H HIS A 132 4.693 -31.950 -2.700 1.00 0.00 H new ATOM 0 HA HIS A 132 2.508 -30.444 -1.530 1.00 0.00 H new ATOM 0 HB2 HIS A 132 2.326 -32.851 -2.203 1.00 0.00 H new ATOM 0 HB3 HIS A 132 3.494 -33.260 -0.962 1.00 0.00 H new ATOM 0 HD2 HIS A 132 -0.027 -31.399 -0.952 1.00 0.00 H new ATOM 0 HE1 HIS A 132 0.371 -33.709 2.582 1.00 0.00 H new ATOM 0 HE2 HIS A 132 -1.162 -32.167 1.262 1.00 0.00 H new ATOM 2072 N HIS A 133 3.545 -29.675 0.562 1.00 0.00 N ATOM 2073 CA HIS A 133 4.093 -29.205 1.825 1.00 0.00 C ATOM 2074 C HIS A 133 3.712 -30.146 2.965 1.00 0.00 C ATOM 2075 O HIS A 133 2.534 -30.314 3.281 1.00 0.00 O ATOM 2076 CB HIS A 133 3.599 -27.785 2.125 1.00 0.00 C ATOM 2077 CG HIS A 133 4.130 -27.220 3.410 1.00 0.00 C ATOM 2078 ND1 HIS A 133 3.327 -26.894 4.481 1.00 0.00 N ATOM 2079 CD2 HIS A 133 5.395 -26.922 3.789 1.00 0.00 C ATOM 2080 CE1 HIS A 133 4.075 -26.421 5.462 1.00 0.00 C ATOM 2081 NE2 HIS A 133 5.335 -26.429 5.069 1.00 0.00 N ATOM 0 H HIS A 133 2.801 -29.089 0.182 1.00 0.00 H new ATOM 0 HA HIS A 133 5.180 -29.190 1.740 1.00 0.00 H new ATOM 0 HB2 HIS A 133 3.887 -27.129 1.304 1.00 0.00 H new ATOM 0 HB3 HIS A 133 2.510 -27.789 2.163 1.00 0.00 H new ATOM 0 HD2 HIS A 133 6.287 -27.049 3.194 1.00 0.00 H new ATOM 0 HE1 HIS A 133 3.716 -26.085 6.423 1.00 0.00 H new ATOM 0 HE2 HIS A 133 6.133 -26.120 5.625 1.00 0.00 H new ATOM 2090 N HIS A 134 4.716 -30.762 3.569 1.00 0.00 N ATOM 2091 CA HIS A 134 4.506 -31.642 4.706 1.00 0.00 C ATOM 2092 C HIS A 134 5.565 -31.381 5.771 1.00 0.00 C ATOM 2093 O HIS A 134 6.757 -31.558 5.527 1.00 0.00 O ATOM 2094 CB HIS A 134 4.545 -33.111 4.258 1.00 0.00 C ATOM 2095 CG HIS A 134 4.431 -34.099 5.385 1.00 0.00 C ATOM 2096 ND1 HIS A 134 3.234 -34.642 5.789 1.00 0.00 N ATOM 2097 CD2 HIS A 134 5.378 -34.641 6.190 1.00 0.00 C ATOM 2098 CE1 HIS A 134 3.445 -35.471 6.792 1.00 0.00 C ATOM 2099 NE2 HIS A 134 4.738 -35.489 7.056 1.00 0.00 N ATOM 0 H HIS A 134 5.692 -30.667 3.287 1.00 0.00 H new ATOM 0 HA HIS A 134 3.524 -31.438 5.133 1.00 0.00 H new ATOM 0 HB2 HIS A 134 3.733 -33.286 3.552 1.00 0.00 H new ATOM 0 HB3 HIS A 134 5.477 -33.292 3.723 1.00 0.00 H new ATOM 0 HD2 HIS A 134 6.439 -34.442 6.155 1.00 0.00 H new ATOM 0 HE1 HIS A 134 2.687 -36.040 7.310 1.00 0.00 H new ATOM 0 HE2 HIS A 134 5.187 -36.043 7.785 1.00 0.00 H new ATOM 2108 N HIS A 135 5.126 -30.957 6.942 1.00 0.00 N ATOM 2109 CA HIS A 135 6.036 -30.706 8.047 1.00 0.00 C ATOM 2110 C HIS A 135 5.577 -31.475 9.274 1.00 0.00 C ATOM 2111 O HIS A 135 6.421 -32.123 9.922 1.00 0.00 O ATOM 2112 CB HIS A 135 6.126 -29.211 8.361 1.00 0.00 C ATOM 2113 CG HIS A 135 7.171 -28.888 9.388 1.00 0.00 C ATOM 2114 ND1 HIS A 135 6.874 -28.431 10.654 1.00 0.00 N ATOM 2115 CD2 HIS A 135 8.523 -28.969 9.330 1.00 0.00 C ATOM 2116 CE1 HIS A 135 7.993 -28.247 11.327 1.00 0.00 C ATOM 2117 NE2 HIS A 135 9.006 -28.569 10.549 1.00 0.00 N ATOM 2118 OXT HIS A 135 4.364 -31.450 9.564 1.00 0.00 O ATOM 0 H HIS A 135 4.144 -30.779 7.154 1.00 0.00 H new ATOM 0 HA HIS A 135 7.030 -31.047 7.758 1.00 0.00 H new ATOM 0 HB2 HIS A 135 6.346 -28.666 7.443 1.00 0.00 H new ATOM 0 HB3 HIS A 135 5.156 -28.861 8.715 1.00 0.00 H new ATOM 0 HD2 HIS A 135 9.110 -29.289 8.482 1.00 0.00 H new ATOM 0 HE1 HIS A 135 8.067 -27.892 12.344 1.00 0.00 H new ATOM 0 HE2 HIS A 135 9.991 -28.527 10.811 1.00 0.00 H new TER 2127 HIS A 135