USER MOD reduce.3.24.130724 H: found=0, std=0, add=823, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 822 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 Single : A 1 MET CE :methyl -128:sc= -0.17 (180deg=-1.58) USER MOD Single : A 1 MET N :NH3+ 138:sc= 0.0118 (180deg=0) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 ASN : amide:sc= -3.4! C(o=-3.4!,f=-5.5!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 SER OG : rot -80:sc= -0.708 USER MOD Single : A 17 TYR OH : rot 180:sc= -0.0139 USER MOD Single : A 22 LYS NZ :NH3+ -155:sc= 1.05 (180deg=0.246) USER MOD Single : A 23 MET CE :methyl -173:sc= -4.11! (180deg=-4.25!) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0.00305 USER MOD Single : A 34 MET CE :methyl -170:sc= -0.706 (180deg=-1.33) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 ASN : amide:sc= -2.59! C(o=-2.6!,f=-7!) USER MOD Single : A 47 LYS NZ :NH3+ -169:sc= 1.26 (180deg=0.999) USER MOD Single : A 48 GLN :FLIP amide:sc= -0.715 F(o=-4.6!,f=-0.71) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : B 101 MET CE :methyl -137:sc= -0.157 (180deg=-1.05) USER MOD Single : B 103 SER OG : rot 180:sc= 0 USER MOD Single : B 105 ASN : amide:sc= -3.19 K(o=-3.2,f=-4.2!) USER MOD Single : B 113 LYS NZ :NH3+ 178:sc= -0.262 (180deg=-0.288) USER MOD Single : B 116 SER OG : rot -66:sc= -1.01! USER MOD Single : B 117 TYR OH : rot 180:sc= -0.343 USER MOD Single : B 122 LYS NZ :NH3+ 176:sc= 0.947 (180deg=0.846) USER MOD Single : B 123 MET CE :methyl -161:sc= -3.54! (180deg=-4.32!) USER MOD Single : B 126 THR OG1 : rot 180:sc= 0 USER MOD Single : B 128 SER OG : rot 180:sc= 0 USER MOD Single : B 134 MET CE :methyl 161:sc= -0.0479 (180deg=-0.177) USER MOD Single : B 137 TYR OH : rot 180:sc= 0 USER MOD Single : B 141 ASN : amide:sc= 0.989 K(o=0.99,f=0) USER MOD Single : B 147 LYS NZ :NH3+ 172:sc=-0.00156 (180deg=-0.0736) USER MOD Single : B 148 GLN :FLIP amide:sc= -0.324 F(o=-3.6!,f=-0.32) USER MOD Single : B 149 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.028 13.278 11.247 1.00 0.00 N ATOM 2 CA MET A 1 -2.463 11.982 10.815 1.00 0.00 C ATOM 3 C MET A 1 -2.719 10.913 11.868 1.00 0.00 C ATOM 4 O MET A 1 -2.584 11.166 13.065 1.00 0.00 O ATOM 5 CB MET A 1 -0.956 12.132 10.542 1.00 0.00 C ATOM 6 CG MET A 1 -0.227 10.814 10.370 1.00 0.00 C ATOM 7 SD MET A 1 1.475 11.027 9.814 1.00 0.00 S ATOM 8 CE MET A 1 1.221 11.699 8.163 1.00 0.00 C ATOM 0 H1 MET A 1 -2.358 14.041 11.022 1.00 0.00 H new ATOM 0 H2 MET A 1 -3.926 13.448 10.750 1.00 0.00 H new ATOM 0 H3 MET A 1 -3.198 13.258 12.273 1.00 0.00 H new ATOM 0 HA MET A 1 -2.954 11.671 9.893 1.00 0.00 H new ATOM 0 HB2 MET A 1 -0.818 12.732 9.643 1.00 0.00 H new ATOM 0 HB3 MET A 1 -0.501 12.683 11.365 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.231 10.275 11.318 1.00 0.00 H new ATOM 0 HG3 MET A 1 -0.765 10.197 9.651 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.790 11.114 7.441 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.161 11.655 7.911 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.557 12.735 8.136 1.00 0.00 H new ATOM 18 N GLY A 2 -3.073 9.720 11.404 1.00 0.00 N ATOM 19 CA GLY A 2 -3.346 8.619 12.315 1.00 0.00 C ATOM 20 C GLY A 2 -2.438 7.440 12.051 1.00 0.00 C ATOM 21 O GLY A 2 -1.938 7.265 10.948 1.00 0.00 O ATOM 0 H GLY A 2 -3.176 9.494 10.415 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -3.216 8.956 13.343 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -4.386 8.309 12.210 1.00 0.00 H new ATOM 25 N SER A 3 -2.233 6.629 13.079 1.00 0.00 N ATOM 26 CA SER A 3 -1.423 5.423 12.974 1.00 0.00 C ATOM 27 C SER A 3 -2.300 4.161 12.987 1.00 0.00 C ATOM 28 O SER A 3 -3.262 4.062 13.744 1.00 0.00 O ATOM 29 CB SER A 3 -0.399 5.366 14.107 1.00 0.00 C ATOM 30 OG SER A 3 -1.000 5.574 15.394 1.00 0.00 O ATOM 0 H SER A 3 -2.623 6.788 14.008 1.00 0.00 H new ATOM 0 HA SER A 3 -0.894 5.458 12.022 1.00 0.00 H new ATOM 0 HB2 SER A 3 0.101 4.397 14.094 1.00 0.00 H new ATOM 0 HB3 SER A 3 0.368 6.123 13.940 1.00 0.00 H new ATOM 0 HG SER A 3 -0.310 5.528 16.089 1.00 0.00 H new ATOM 36 N ILE A 4 -1.929 3.198 12.138 1.00 0.00 N ATOM 37 CA ILE A 4 -2.661 1.948 11.994 1.00 0.00 C ATOM 38 C ILE A 4 -1.707 0.775 12.141 1.00 0.00 C ATOM 39 O ILE A 4 -0.483 0.947 12.027 1.00 0.00 O ATOM 40 CB ILE A 4 -3.391 1.873 10.624 1.00 0.00 C ATOM 41 CG1 ILE A 4 -2.385 1.783 9.457 1.00 0.00 C ATOM 42 CG2 ILE A 4 -4.301 3.079 10.452 1.00 0.00 C ATOM 43 CD1 ILE A 4 -2.129 0.375 8.944 1.00 0.00 C ATOM 0 H ILE A 4 -1.111 3.269 11.533 1.00 0.00 H new ATOM 0 HA ILE A 4 -3.417 1.904 12.778 1.00 0.00 H new ATOM 0 HB ILE A 4 -3.996 0.967 10.610 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -2.751 2.394 8.632 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -1.437 2.216 9.778 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -4.808 3.018 9.489 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -5.041 3.093 11.252 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -3.707 3.992 10.491 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -1.410 0.411 8.126 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -1.730 -0.239 9.751 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -3.064 -0.058 8.587 1.00 0.00 H new ATOM 55 N ASN A 5 -2.253 -0.422 12.362 1.00 0.00 N ATOM 56 CA ASN A 5 -1.433 -1.625 12.494 1.00 0.00 C ATOM 57 C ASN A 5 -1.526 -2.442 11.218 1.00 0.00 C ATOM 58 O ASN A 5 -2.615 -2.800 10.758 1.00 0.00 O ATOM 59 CB ASN A 5 -1.913 -2.480 13.677 1.00 0.00 C ATOM 60 CG ASN A 5 -1.029 -3.693 13.896 1.00 0.00 C ATOM 61 OD1 ASN A 5 -0.086 -3.661 14.677 1.00 0.00 O ATOM 62 ND2 ASN A 5 -1.322 -4.777 13.184 1.00 0.00 N ATOM 0 H ASN A 5 -3.256 -0.583 12.453 1.00 0.00 H new ATOM 0 HA ASN A 5 -0.400 -1.325 12.672 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -1.926 -1.872 14.582 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -2.938 -2.806 13.497 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -0.753 -5.618 13.279 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -2.115 -4.767 12.543 1.00 0.00 H new ATOM 69 N LEU A 6 -0.373 -2.753 10.658 1.00 0.00 N ATOM 70 CA LEU A 6 -0.267 -3.550 9.434 1.00 0.00 C ATOM 71 C LEU A 6 0.455 -4.858 9.784 1.00 0.00 C ATOM 72 O LEU A 6 1.320 -4.846 10.648 1.00 0.00 O ATOM 73 CB LEU A 6 0.474 -2.699 8.380 1.00 0.00 C ATOM 74 CG LEU A 6 0.797 -3.339 7.016 1.00 0.00 C ATOM 75 CD1 LEU A 6 2.090 -4.153 7.066 1.00 0.00 C ATOM 76 CD2 LEU A 6 -0.372 -4.167 6.499 1.00 0.00 C ATOM 0 H LEU A 6 0.528 -2.461 11.037 1.00 0.00 H new ATOM 0 HA LEU A 6 -1.236 -3.818 9.013 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -0.123 -1.806 8.195 1.00 0.00 H new ATOM 0 HB3 LEU A 6 1.414 -2.368 8.822 1.00 0.00 H new ATOM 0 HG LEU A 6 0.958 -2.528 6.306 1.00 0.00 H new ATOM 0 HD11 LEU A 6 2.284 -4.588 6.086 1.00 0.00 H new ATOM 0 HD12 LEU A 6 2.919 -3.502 7.344 1.00 0.00 H new ATOM 0 HD13 LEU A 6 1.990 -4.949 7.803 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -0.110 -4.604 5.535 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -0.597 -4.963 7.209 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -1.247 -3.528 6.382 1.00 0.00 H new ATOM 88 N ARG A 7 0.121 -5.978 9.148 1.00 0.00 N ATOM 89 CA ARG A 7 0.697 -7.275 9.503 1.00 0.00 C ATOM 90 C ARG A 7 1.049 -8.017 8.212 1.00 0.00 C ATOM 91 O ARG A 7 0.173 -8.172 7.362 1.00 0.00 O ATOM 92 CB ARG A 7 -0.267 -8.114 10.359 1.00 0.00 C ATOM 93 CG ARG A 7 -0.421 -7.624 11.802 1.00 0.00 C ATOM 94 CD ARG A 7 -1.099 -8.664 12.679 1.00 0.00 C ATOM 95 NE ARG A 7 -1.266 -8.217 14.077 1.00 0.00 N ATOM 96 CZ ARG A 7 -2.161 -8.716 14.927 1.00 0.00 C ATOM 97 NH1 ARG A 7 -3.069 -9.586 14.526 1.00 0.00 N ATOM 98 NH2 ARG A 7 -2.165 -8.290 16.189 1.00 0.00 N ATOM 0 H ARG A 7 -0.549 -6.014 8.380 1.00 0.00 H new ATOM 0 HA ARG A 7 1.592 -7.112 10.103 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -1.247 -8.117 9.883 1.00 0.00 H new ATOM 0 HB3 ARG A 7 0.084 -9.146 10.374 1.00 0.00 H new ATOM 0 HG2 ARG A 7 0.560 -7.386 12.212 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -1.003 -6.703 11.813 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -2.076 -8.903 12.260 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -0.512 -9.583 12.664 1.00 0.00 H new ATOM 0 HE ARG A 7 -0.653 -7.475 14.414 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -3.092 -9.886 13.551 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -3.747 -9.958 15.191 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -1.488 -7.590 16.493 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -2.845 -8.664 16.851 1.00 0.00 H new ATOM 112 N ILE A 8 2.279 -8.437 8.045 1.00 0.00 N ATOM 113 CA ILE A 8 2.700 -9.136 6.814 1.00 0.00 C ATOM 114 C ILE A 8 3.742 -10.203 7.114 1.00 0.00 C ATOM 115 O ILE A 8 4.265 -10.310 8.228 1.00 0.00 O ATOM 116 CB ILE A 8 3.291 -8.193 5.726 1.00 0.00 C ATOM 117 CG1 ILE A 8 4.684 -7.659 6.141 1.00 0.00 C ATOM 118 CG2 ILE A 8 2.332 -7.042 5.426 1.00 0.00 C ATOM 119 CD1 ILE A 8 4.742 -6.923 7.472 1.00 0.00 C ATOM 0 H ILE A 8 3.020 -8.316 8.735 1.00 0.00 H new ATOM 0 HA ILE A 8 1.784 -9.580 6.424 1.00 0.00 H new ATOM 0 HB ILE A 8 3.419 -8.776 4.814 1.00 0.00 H new ATOM 0 HG12 ILE A 8 5.377 -8.499 6.182 1.00 0.00 H new ATOM 0 HG13 ILE A 8 5.042 -6.988 5.360 1.00 0.00 H new ATOM 0 HG21 ILE A 8 2.766 -6.396 4.663 1.00 0.00 H new ATOM 0 HG22 ILE A 8 1.384 -7.442 5.066 1.00 0.00 H new ATOM 0 HG23 ILE A 8 2.160 -6.465 6.335 1.00 0.00 H new ATOM 0 HD11 ILE A 8 5.764 -6.594 7.662 1.00 0.00 H new ATOM 0 HD12 ILE A 8 4.082 -6.056 7.438 1.00 0.00 H new ATOM 0 HD13 ILE A 8 4.422 -7.591 8.271 1.00 0.00 H new ATOM 131 N ASP A 9 4.041 -10.986 6.072 1.00 0.00 N ATOM 132 CA ASP A 9 5.132 -11.955 6.108 1.00 0.00 C ATOM 133 C ASP A 9 6.431 -11.264 6.499 1.00 0.00 C ATOM 134 O ASP A 9 6.816 -10.280 5.869 1.00 0.00 O ATOM 135 CB ASP A 9 5.286 -12.590 4.731 1.00 0.00 C ATOM 136 CG ASP A 9 4.017 -13.240 4.202 1.00 0.00 C ATOM 137 OD1 ASP A 9 3.016 -12.508 3.973 1.00 0.00 O ATOM 138 OD2 ASP A 9 4.014 -14.462 3.990 1.00 0.00 O ATOM 0 H ASP A 9 3.535 -10.964 5.187 1.00 0.00 H new ATOM 0 HA ASP A 9 4.905 -12.725 6.845 1.00 0.00 H new ATOM 0 HB2 ASP A 9 5.612 -11.826 4.025 1.00 0.00 H new ATOM 0 HB3 ASP A 9 6.075 -13.341 4.775 1.00 0.00 H new ATOM 143 N ASP A 10 7.106 -11.774 7.518 1.00 0.00 N ATOM 144 CA ASP A 10 8.359 -11.184 8.007 1.00 0.00 C ATOM 145 C ASP A 10 9.405 -11.173 6.903 1.00 0.00 C ATOM 146 O ASP A 10 10.248 -10.258 6.836 1.00 0.00 O ATOM 147 CB ASP A 10 8.894 -11.945 9.205 1.00 0.00 C ATOM 148 CG ASP A 10 7.959 -11.903 10.401 1.00 0.00 C ATOM 149 OD1 ASP A 10 7.892 -10.848 11.072 1.00 0.00 O ATOM 150 OD2 ASP A 10 7.277 -12.912 10.691 1.00 0.00 O ATOM 0 H ASP A 10 6.809 -12.604 8.032 1.00 0.00 H new ATOM 0 HA ASP A 10 8.145 -10.160 8.314 1.00 0.00 H new ATOM 0 HB2 ASP A 10 9.066 -12.983 8.922 1.00 0.00 H new ATOM 0 HB3 ASP A 10 9.860 -11.529 9.491 1.00 0.00 H new ATOM 155 N GLU A 11 9.360 -12.173 6.042 1.00 0.00 N ATOM 156 CA GLU A 11 10.306 -12.297 4.934 1.00 0.00 C ATOM 157 C GLU A 11 10.047 -11.216 3.893 1.00 0.00 C ATOM 158 O GLU A 11 10.985 -10.633 3.357 1.00 0.00 O ATOM 159 CB GLU A 11 10.240 -13.676 4.282 1.00 0.00 C ATOM 160 CG GLU A 11 8.927 -13.975 3.539 1.00 0.00 C ATOM 161 CD GLU A 11 9.051 -15.193 2.643 1.00 0.00 C ATOM 162 OE1 GLU A 11 9.784 -15.139 1.636 1.00 0.00 O ATOM 163 OE2 GLU A 11 8.415 -16.213 2.940 1.00 0.00 O ATOM 0 H GLU A 11 8.671 -12.924 6.086 1.00 0.00 H new ATOM 0 HA GLU A 11 11.308 -12.171 5.345 1.00 0.00 H new ATOM 0 HB2 GLU A 11 11.068 -13.771 3.580 1.00 0.00 H new ATOM 0 HB3 GLU A 11 10.386 -14.434 5.052 1.00 0.00 H new ATOM 0 HG2 GLU A 11 8.128 -14.136 4.263 1.00 0.00 H new ATOM 0 HG3 GLU A 11 8.644 -13.110 2.939 1.00 0.00 H new ATOM 170 N LEU A 12 8.782 -10.928 3.626 1.00 0.00 N ATOM 171 CA LEU A 12 8.417 -10.012 2.564 1.00 0.00 C ATOM 172 C LEU A 12 8.754 -8.601 3.015 1.00 0.00 C ATOM 173 O LEU A 12 9.271 -7.804 2.249 1.00 0.00 O ATOM 174 CB LEU A 12 6.914 -10.126 2.259 1.00 0.00 C ATOM 175 CG LEU A 12 6.409 -9.159 1.179 1.00 0.00 C ATOM 176 CD1 LEU A 12 7.112 -9.399 -0.152 1.00 0.00 C ATOM 177 CD2 LEU A 12 4.876 -9.269 1.028 1.00 0.00 C ATOM 0 H LEU A 12 7.990 -11.320 4.135 1.00 0.00 H new ATOM 0 HA LEU A 12 8.968 -10.255 1.655 1.00 0.00 H new ATOM 0 HB2 LEU A 12 6.696 -11.147 1.945 1.00 0.00 H new ATOM 0 HB3 LEU A 12 6.355 -9.949 3.178 1.00 0.00 H new ATOM 0 HG LEU A 12 6.648 -8.144 1.495 1.00 0.00 H new ATOM 0 HD11 LEU A 12 6.732 -8.698 -0.896 1.00 0.00 H new ATOM 0 HD12 LEU A 12 8.185 -9.251 -0.029 1.00 0.00 H new ATOM 0 HD13 LEU A 12 6.922 -10.420 -0.485 1.00 0.00 H new ATOM 0 HD21 LEU A 12 4.536 -8.576 0.258 1.00 0.00 H new ATOM 0 HD22 LEU A 12 4.611 -10.287 0.743 1.00 0.00 H new ATOM 0 HD23 LEU A 12 4.398 -9.021 1.976 1.00 0.00 H new ATOM 189 N LYS A 13 8.449 -8.345 4.276 1.00 0.00 N ATOM 190 CA LYS A 13 8.792 -7.096 4.945 1.00 0.00 C ATOM 191 C LYS A 13 10.229 -6.714 4.656 1.00 0.00 C ATOM 192 O LYS A 13 10.525 -5.604 4.230 1.00 0.00 O ATOM 193 CB LYS A 13 8.609 -7.262 6.457 1.00 0.00 C ATOM 194 CG LYS A 13 9.219 -6.164 7.306 1.00 0.00 C ATOM 195 CD LYS A 13 9.458 -6.652 8.726 1.00 0.00 C ATOM 196 CE LYS A 13 10.077 -5.569 9.592 1.00 0.00 C ATOM 197 NZ LYS A 13 10.224 -5.991 11.002 1.00 0.00 N ATOM 0 H LYS A 13 7.950 -9.005 4.873 1.00 0.00 H new ATOM 0 HA LYS A 13 8.136 -6.309 4.573 1.00 0.00 H new ATOM 0 HB2 LYS A 13 7.542 -7.316 6.674 1.00 0.00 H new ATOM 0 HB3 LYS A 13 9.044 -8.215 6.757 1.00 0.00 H new ATOM 0 HG2 LYS A 13 10.161 -5.838 6.865 1.00 0.00 H new ATOM 0 HG3 LYS A 13 8.557 -5.298 7.320 1.00 0.00 H new ATOM 0 HD2 LYS A 13 8.514 -6.974 9.165 1.00 0.00 H new ATOM 0 HD3 LYS A 13 10.114 -7.523 8.707 1.00 0.00 H new ATOM 0 HE2 LYS A 13 11.055 -5.302 9.192 1.00 0.00 H new ATOM 0 HE3 LYS A 13 9.458 -4.673 9.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 10.651 -5.219 11.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 9.289 -6.221 11.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 10.836 -6.830 11.051 1.00 0.00 H new ATOM 211 N ALA A 14 11.136 -7.661 4.900 1.00 0.00 N ATOM 212 CA ALA A 14 12.576 -7.455 4.731 1.00 0.00 C ATOM 213 C ALA A 14 12.916 -6.919 3.342 1.00 0.00 C ATOM 214 O ALA A 14 13.628 -5.919 3.198 1.00 0.00 O ATOM 215 CB ALA A 14 13.310 -8.737 5.018 1.00 0.00 C ATOM 0 H ALA A 14 10.892 -8.597 5.222 1.00 0.00 H new ATOM 0 HA ALA A 14 12.899 -6.697 5.444 1.00 0.00 H new ATOM 0 HB1 ALA A 14 14.381 -8.579 4.891 1.00 0.00 H new ATOM 0 HB2 ALA A 14 13.108 -9.050 6.042 1.00 0.00 H new ATOM 0 HB3 ALA A 14 12.973 -9.511 4.329 1.00 0.00 H new ATOM 221 N ARG A 15 12.393 -7.579 2.297 1.00 0.00 N ATOM 222 CA ARG A 15 12.709 -7.217 0.925 1.00 0.00 C ATOM 223 C ARG A 15 12.106 -5.858 0.560 1.00 0.00 C ATOM 224 O ARG A 15 12.784 -4.999 -0.015 1.00 0.00 O ATOM 225 CB ARG A 15 12.225 -8.281 -0.084 1.00 0.00 C ATOM 226 CG ARG A 15 13.016 -9.595 -0.088 1.00 0.00 C ATOM 227 CD ARG A 15 12.791 -10.413 1.178 1.00 0.00 C ATOM 228 NE ARG A 15 13.499 -11.693 1.153 1.00 0.00 N ATOM 229 CZ ARG A 15 12.914 -12.880 1.251 1.00 0.00 C ATOM 230 NH1 ARG A 15 11.579 -12.981 1.242 1.00 0.00 N ATOM 231 NH2 ARG A 15 13.650 -13.981 1.312 1.00 0.00 N ATOM 0 H ARG A 15 11.750 -8.366 2.386 1.00 0.00 H new ATOM 0 HA ARG A 15 13.796 -7.158 0.864 1.00 0.00 H new ATOM 0 HB2 ARG A 15 11.180 -8.507 0.126 1.00 0.00 H new ATOM 0 HB3 ARG A 15 12.263 -7.851 -1.085 1.00 0.00 H new ATOM 0 HG2 ARG A 15 12.727 -10.187 -0.956 1.00 0.00 H new ATOM 0 HG3 ARG A 15 14.079 -9.376 -0.191 1.00 0.00 H new ATOM 0 HD2 ARG A 15 13.121 -9.836 2.042 1.00 0.00 H new ATOM 0 HD3 ARG A 15 11.724 -10.595 1.304 1.00 0.00 H new ATOM 0 HE ARG A 15 14.514 -11.671 1.053 1.00 0.00 H new ATOM 0 HH11 ARG A 15 11.005 -12.142 1.159 1.00 0.00 H new ATOM 0 HH12 ARG A 15 11.136 -13.897 1.318 1.00 0.00 H new ATOM 0 HH21 ARG A 15 14.668 -13.916 1.284 1.00 0.00 H new ATOM 0 HH22 ARG A 15 13.199 -14.893 1.387 1.00 0.00 H new ATOM 245 N SER A 16 10.848 -5.655 0.917 1.00 0.00 N ATOM 246 CA SER A 16 10.133 -4.416 0.650 1.00 0.00 C ATOM 247 C SER A 16 10.871 -3.219 1.232 1.00 0.00 C ATOM 248 O SER A 16 11.170 -2.243 0.525 1.00 0.00 O ATOM 249 CB SER A 16 8.723 -4.503 1.227 1.00 0.00 C ATOM 250 OG SER A 16 8.010 -3.301 1.029 1.00 0.00 O ATOM 0 H SER A 16 10.288 -6.353 1.406 1.00 0.00 H new ATOM 0 HA SER A 16 10.073 -4.277 -0.429 1.00 0.00 H new ATOM 0 HB2 SER A 16 8.186 -5.328 0.758 1.00 0.00 H new ATOM 0 HB3 SER A 16 8.778 -4.724 2.293 1.00 0.00 H new ATOM 0 HG SER A 16 8.278 -2.646 1.707 1.00 0.00 H new ATOM 256 N TYR A 17 11.165 -3.291 2.526 1.00 0.00 N ATOM 257 CA TYR A 17 11.853 -2.228 3.235 1.00 0.00 C ATOM 258 C TYR A 17 13.227 -1.979 2.611 1.00 0.00 C ATOM 259 O TYR A 17 13.671 -0.845 2.493 1.00 0.00 O ATOM 260 CB TYR A 17 12.001 -2.566 4.715 1.00 0.00 C ATOM 261 CG TYR A 17 10.728 -2.364 5.528 1.00 0.00 C ATOM 262 CD1 TYR A 17 9.510 -2.872 5.107 1.00 0.00 C ATOM 263 CD2 TYR A 17 10.754 -1.669 6.751 1.00 0.00 C ATOM 264 CE1 TYR A 17 8.352 -2.703 5.841 1.00 0.00 C ATOM 265 CE2 TYR A 17 9.601 -1.497 7.491 1.00 0.00 C ATOM 266 CZ TYR A 17 8.407 -2.002 7.046 1.00 0.00 C ATOM 267 OH TYR A 17 7.264 -1.831 7.789 1.00 0.00 O ATOM 0 H TYR A 17 10.930 -4.093 3.111 1.00 0.00 H new ATOM 0 HA TYR A 17 11.255 -1.321 3.150 1.00 0.00 H new ATOM 0 HB2 TYR A 17 12.319 -3.604 4.810 1.00 0.00 H new ATOM 0 HB3 TYR A 17 12.793 -1.950 5.140 1.00 0.00 H new ATOM 0 HD1 TYR A 17 9.464 -3.417 4.176 1.00 0.00 H new ATOM 0 HD2 TYR A 17 11.687 -1.265 7.115 1.00 0.00 H new ATOM 0 HE1 TYR A 17 7.416 -3.108 5.487 1.00 0.00 H new ATOM 0 HE2 TYR A 17 9.640 -0.961 8.428 1.00 0.00 H new ATOM 0 HH TYR A 17 7.474 -1.322 8.600 1.00 0.00 H new ATOM 277 N ALA A 18 13.872 -3.063 2.194 1.00 0.00 N ATOM 278 CA ALA A 18 15.188 -2.989 1.584 1.00 0.00 C ATOM 279 C ALA A 18 15.142 -2.159 0.304 1.00 0.00 C ATOM 280 O ALA A 18 16.011 -1.336 0.061 1.00 0.00 O ATOM 281 CB ALA A 18 15.726 -4.388 1.294 1.00 0.00 C ATOM 0 H ALA A 18 13.498 -4.009 2.270 1.00 0.00 H new ATOM 0 HA ALA A 18 15.862 -2.500 2.287 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.713 -4.311 0.837 1.00 0.00 H new ATOM 0 HB2 ALA A 18 15.800 -4.950 2.225 1.00 0.00 H new ATOM 0 HB3 ALA A 18 15.050 -4.904 0.612 1.00 0.00 H new ATOM 287 N ALA A 19 14.119 -2.396 -0.509 1.00 0.00 N ATOM 288 CA ALA A 19 13.953 -1.691 -1.776 1.00 0.00 C ATOM 289 C ALA A 19 13.733 -0.192 -1.575 1.00 0.00 C ATOM 290 O ALA A 19 14.365 0.642 -2.229 1.00 0.00 O ATOM 291 CB ALA A 19 12.783 -2.291 -2.542 1.00 0.00 C ATOM 0 H ALA A 19 13.386 -3.077 -0.311 1.00 0.00 H new ATOM 0 HA ALA A 19 14.873 -1.810 -2.348 1.00 0.00 H new ATOM 0 HB1 ALA A 19 12.659 -1.764 -3.488 1.00 0.00 H new ATOM 0 HB2 ALA A 19 12.978 -3.346 -2.737 1.00 0.00 H new ATOM 0 HB3 ALA A 19 11.873 -2.193 -1.951 1.00 0.00 H new ATOM 297 N LEU A 20 12.840 0.158 -0.645 1.00 0.00 N ATOM 298 CA LEU A 20 12.474 1.566 -0.449 1.00 0.00 C ATOM 299 C LEU A 20 13.599 2.367 0.211 1.00 0.00 C ATOM 300 O LEU A 20 13.809 3.525 -0.150 1.00 0.00 O ATOM 301 CB LEU A 20 11.137 1.686 0.329 1.00 0.00 C ATOM 302 CG LEU A 20 11.021 0.881 1.633 1.00 0.00 C ATOM 303 CD1 LEU A 20 11.700 1.588 2.803 1.00 0.00 C ATOM 304 CD2 LEU A 20 9.557 0.575 1.959 1.00 0.00 C ATOM 0 H LEU A 20 12.364 -0.499 -0.026 1.00 0.00 H new ATOM 0 HA LEU A 20 12.323 2.008 -1.434 1.00 0.00 H new ATOM 0 HB2 LEU A 20 10.973 2.738 0.563 1.00 0.00 H new ATOM 0 HB3 LEU A 20 10.329 1.377 -0.334 1.00 0.00 H new ATOM 0 HG LEU A 20 11.544 -0.063 1.476 1.00 0.00 H new ATOM 0 HD11 LEU A 20 11.594 0.984 3.704 1.00 0.00 H new ATOM 0 HD12 LEU A 20 12.758 1.725 2.581 1.00 0.00 H new ATOM 0 HD13 LEU A 20 11.234 2.560 2.961 1.00 0.00 H new ATOM 0 HD21 LEU A 20 9.502 0.005 2.886 1.00 0.00 H new ATOM 0 HD22 LEU A 20 9.007 1.509 2.075 1.00 0.00 H new ATOM 0 HD23 LEU A 20 9.118 -0.007 1.149 1.00 0.00 H new ATOM 316 N GLU A 21 14.337 1.758 1.132 1.00 0.00 N ATOM 317 CA GLU A 21 15.453 2.442 1.787 1.00 0.00 C ATOM 318 C GLU A 21 16.595 2.658 0.806 1.00 0.00 C ATOM 319 O GLU A 21 17.438 3.538 1.000 1.00 0.00 O ATOM 320 CB GLU A 21 15.926 1.644 3.023 1.00 0.00 C ATOM 321 CG GLU A 21 16.463 0.254 2.723 1.00 0.00 C ATOM 322 CD GLU A 21 17.983 0.172 2.679 1.00 0.00 C ATOM 323 OE1 GLU A 21 18.603 -0.054 3.745 1.00 0.00 O ATOM 324 OE2 GLU A 21 18.575 0.305 1.592 1.00 0.00 O ATOM 0 H GLU A 21 14.187 0.798 1.443 1.00 0.00 H new ATOM 0 HA GLU A 21 15.111 3.420 2.127 1.00 0.00 H new ATOM 0 HB2 GLU A 21 16.703 2.216 3.530 1.00 0.00 H new ATOM 0 HB3 GLU A 21 15.092 1.553 3.719 1.00 0.00 H new ATOM 0 HG2 GLU A 21 16.094 -0.438 3.480 1.00 0.00 H new ATOM 0 HG3 GLU A 21 16.064 -0.079 1.765 1.00 0.00 H new ATOM 331 N LYS A 22 16.595 1.881 -0.272 1.00 0.00 N ATOM 332 CA LYS A 22 17.559 2.039 -1.355 1.00 0.00 C ATOM 333 C LYS A 22 17.284 3.356 -2.082 1.00 0.00 C ATOM 334 O LYS A 22 18.191 4.143 -2.359 1.00 0.00 O ATOM 335 CB LYS A 22 17.480 0.868 -2.338 1.00 0.00 C ATOM 336 CG LYS A 22 18.015 -0.441 -1.794 1.00 0.00 C ATOM 337 CD LYS A 22 19.485 -0.312 -1.412 1.00 0.00 C ATOM 338 CE LYS A 22 19.994 -1.630 -0.869 1.00 0.00 C ATOM 339 NZ LYS A 22 19.179 -2.121 0.279 1.00 0.00 N ATOM 0 H LYS A 22 15.927 1.124 -0.420 1.00 0.00 H new ATOM 0 HA LYS A 22 18.564 2.053 -0.933 1.00 0.00 H new ATOM 0 HB2 LYS A 22 16.440 0.727 -2.634 1.00 0.00 H new ATOM 0 HB3 LYS A 22 18.036 1.127 -3.239 1.00 0.00 H new ATOM 0 HG2 LYS A 22 17.434 -0.742 -0.922 1.00 0.00 H new ATOM 0 HG3 LYS A 22 17.897 -1.225 -2.542 1.00 0.00 H new ATOM 0 HD2 LYS A 22 20.071 -0.017 -2.282 1.00 0.00 H new ATOM 0 HD3 LYS A 22 19.608 0.471 -0.664 1.00 0.00 H new ATOM 0 HE2 LYS A 22 19.985 -2.376 -1.664 1.00 0.00 H new ATOM 0 HE3 LYS A 22 21.031 -1.514 -0.553 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 19.758 -2.748 0.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 18.853 -1.311 0.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 18.356 -2.647 -0.079 1.00 0.00 H new ATOM 353 N MET A 23 16.005 3.576 -2.374 1.00 0.00 N ATOM 354 CA MET A 23 15.562 4.804 -3.023 1.00 0.00 C ATOM 355 C MET A 23 15.562 5.975 -2.051 1.00 0.00 C ATOM 356 O MET A 23 15.372 7.123 -2.456 1.00 0.00 O ATOM 357 CB MET A 23 14.158 4.622 -3.623 1.00 0.00 C ATOM 358 CG MET A 23 14.077 3.496 -4.641 1.00 0.00 C ATOM 359 SD MET A 23 12.427 3.317 -5.335 1.00 0.00 S ATOM 360 CE MET A 23 11.448 3.075 -3.854 1.00 0.00 C ATOM 0 H MET A 23 15.255 2.916 -2.170 1.00 0.00 H new ATOM 0 HA MET A 23 16.266 5.025 -3.825 1.00 0.00 H new ATOM 0 HB2 MET A 23 13.450 4.426 -2.818 1.00 0.00 H new ATOM 0 HB3 MET A 23 13.850 5.554 -4.098 1.00 0.00 H new ATOM 0 HG2 MET A 23 14.788 3.685 -5.445 1.00 0.00 H new ATOM 0 HG3 MET A 23 14.373 2.560 -4.168 1.00 0.00 H new ATOM 0 HE1 MET A 23 10.424 2.826 -4.132 1.00 0.00 H new ATOM 0 HE2 MET A 23 11.873 2.261 -3.266 1.00 0.00 H new ATOM 0 HE3 MET A 23 11.451 3.990 -3.262 1.00 0.00 H new ATOM 370 N GLY A 24 15.767 5.683 -0.783 1.00 0.00 N ATOM 371 CA GLY A 24 15.779 6.722 0.246 1.00 0.00 C ATOM 372 C GLY A 24 14.379 7.062 0.742 1.00 0.00 C ATOM 373 O GLY A 24 14.186 8.082 1.398 1.00 0.00 O ATOM 0 H GLY A 24 15.928 4.739 -0.433 1.00 0.00 H new ATOM 0 HA2 GLY A 24 16.389 6.391 1.086 1.00 0.00 H new ATOM 0 HA3 GLY A 24 16.248 7.621 -0.154 1.00 0.00 H new ATOM 377 N VAL A 25 13.422 6.192 0.443 1.00 0.00 N ATOM 378 CA VAL A 25 12.031 6.397 0.835 1.00 0.00 C ATOM 379 C VAL A 25 11.749 5.772 2.188 1.00 0.00 C ATOM 380 O VAL A 25 12.170 4.641 2.448 1.00 0.00 O ATOM 381 CB VAL A 25 11.068 5.801 -0.225 1.00 0.00 C ATOM 382 CG1 VAL A 25 9.621 6.105 0.145 1.00 0.00 C ATOM 383 CG2 VAL A 25 11.407 6.330 -1.614 1.00 0.00 C ATOM 0 H VAL A 25 13.586 5.329 -0.075 1.00 0.00 H new ATOM 0 HA VAL A 25 11.863 7.472 0.904 1.00 0.00 H new ATOM 0 HB VAL A 25 11.192 4.718 -0.242 1.00 0.00 H new ATOM 0 HG11 VAL A 25 8.956 5.681 -0.608 1.00 0.00 H new ATOM 0 HG12 VAL A 25 9.394 5.668 1.117 1.00 0.00 H new ATOM 0 HG13 VAL A 25 9.476 7.184 0.190 1.00 0.00 H new ATOM 0 HG21 VAL A 25 10.721 5.901 -2.344 1.00 0.00 H new ATOM 0 HG22 VAL A 25 11.313 7.416 -1.623 1.00 0.00 H new ATOM 0 HG23 VAL A 25 12.429 6.052 -1.870 1.00 0.00 H new ATOM 393 N THR A 26 11.070 6.497 3.051 1.00 0.00 N ATOM 394 CA THR A 26 10.636 5.998 4.334 1.00 0.00 C ATOM 395 C THR A 26 9.470 5.018 4.154 1.00 0.00 C ATOM 396 O THR A 26 8.542 5.283 3.376 1.00 0.00 O ATOM 397 CB THR A 26 10.221 7.185 5.233 1.00 0.00 C ATOM 398 OG1 THR A 26 11.348 8.052 5.430 1.00 0.00 O ATOM 399 CG2 THR A 26 9.678 6.720 6.578 1.00 0.00 C ATOM 0 H THR A 26 10.801 7.465 2.876 1.00 0.00 H new ATOM 0 HA THR A 26 11.456 5.463 4.813 1.00 0.00 H new ATOM 0 HB THR A 26 9.419 7.725 4.729 1.00 0.00 H new ATOM 0 HG1 THR A 26 11.085 8.806 5.998 1.00 0.00 H new ATOM 0 HG21 THR A 26 9.399 7.587 7.177 1.00 0.00 H new ATOM 0 HG22 THR A 26 8.802 6.091 6.419 1.00 0.00 H new ATOM 0 HG23 THR A 26 10.444 6.149 7.102 1.00 0.00 H new ATOM 407 N PRO A 27 9.486 3.856 4.849 1.00 0.00 N ATOM 408 CA PRO A 27 8.419 2.860 4.742 1.00 0.00 C ATOM 409 C PRO A 27 7.020 3.475 4.885 1.00 0.00 C ATOM 410 O PRO A 27 6.140 3.241 4.051 1.00 0.00 O ATOM 411 CB PRO A 27 8.710 1.869 5.895 1.00 0.00 C ATOM 412 CG PRO A 27 9.775 2.518 6.727 1.00 0.00 C ATOM 413 CD PRO A 27 10.541 3.410 5.789 1.00 0.00 C ATOM 0 HA PRO A 27 8.413 2.385 3.761 1.00 0.00 H new ATOM 0 HB2 PRO A 27 7.813 1.680 6.485 1.00 0.00 H new ATOM 0 HB3 PRO A 27 9.046 0.907 5.509 1.00 0.00 H new ATOM 0 HG2 PRO A 27 9.337 3.093 7.543 1.00 0.00 H new ATOM 0 HG3 PRO A 27 10.429 1.771 7.178 1.00 0.00 H new ATOM 0 HD2 PRO A 27 11.002 4.249 6.311 1.00 0.00 H new ATOM 0 HD3 PRO A 27 11.341 2.873 5.279 1.00 0.00 H new ATOM 421 N SER A 28 6.848 4.301 5.921 1.00 0.00 N ATOM 422 CA SER A 28 5.573 4.971 6.178 1.00 0.00 C ATOM 423 C SER A 28 5.104 5.767 4.958 1.00 0.00 C ATOM 424 O SER A 28 3.912 5.912 4.709 1.00 0.00 O ATOM 425 CB SER A 28 5.732 5.910 7.393 1.00 0.00 C ATOM 426 OG SER A 28 6.338 5.226 8.485 1.00 0.00 O ATOM 0 H SER A 28 7.580 4.521 6.597 1.00 0.00 H new ATOM 0 HA SER A 28 4.818 4.213 6.388 1.00 0.00 H new ATOM 0 HB2 SER A 28 6.339 6.771 7.115 1.00 0.00 H new ATOM 0 HB3 SER A 28 4.756 6.292 7.694 1.00 0.00 H new ATOM 0 HG SER A 28 6.431 5.839 9.244 1.00 0.00 H new ATOM 432 N GLU A 29 6.061 6.270 4.186 1.00 0.00 N ATOM 433 CA GLU A 29 5.782 7.108 3.046 1.00 0.00 C ATOM 434 C GLU A 29 5.367 6.274 1.830 1.00 0.00 C ATOM 435 O GLU A 29 4.433 6.621 1.107 1.00 0.00 O ATOM 436 CB GLU A 29 6.985 7.980 2.706 1.00 0.00 C ATOM 437 CG GLU A 29 7.369 8.931 3.835 1.00 0.00 C ATOM 438 CD GLU A 29 6.210 9.847 4.254 1.00 0.00 C ATOM 439 OE1 GLU A 29 5.985 10.877 3.593 1.00 0.00 O ATOM 440 OE2 GLU A 29 5.526 9.539 5.251 1.00 0.00 O ATOM 0 H GLU A 29 7.055 6.102 4.342 1.00 0.00 H new ATOM 0 HA GLU A 29 4.947 7.757 3.311 1.00 0.00 H new ATOM 0 HB2 GLU A 29 7.836 7.340 2.472 1.00 0.00 H new ATOM 0 HB3 GLU A 29 6.765 8.559 1.809 1.00 0.00 H new ATOM 0 HG2 GLU A 29 7.699 8.351 4.697 1.00 0.00 H new ATOM 0 HG3 GLU A 29 8.214 9.542 3.519 1.00 0.00 H new ATOM 447 N ALA A 30 6.087 5.170 1.602 1.00 0.00 N ATOM 448 CA ALA A 30 5.754 4.258 0.507 1.00 0.00 C ATOM 449 C ALA A 30 4.336 3.714 0.658 1.00 0.00 C ATOM 450 O ALA A 30 3.603 3.558 -0.318 1.00 0.00 O ATOM 451 CB ALA A 30 6.759 3.111 0.440 1.00 0.00 C ATOM 0 H ALA A 30 6.896 4.890 2.156 1.00 0.00 H new ATOM 0 HA ALA A 30 5.804 4.820 -0.425 1.00 0.00 H new ATOM 0 HB1 ALA A 30 6.495 2.443 -0.380 1.00 0.00 H new ATOM 0 HB2 ALA A 30 7.759 3.512 0.274 1.00 0.00 H new ATOM 0 HB3 ALA A 30 6.742 2.557 1.379 1.00 0.00 H new ATOM 457 N LEU A 31 3.948 3.417 1.887 1.00 0.00 N ATOM 458 CA LEU A 31 2.595 2.959 2.175 1.00 0.00 C ATOM 459 C LEU A 31 1.585 4.100 1.978 1.00 0.00 C ATOM 460 O LEU A 31 0.454 3.872 1.547 1.00 0.00 O ATOM 461 CB LEU A 31 2.500 2.400 3.607 1.00 0.00 C ATOM 462 CG LEU A 31 3.018 0.959 3.811 1.00 0.00 C ATOM 463 CD1 LEU A 31 2.268 -0.019 2.926 1.00 0.00 C ATOM 464 CD2 LEU A 31 4.516 0.875 3.559 1.00 0.00 C ATOM 0 H LEU A 31 4.552 3.485 2.706 1.00 0.00 H new ATOM 0 HA LEU A 31 2.353 2.157 1.477 1.00 0.00 H new ATOM 0 HB2 LEU A 31 3.056 3.062 4.271 1.00 0.00 H new ATOM 0 HB3 LEU A 31 1.457 2.437 3.921 1.00 0.00 H new ATOM 0 HG LEU A 31 2.835 0.684 4.850 1.00 0.00 H new ATOM 0 HD11 LEU A 31 2.652 -1.026 3.089 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.206 0.008 3.172 1.00 0.00 H new ATOM 0 HD13 LEU A 31 2.406 0.257 1.881 1.00 0.00 H new ATOM 0 HD21 LEU A 31 4.853 -0.150 3.710 1.00 0.00 H new ATOM 0 HD22 LEU A 31 4.730 1.181 2.535 1.00 0.00 H new ATOM 0 HD23 LEU A 31 5.039 1.535 4.251 1.00 0.00 H new ATOM 476 N ARG A 32 2.041 5.317 2.263 1.00 0.00 N ATOM 477 CA ARG A 32 1.200 6.510 2.119 1.00 0.00 C ATOM 478 C ARG A 32 0.790 6.709 0.648 1.00 0.00 C ATOM 479 O ARG A 32 -0.378 6.889 0.348 1.00 0.00 O ATOM 480 CB ARG A 32 1.970 7.751 2.631 1.00 0.00 C ATOM 481 CG ARG A 32 1.088 8.971 2.941 1.00 0.00 C ATOM 482 CD ARG A 32 0.765 9.801 1.697 1.00 0.00 C ATOM 483 NE ARG A 32 0.077 11.051 2.060 1.00 0.00 N ATOM 484 CZ ARG A 32 -0.163 12.050 1.215 1.00 0.00 C ATOM 485 NH1 ARG A 32 0.151 11.951 -0.065 1.00 0.00 N ATOM 486 NH2 ARG A 32 -0.757 13.150 1.660 1.00 0.00 N ATOM 0 H ARG A 32 2.987 5.507 2.595 1.00 0.00 H new ATOM 0 HA ARG A 32 0.294 6.378 2.711 1.00 0.00 H new ATOM 0 HB2 ARG A 32 2.516 7.476 3.533 1.00 0.00 H new ATOM 0 HB3 ARG A 32 2.711 8.036 1.884 1.00 0.00 H new ATOM 0 HG2 ARG A 32 0.158 8.634 3.399 1.00 0.00 H new ATOM 0 HG3 ARG A 32 1.593 9.602 3.672 1.00 0.00 H new ATOM 0 HD2 ARG A 32 1.685 10.031 1.160 1.00 0.00 H new ATOM 0 HD3 ARG A 32 0.138 9.220 1.021 1.00 0.00 H new ATOM 0 HE ARG A 32 -0.237 11.158 3.025 1.00 0.00 H new ATOM 0 HH11 ARG A 32 0.585 11.098 -0.419 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -0.040 12.727 -0.699 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -1.025 13.224 2.641 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -0.946 13.922 1.021 1.00 0.00 H new ATOM 500 N LEU A 33 1.771 6.645 -0.254 1.00 0.00 N ATOM 501 CA LEU A 33 1.504 6.822 -1.679 1.00 0.00 C ATOM 502 C LEU A 33 0.690 5.652 -2.231 1.00 0.00 C ATOM 503 O LEU A 33 -0.021 5.788 -3.229 1.00 0.00 O ATOM 504 CB LEU A 33 2.810 6.995 -2.477 1.00 0.00 C ATOM 505 CG LEU A 33 3.884 5.936 -2.228 1.00 0.00 C ATOM 506 CD1 LEU A 33 3.864 4.860 -3.313 1.00 0.00 C ATOM 507 CD2 LEU A 33 5.247 6.592 -2.137 1.00 0.00 C ATOM 0 H LEU A 33 2.750 6.473 -0.024 1.00 0.00 H new ATOM 0 HA LEU A 33 0.917 7.734 -1.793 1.00 0.00 H new ATOM 0 HB2 LEU A 33 2.567 6.997 -3.540 1.00 0.00 H new ATOM 0 HB3 LEU A 33 3.230 7.974 -2.244 1.00 0.00 H new ATOM 0 HG LEU A 33 3.669 5.444 -1.279 1.00 0.00 H new ATOM 0 HD11 LEU A 33 4.639 4.122 -3.108 1.00 0.00 H new ATOM 0 HD12 LEU A 33 2.890 4.371 -3.322 1.00 0.00 H new ATOM 0 HD13 LEU A 33 4.048 5.319 -4.284 1.00 0.00 H new ATOM 0 HD21 LEU A 33 6.006 5.830 -1.959 1.00 0.00 H new ATOM 0 HD22 LEU A 33 5.464 7.110 -3.071 1.00 0.00 H new ATOM 0 HD23 LEU A 33 5.252 7.308 -1.315 1.00 0.00 H new ATOM 519 N MET A 34 0.786 4.497 -1.557 1.00 0.00 N ATOM 520 CA MET A 34 -0.026 3.350 -1.925 1.00 0.00 C ATOM 521 C MET A 34 -1.497 3.653 -1.698 1.00 0.00 C ATOM 522 O MET A 34 -2.346 3.363 -2.555 1.00 0.00 O ATOM 523 CB MET A 34 0.362 2.105 -1.120 1.00 0.00 C ATOM 524 CG MET A 34 -0.624 0.967 -1.328 1.00 0.00 C ATOM 525 SD MET A 34 -0.797 -0.118 0.093 1.00 0.00 S ATOM 526 CE MET A 34 -2.509 -0.603 -0.105 1.00 0.00 C ATOM 0 H MET A 34 1.411 4.342 -0.766 1.00 0.00 H new ATOM 0 HA MET A 34 0.152 3.149 -2.981 1.00 0.00 H new ATOM 0 HB2 MET A 34 1.360 1.779 -1.413 1.00 0.00 H new ATOM 0 HB3 MET A 34 0.408 2.357 -0.061 1.00 0.00 H new ATOM 0 HG2 MET A 34 -1.600 1.386 -1.574 1.00 0.00 H new ATOM 0 HG3 MET A 34 -0.305 0.376 -2.187 1.00 0.00 H new ATOM 0 HE1 MET A 34 -2.842 -1.136 0.786 1.00 0.00 H new ATOM 0 HE2 MET A 34 -3.125 0.285 -0.248 1.00 0.00 H new ATOM 0 HE3 MET A 34 -2.605 -1.254 -0.974 1.00 0.00 H new ATOM 536 N LEU A 35 -1.796 4.256 -0.559 1.00 0.00 N ATOM 537 CA LEU A 35 -3.169 4.537 -0.167 1.00 0.00 C ATOM 538 C LEU A 35 -3.792 5.498 -1.186 1.00 0.00 C ATOM 539 O LEU A 35 -5.004 5.504 -1.413 1.00 0.00 O ATOM 540 CB LEU A 35 -3.236 5.122 1.242 1.00 0.00 C ATOM 541 CG LEU A 35 -2.807 4.162 2.363 1.00 0.00 C ATOM 542 CD1 LEU A 35 -3.024 4.808 3.727 1.00 0.00 C ATOM 543 CD2 LEU A 35 -3.561 2.830 2.269 1.00 0.00 C ATOM 0 H LEU A 35 -1.098 4.564 0.118 1.00 0.00 H new ATOM 0 HA LEU A 35 -3.732 3.604 -0.154 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -2.604 6.009 1.282 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -4.257 5.450 1.435 1.00 0.00 H new ATOM 0 HG LEU A 35 -1.744 3.953 2.242 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -2.716 4.116 4.511 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -2.432 5.721 3.796 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -4.080 5.050 3.851 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -3.237 2.171 3.074 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -4.632 3.011 2.357 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -3.350 2.360 1.309 1.00 0.00 H new ATOM 555 N GLU A 36 -2.935 6.278 -1.810 1.00 0.00 N ATOM 556 CA GLU A 36 -3.345 7.196 -2.850 1.00 0.00 C ATOM 557 C GLU A 36 -3.837 6.450 -4.090 1.00 0.00 C ATOM 558 O GLU A 36 -4.899 6.766 -4.608 1.00 0.00 O ATOM 559 CB GLU A 36 -2.211 8.140 -3.210 1.00 0.00 C ATOM 560 CG GLU A 36 -1.610 8.872 -2.006 1.00 0.00 C ATOM 561 CD GLU A 36 -0.693 10.022 -2.413 1.00 0.00 C ATOM 562 OE1 GLU A 36 -1.137 10.912 -3.180 1.00 0.00 O ATOM 563 OE2 GLU A 36 0.456 10.043 -1.954 1.00 0.00 O ATOM 0 H GLU A 36 -1.935 6.293 -1.610 1.00 0.00 H new ATOM 0 HA GLU A 36 -4.177 7.785 -2.463 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -1.424 7.574 -3.709 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -2.577 8.876 -3.925 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -2.416 9.259 -1.382 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -1.048 8.163 -1.398 1.00 0.00 H new ATOM 570 N TYR A 37 -3.085 5.446 -4.543 1.00 0.00 N ATOM 571 CA TYR A 37 -3.419 4.768 -5.803 1.00 0.00 C ATOM 572 C TYR A 37 -4.641 3.858 -5.652 1.00 0.00 C ATOM 573 O TYR A 37 -5.369 3.660 -6.602 1.00 0.00 O ATOM 574 CB TYR A 37 -2.209 3.973 -6.363 1.00 0.00 C ATOM 575 CG TYR A 37 -1.981 2.571 -5.805 1.00 0.00 C ATOM 576 CD1 TYR A 37 -2.847 1.516 -6.092 1.00 0.00 C ATOM 577 CD2 TYR A 37 -0.859 2.286 -5.030 1.00 0.00 C ATOM 578 CE1 TYR A 37 -2.614 0.243 -5.619 1.00 0.00 C ATOM 579 CE2 TYR A 37 -0.621 1.006 -4.556 1.00 0.00 C ATOM 580 CZ TYR A 37 -1.499 -0.001 -4.850 1.00 0.00 C ATOM 581 OH TYR A 37 -1.274 -1.286 -4.375 1.00 0.00 O ATOM 0 H TYR A 37 -2.256 5.087 -4.070 1.00 0.00 H new ATOM 0 HA TYR A 37 -3.671 5.547 -6.522 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -2.328 3.892 -7.443 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -1.307 4.559 -6.185 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -3.721 1.701 -6.699 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -0.162 3.077 -4.794 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -3.301 -0.557 -5.850 1.00 0.00 H new ATOM 0 HE2 TYR A 37 0.254 0.804 -3.957 1.00 0.00 H new ATOM 0 HH TYR A 37 -0.447 -1.300 -3.849 1.00 0.00 H new ATOM 591 N ILE A 38 -4.833 3.285 -4.466 1.00 0.00 N ATOM 592 CA ILE A 38 -5.984 2.394 -4.236 1.00 0.00 C ATOM 593 C ILE A 38 -7.289 3.183 -4.269 1.00 0.00 C ATOM 594 O ILE A 38 -8.279 2.733 -4.842 1.00 0.00 O ATOM 595 CB ILE A 38 -5.850 1.596 -2.911 1.00 0.00 C ATOM 596 CG1 ILE A 38 -7.198 0.906 -2.537 1.00 0.00 C ATOM 597 CG2 ILE A 38 -5.393 2.498 -1.772 1.00 0.00 C ATOM 598 CD1 ILE A 38 -7.668 -0.128 -3.550 1.00 0.00 C ATOM 0 H ILE A 38 -4.223 3.414 -3.659 1.00 0.00 H new ATOM 0 HA ILE A 38 -5.998 1.665 -5.046 1.00 0.00 H new ATOM 0 HB ILE A 38 -5.095 0.825 -3.067 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -7.090 0.424 -1.565 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -7.968 1.670 -2.430 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -5.308 1.913 -0.856 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -4.423 2.931 -2.018 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -6.121 3.296 -1.626 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -8.611 -0.561 -3.217 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -7.811 0.351 -4.519 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -6.919 -0.915 -3.641 1.00 0.00 H new ATOM 610 N ALA A 39 -7.277 4.368 -3.697 1.00 0.00 N ATOM 611 CA ALA A 39 -8.456 5.227 -3.675 1.00 0.00 C ATOM 612 C ALA A 39 -8.754 5.751 -5.079 1.00 0.00 C ATOM 613 O ALA A 39 -9.903 6.012 -5.438 1.00 0.00 O ATOM 614 CB ALA A 39 -8.251 6.379 -2.695 1.00 0.00 C ATOM 0 H ALA A 39 -6.459 4.767 -3.236 1.00 0.00 H new ATOM 0 HA ALA A 39 -9.313 4.643 -3.340 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -9.138 7.013 -2.688 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -8.082 5.980 -1.695 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -7.387 6.968 -3.002 1.00 0.00 H new ATOM 620 N ASP A 40 -7.710 5.927 -5.869 1.00 0.00 N ATOM 621 CA ASP A 40 -7.820 6.466 -7.218 1.00 0.00 C ATOM 622 C ASP A 40 -8.292 5.401 -8.214 1.00 0.00 C ATOM 623 O ASP A 40 -9.177 5.651 -9.026 1.00 0.00 O ATOM 624 CB ASP A 40 -6.463 7.025 -7.673 1.00 0.00 C ATOM 625 CG ASP A 40 -6.542 7.704 -9.035 1.00 0.00 C ATOM 626 OD1 ASP A 40 -6.877 8.909 -9.093 1.00 0.00 O ATOM 627 OD2 ASP A 40 -6.285 7.031 -10.060 1.00 0.00 O ATOM 0 H ASP A 40 -6.755 5.699 -5.593 1.00 0.00 H new ATOM 0 HA ASP A 40 -8.561 7.265 -7.195 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -6.101 7.740 -6.934 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -5.735 6.215 -7.716 1.00 0.00 H new ATOM 632 N ASN A 41 -7.700 4.225 -8.123 1.00 0.00 N ATOM 633 CA ASN A 41 -7.906 3.168 -9.102 1.00 0.00 C ATOM 634 C ASN A 41 -9.010 2.200 -8.667 1.00 0.00 C ATOM 635 O ASN A 41 -9.785 1.708 -9.480 1.00 0.00 O ATOM 636 CB ASN A 41 -6.602 2.365 -9.310 1.00 0.00 C ATOM 637 CG ASN A 41 -5.471 3.163 -9.955 1.00 0.00 C ATOM 638 OD1 ASN A 41 -4.798 2.679 -10.874 1.00 0.00 O ATOM 639 ND2 ASN A 41 -5.212 4.360 -9.450 1.00 0.00 N ATOM 0 H ASN A 41 -7.062 3.973 -7.368 1.00 0.00 H new ATOM 0 HA ASN A 41 -8.205 3.650 -10.033 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -6.262 1.990 -8.345 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -6.819 1.496 -9.932 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -4.438 4.912 -9.819 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -5.787 4.729 -8.693 1.00 0.00 H new ATOM 646 N GLU A 42 -9.081 1.945 -7.350 1.00 0.00 N ATOM 647 CA GLU A 42 -10.035 0.994 -6.757 1.00 0.00 C ATOM 648 C GLU A 42 -9.963 -0.372 -7.437 1.00 0.00 C ATOM 649 O GLU A 42 -10.988 -0.932 -7.830 1.00 0.00 O ATOM 650 CB GLU A 42 -11.477 1.547 -6.822 1.00 0.00 C ATOM 651 CG GLU A 42 -11.652 2.914 -6.192 1.00 0.00 C ATOM 652 CD GLU A 42 -13.121 3.327 -6.101 1.00 0.00 C ATOM 653 OE1 GLU A 42 -13.823 3.244 -7.124 1.00 0.00 O ATOM 654 OE2 GLU A 42 -13.570 3.722 -5.003 1.00 0.00 O ATOM 0 H GLU A 42 -8.475 2.395 -6.664 1.00 0.00 H new ATOM 0 HA GLU A 42 -9.756 0.865 -5.711 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -11.786 1.599 -7.866 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -12.146 0.843 -6.326 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -11.216 2.910 -5.193 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -11.104 3.654 -6.776 1.00 0.00 H new ATOM 661 N ARG A 43 -8.752 -0.924 -7.589 1.00 0.00 N ATOM 662 CA ARG A 43 -8.585 -2.207 -8.256 1.00 0.00 C ATOM 663 C ARG A 43 -7.392 -3.009 -7.714 1.00 0.00 C ATOM 664 O ARG A 43 -7.490 -4.240 -7.604 1.00 0.00 O ATOM 665 CB ARG A 43 -8.436 -2.003 -9.774 1.00 0.00 C ATOM 666 CG ARG A 43 -7.345 -1.019 -10.154 1.00 0.00 C ATOM 667 CD ARG A 43 -7.275 -0.794 -11.654 1.00 0.00 C ATOM 668 NE ARG A 43 -6.269 0.218 -12.006 1.00 0.00 N ATOM 669 CZ ARG A 43 -5.194 -0.022 -12.752 1.00 0.00 C ATOM 670 NH1 ARG A 43 -4.982 -1.202 -13.302 1.00 0.00 N ATOM 671 NH2 ARG A 43 -4.326 0.957 -12.970 1.00 0.00 N ATOM 0 H ARG A 43 -7.884 -0.501 -7.260 1.00 0.00 H new ATOM 0 HA ARG A 43 -9.483 -2.789 -8.048 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -8.224 -2.965 -10.242 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -9.385 -1.653 -10.179 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -7.525 -0.068 -9.653 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -6.384 -1.389 -9.798 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -7.036 -1.734 -12.152 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -8.252 -0.479 -12.021 1.00 0.00 H new ATOM 0 HE ARG A 43 -6.404 1.166 -11.655 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -5.651 -1.959 -13.160 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -4.149 -1.358 -13.869 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -4.487 1.880 -12.567 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -3.498 0.787 -13.540 1.00 0.00 H new ATOM 685 N LEU A 44 -6.304 -2.318 -7.377 1.00 0.00 N ATOM 686 CA LEU A 44 -5.067 -2.972 -6.843 1.00 0.00 C ATOM 687 C LEU A 44 -4.352 -3.746 -7.940 1.00 0.00 C ATOM 688 O LEU A 44 -4.978 -4.380 -8.789 1.00 0.00 O ATOM 689 CB LEU A 44 -5.378 -3.910 -5.660 1.00 0.00 C ATOM 690 CG LEU A 44 -5.802 -3.216 -4.341 1.00 0.00 C ATOM 691 CD1 LEU A 44 -6.176 -4.251 -3.296 1.00 0.00 C ATOM 692 CD2 LEU A 44 -4.694 -2.285 -3.840 1.00 0.00 C ATOM 0 H LEU A 44 -6.235 -1.304 -7.457 1.00 0.00 H new ATOM 0 HA LEU A 44 -4.416 -2.177 -6.481 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -6.173 -4.592 -5.961 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -4.495 -4.518 -5.461 1.00 0.00 H new ATOM 0 HG LEU A 44 -6.683 -2.604 -4.534 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -6.472 -3.748 -2.375 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -7.006 -4.854 -3.662 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -5.319 -4.895 -3.099 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -5.011 -1.807 -2.913 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -3.788 -2.863 -3.659 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -4.493 -1.521 -4.591 1.00 0.00 H new ATOM 704 N PRO A 45 -3.004 -3.730 -7.942 1.00 0.00 N ATOM 705 CA PRO A 45 -2.184 -4.466 -8.919 1.00 0.00 C ATOM 706 C PRO A 45 -2.361 -5.984 -8.803 1.00 0.00 C ATOM 707 O PRO A 45 -2.538 -6.674 -9.809 1.00 0.00 O ATOM 708 CB PRO A 45 -0.744 -4.065 -8.551 1.00 0.00 C ATOM 709 CG PRO A 45 -0.828 -3.641 -7.135 1.00 0.00 C ATOM 710 CD PRO A 45 -2.164 -2.979 -6.991 1.00 0.00 C ATOM 0 HA PRO A 45 -2.460 -4.224 -9.945 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -0.055 -4.901 -8.675 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -0.382 -3.257 -9.187 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -0.740 -4.496 -6.464 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -0.021 -2.953 -6.883 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -2.543 -3.051 -5.972 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -2.119 -1.919 -7.240 1.00 0.00 H new ATOM 718 N PHE A 46 -2.305 -6.505 -7.577 1.00 0.00 N ATOM 719 CA PHE A 46 -2.372 -7.937 -7.331 1.00 0.00 C ATOM 720 C PHE A 46 -3.756 -8.324 -6.853 1.00 0.00 C ATOM 721 O PHE A 46 -4.463 -9.049 -7.550 1.00 0.00 O ATOM 722 CB PHE A 46 -1.329 -8.352 -6.296 1.00 0.00 C ATOM 723 CG PHE A 46 0.091 -8.165 -6.745 1.00 0.00 C ATOM 724 CD1 PHE A 46 0.757 -9.164 -7.417 1.00 0.00 C ATOM 725 CD2 PHE A 46 0.773 -6.968 -6.483 1.00 0.00 C ATOM 726 CE1 PHE A 46 2.074 -8.996 -7.828 1.00 0.00 C ATOM 727 CE2 PHE A 46 2.070 -6.795 -6.895 1.00 0.00 C ATOM 728 CZ PHE A 46 2.721 -7.810 -7.566 1.00 0.00 C ATOM 0 H PHE A 46 -2.212 -5.943 -6.731 1.00 0.00 H new ATOM 0 HA PHE A 46 -2.162 -8.456 -8.266 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -1.489 -7.776 -5.384 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -1.483 -9.401 -6.042 1.00 0.00 H new ATOM 0 HD1 PHE A 46 0.248 -10.093 -7.628 1.00 0.00 H new ATOM 0 HD2 PHE A 46 0.271 -6.173 -5.951 1.00 0.00 H new ATOM 0 HE1 PHE A 46 2.586 -9.791 -8.350 1.00 0.00 H new ATOM 0 HE2 PHE A 46 2.581 -5.865 -6.694 1.00 0.00 H new ATOM 0 HZ PHE A 46 3.743 -7.673 -7.887 1.00 0.00 H new ATOM 738 N LYS A 47 -4.108 -7.869 -5.658 1.00 0.00 N ATOM 739 CA LYS A 47 -5.388 -8.172 -5.021 1.00 0.00 C ATOM 740 C LYS A 47 -5.492 -9.653 -4.578 1.00 0.00 C ATOM 741 O LYS A 47 -6.199 -9.948 -3.616 1.00 0.00 O ATOM 742 CB LYS A 47 -6.551 -7.809 -5.919 1.00 0.00 C ATOM 743 CG LYS A 47 -7.895 -7.896 -5.224 1.00 0.00 C ATOM 744 CD LYS A 47 -9.035 -7.476 -6.138 1.00 0.00 C ATOM 745 CE LYS A 47 -10.304 -7.207 -5.343 1.00 0.00 C ATOM 746 NZ LYS A 47 -10.851 -8.434 -4.711 1.00 0.00 N ATOM 0 H LYS A 47 -3.505 -7.270 -5.094 1.00 0.00 H new ATOM 0 HA LYS A 47 -5.437 -7.557 -4.122 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -6.409 -6.796 -6.294 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -6.554 -8.472 -6.784 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -8.061 -8.918 -4.882 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -7.887 -7.261 -4.338 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -8.751 -6.580 -6.690 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -9.222 -8.258 -6.874 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -10.095 -6.467 -4.571 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -11.057 -6.775 -6.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -11.804 -8.239 -4.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -10.903 -9.195 -5.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -10.231 -8.728 -3.930 1.00 0.00 H new ATOM 760 N GLN A 48 -4.796 -10.539 -5.275 1.00 0.00 N ATOM 761 CA GLN A 48 -4.728 -11.966 -4.906 1.00 0.00 C ATOM 762 C GLN A 48 -6.116 -12.586 -4.990 1.00 0.00 C ATOM 763 O GLN A 48 -6.366 -13.681 -4.464 1.00 0.00 O ATOM 764 CB GLN A 48 -4.145 -12.117 -3.489 1.00 0.00 C ATOM 765 CG GLN A 48 -3.008 -11.150 -3.211 1.00 0.00 C ATOM 766 CD GLN A 48 -3.182 -10.402 -1.888 1.00 0.00 C ATOM 767 OE1 GLN A 48 -4.047 -9.408 -1.903 1.00 0.00 O flip ATOM 768 NE2 GLN A 48 -2.634 -10.785 -0.856 1.00 0.00 N flip ATOM 0 H GLN A 48 -4.261 -10.302 -6.110 1.00 0.00 H new ATOM 0 HA GLN A 48 -4.072 -12.489 -5.602 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -4.937 -11.958 -2.757 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -3.787 -13.138 -3.356 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -2.066 -11.698 -3.193 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -2.942 -10.429 -4.026 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -1.970 -11.559 -0.888 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -2.843 -10.329 0.032 1.00 0.00 H new ATOM 777 N THR A 49 -7.030 -11.872 -5.639 1.00 0.00 N ATOM 778 CA THR A 49 -8.427 -12.253 -5.766 1.00 0.00 C ATOM 779 C THR A 49 -9.117 -12.312 -4.387 1.00 0.00 C ATOM 780 O THR A 49 -10.181 -12.924 -4.239 1.00 0.00 O ATOM 781 CB THR A 49 -8.571 -13.603 -6.531 1.00 0.00 C ATOM 782 OG1 THR A 49 -7.667 -13.631 -7.654 1.00 0.00 O ATOM 783 CG2 THR A 49 -9.998 -13.814 -7.057 1.00 0.00 C ATOM 0 H THR A 49 -6.811 -10.990 -6.102 1.00 0.00 H new ATOM 0 HA THR A 49 -8.931 -11.485 -6.352 1.00 0.00 H new ATOM 0 HB THR A 49 -8.335 -14.399 -5.824 1.00 0.00 H new ATOM 0 HG1 THR A 49 -7.762 -14.483 -8.129 1.00 0.00 H new ATOM 0 HG21 THR A 49 -10.054 -14.767 -7.584 1.00 0.00 H new ATOM 0 HG22 THR A 49 -10.697 -13.820 -6.221 1.00 0.00 H new ATOM 0 HG23 THR A 49 -10.257 -13.005 -7.741 1.00 0.00 H new ATOM 791 N LEU A 50 -8.515 -11.660 -3.400 1.00 0.00 N ATOM 792 CA LEU A 50 -9.086 -11.586 -2.064 1.00 0.00 C ATOM 793 C LEU A 50 -10.257 -10.603 -2.060 1.00 0.00 C ATOM 794 O LEU A 50 -11.391 -11.014 -1.731 1.00 0.00 O ATOM 795 CB LEU A 50 -8.023 -11.148 -1.045 1.00 0.00 C ATOM 796 CG LEU A 50 -6.835 -12.112 -0.872 1.00 0.00 C ATOM 797 CD1 LEU A 50 -5.857 -11.574 0.165 1.00 0.00 C ATOM 798 CD2 LEU A 50 -7.319 -13.507 -0.489 1.00 0.00 C ATOM 799 OXT LEU A 50 -10.044 -9.425 -2.432 1.00 0.00 O ATOM 0 H LEU A 50 -7.625 -11.172 -3.503 1.00 0.00 H new ATOM 0 HA LEU A 50 -9.445 -12.575 -1.779 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -7.637 -10.174 -1.344 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -8.505 -11.016 -0.077 1.00 0.00 H new ATOM 0 HG LEU A 50 -6.314 -12.187 -1.827 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -5.024 -12.268 0.274 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -5.481 -10.604 -0.159 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -6.366 -11.465 1.123 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -6.462 -14.170 -0.372 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -7.869 -13.456 0.451 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -7.973 -13.893 -1.271 1.00 0.00 H new TER 811 LEU A 50 ATOM 812 N MET B 101 4.642 -13.741 10.905 1.00 0.00 N ATOM 813 CA MET B 101 4.084 -12.431 10.508 1.00 0.00 C ATOM 814 C MET B 101 4.314 -11.392 11.604 1.00 0.00 C ATOM 815 O MET B 101 4.156 -11.694 12.786 1.00 0.00 O ATOM 816 CB MET B 101 2.582 -12.569 10.204 1.00 0.00 C ATOM 817 CG MET B 101 1.863 -11.237 9.981 1.00 0.00 C ATOM 818 SD MET B 101 0.188 -11.445 9.358 1.00 0.00 S ATOM 819 CE MET B 101 0.501 -12.176 7.744 1.00 0.00 C ATOM 0 HA MET B 101 4.596 -12.093 9.607 1.00 0.00 H new ATOM 0 HB2 MET B 101 2.458 -13.189 9.316 1.00 0.00 H new ATOM 0 HB3 MET B 101 2.102 -13.094 11.030 1.00 0.00 H new ATOM 0 HG2 MET B 101 1.830 -10.685 10.920 1.00 0.00 H new ATOM 0 HG3 MET B 101 2.436 -10.634 9.277 1.00 0.00 H new ATOM 0 HE1 MET B 101 -0.149 -11.712 7.002 1.00 0.00 H new ATOM 0 HE2 MET B 101 1.543 -12.013 7.467 1.00 0.00 H new ATOM 0 HE3 MET B 101 0.299 -13.246 7.784 1.00 0.00 H new ATOM 829 N GLY B 102 4.702 -10.189 11.204 1.00 0.00 N ATOM 830 CA GLY B 102 4.953 -9.105 12.155 1.00 0.00 C ATOM 831 C GLY B 102 4.044 -7.912 11.901 1.00 0.00 C ATOM 832 O GLY B 102 3.570 -7.719 10.786 1.00 0.00 O ATOM 0 H GLY B 102 4.851 -9.935 10.227 1.00 0.00 H new ATOM 0 HA2 GLY B 102 4.800 -9.469 13.171 1.00 0.00 H new ATOM 0 HA3 GLY B 102 5.994 -8.791 12.082 1.00 0.00 H new ATOM 836 N SER B 103 3.812 -7.130 12.948 1.00 0.00 N ATOM 837 CA SER B 103 3.004 -5.937 12.857 1.00 0.00 C ATOM 838 C SER B 103 3.862 -4.676 12.939 1.00 0.00 C ATOM 839 O SER B 103 4.820 -4.596 13.722 1.00 0.00 O ATOM 840 CB SER B 103 1.947 -5.931 13.973 1.00 0.00 C ATOM 841 OG SER B 103 2.518 -6.257 15.229 1.00 0.00 O ATOM 0 H SER B 103 4.182 -7.312 13.881 1.00 0.00 H new ATOM 0 HA SER B 103 2.505 -5.941 11.888 1.00 0.00 H new ATOM 0 HB2 SER B 103 1.480 -4.948 14.028 1.00 0.00 H new ATOM 0 HB3 SER B 103 1.159 -6.645 13.734 1.00 0.00 H new ATOM 0 HG SER B 103 1.822 -6.243 15.918 1.00 0.00 H new ATOM 847 N ILE B 104 3.537 -3.681 12.109 1.00 0.00 N ATOM 848 CA ILE B 104 4.276 -2.430 12.031 1.00 0.00 C ATOM 849 C ILE B 104 3.314 -1.266 12.189 1.00 0.00 C ATOM 850 O ILE B 104 2.096 -1.431 12.046 1.00 0.00 O ATOM 851 CB ILE B 104 5.045 -2.322 10.683 1.00 0.00 C ATOM 852 CG1 ILE B 104 4.091 -2.194 9.479 1.00 0.00 C ATOM 853 CG2 ILE B 104 5.947 -3.539 10.510 1.00 0.00 C ATOM 854 CD1 ILE B 104 3.804 -0.766 9.051 1.00 0.00 C ATOM 0 H ILE B 104 2.745 -3.727 11.468 1.00 0.00 H new ATOM 0 HA ILE B 104 5.011 -2.403 12.836 1.00 0.00 H new ATOM 0 HB ILE B 104 5.648 -1.415 10.715 1.00 0.00 H new ATOM 0 HG12 ILE B 104 4.518 -2.734 8.634 1.00 0.00 H new ATOM 0 HG13 ILE B 104 3.148 -2.682 9.725 1.00 0.00 H new ATOM 0 HG21 ILE B 104 6.485 -3.462 9.565 1.00 0.00 H new ATOM 0 HG22 ILE B 104 6.662 -3.582 11.332 1.00 0.00 H new ATOM 0 HG23 ILE B 104 5.340 -4.444 10.509 1.00 0.00 H new ATOM 0 HD11 ILE B 104 3.125 -0.771 8.198 1.00 0.00 H new ATOM 0 HD12 ILE B 104 3.345 -0.224 9.878 1.00 0.00 H new ATOM 0 HD13 ILE B 104 4.736 -0.276 8.769 1.00 0.00 H new ATOM 866 N ASN B 105 3.856 -0.078 12.481 1.00 0.00 N ATOM 867 CA ASN B 105 3.045 1.128 12.630 1.00 0.00 C ATOM 868 C ASN B 105 3.156 1.986 11.371 1.00 0.00 C ATOM 869 O ASN B 105 4.259 2.332 10.931 1.00 0.00 O ATOM 870 CB ASN B 105 3.499 1.947 13.839 1.00 0.00 C ATOM 871 CG ASN B 105 2.661 3.186 14.081 1.00 0.00 C ATOM 872 OD1 ASN B 105 1.755 3.191 14.898 1.00 0.00 O ATOM 873 ND2 ASN B 105 2.962 4.259 13.356 1.00 0.00 N ATOM 0 H ASN B 105 4.856 0.070 12.618 1.00 0.00 H new ATOM 0 HA ASN B 105 2.009 0.824 12.782 1.00 0.00 H new ATOM 0 HB2 ASN B 105 3.466 1.317 14.728 1.00 0.00 H new ATOM 0 HB3 ASN B 105 4.538 2.243 13.697 1.00 0.00 H new ATOM 0 HD21 ASN B 105 2.429 5.120 13.474 1.00 0.00 H new ATOM 0 HD22 ASN B 105 3.726 4.221 12.681 1.00 0.00 H new ATOM 880 N LEU B 106 2.012 2.311 10.795 1.00 0.00 N ATOM 881 CA LEU B 106 1.943 3.140 9.603 1.00 0.00 C ATOM 882 C LEU B 106 1.218 4.433 9.975 1.00 0.00 C ATOM 883 O LEU B 106 0.321 4.405 10.818 1.00 0.00 O ATOM 884 CB LEU B 106 1.189 2.339 8.517 1.00 0.00 C ATOM 885 CG LEU B 106 1.662 2.567 7.078 1.00 0.00 C ATOM 886 CD1 LEU B 106 1.145 3.898 6.532 1.00 0.00 C ATOM 887 CD2 LEU B 106 3.201 2.498 7.020 1.00 0.00 C ATOM 0 H LEU B 106 1.102 2.007 11.141 1.00 0.00 H new ATOM 0 HA LEU B 106 2.927 3.401 9.215 1.00 0.00 H new ATOM 0 HB2 LEU B 106 1.279 1.277 8.746 1.00 0.00 H new ATOM 0 HB3 LEU B 106 0.130 2.589 8.576 1.00 0.00 H new ATOM 0 HG LEU B 106 1.253 1.780 6.445 1.00 0.00 H new ATOM 0 HD11 LEU B 106 1.497 4.033 5.509 1.00 0.00 H new ATOM 0 HD12 LEU B 106 0.055 3.897 6.544 1.00 0.00 H new ATOM 0 HD13 LEU B 106 1.514 4.714 7.153 1.00 0.00 H new ATOM 0 HD21 LEU B 106 3.534 2.661 5.995 1.00 0.00 H new ATOM 0 HD22 LEU B 106 3.624 3.268 7.666 1.00 0.00 H new ATOM 0 HD23 LEU B 106 3.534 1.517 7.358 1.00 0.00 H new ATOM 899 N ARG B 107 1.568 5.579 9.375 1.00 0.00 N ATOM 900 CA ARG B 107 0.984 6.873 9.766 1.00 0.00 C ATOM 901 C ARG B 107 0.670 7.659 8.500 1.00 0.00 C ATOM 902 O ARG B 107 1.564 7.845 7.664 1.00 0.00 O ATOM 903 CB ARG B 107 1.923 7.677 10.655 1.00 0.00 C ATOM 904 CG ARG B 107 2.116 7.114 12.069 1.00 0.00 C ATOM 905 CD ARG B 107 2.773 8.135 12.978 1.00 0.00 C ATOM 906 NE ARG B 107 3.046 7.615 14.324 1.00 0.00 N ATOM 907 CZ ARG B 107 4.206 7.738 14.941 1.00 0.00 C ATOM 908 NH1 ARG B 107 5.271 8.220 14.308 1.00 0.00 N ATOM 909 NH2 ARG B 107 4.317 7.348 16.205 1.00 0.00 N ATOM 0 H ARG B 107 2.250 5.638 8.619 1.00 0.00 H new ATOM 0 HA ARG B 107 0.078 6.687 10.342 1.00 0.00 H new ATOM 0 HB2 ARG B 107 2.896 7.738 10.168 1.00 0.00 H new ATOM 0 HB3 ARG B 107 1.542 8.695 10.734 1.00 0.00 H new ATOM 0 HG2 ARG B 107 1.151 6.822 12.483 1.00 0.00 H new ATOM 0 HG3 ARG B 107 2.729 6.214 12.025 1.00 0.00 H new ATOM 0 HD2 ARG B 107 3.708 8.467 12.526 1.00 0.00 H new ATOM 0 HD3 ARG B 107 2.129 9.011 13.057 1.00 0.00 H new ATOM 0 HE ARG B 107 2.293 7.129 14.812 1.00 0.00 H new ATOM 0 HH11 ARG B 107 5.199 8.501 13.330 1.00 0.00 H new ATOM 0 HH12 ARG B 107 6.160 8.308 14.800 1.00 0.00 H new ATOM 0 HH21 ARG B 107 3.510 6.957 16.691 1.00 0.00 H new ATOM 0 HH22 ARG B 107 5.210 7.439 16.690 1.00 0.00 H new ATOM 923 N ILE B 108 -0.568 8.085 8.317 1.00 0.00 N ATOM 924 CA ILE B 108 -0.953 8.818 7.099 1.00 0.00 C ATOM 925 C ILE B 108 -2.000 9.887 7.406 1.00 0.00 C ATOM 926 O ILE B 108 -2.536 9.954 8.515 1.00 0.00 O ATOM 927 CB ILE B 108 -1.533 7.890 5.982 1.00 0.00 C ATOM 928 CG1 ILE B 108 -2.950 7.385 6.350 1.00 0.00 C ATOM 929 CG2 ILE B 108 -0.603 6.722 5.689 1.00 0.00 C ATOM 930 CD1 ILE B 108 -3.024 6.611 7.660 1.00 0.00 C ATOM 0 H ILE B 108 -1.326 7.943 8.984 1.00 0.00 H new ATOM 0 HA ILE B 108 -0.031 9.272 6.735 1.00 0.00 H new ATOM 0 HB ILE B 108 -1.613 8.488 5.074 1.00 0.00 H new ATOM 0 HG12 ILE B 108 -3.623 8.241 6.410 1.00 0.00 H new ATOM 0 HG13 ILE B 108 -3.315 6.748 5.545 1.00 0.00 H new ATOM 0 HG21 ILE B 108 -1.038 6.098 4.908 1.00 0.00 H new ATOM 0 HG22 ILE B 108 0.363 7.101 5.355 1.00 0.00 H new ATOM 0 HG23 ILE B 108 -0.467 6.129 6.594 1.00 0.00 H new ATOM 0 HD11 ILE B 108 -4.052 6.296 7.839 1.00 0.00 H new ATOM 0 HD12 ILE B 108 -2.380 5.733 7.601 1.00 0.00 H new ATOM 0 HD13 ILE B 108 -2.693 7.249 8.479 1.00 0.00 H new ATOM 942 N ASP B 109 -2.288 10.692 6.385 1.00 0.00 N ATOM 943 CA ASP B 109 -3.361 11.669 6.443 1.00 0.00 C ATOM 944 C ASP B 109 -4.693 10.979 6.772 1.00 0.00 C ATOM 945 O ASP B 109 -5.059 10.014 6.104 1.00 0.00 O ATOM 946 CB ASP B 109 -3.486 12.389 5.082 1.00 0.00 C ATOM 947 CG ASP B 109 -2.217 13.144 4.735 1.00 0.00 C ATOM 948 OD1 ASP B 109 -1.240 12.512 4.285 1.00 0.00 O ATOM 949 OD2 ASP B 109 -2.183 14.382 4.911 1.00 0.00 O ATOM 0 H ASP B 109 -1.783 10.682 5.499 1.00 0.00 H new ATOM 0 HA ASP B 109 -3.130 12.394 7.224 1.00 0.00 H new ATOM 0 HB2 ASP B 109 -3.702 11.659 4.301 1.00 0.00 H new ATOM 0 HB3 ASP B 109 -4.327 13.082 5.112 1.00 0.00 H new ATOM 954 N ASP B 110 -5.394 11.461 7.784 1.00 0.00 N ATOM 955 CA ASP B 110 -6.633 10.848 8.229 1.00 0.00 C ATOM 956 C ASP B 110 -7.656 10.876 7.106 1.00 0.00 C ATOM 957 O ASP B 110 -8.493 9.962 6.987 1.00 0.00 O ATOM 958 CB ASP B 110 -7.183 11.579 9.463 1.00 0.00 C ATOM 959 CG ASP B 110 -7.805 12.926 9.153 1.00 0.00 C ATOM 960 OD1 ASP B 110 -7.070 13.928 9.104 1.00 0.00 O ATOM 961 OD2 ASP B 110 -9.045 12.998 8.952 1.00 0.00 O ATOM 0 H ASP B 110 -5.121 12.286 8.319 1.00 0.00 H new ATOM 0 HA ASP B 110 -6.432 9.812 8.503 1.00 0.00 H new ATOM 0 HB2 ASP B 110 -7.930 10.947 9.944 1.00 0.00 H new ATOM 0 HB3 ASP B 110 -6.374 11.720 10.180 1.00 0.00 H new ATOM 966 N GLU B 111 -7.594 11.914 6.270 1.00 0.00 N ATOM 967 CA GLU B 111 -8.509 12.060 5.161 1.00 0.00 C ATOM 968 C GLU B 111 -8.243 11.024 4.077 1.00 0.00 C ATOM 969 O GLU B 111 -9.166 10.467 3.506 1.00 0.00 O ATOM 970 CB GLU B 111 -8.427 13.461 4.556 1.00 0.00 C ATOM 971 CG GLU B 111 -7.051 13.803 3.977 1.00 0.00 C ATOM 972 CD GLU B 111 -7.080 15.086 3.158 1.00 0.00 C ATOM 973 OE1 GLU B 111 -7.412 15.010 1.956 1.00 0.00 O ATOM 974 OE2 GLU B 111 -6.769 16.158 3.706 1.00 0.00 O ATOM 0 H GLU B 111 -6.910 12.666 6.350 1.00 0.00 H new ATOM 0 HA GLU B 111 -9.512 11.902 5.557 1.00 0.00 H new ATOM 0 HB2 GLU B 111 -9.175 13.551 3.768 1.00 0.00 H new ATOM 0 HB3 GLU B 111 -8.681 14.193 5.322 1.00 0.00 H new ATOM 0 HG2 GLU B 111 -6.332 13.908 4.789 1.00 0.00 H new ATOM 0 HG3 GLU B 111 -6.707 12.980 3.350 1.00 0.00 H new ATOM 981 N LEU B 112 -6.965 10.727 3.843 1.00 0.00 N ATOM 982 CA LEU B 112 -6.583 9.847 2.742 1.00 0.00 C ATOM 983 C LEU B 112 -6.930 8.416 3.148 1.00 0.00 C ATOM 984 O LEU B 112 -7.439 7.648 2.342 1.00 0.00 O ATOM 985 CB LEU B 112 -5.068 9.977 2.469 1.00 0.00 C ATOM 986 CG LEU B 112 -4.528 9.051 1.360 1.00 0.00 C ATOM 987 CD1 LEU B 112 -5.119 9.387 0.008 1.00 0.00 C ATOM 988 CD2 LEU B 112 -2.993 9.112 1.328 1.00 0.00 C ATOM 0 H LEU B 112 -6.184 11.080 4.396 1.00 0.00 H new ATOM 0 HA LEU B 112 -7.115 10.118 1.830 1.00 0.00 H new ATOM 0 HB2 LEU B 112 -4.849 11.010 2.199 1.00 0.00 H new ATOM 0 HB3 LEU B 112 -4.528 9.768 3.392 1.00 0.00 H new ATOM 0 HG LEU B 112 -4.834 8.031 1.591 1.00 0.00 H new ATOM 0 HD11 LEU B 112 -4.712 8.712 -0.745 1.00 0.00 H new ATOM 0 HD12 LEU B 112 -6.203 9.277 0.047 1.00 0.00 H new ATOM 0 HD13 LEU B 112 -4.868 10.415 -0.253 1.00 0.00 H new ATOM 0 HD21 LEU B 112 -2.619 8.455 0.542 1.00 0.00 H new ATOM 0 HD22 LEU B 112 -2.674 10.135 1.129 1.00 0.00 H new ATOM 0 HD23 LEU B 112 -2.596 8.789 2.290 1.00 0.00 H new ATOM 1000 N LYS B 113 -6.666 8.132 4.406 1.00 0.00 N ATOM 1001 CA LYS B 113 -7.015 6.862 5.024 1.00 0.00 C ATOM 1002 C LYS B 113 -8.457 6.493 4.703 1.00 0.00 C ATOM 1003 O LYS B 113 -8.736 5.386 4.239 1.00 0.00 O ATOM 1004 CB LYS B 113 -6.843 6.982 6.553 1.00 0.00 C ATOM 1005 CG LYS B 113 -7.345 5.778 7.350 1.00 0.00 C ATOM 1006 CD LYS B 113 -7.759 6.202 8.754 1.00 0.00 C ATOM 1007 CE LYS B 113 -8.310 5.026 9.578 1.00 0.00 C ATOM 1008 NZ LYS B 113 -7.266 4.007 9.849 1.00 0.00 N ATOM 0 H LYS B 113 -6.198 8.781 5.039 1.00 0.00 H new ATOM 0 HA LYS B 113 -6.360 6.083 4.634 1.00 0.00 H new ATOM 0 HB2 LYS B 113 -5.787 7.132 6.775 1.00 0.00 H new ATOM 0 HB3 LYS B 113 -7.371 7.872 6.895 1.00 0.00 H new ATOM 0 HG2 LYS B 113 -8.192 5.322 6.837 1.00 0.00 H new ATOM 0 HG3 LYS B 113 -6.563 5.021 7.408 1.00 0.00 H new ATOM 0 HD2 LYS B 113 -6.901 6.634 9.269 1.00 0.00 H new ATOM 0 HD3 LYS B 113 -8.516 6.983 8.687 1.00 0.00 H new ATOM 0 HE2 LYS B 113 -8.708 5.398 10.522 1.00 0.00 H new ATOM 0 HE3 LYS B 113 -9.139 4.564 9.042 1.00 0.00 H new ATOM 0 HZ1 LYS B 113 -7.667 3.247 10.435 1.00 0.00 H new ATOM 0 HZ2 LYS B 113 -6.928 3.609 8.950 1.00 0.00 H new ATOM 0 HZ3 LYS B 113 -6.471 4.450 10.352 1.00 0.00 H new ATOM 1022 N ALA B 114 -9.362 7.443 4.958 1.00 0.00 N ATOM 1023 CA ALA B 114 -10.794 7.244 4.731 1.00 0.00 C ATOM 1024 C ALA B 114 -11.098 6.761 3.313 1.00 0.00 C ATOM 1025 O ALA B 114 -11.813 5.767 3.128 1.00 0.00 O ATOM 1026 CB ALA B 114 -11.540 8.530 5.027 1.00 0.00 C ATOM 0 H ALA B 114 -9.124 8.364 5.325 1.00 0.00 H new ATOM 0 HA ALA B 114 -11.131 6.460 5.409 1.00 0.00 H new ATOM 0 HB1 ALA B 114 -12.606 8.379 4.857 1.00 0.00 H new ATOM 0 HB2 ALA B 114 -11.375 8.816 6.066 1.00 0.00 H new ATOM 0 HB3 ALA B 114 -11.176 9.321 4.371 1.00 0.00 H new ATOM 1032 N ARG B 115 -10.555 7.448 2.317 1.00 0.00 N ATOM 1033 CA ARG B 115 -10.845 7.116 0.906 1.00 0.00 C ATOM 1034 C ARG B 115 -10.236 5.761 0.531 1.00 0.00 C ATOM 1035 O ARG B 115 -10.906 4.933 -0.087 1.00 0.00 O ATOM 1036 CB ARG B 115 -10.339 8.229 -0.043 1.00 0.00 C ATOM 1037 CG ARG B 115 -11.170 9.506 -0.008 1.00 0.00 C ATOM 1038 CD ARG B 115 -10.944 10.309 1.258 1.00 0.00 C ATOM 1039 NE ARG B 115 -11.757 11.520 1.315 1.00 0.00 N ATOM 1040 CZ ARG B 115 -11.294 12.733 1.646 1.00 0.00 C ATOM 1041 NH1 ARG B 115 -9.993 12.928 1.838 1.00 0.00 N ATOM 1042 NH2 ARG B 115 -12.117 13.766 1.750 1.00 0.00 N ATOM 0 H ARG B 115 -9.916 8.233 2.445 1.00 0.00 H new ATOM 0 HA ARG B 115 -11.927 7.046 0.792 1.00 0.00 H new ATOM 0 HB2 ARG B 115 -9.309 8.472 0.217 1.00 0.00 H new ATOM 0 HB3 ARG B 115 -10.328 7.844 -1.063 1.00 0.00 H new ATOM 0 HG2 ARG B 115 -10.923 10.121 -0.874 1.00 0.00 H new ATOM 0 HG3 ARG B 115 -12.227 9.251 -0.089 1.00 0.00 H new ATOM 0 HD2 ARG B 115 -11.169 9.685 2.123 1.00 0.00 H new ATOM 0 HD3 ARG B 115 -9.891 10.581 1.327 1.00 0.00 H new ATOM 0 HE ARG B 115 -12.748 11.437 1.087 1.00 0.00 H new ATOM 0 HH11 ARG B 115 -9.340 12.151 1.733 1.00 0.00 H new ATOM 0 HH12 ARG B 115 -9.648 13.854 2.090 1.00 0.00 H new ATOM 0 HH21 ARG B 115 -13.115 13.643 1.577 1.00 0.00 H new ATOM 0 HH22 ARG B 115 -11.753 14.685 2.003 1.00 0.00 H new ATOM 1056 N SER B 116 -8.979 5.557 0.910 1.00 0.00 N ATOM 1057 CA SER B 116 -8.259 4.332 0.613 1.00 0.00 C ATOM 1058 C SER B 116 -9.011 3.105 1.143 1.00 0.00 C ATOM 1059 O SER B 116 -9.301 2.167 0.402 1.00 0.00 O ATOM 1060 CB SER B 116 -6.868 4.404 1.235 1.00 0.00 C ATOM 1061 OG SER B 116 -6.251 5.642 0.954 1.00 0.00 O ATOM 0 H SER B 116 -8.432 6.241 1.433 1.00 0.00 H new ATOM 0 HA SER B 116 -8.175 4.229 -0.469 1.00 0.00 H new ATOM 0 HB2 SER B 116 -6.941 4.267 2.314 1.00 0.00 H new ATOM 0 HB3 SER B 116 -6.252 3.591 0.851 1.00 0.00 H new ATOM 0 HG SER B 116 -6.076 5.709 -0.008 1.00 0.00 H new ATOM 1067 N TYR B 117 -9.336 3.141 2.438 1.00 0.00 N ATOM 1068 CA TYR B 117 -10.059 2.059 3.090 1.00 0.00 C ATOM 1069 C TYR B 117 -11.409 1.833 2.421 1.00 0.00 C ATOM 1070 O TYR B 117 -11.838 0.698 2.267 1.00 0.00 O ATOM 1071 CB TYR B 117 -10.222 2.339 4.576 1.00 0.00 C ATOM 1072 CG TYR B 117 -8.948 2.161 5.385 1.00 0.00 C ATOM 1073 CD1 TYR B 117 -7.730 2.681 4.945 1.00 0.00 C ATOM 1074 CD2 TYR B 117 -8.960 1.480 6.600 1.00 0.00 C ATOM 1075 CE1 TYR B 117 -6.576 2.534 5.681 1.00 0.00 C ATOM 1076 CE2 TYR B 117 -7.799 1.328 7.339 1.00 0.00 C ATOM 1077 CZ TYR B 117 -6.610 1.856 6.874 1.00 0.00 C ATOM 1078 OH TYR B 117 -5.466 1.703 7.624 1.00 0.00 O ATOM 0 H TYR B 117 -9.105 3.919 3.056 1.00 0.00 H new ATOM 0 HA TYR B 117 -9.476 1.144 2.984 1.00 0.00 H new ATOM 0 HB2 TYR B 117 -10.582 3.360 4.705 1.00 0.00 H new ATOM 0 HB3 TYR B 117 -10.990 1.677 4.977 1.00 0.00 H new ATOM 0 HD1 TYR B 117 -7.692 3.211 4.005 1.00 0.00 H new ATOM 0 HD2 TYR B 117 -9.886 1.066 6.970 1.00 0.00 H new ATOM 0 HE1 TYR B 117 -5.647 2.951 5.321 1.00 0.00 H new ATOM 0 HE2 TYR B 117 -7.823 0.797 8.279 1.00 0.00 H new ATOM 0 HH TYR B 117 -5.674 1.198 8.438 1.00 0.00 H new ATOM 1088 N ALA B 118 -12.053 2.922 2.048 1.00 0.00 N ATOM 1089 CA ALA B 118 -13.361 2.876 1.378 1.00 0.00 C ATOM 1090 C ALA B 118 -13.274 2.093 0.072 1.00 0.00 C ATOM 1091 O ALA B 118 -14.128 1.259 -0.232 1.00 0.00 O ATOM 1092 CB ALA B 118 -13.863 4.284 1.129 1.00 0.00 C ATOM 0 H ALA B 118 -11.695 3.866 2.195 1.00 0.00 H new ATOM 0 HA ALA B 118 -14.069 2.362 2.028 1.00 0.00 H new ATOM 0 HB1 ALA B 118 -14.832 4.242 0.632 1.00 0.00 H new ATOM 0 HB2 ALA B 118 -13.965 4.807 2.080 1.00 0.00 H new ATOM 0 HB3 ALA B 118 -13.154 4.817 0.496 1.00 0.00 H new ATOM 1098 N ALA B 119 -12.229 2.361 -0.698 1.00 0.00 N ATOM 1099 CA ALA B 119 -12.017 1.690 -1.991 1.00 0.00 C ATOM 1100 C ALA B 119 -11.810 0.184 -1.819 1.00 0.00 C ATOM 1101 O ALA B 119 -12.424 -0.623 -2.522 1.00 0.00 O ATOM 1102 CB ALA B 119 -10.827 2.314 -2.694 1.00 0.00 C ATOM 0 H ALA B 119 -11.507 3.040 -0.456 1.00 0.00 H new ATOM 0 HA ALA B 119 -12.912 1.825 -2.599 1.00 0.00 H new ATOM 0 HB1 ALA B 119 -10.669 1.818 -3.652 1.00 0.00 H new ATOM 0 HB2 ALA B 119 -11.018 3.374 -2.862 1.00 0.00 H new ATOM 0 HB3 ALA B 119 -9.937 2.199 -2.075 1.00 0.00 H new ATOM 1108 N LEU B 120 -10.954 -0.204 -0.875 1.00 0.00 N ATOM 1109 CA LEU B 120 -10.584 -1.607 -0.725 1.00 0.00 C ATOM 1110 C LEU B 120 -11.722 -2.426 -0.131 1.00 0.00 C ATOM 1111 O LEU B 120 -11.933 -3.576 -0.528 1.00 0.00 O ATOM 1112 CB LEU B 120 -9.267 -1.752 0.066 1.00 0.00 C ATOM 1113 CG LEU B 120 -9.162 -1.001 1.408 1.00 0.00 C ATOM 1114 CD1 LEU B 120 -9.874 -1.760 2.524 1.00 0.00 C ATOM 1115 CD2 LEU B 120 -7.716 -0.727 1.779 1.00 0.00 C ATOM 0 H LEU B 120 -10.508 0.428 -0.209 1.00 0.00 H new ATOM 0 HA LEU B 120 -10.401 -2.017 -1.718 1.00 0.00 H new ATOM 0 HB2 LEU B 120 -9.105 -2.812 0.259 1.00 0.00 H new ATOM 0 HB3 LEU B 120 -8.451 -1.416 -0.573 1.00 0.00 H new ATOM 0 HG LEU B 120 -9.661 -0.040 1.282 1.00 0.00 H new ATOM 0 HD11 LEU B 120 -9.782 -1.205 3.458 1.00 0.00 H new ATOM 0 HD12 LEU B 120 -10.928 -1.874 2.272 1.00 0.00 H new ATOM 0 HD13 LEU B 120 -9.421 -2.744 2.641 1.00 0.00 H new ATOM 0 HD21 LEU B 120 -7.679 -0.196 2.730 1.00 0.00 H new ATOM 0 HD22 LEU B 120 -7.178 -1.671 1.869 1.00 0.00 H new ATOM 0 HD23 LEU B 120 -7.251 -0.117 1.005 1.00 0.00 H new ATOM 1127 N GLU B 121 -12.488 -1.841 0.807 1.00 0.00 N ATOM 1128 CA GLU B 121 -13.606 -2.545 1.424 1.00 0.00 C ATOM 1129 C GLU B 121 -14.746 -2.742 0.399 1.00 0.00 C ATOM 1130 O GLU B 121 -15.599 -3.616 0.548 1.00 0.00 O ATOM 1131 CB GLU B 121 -14.134 -1.796 2.655 1.00 0.00 C ATOM 1132 CG GLU B 121 -14.627 -0.380 2.365 1.00 0.00 C ATOM 1133 CD GLU B 121 -15.373 0.226 3.534 1.00 0.00 C ATOM 1134 OE1 GLU B 121 -14.730 0.605 4.546 1.00 0.00 O ATOM 1135 OE2 GLU B 121 -16.623 0.322 3.455 1.00 0.00 O ATOM 0 H GLU B 121 -12.348 -0.889 1.147 1.00 0.00 H new ATOM 0 HA GLU B 121 -13.242 -3.519 1.752 1.00 0.00 H new ATOM 0 HB2 GLU B 121 -14.951 -2.370 3.092 1.00 0.00 H new ATOM 0 HB3 GLU B 121 -13.343 -1.747 3.403 1.00 0.00 H new ATOM 0 HG2 GLU B 121 -13.776 0.253 2.114 1.00 0.00 H new ATOM 0 HG3 GLU B 121 -15.279 -0.398 1.492 1.00 0.00 H new ATOM 1142 N LYS B 122 -14.727 -1.927 -0.642 1.00 0.00 N ATOM 1143 CA LYS B 122 -15.655 -2.044 -1.752 1.00 0.00 C ATOM 1144 C LYS B 122 -15.363 -3.329 -2.536 1.00 0.00 C ATOM 1145 O LYS B 122 -16.261 -4.098 -2.856 1.00 0.00 O ATOM 1146 CB LYS B 122 -15.507 -0.807 -2.635 1.00 0.00 C ATOM 1147 CG LYS B 122 -16.195 -0.845 -3.996 1.00 0.00 C ATOM 1148 CD LYS B 122 -15.839 0.433 -4.745 1.00 0.00 C ATOM 1149 CE LYS B 122 -16.371 0.427 -6.186 1.00 0.00 C ATOM 1150 NZ LYS B 122 -16.075 1.694 -6.913 1.00 0.00 N ATOM 0 H LYS B 122 -14.062 -1.160 -0.741 1.00 0.00 H new ATOM 0 HA LYS B 122 -16.682 -2.102 -1.392 1.00 0.00 H new ATOM 0 HB2 LYS B 122 -15.892 0.051 -2.084 1.00 0.00 H new ATOM 0 HB3 LYS B 122 -14.444 -0.631 -2.797 1.00 0.00 H new ATOM 0 HG2 LYS B 122 -15.872 -1.719 -4.561 1.00 0.00 H new ATOM 0 HG3 LYS B 122 -17.275 -0.926 -3.874 1.00 0.00 H new ATOM 0 HD2 LYS B 122 -16.248 1.291 -4.212 1.00 0.00 H new ATOM 0 HD3 LYS B 122 -14.756 0.554 -4.760 1.00 0.00 H new ATOM 0 HE2 LYS B 122 -15.931 -0.410 -6.728 1.00 0.00 H new ATOM 0 HE3 LYS B 122 -17.449 0.265 -6.171 1.00 0.00 H new ATOM 0 HZ1 LYS B 122 -16.395 1.611 -7.899 1.00 0.00 H new ATOM 0 HZ2 LYS B 122 -16.572 2.483 -6.453 1.00 0.00 H new ATOM 0 HZ3 LYS B 122 -15.051 1.873 -6.895 1.00 0.00 H new ATOM 1164 N MET B 123 -14.078 -3.547 -2.807 1.00 0.00 N ATOM 1165 CA MET B 123 -13.621 -4.758 -3.488 1.00 0.00 C ATOM 1166 C MET B 123 -13.645 -5.955 -2.546 1.00 0.00 C ATOM 1167 O MET B 123 -13.461 -7.090 -2.980 1.00 0.00 O ATOM 1168 CB MET B 123 -12.206 -4.554 -4.039 1.00 0.00 C ATOM 1169 CG MET B 123 -12.104 -3.409 -5.056 1.00 0.00 C ATOM 1170 SD MET B 123 -10.445 -3.284 -5.753 1.00 0.00 S ATOM 1171 CE MET B 123 -9.482 -2.993 -4.275 1.00 0.00 C ATOM 0 H MET B 123 -13.330 -2.897 -2.564 1.00 0.00 H new ATOM 0 HA MET B 123 -14.301 -4.958 -4.316 1.00 0.00 H new ATOM 0 HB2 MET B 123 -11.527 -4.354 -3.210 1.00 0.00 H new ATOM 0 HB3 MET B 123 -11.871 -5.478 -4.510 1.00 0.00 H new ATOM 0 HG2 MET B 123 -12.825 -3.569 -5.858 1.00 0.00 H new ATOM 0 HG3 MET B 123 -12.368 -2.468 -4.573 1.00 0.00 H new ATOM 0 HE1 MET B 123 -8.517 -2.566 -4.548 1.00 0.00 H new ATOM 0 HE2 MET B 123 -10.015 -2.300 -3.624 1.00 0.00 H new ATOM 0 HE3 MET B 123 -9.326 -3.936 -3.751 1.00 0.00 H new ATOM 1181 N GLY B 124 -13.881 -5.696 -1.259 1.00 0.00 N ATOM 1182 CA GLY B 124 -13.918 -6.771 -0.275 1.00 0.00 C ATOM 1183 C GLY B 124 -12.541 -7.139 0.241 1.00 0.00 C ATOM 1184 O GLY B 124 -12.355 -8.179 0.865 1.00 0.00 O ATOM 0 H GLY B 124 -14.047 -4.764 -0.880 1.00 0.00 H new ATOM 0 HA2 GLY B 124 -14.547 -6.470 0.563 1.00 0.00 H new ATOM 0 HA3 GLY B 124 -14.381 -7.651 -0.721 1.00 0.00 H new ATOM 1188 N VAL B 125 -11.572 -6.269 -0.013 1.00 0.00 N ATOM 1189 CA VAL B 125 -10.189 -6.487 0.398 1.00 0.00 C ATOM 1190 C VAL B 125 -9.938 -5.905 1.782 1.00 0.00 C ATOM 1191 O VAL B 125 -10.353 -4.777 2.080 1.00 0.00 O ATOM 1192 CB VAL B 125 -9.191 -5.849 -0.606 1.00 0.00 C ATOM 1193 CG1 VAL B 125 -7.749 -6.151 -0.220 1.00 0.00 C ATOM 1194 CG2 VAL B 125 -9.487 -6.298 -2.026 1.00 0.00 C ATOM 0 H VAL B 125 -11.722 -5.391 -0.510 1.00 0.00 H new ATOM 0 HA VAL B 125 -10.029 -7.565 0.420 1.00 0.00 H new ATOM 0 HB VAL B 125 -9.321 -4.768 -0.564 1.00 0.00 H new ATOM 0 HG11 VAL B 125 -7.075 -5.691 -0.942 1.00 0.00 H new ATOM 0 HG12 VAL B 125 -7.546 -5.749 0.773 1.00 0.00 H new ATOM 0 HG13 VAL B 125 -7.592 -7.230 -0.214 1.00 0.00 H new ATOM 0 HG21 VAL B 125 -8.774 -5.837 -2.709 1.00 0.00 H new ATOM 0 HG22 VAL B 125 -9.402 -7.383 -2.090 1.00 0.00 H new ATOM 0 HG23 VAL B 125 -10.498 -5.997 -2.299 1.00 0.00 H new ATOM 1204 N THR B 126 -9.271 -6.670 2.640 1.00 0.00 N ATOM 1205 CA THR B 126 -8.859 -6.210 3.960 1.00 0.00 C ATOM 1206 C THR B 126 -7.690 -5.220 3.823 1.00 0.00 C ATOM 1207 O THR B 126 -6.761 -5.463 3.056 1.00 0.00 O ATOM 1208 CB THR B 126 -8.455 -7.428 4.804 1.00 0.00 C ATOM 1209 OG1 THR B 126 -9.580 -8.309 4.935 1.00 0.00 O ATOM 1210 CG2 THR B 126 -7.968 -7.015 6.195 1.00 0.00 C ATOM 0 H THR B 126 -9.000 -7.632 2.437 1.00 0.00 H new ATOM 0 HA THR B 126 -9.682 -5.693 4.455 1.00 0.00 H new ATOM 0 HB THR B 126 -7.634 -7.934 4.296 1.00 0.00 H new ATOM 0 HG1 THR B 126 -9.325 -9.088 5.472 1.00 0.00 H new ATOM 0 HG21 THR B 126 -7.691 -7.904 6.762 1.00 0.00 H new ATOM 0 HG22 THR B 126 -7.101 -6.362 6.098 1.00 0.00 H new ATOM 0 HG23 THR B 126 -8.765 -6.485 6.717 1.00 0.00 H new ATOM 1218 N PRO B 127 -7.714 -4.079 4.556 1.00 0.00 N ATOM 1219 CA PRO B 127 -6.651 -3.077 4.514 1.00 0.00 C ATOM 1220 C PRO B 127 -5.255 -3.705 4.667 1.00 0.00 C ATOM 1221 O PRO B 127 -4.359 -3.440 3.855 1.00 0.00 O ATOM 1222 CB PRO B 127 -6.969 -2.134 5.695 1.00 0.00 C ATOM 1223 CG PRO B 127 -8.088 -2.781 6.450 1.00 0.00 C ATOM 1224 CD PRO B 127 -8.805 -3.652 5.457 1.00 0.00 C ATOM 0 HA PRO B 127 -6.623 -2.558 3.556 1.00 0.00 H new ATOM 0 HB2 PRO B 127 -6.095 -1.999 6.332 1.00 0.00 H new ATOM 0 HB3 PRO B 127 -7.259 -1.146 5.338 1.00 0.00 H new ATOM 0 HG2 PRO B 127 -7.707 -3.371 7.284 1.00 0.00 H new ATOM 0 HG3 PRO B 127 -8.760 -2.033 6.870 1.00 0.00 H new ATOM 0 HD2 PRO B 127 -9.289 -4.502 5.938 1.00 0.00 H new ATOM 0 HD3 PRO B 127 -9.581 -3.104 4.923 1.00 0.00 H new ATOM 1232 N SER B 128 -5.108 -4.567 5.680 1.00 0.00 N ATOM 1233 CA SER B 128 -3.831 -5.252 5.936 1.00 0.00 C ATOM 1234 C SER B 128 -3.349 -6.003 4.700 1.00 0.00 C ATOM 1235 O SER B 128 -2.142 -6.124 4.476 1.00 0.00 O ATOM 1236 CB SER B 128 -4.021 -6.221 7.119 1.00 0.00 C ATOM 1237 OG SER B 128 -4.580 -5.559 8.254 1.00 0.00 O ATOM 0 H SER B 128 -5.853 -4.807 6.334 1.00 0.00 H new ATOM 0 HA SER B 128 -3.069 -4.512 6.181 1.00 0.00 H new ATOM 0 HB2 SER B 128 -4.673 -7.041 6.818 1.00 0.00 H new ATOM 0 HB3 SER B 128 -3.060 -6.660 7.389 1.00 0.00 H new ATOM 0 HG SER B 128 -4.689 -6.201 8.986 1.00 0.00 H new ATOM 1243 N GLU B 129 -4.282 -6.475 3.888 1.00 0.00 N ATOM 1244 CA GLU B 129 -3.968 -7.271 2.719 1.00 0.00 C ATOM 1245 C GLU B 129 -3.546 -6.402 1.549 1.00 0.00 C ATOM 1246 O GLU B 129 -2.584 -6.715 0.846 1.00 0.00 O ATOM 1247 CB GLU B 129 -5.179 -8.128 2.337 1.00 0.00 C ATOM 1248 CG GLU B 129 -5.603 -9.099 3.429 1.00 0.00 C ATOM 1249 CD GLU B 129 -4.620 -10.257 3.630 1.00 0.00 C ATOM 1250 OE1 GLU B 129 -3.495 -10.012 4.123 1.00 0.00 O ATOM 1251 OE2 GLU B 129 -4.959 -11.395 3.289 1.00 0.00 O ATOM 0 H GLU B 129 -5.280 -6.315 4.024 1.00 0.00 H new ATOM 0 HA GLU B 129 -3.127 -7.920 2.965 1.00 0.00 H new ATOM 0 HB2 GLU B 129 -6.017 -7.473 2.098 1.00 0.00 H new ATOM 0 HB3 GLU B 129 -4.946 -8.690 1.432 1.00 0.00 H new ATOM 0 HG2 GLU B 129 -5.708 -8.555 4.368 1.00 0.00 H new ATOM 0 HG3 GLU B 129 -6.585 -9.504 3.183 1.00 0.00 H new ATOM 1258 N ALA B 130 -4.260 -5.309 1.328 1.00 0.00 N ATOM 1259 CA ALA B 130 -3.897 -4.362 0.269 1.00 0.00 C ATOM 1260 C ALA B 130 -2.476 -3.829 0.482 1.00 0.00 C ATOM 1261 O ALA B 130 -1.724 -3.652 -0.462 1.00 0.00 O ATOM 1262 CB ALA B 130 -4.896 -3.217 0.214 1.00 0.00 C ATOM 0 H ALA B 130 -5.091 -5.051 1.861 1.00 0.00 H new ATOM 0 HA ALA B 130 -3.923 -4.888 -0.685 1.00 0.00 H new ATOM 0 HB1 ALA B 130 -4.611 -2.524 -0.577 1.00 0.00 H new ATOM 0 HB2 ALA B 130 -5.891 -3.612 0.010 1.00 0.00 H new ATOM 0 HB3 ALA B 130 -4.902 -2.694 1.170 1.00 0.00 H new ATOM 1268 N LEU B 131 -2.122 -3.575 1.743 1.00 0.00 N ATOM 1269 CA LEU B 131 -0.775 -3.110 2.075 1.00 0.00 C ATOM 1270 C LEU B 131 0.230 -4.248 1.861 1.00 0.00 C ATOM 1271 O LEU B 131 1.372 -4.002 1.467 1.00 0.00 O ATOM 1272 CB LEU B 131 -0.726 -2.617 3.538 1.00 0.00 C ATOM 1273 CG LEU B 131 -1.680 -1.440 3.898 1.00 0.00 C ATOM 1274 CD1 LEU B 131 -1.713 -1.175 5.398 1.00 0.00 C ATOM 1275 CD2 LEU B 131 -1.294 -0.159 3.163 1.00 0.00 C ATOM 0 H LEU B 131 -2.743 -3.682 2.545 1.00 0.00 H new ATOM 0 HA LEU B 131 -0.513 -2.277 1.422 1.00 0.00 H new ATOM 0 HB2 LEU B 131 -0.958 -3.458 4.191 1.00 0.00 H new ATOM 0 HB3 LEU B 131 0.296 -2.311 3.763 1.00 0.00 H new ATOM 0 HG LEU B 131 -2.676 -1.744 3.577 1.00 0.00 H new ATOM 0 HD11 LEU B 131 -2.390 -0.347 5.606 1.00 0.00 H new ATOM 0 HD12 LEU B 131 -2.061 -2.068 5.918 1.00 0.00 H new ATOM 0 HD13 LEU B 131 -0.711 -0.921 5.745 1.00 0.00 H new ATOM 0 HD21 LEU B 131 -1.982 0.640 3.439 1.00 0.00 H new ATOM 0 HD22 LEU B 131 -0.278 0.126 3.437 1.00 0.00 H new ATOM 0 HD23 LEU B 131 -1.346 -0.327 2.087 1.00 0.00 H new ATOM 1287 N ARG B 132 -0.211 -5.480 2.088 1.00 0.00 N ATOM 1288 CA ARG B 132 0.623 -6.667 1.937 1.00 0.00 C ATOM 1289 C ARG B 132 1.063 -6.808 0.466 1.00 0.00 C ATOM 1290 O ARG B 132 2.248 -6.974 0.192 1.00 0.00 O ATOM 1291 CB ARG B 132 -0.145 -7.921 2.397 1.00 0.00 C ATOM 1292 CG ARG B 132 0.713 -9.153 2.671 1.00 0.00 C ATOM 1293 CD ARG B 132 1.104 -9.915 1.399 1.00 0.00 C ATOM 1294 NE ARG B 132 1.805 -11.157 1.714 1.00 0.00 N ATOM 1295 CZ ARG B 132 2.136 -12.083 0.819 1.00 0.00 C ATOM 1296 NH1 ARG B 132 1.894 -11.901 -0.471 1.00 0.00 N ATOM 1297 NH2 ARG B 132 2.712 -13.195 1.232 1.00 0.00 N ATOM 0 H ARG B 132 -1.165 -5.685 2.384 1.00 0.00 H new ATOM 0 HA ARG B 132 1.511 -6.564 2.561 1.00 0.00 H new ATOM 0 HB2 ARG B 132 -0.697 -7.675 3.304 1.00 0.00 H new ATOM 0 HB3 ARG B 132 -0.881 -8.175 1.635 1.00 0.00 H new ATOM 0 HG2 ARG B 132 1.618 -8.847 3.196 1.00 0.00 H new ATOM 0 HG3 ARG B 132 0.170 -9.825 3.336 1.00 0.00 H new ATOM 0 HD2 ARG B 132 0.209 -10.138 0.818 1.00 0.00 H new ATOM 0 HD3 ARG B 132 1.740 -9.285 0.777 1.00 0.00 H new ATOM 0 HE ARG B 132 2.058 -11.326 2.688 1.00 0.00 H new ATOM 0 HH11 ARG B 132 1.448 -11.041 -0.790 1.00 0.00 H new ATOM 0 HH12 ARG B 132 2.154 -12.621 -1.145 1.00 0.00 H new ATOM 0 HH21 ARG B 132 2.897 -13.335 2.225 1.00 0.00 H new ATOM 0 HH22 ARG B 132 2.972 -13.915 0.558 1.00 0.00 H new ATOM 1311 N LEU B 133 0.095 -6.712 -0.454 1.00 0.00 N ATOM 1312 CA LEU B 133 0.399 -6.837 -1.881 1.00 0.00 C ATOM 1313 C LEU B 133 1.233 -5.660 -2.385 1.00 0.00 C ATOM 1314 O LEU B 133 1.946 -5.756 -3.376 1.00 0.00 O ATOM 1315 CB LEU B 133 -0.879 -7.003 -2.714 1.00 0.00 C ATOM 1316 CG LEU B 133 -1.909 -5.882 -2.586 1.00 0.00 C ATOM 1317 CD1 LEU B 133 -1.701 -4.771 -3.613 1.00 0.00 C ATOM 1318 CD2 LEU B 133 -3.305 -6.469 -2.686 1.00 0.00 C ATOM 0 H LEU B 133 -0.889 -6.551 -0.239 1.00 0.00 H new ATOM 0 HA LEU B 133 0.997 -7.740 -2.004 1.00 0.00 H new ATOM 0 HB2 LEU B 133 -0.597 -7.093 -3.763 1.00 0.00 H new ATOM 0 HB3 LEU B 133 -1.355 -7.942 -2.431 1.00 0.00 H new ATOM 0 HG LEU B 133 -1.779 -5.415 -1.610 1.00 0.00 H new ATOM 0 HD11 LEU B 133 -2.461 -4.002 -3.476 1.00 0.00 H new ATOM 0 HD12 LEU B 133 -0.712 -4.332 -3.479 1.00 0.00 H new ATOM 0 HD13 LEU B 133 -1.781 -5.185 -4.618 1.00 0.00 H new ATOM 0 HD21 LEU B 133 -4.042 -5.671 -2.595 1.00 0.00 H new ATOM 0 HD22 LEU B 133 -3.423 -6.964 -3.650 1.00 0.00 H new ATOM 0 HD23 LEU B 133 -3.453 -7.193 -1.885 1.00 0.00 H new ATOM 1330 N MET B 134 1.118 -4.531 -1.684 1.00 0.00 N ATOM 1331 CA MET B 134 1.939 -3.368 -1.978 1.00 0.00 C ATOM 1332 C MET B 134 3.409 -3.674 -1.729 1.00 0.00 C ATOM 1333 O MET B 134 4.278 -3.353 -2.553 1.00 0.00 O ATOM 1334 CB MET B 134 1.497 -2.151 -1.139 1.00 0.00 C ATOM 1335 CG MET B 134 2.494 -0.996 -1.092 1.00 0.00 C ATOM 1336 SD MET B 134 3.902 -1.310 -0.007 1.00 0.00 S ATOM 1337 CE MET B 134 4.895 0.148 -0.284 1.00 0.00 C ATOM 0 H MET B 134 0.464 -4.403 -0.912 1.00 0.00 H new ATOM 0 HA MET B 134 1.806 -3.122 -3.032 1.00 0.00 H new ATOM 0 HB2 MET B 134 0.553 -1.779 -1.538 1.00 0.00 H new ATOM 0 HB3 MET B 134 1.303 -2.484 -0.119 1.00 0.00 H new ATOM 0 HG2 MET B 134 2.858 -0.799 -2.100 1.00 0.00 H new ATOM 0 HG3 MET B 134 1.980 -0.095 -0.757 1.00 0.00 H new ATOM 0 HE1 MET B 134 5.603 0.267 0.536 1.00 0.00 H new ATOM 0 HE2 MET B 134 5.441 0.044 -1.222 1.00 0.00 H new ATOM 0 HE3 MET B 134 4.249 1.024 -0.336 1.00 0.00 H new ATOM 1347 N LEU B 135 3.679 -4.321 -0.598 1.00 0.00 N ATOM 1348 CA LEU B 135 5.051 -4.619 -0.195 1.00 0.00 C ATOM 1349 C LEU B 135 5.683 -5.547 -1.233 1.00 0.00 C ATOM 1350 O LEU B 135 6.902 -5.570 -1.428 1.00 0.00 O ATOM 1351 CB LEU B 135 5.088 -5.245 1.198 1.00 0.00 C ATOM 1352 CG LEU B 135 4.502 -4.390 2.341 1.00 0.00 C ATOM 1353 CD1 LEU B 135 4.683 -5.065 3.686 1.00 0.00 C ATOM 1354 CD2 LEU B 135 5.141 -3.002 2.351 1.00 0.00 C ATOM 0 H LEU B 135 2.967 -4.649 0.055 1.00 0.00 H new ATOM 0 HA LEU B 135 5.623 -3.692 -0.146 1.00 0.00 H new ATOM 0 HB2 LEU B 135 4.546 -6.190 1.164 1.00 0.00 H new ATOM 0 HB3 LEU B 135 6.124 -5.480 1.441 1.00 0.00 H new ATOM 0 HG LEU B 135 3.432 -4.284 2.162 1.00 0.00 H new ATOM 0 HD11 LEU B 135 4.259 -4.436 4.469 1.00 0.00 H new ATOM 0 HD12 LEU B 135 4.175 -6.029 3.680 1.00 0.00 H new ATOM 0 HD13 LEU B 135 5.745 -5.216 3.877 1.00 0.00 H new ATOM 0 HD21 LEU B 135 4.716 -2.412 3.163 1.00 0.00 H new ATOM 0 HD22 LEU B 135 6.217 -3.098 2.496 1.00 0.00 H new ATOM 0 HD23 LEU B 135 4.946 -2.505 1.401 1.00 0.00 H new ATOM 1366 N GLU B 136 4.834 -6.303 -1.907 1.00 0.00 N ATOM 1367 CA GLU B 136 5.271 -7.190 -2.955 1.00 0.00 C ATOM 1368 C GLU B 136 5.793 -6.406 -4.157 1.00 0.00 C ATOM 1369 O GLU B 136 6.866 -6.720 -4.677 1.00 0.00 O ATOM 1370 CB GLU B 136 4.130 -8.135 -3.382 1.00 0.00 C ATOM 1371 CG GLU B 136 3.487 -8.870 -2.221 1.00 0.00 C ATOM 1372 CD GLU B 136 2.595 -10.029 -2.651 1.00 0.00 C ATOM 1373 OE1 GLU B 136 3.116 -10.978 -3.269 1.00 0.00 O ATOM 1374 OE2 GLU B 136 1.367 -10.011 -2.383 1.00 0.00 O ATOM 0 H GLU B 136 3.828 -6.315 -1.739 1.00 0.00 H new ATOM 0 HA GLU B 136 6.090 -7.792 -2.562 1.00 0.00 H new ATOM 0 HB2 GLU B 136 3.367 -7.558 -3.904 1.00 0.00 H new ATOM 0 HB3 GLU B 136 4.519 -8.864 -4.093 1.00 0.00 H new ATOM 0 HG2 GLU B 136 4.270 -9.249 -1.564 1.00 0.00 H new ATOM 0 HG3 GLU B 136 2.895 -8.164 -1.638 1.00 0.00 H new ATOM 1381 N TYR B 137 5.054 -5.376 -4.620 1.00 0.00 N ATOM 1382 CA TYR B 137 5.426 -4.660 -5.829 1.00 0.00 C ATOM 1383 C TYR B 137 6.623 -3.758 -5.612 1.00 0.00 C ATOM 1384 O TYR B 137 7.380 -3.526 -6.548 1.00 0.00 O ATOM 1385 CB TYR B 137 4.220 -3.863 -6.397 1.00 0.00 C ATOM 1386 CG TYR B 137 3.964 -2.468 -5.821 1.00 0.00 C ATOM 1387 CD1 TYR B 137 4.827 -1.405 -6.091 1.00 0.00 C ATOM 1388 CD2 TYR B 137 2.862 -2.207 -5.023 1.00 0.00 C ATOM 1389 CE1 TYR B 137 4.594 -0.152 -5.585 1.00 0.00 C ATOM 1390 CE2 TYR B 137 2.616 -0.945 -4.513 1.00 0.00 C ATOM 1391 CZ TYR B 137 3.498 0.080 -4.800 1.00 0.00 C ATOM 1392 OH TYR B 137 3.240 1.337 -4.287 1.00 0.00 O ATOM 0 H TYR B 137 4.205 -5.034 -4.170 1.00 0.00 H new ATOM 0 HA TYR B 137 5.719 -5.406 -6.567 1.00 0.00 H new ATOM 0 HB2 TYR B 137 4.359 -3.763 -7.473 1.00 0.00 H new ATOM 0 HB3 TYR B 137 3.321 -4.460 -6.246 1.00 0.00 H new ATOM 0 HD1 TYR B 137 5.696 -1.573 -6.711 1.00 0.00 H new ATOM 0 HD2 TYR B 137 2.177 -3.010 -4.793 1.00 0.00 H new ATOM 0 HE1 TYR B 137 5.278 0.654 -5.807 1.00 0.00 H new ATOM 0 HE2 TYR B 137 1.747 -0.763 -3.899 1.00 0.00 H new ATOM 0 HH TYR B 137 2.418 1.311 -3.754 1.00 0.00 H new ATOM 1402 N ILE B 138 6.810 -3.218 -4.407 1.00 0.00 N ATOM 1403 CA ILE B 138 7.946 -2.355 -4.142 1.00 0.00 C ATOM 1404 C ILE B 138 9.242 -3.146 -4.170 1.00 0.00 C ATOM 1405 O ILE B 138 10.241 -2.669 -4.707 1.00 0.00 O ATOM 1406 CB ILE B 138 7.794 -1.577 -2.788 1.00 0.00 C ATOM 1407 CG1 ILE B 138 9.132 -0.989 -2.305 1.00 0.00 C ATOM 1408 CG2 ILE B 138 7.164 -2.458 -1.716 1.00 0.00 C ATOM 1409 CD1 ILE B 138 9.727 0.039 -3.244 1.00 0.00 C ATOM 0 H ILE B 138 6.191 -3.365 -3.609 1.00 0.00 H new ATOM 0 HA ILE B 138 7.978 -1.610 -4.937 1.00 0.00 H new ATOM 0 HB ILE B 138 7.124 -0.738 -2.975 1.00 0.00 H new ATOM 0 HG12 ILE B 138 8.984 -0.530 -1.327 1.00 0.00 H new ATOM 0 HG13 ILE B 138 9.847 -1.801 -2.171 1.00 0.00 H new ATOM 0 HG21 ILE B 138 7.071 -1.893 -0.789 1.00 0.00 H new ATOM 0 HG22 ILE B 138 6.176 -2.781 -2.045 1.00 0.00 H new ATOM 0 HG23 ILE B 138 7.794 -3.332 -1.547 1.00 0.00 H new ATOM 0 HD11 ILE B 138 10.668 0.405 -2.833 1.00 0.00 H new ATOM 0 HD12 ILE B 138 9.909 -0.419 -4.216 1.00 0.00 H new ATOM 0 HD13 ILE B 138 9.033 0.871 -3.359 1.00 0.00 H new ATOM 1421 N ALA B 139 9.218 -4.351 -3.616 1.00 0.00 N ATOM 1422 CA ALA B 139 10.399 -5.213 -3.606 1.00 0.00 C ATOM 1423 C ALA B 139 10.748 -5.695 -5.011 1.00 0.00 C ATOM 1424 O ALA B 139 11.909 -5.925 -5.349 1.00 0.00 O ATOM 1425 CB ALA B 139 10.173 -6.398 -2.675 1.00 0.00 C ATOM 0 H ALA B 139 8.396 -4.756 -3.167 1.00 0.00 H new ATOM 0 HA ALA B 139 11.243 -4.628 -3.239 1.00 0.00 H new ATOM 0 HB1 ALA B 139 11.058 -7.034 -2.674 1.00 0.00 H new ATOM 0 HB2 ALA B 139 9.986 -6.036 -1.664 1.00 0.00 H new ATOM 0 HB3 ALA B 139 9.313 -6.973 -3.020 1.00 0.00 H new ATOM 1431 N ASP B 140 9.710 -5.852 -5.836 1.00 0.00 N ATOM 1432 CA ASP B 140 9.860 -6.344 -7.203 1.00 0.00 C ATOM 1433 C ASP B 140 10.345 -5.246 -8.151 1.00 0.00 C ATOM 1434 O ASP B 140 11.259 -5.474 -8.965 1.00 0.00 O ATOM 1435 CB ASP B 140 8.487 -6.887 -7.709 1.00 0.00 C ATOM 1436 CG ASP B 140 8.586 -7.517 -9.089 1.00 0.00 C ATOM 1437 OD1 ASP B 140 8.901 -8.717 -9.167 1.00 0.00 O ATOM 1438 OD2 ASP B 140 8.322 -6.826 -10.090 1.00 0.00 O ATOM 0 H ASP B 140 8.747 -5.642 -5.574 1.00 0.00 H new ATOM 0 HA ASP B 140 10.607 -7.138 -7.194 1.00 0.00 H new ATOM 0 HB2 ASP B 140 8.108 -7.625 -7.002 1.00 0.00 H new ATOM 0 HB3 ASP B 140 7.764 -6.071 -7.736 1.00 0.00 H new ATOM 1443 N ASN B 141 9.750 -4.057 -8.053 1.00 0.00 N ATOM 1444 CA ASN B 141 9.990 -2.961 -8.985 1.00 0.00 C ATOM 1445 C ASN B 141 11.080 -2.038 -8.467 1.00 0.00 C ATOM 1446 O ASN B 141 11.876 -1.505 -9.253 1.00 0.00 O ATOM 1447 CB ASN B 141 8.688 -2.175 -9.219 1.00 0.00 C ATOM 1448 CG ASN B 141 7.664 -2.959 -10.025 1.00 0.00 C ATOM 1449 OD1 ASN B 141 7.640 -2.917 -11.258 1.00 0.00 O ATOM 1450 ND2 ASN B 141 6.793 -3.675 -9.328 1.00 0.00 N ATOM 0 H ASN B 141 9.082 -3.828 -7.317 1.00 0.00 H new ATOM 0 HA ASN B 141 10.326 -3.381 -9.933 1.00 0.00 H new ATOM 0 HB2 ASN B 141 8.255 -1.903 -8.256 1.00 0.00 H new ATOM 0 HB3 ASN B 141 8.919 -1.245 -9.739 1.00 0.00 H new ATOM 0 HD21 ASN B 141 6.074 -4.214 -9.810 1.00 0.00 H new ATOM 0 HD22 ASN B 141 6.842 -3.687 -8.309 1.00 0.00 H new ATOM 1457 N GLU B 142 11.120 -1.854 -7.151 1.00 0.00 N ATOM 1458 CA GLU B 142 12.071 -0.949 -6.512 1.00 0.00 C ATOM 1459 C GLU B 142 12.032 0.450 -7.153 1.00 0.00 C ATOM 1460 O GLU B 142 13.061 0.999 -7.562 1.00 0.00 O ATOM 1461 CB GLU B 142 13.494 -1.544 -6.582 1.00 0.00 C ATOM 1462 CG GLU B 142 13.599 -2.945 -6.016 1.00 0.00 C ATOM 1463 CD GLU B 142 15.009 -3.512 -6.109 1.00 0.00 C ATOM 1464 OE1 GLU B 142 15.368 -4.070 -7.169 1.00 0.00 O ATOM 1465 OE2 GLU B 142 15.766 -3.409 -5.120 1.00 0.00 O ATOM 0 H GLU B 142 10.495 -2.327 -6.498 1.00 0.00 H new ATOM 0 HA GLU B 142 11.786 -0.837 -5.466 1.00 0.00 H new ATOM 0 HB2 GLU B 142 13.822 -1.557 -7.621 1.00 0.00 H new ATOM 0 HB3 GLU B 142 14.178 -0.891 -6.040 1.00 0.00 H new ATOM 0 HG2 GLU B 142 13.284 -2.936 -4.973 1.00 0.00 H new ATOM 0 HG3 GLU B 142 12.912 -3.601 -6.551 1.00 0.00 H new ATOM 1472 N ARG B 143 10.830 1.028 -7.261 1.00 0.00 N ATOM 1473 CA ARG B 143 10.679 2.371 -7.821 1.00 0.00 C ATOM 1474 C ARG B 143 9.486 3.128 -7.238 1.00 0.00 C ATOM 1475 O ARG B 143 9.565 4.335 -7.021 1.00 0.00 O ATOM 1476 CB ARG B 143 10.564 2.313 -9.344 1.00 0.00 C ATOM 1477 CG ARG B 143 9.279 1.695 -9.857 1.00 0.00 C ATOM 1478 CD ARG B 143 9.128 1.852 -11.370 1.00 0.00 C ATOM 1479 NE ARG B 143 9.147 3.259 -11.781 1.00 0.00 N ATOM 1480 CZ ARG B 143 9.491 3.688 -12.995 1.00 0.00 C ATOM 1481 NH1 ARG B 143 9.881 2.814 -13.923 1.00 0.00 N ATOM 1482 NH2 ARG B 143 9.454 4.981 -13.274 1.00 0.00 N ATOM 0 H ARG B 143 9.956 0.589 -6.970 1.00 0.00 H new ATOM 0 HA ARG B 143 11.578 2.921 -7.544 1.00 0.00 H new ATOM 0 HB2 ARG B 143 10.648 3.325 -9.740 1.00 0.00 H new ATOM 0 HB3 ARG B 143 11.407 1.745 -9.737 1.00 0.00 H new ATOM 0 HG2 ARG B 143 9.259 0.636 -9.599 1.00 0.00 H new ATOM 0 HG3 ARG B 143 8.429 2.161 -9.358 1.00 0.00 H new ATOM 0 HD2 ARG B 143 9.934 1.317 -11.872 1.00 0.00 H new ATOM 0 HD3 ARG B 143 8.193 1.393 -11.690 1.00 0.00 H new ATOM 0 HE ARG B 143 8.878 3.959 -11.089 1.00 0.00 H new ATOM 0 HH11 ARG B 143 9.916 1.819 -13.703 1.00 0.00 H new ATOM 0 HH12 ARG B 143 10.145 3.141 -14.853 1.00 0.00 H new ATOM 0 HH21 ARG B 143 9.162 5.649 -12.560 1.00 0.00 H new ATOM 0 HH22 ARG B 143 9.717 5.310 -14.203 1.00 0.00 H new ATOM 1496 N LEU B 144 8.367 2.424 -6.992 1.00 0.00 N ATOM 1497 CA LEU B 144 7.135 3.050 -6.502 1.00 0.00 C ATOM 1498 C LEU B 144 6.508 3.990 -7.544 1.00 0.00 C ATOM 1499 O LEU B 144 7.222 4.596 -8.341 1.00 0.00 O ATOM 1500 CB LEU B 144 7.375 3.841 -5.192 1.00 0.00 C ATOM 1501 CG LEU B 144 7.744 3.007 -3.954 1.00 0.00 C ATOM 1502 CD1 LEU B 144 8.066 3.908 -2.763 1.00 0.00 C ATOM 1503 CD2 LEU B 144 6.613 2.035 -3.598 1.00 0.00 C ATOM 0 H LEU B 144 8.295 1.416 -7.127 1.00 0.00 H new ATOM 0 HA LEU B 144 6.443 2.231 -6.306 1.00 0.00 H new ATOM 0 HB2 LEU B 144 8.172 4.563 -5.369 1.00 0.00 H new ATOM 0 HB3 LEU B 144 6.474 4.410 -4.965 1.00 0.00 H new ATOM 0 HG LEU B 144 8.636 2.428 -4.194 1.00 0.00 H new ATOM 0 HD11 LEU B 144 8.324 3.293 -1.901 1.00 0.00 H new ATOM 0 HD12 LEU B 144 8.908 4.554 -3.013 1.00 0.00 H new ATOM 0 HD13 LEU B 144 7.197 4.521 -2.525 1.00 0.00 H new ATOM 0 HD21 LEU B 144 6.895 1.455 -2.719 1.00 0.00 H new ATOM 0 HD22 LEU B 144 5.704 2.597 -3.385 1.00 0.00 H new ATOM 0 HD23 LEU B 144 6.435 1.361 -4.436 1.00 0.00 H new ATOM 1515 N PRO B 145 5.164 4.092 -7.583 1.00 0.00 N ATOM 1516 CA PRO B 145 4.460 4.979 -8.523 1.00 0.00 C ATOM 1517 C PRO B 145 4.863 6.443 -8.355 1.00 0.00 C ATOM 1518 O PRO B 145 5.167 7.129 -9.336 1.00 0.00 O ATOM 1519 CB PRO B 145 2.970 4.771 -8.196 1.00 0.00 C ATOM 1520 CG PRO B 145 2.960 4.174 -6.833 1.00 0.00 C ATOM 1521 CD PRO B 145 4.215 3.355 -6.721 1.00 0.00 C ATOM 0 HA PRO B 145 4.703 4.741 -9.559 1.00 0.00 H new ATOM 0 HB2 PRO B 145 2.425 5.714 -8.219 1.00 0.00 H new ATOM 0 HB3 PRO B 145 2.494 4.110 -8.921 1.00 0.00 H new ATOM 0 HG2 PRO B 145 2.933 4.951 -6.069 1.00 0.00 H new ATOM 0 HG3 PRO B 145 2.076 3.553 -6.687 1.00 0.00 H new ATOM 0 HD2 PRO B 145 4.567 3.293 -5.691 1.00 0.00 H new ATOM 0 HD3 PRO B 145 4.063 2.333 -7.068 1.00 0.00 H new ATOM 1529 N PHE B 146 4.859 6.923 -7.115 1.00 0.00 N ATOM 1530 CA PHE B 146 5.247 8.299 -6.799 1.00 0.00 C ATOM 1531 C PHE B 146 5.965 8.348 -5.459 1.00 0.00 C ATOM 1532 O PHE B 146 5.345 8.583 -4.420 1.00 0.00 O ATOM 1533 CB PHE B 146 4.019 9.220 -6.758 1.00 0.00 C ATOM 1534 CG PHE B 146 3.186 9.204 -8.023 1.00 0.00 C ATOM 1535 CD1 PHE B 146 3.555 9.972 -9.119 1.00 0.00 C ATOM 1536 CD2 PHE B 146 2.022 8.445 -8.096 1.00 0.00 C ATOM 1537 CE1 PHE B 146 2.791 9.973 -10.274 1.00 0.00 C ATOM 1538 CE2 PHE B 146 1.254 8.436 -9.251 1.00 0.00 C ATOM 1539 CZ PHE B 146 1.640 9.206 -10.337 1.00 0.00 C ATOM 0 H PHE B 146 4.588 6.372 -6.300 1.00 0.00 H new ATOM 0 HA PHE B 146 5.919 8.648 -7.583 1.00 0.00 H new ATOM 0 HB2 PHE B 146 3.389 8.929 -5.918 1.00 0.00 H new ATOM 0 HB3 PHE B 146 4.351 10.241 -6.568 1.00 0.00 H new ATOM 0 HD1 PHE B 146 4.449 10.576 -9.070 1.00 0.00 H new ATOM 0 HD2 PHE B 146 1.713 7.857 -7.244 1.00 0.00 H new ATOM 0 HE1 PHE B 146 3.092 10.570 -11.122 1.00 0.00 H new ATOM 0 HE2 PHE B 146 0.360 7.832 -9.304 1.00 0.00 H new ATOM 0 HZ PHE B 146 1.041 9.208 -11.236 1.00 0.00 H new ATOM 1549 N LYS B 147 7.274 8.100 -5.461 1.00 0.00 N ATOM 1550 CA LYS B 147 8.041 8.041 -4.222 1.00 0.00 C ATOM 1551 C LYS B 147 8.460 9.431 -3.750 1.00 0.00 C ATOM 1552 O LYS B 147 9.622 9.821 -3.824 1.00 0.00 O ATOM 1553 CB LYS B 147 9.251 7.097 -4.348 1.00 0.00 C ATOM 1554 CG LYS B 147 10.181 7.415 -5.527 1.00 0.00 C ATOM 1555 CD LYS B 147 11.389 6.474 -5.559 1.00 0.00 C ATOM 1556 CE LYS B 147 12.281 6.723 -6.766 1.00 0.00 C ATOM 1557 NZ LYS B 147 12.831 8.107 -6.786 1.00 0.00 N ATOM 0 H LYS B 147 7.822 7.937 -6.305 1.00 0.00 H new ATOM 0 HA LYS B 147 7.384 7.626 -3.457 1.00 0.00 H new ATOM 0 HB2 LYS B 147 9.828 7.139 -3.424 1.00 0.00 H new ATOM 0 HB3 LYS B 147 8.889 6.074 -4.451 1.00 0.00 H new ATOM 0 HG2 LYS B 147 9.627 7.330 -6.462 1.00 0.00 H new ATOM 0 HG3 LYS B 147 10.524 8.447 -5.453 1.00 0.00 H new ATOM 0 HD2 LYS B 147 11.971 6.602 -4.647 1.00 0.00 H new ATOM 0 HD3 LYS B 147 11.042 5.441 -5.573 1.00 0.00 H new ATOM 0 HE2 LYS B 147 13.103 6.008 -6.761 1.00 0.00 H new ATOM 0 HE3 LYS B 147 11.711 6.548 -7.679 1.00 0.00 H new ATOM 0 HZ1 LYS B 147 13.536 8.190 -7.546 1.00 0.00 H new ATOM 0 HZ2 LYS B 147 12.060 8.785 -6.954 1.00 0.00 H new ATOM 0 HZ3 LYS B 147 13.282 8.315 -5.872 1.00 0.00 H new ATOM 1571 N GLN B 148 7.473 10.185 -3.294 1.00 0.00 N ATOM 1572 CA GLN B 148 7.683 11.488 -2.692 1.00 0.00 C ATOM 1573 C GLN B 148 7.858 11.387 -1.178 1.00 0.00 C ATOM 1574 O GLN B 148 7.609 10.332 -0.586 1.00 0.00 O ATOM 1575 CB GLN B 148 6.525 12.452 -3.048 1.00 0.00 C ATOM 1576 CG GLN B 148 5.142 11.806 -3.118 1.00 0.00 C ATOM 1577 CD GLN B 148 4.751 10.998 -1.888 1.00 0.00 C ATOM 1578 OE1 GLN B 148 4.969 9.693 -1.950 1.00 0.00 O flip ATOM 1579 NE2 GLN B 148 4.227 11.528 -0.917 1.00 0.00 N flip ATOM 0 H GLN B 148 6.493 9.905 -3.333 1.00 0.00 H new ATOM 0 HA GLN B 148 8.607 11.894 -3.103 1.00 0.00 H new ATOM 0 HB2 GLN B 148 6.498 13.252 -2.308 1.00 0.00 H new ATOM 0 HB3 GLN B 148 6.742 12.915 -4.011 1.00 0.00 H new ATOM 0 HG2 GLN B 148 4.399 12.588 -3.273 1.00 0.00 H new ATOM 0 HG3 GLN B 148 5.105 11.154 -3.991 1.00 0.00 H new ATOM 0 HE21 GLN B 148 4.076 12.537 -0.906 1.00 0.00 H new ATOM 0 HE22 GLN B 148 3.942 10.961 -0.119 1.00 0.00 H new ATOM 1588 N THR B 149 8.311 12.472 -0.572 1.00 0.00 N ATOM 1589 CA THR B 149 8.383 12.591 0.880 1.00 0.00 C ATOM 1590 C THR B 149 8.157 14.063 1.271 1.00 0.00 C ATOM 1591 O THR B 149 9.108 14.788 1.579 1.00 0.00 O ATOM 1592 CB THR B 149 9.736 12.085 1.420 1.00 0.00 C ATOM 1593 OG1 THR B 149 9.996 10.753 0.964 1.00 0.00 O ATOM 1594 CG2 THR B 149 9.752 12.085 2.957 1.00 0.00 C ATOM 0 H THR B 149 8.640 13.298 -1.071 1.00 0.00 H new ATOM 0 HA THR B 149 7.607 11.969 1.326 1.00 0.00 H new ATOM 0 HB THR B 149 10.506 12.761 1.048 1.00 0.00 H new ATOM 0 HG1 THR B 149 10.859 10.450 1.315 1.00 0.00 H new ATOM 0 HG21 THR B 149 10.718 11.724 3.311 1.00 0.00 H new ATOM 0 HG22 THR B 149 9.588 13.099 3.323 1.00 0.00 H new ATOM 0 HG23 THR B 149 8.962 11.433 3.329 1.00 0.00 H new ATOM 1602 N LEU B 150 6.911 14.476 1.172 1.00 0.00 N ATOM 1603 CA LEU B 150 6.523 15.865 1.431 1.00 0.00 C ATOM 1604 C LEU B 150 6.065 16.042 2.881 1.00 0.00 C ATOM 1605 O LEU B 150 5.638 15.042 3.511 1.00 0.00 O ATOM 1606 CB LEU B 150 5.451 16.320 0.411 1.00 0.00 C ATOM 1607 CG LEU B 150 4.308 15.318 0.133 1.00 0.00 C ATOM 1608 CD1 LEU B 150 3.324 15.236 1.293 1.00 0.00 C ATOM 1609 CD2 LEU B 150 3.575 15.689 -1.163 1.00 0.00 C ATOM 1610 OXT LEU B 150 6.132 17.174 3.408 1.00 0.00 O ATOM 0 H LEU B 150 6.134 13.869 0.911 1.00 0.00 H new ATOM 0 HA LEU B 150 7.392 16.509 1.298 1.00 0.00 H new ATOM 0 HB2 LEU B 150 5.011 17.251 0.768 1.00 0.00 H new ATOM 0 HB3 LEU B 150 5.948 16.543 -0.533 1.00 0.00 H new ATOM 0 HG LEU B 150 4.760 14.333 0.019 1.00 0.00 H new ATOM 0 HD11 LEU B 150 2.538 14.520 1.053 1.00 0.00 H new ATOM 0 HD12 LEU B 150 3.848 14.912 2.192 1.00 0.00 H new ATOM 0 HD13 LEU B 150 2.881 16.217 1.464 1.00 0.00 H new ATOM 0 HD21 LEU B 150 2.773 14.974 -1.345 1.00 0.00 H new ATOM 0 HD22 LEU B 150 3.154 16.690 -1.069 1.00 0.00 H new ATOM 0 HD23 LEU B 150 4.277 15.667 -1.997 1.00 0.00 H new TER 1622 LEU B 150