USER MOD reduce.3.24.130724 H: found=0, std=0, add=1075, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1071 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 25 GLN : amide:sc= 0 X(o=0.0092,f=-0.47) USER MOD Set 1.2: A 128 ASN : amide:sc= 0.00925 K(o=0.0092,f=-3.3!) USER MOD Set 2.1: A 52 CYS SG : rot 170:sc= 0 USER MOD Set 2.2: A 54 TYR OH : rot 53:sc= 0.163 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -137:sc= 0.739 (180deg=-0.00358) USER MOD Single : A 7 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 11 GLN : amide:sc= -0.189 X(o=-0.19,f=-0.11) USER MOD Single : A 12 ASN : amide:sc= 0.444 K(o=0.44,f=-0.36) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 80:sc= 0.00524 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 ASN : amide:sc= 0.132 K(o=0.13,f=-1.2) USER MOD Single : A 38 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 CYS SG : rot 18:sc= 0.206 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 CYS SG : rot 180:sc= -0.754 USER MOD Single : A 45 ASN : amide:sc= 0.166 K(o=0.17,f=-3.7!) USER MOD Single : A 49 CYS SG : rot 12:sc= 0.748 USER MOD Single : A 55 SER OG : rot 180:sc= 0.00545 USER MOD Single : A 60 MET CE :methyl -172:sc= 0 (180deg=-0.0622) USER MOD Single : A 61 GLN : amide:sc= 0.88 K(o=0.88,f=-1.3!) USER MOD Single : A 64 CYS SG : rot 180:sc= -1.32 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 CYS SG : rot 70:sc= 0.209 USER MOD Single : A 70 HIS : no HE2:sc= 0.266 K(o=0.27,f=-1.3) USER MOD Single : A 74 THR OG1 : rot -92:sc= 1.32 USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 GLN : amide:sc= 0.81 K(o=0.81,f=-4.2!) USER MOD Single : A 84 GLN : amide:sc= -0.0263 X(o=-0.026,f=-0.026) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 TYR OH : rot 180:sc= 0.0112 USER MOD Single : A 101 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.045) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 105 CYS SG : rot 180:sc= 0 USER MOD Single : A 108 CYS SG : rot 72:sc= 0.143 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 ASN : amide:sc= 0.0216 K(o=0.022,f=-3.3!) USER MOD Single : A 124 MET CE :methyl 167:sc= -0.0849 (180deg=-0.319) USER MOD Single : A 133 MET CE :methyl 176:sc= 0 (180deg=-0.0208) USER MOD Single : A 135 LYS NZ :NH3+ 163:sc= 1.13 (180deg=0.928) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 11.458 -17.494 11.040 1.00 0.00 N ATOM 2 CA MET A 1 10.880 -18.870 11.151 1.00 0.00 C ATOM 3 C MET A 1 11.258 -19.742 9.936 1.00 0.00 C ATOM 4 O MET A 1 11.189 -19.249 8.806 1.00 0.00 O ATOM 5 CB MET A 1 9.348 -18.871 11.411 1.00 0.00 C ATOM 6 CG MET A 1 8.444 -18.237 10.334 1.00 0.00 C ATOM 7 SD MET A 1 8.462 -16.421 10.193 1.00 0.00 S ATOM 8 CE MET A 1 7.493 -15.954 11.657 1.00 0.00 C ATOM 0 H1 MET A 1 11.845 -17.205 11.961 1.00 0.00 H new ATOM 0 H2 MET A 1 12.218 -17.493 10.330 1.00 0.00 H new ATOM 0 H3 MET A 1 10.714 -16.827 10.752 1.00 0.00 H new ATOM 0 HA MET A 1 11.331 -19.320 12.035 1.00 0.00 H new ATOM 0 HB2 MET A 1 9.031 -19.904 11.551 1.00 0.00 H new ATOM 0 HB3 MET A 1 9.166 -18.352 12.352 1.00 0.00 H new ATOM 0 HG2 MET A 1 8.728 -18.653 9.367 1.00 0.00 H new ATOM 0 HG3 MET A 1 7.418 -18.550 10.527 1.00 0.00 H new ATOM 0 HE1 MET A 1 7.415 -14.868 11.710 1.00 0.00 H new ATOM 0 HE2 MET A 1 6.495 -16.387 11.586 1.00 0.00 H new ATOM 0 HE3 MET A 1 7.987 -16.326 12.554 1.00 0.00 H new ATOM 18 N PRO A 2 11.659 -21.020 10.129 1.00 0.00 N ATOM 19 CA PRO A 2 12.077 -21.906 9.039 1.00 0.00 C ATOM 20 C PRO A 2 10.857 -22.475 8.289 1.00 0.00 C ATOM 21 O PRO A 2 10.317 -23.516 8.657 1.00 0.00 O ATOM 22 CB PRO A 2 12.934 -22.985 9.715 1.00 0.00 C ATOM 23 CG PRO A 2 12.319 -23.107 11.110 1.00 0.00 C ATOM 24 CD PRO A 2 11.865 -21.680 11.419 1.00 0.00 C ATOM 0 HA PRO A 2 12.650 -21.389 8.269 1.00 0.00 H new ATOM 0 HB2 PRO A 2 12.891 -23.930 9.173 1.00 0.00 H new ATOM 0 HB3 PRO A 2 13.983 -22.693 9.763 1.00 0.00 H new ATOM 0 HG2 PRO A 2 11.483 -23.807 11.122 1.00 0.00 H new ATOM 0 HG3 PRO A 2 13.045 -23.465 11.840 1.00 0.00 H new ATOM 0 HD2 PRO A 2 10.945 -21.684 12.004 1.00 0.00 H new ATOM 0 HD3 PRO A 2 12.615 -21.153 12.009 1.00 0.00 H new ATOM 32 N VAL A 3 10.424 -21.783 7.225 1.00 0.00 N ATOM 33 CA VAL A 3 9.302 -22.190 6.348 1.00 0.00 C ATOM 34 C VAL A 3 9.592 -21.882 4.872 1.00 0.00 C ATOM 35 O VAL A 3 10.329 -20.943 4.559 1.00 0.00 O ATOM 36 CB VAL A 3 7.949 -21.550 6.759 1.00 0.00 C ATOM 37 CG1 VAL A 3 7.509 -21.970 8.172 1.00 0.00 C ATOM 38 CG2 VAL A 3 7.944 -20.014 6.656 1.00 0.00 C ATOM 0 H VAL A 3 10.851 -20.902 6.938 1.00 0.00 H new ATOM 0 HA VAL A 3 9.211 -23.269 6.475 1.00 0.00 H new ATOM 0 HB VAL A 3 7.231 -21.935 6.035 1.00 0.00 H new ATOM 0 HG11 VAL A 3 6.557 -21.496 8.413 1.00 0.00 H new ATOM 0 HG12 VAL A 3 7.395 -23.053 8.211 1.00 0.00 H new ATOM 0 HG13 VAL A 3 8.263 -21.659 8.895 1.00 0.00 H new ATOM 0 HG21 VAL A 3 6.969 -19.632 6.958 1.00 0.00 H new ATOM 0 HG22 VAL A 3 8.713 -19.603 7.310 1.00 0.00 H new ATOM 0 HG23 VAL A 3 8.147 -19.718 5.627 1.00 0.00 H new ATOM 48 N ARG A 4 8.983 -22.661 3.968 1.00 0.00 N ATOM 49 CA ARG A 4 9.096 -22.501 2.509 1.00 0.00 C ATOM 50 C ARG A 4 8.534 -21.150 2.036 1.00 0.00 C ATOM 51 O ARG A 4 7.455 -20.735 2.470 1.00 0.00 O ATOM 52 CB ARG A 4 8.370 -23.654 1.789 1.00 0.00 C ATOM 53 CG ARG A 4 9.077 -25.008 1.973 1.00 0.00 C ATOM 54 CD ARG A 4 8.290 -26.169 1.346 1.00 0.00 C ATOM 55 NE ARG A 4 8.079 -26.000 -0.106 1.00 0.00 N ATOM 56 CZ ARG A 4 8.939 -26.273 -1.083 1.00 0.00 C ATOM 57 NH1 ARG A 4 10.149 -26.740 -0.845 1.00 0.00 N ATOM 58 NH2 ARG A 4 8.586 -26.074 -2.335 1.00 0.00 N ATOM 0 H ARG A 4 8.382 -23.440 4.236 1.00 0.00 H new ATOM 0 HA ARG A 4 10.156 -22.526 2.258 1.00 0.00 H new ATOM 0 HB2 ARG A 4 7.350 -23.727 2.166 1.00 0.00 H new ATOM 0 HB3 ARG A 4 8.301 -23.426 0.725 1.00 0.00 H new ATOM 0 HG2 ARG A 4 10.069 -24.961 1.524 1.00 0.00 H new ATOM 0 HG3 ARG A 4 9.217 -25.200 3.037 1.00 0.00 H new ATOM 0 HD2 ARG A 4 8.824 -27.102 1.525 1.00 0.00 H new ATOM 0 HD3 ARG A 4 7.323 -26.256 1.841 1.00 0.00 H new ATOM 0 HE ARG A 4 7.171 -25.632 -0.392 1.00 0.00 H new ATOM 0 HH11 ARG A 4 10.453 -26.904 0.115 1.00 0.00 H new ATOM 0 HH12 ARG A 4 10.781 -26.938 -1.621 1.00 0.00 H new ATOM 0 HH21 ARG A 4 7.657 -25.712 -2.552 1.00 0.00 H new ATOM 0 HH22 ARG A 4 9.241 -26.281 -3.089 1.00 0.00 H new ATOM 72 N ARG A 5 9.265 -20.488 1.129 1.00 0.00 N ATOM 73 CA ARG A 5 8.975 -19.152 0.573 1.00 0.00 C ATOM 74 C ARG A 5 9.896 -18.811 -0.612 1.00 0.00 C ATOM 75 O ARG A 5 11.039 -19.272 -0.667 1.00 0.00 O ATOM 76 CB ARG A 5 9.055 -18.067 1.675 1.00 0.00 C ATOM 77 CG ARG A 5 10.470 -17.878 2.252 1.00 0.00 C ATOM 78 CD ARG A 5 10.445 -17.071 3.556 1.00 0.00 C ATOM 79 NE ARG A 5 11.806 -16.727 4.012 1.00 0.00 N ATOM 80 CZ ARG A 5 12.704 -17.529 4.577 1.00 0.00 C ATOM 81 NH1 ARG A 5 12.481 -18.810 4.796 1.00 0.00 N ATOM 82 NH2 ARG A 5 13.870 -17.038 4.935 1.00 0.00 N ATOM 0 H ARG A 5 10.120 -20.887 0.741 1.00 0.00 H new ATOM 0 HA ARG A 5 7.955 -19.172 0.189 1.00 0.00 H new ATOM 0 HB2 ARG A 5 8.709 -17.118 1.265 1.00 0.00 H new ATOM 0 HB3 ARG A 5 8.374 -18.332 2.484 1.00 0.00 H new ATOM 0 HG2 ARG A 5 10.922 -18.853 2.435 1.00 0.00 H new ATOM 0 HG3 ARG A 5 11.097 -17.369 1.520 1.00 0.00 H new ATOM 0 HD2 ARG A 5 9.869 -16.157 3.407 1.00 0.00 H new ATOM 0 HD3 ARG A 5 9.936 -17.646 4.330 1.00 0.00 H new ATOM 0 HE ARG A 5 12.092 -15.757 3.878 1.00 0.00 H new ATOM 0 HH11 ARG A 5 11.589 -19.225 4.529 1.00 0.00 H new ATOM 0 HH12 ARG A 5 13.201 -19.386 5.233 1.00 0.00 H new ATOM 0 HH21 ARG A 5 14.078 -16.052 4.779 1.00 0.00 H new ATOM 0 HH22 ARG A 5 14.567 -17.643 5.369 1.00 0.00 H new ATOM 96 N GLY A 6 9.415 -17.967 -1.530 1.00 0.00 N ATOM 97 CA GLY A 6 10.212 -17.339 -2.597 1.00 0.00 C ATOM 98 C GLY A 6 10.576 -15.910 -2.200 1.00 0.00 C ATOM 99 O GLY A 6 9.683 -15.086 -2.021 1.00 0.00 O ATOM 0 H GLY A 6 8.433 -17.692 -1.555 1.00 0.00 H new ATOM 0 HA2 GLY A 6 11.118 -17.918 -2.775 1.00 0.00 H new ATOM 0 HA3 GLY A 6 9.648 -17.334 -3.530 1.00 0.00 H new ATOM 103 N HIS A 7 11.869 -15.611 -2.052 1.00 0.00 N ATOM 104 CA HIS A 7 12.338 -14.340 -1.476 1.00 0.00 C ATOM 105 C HIS A 7 11.937 -13.108 -2.318 1.00 0.00 C ATOM 106 O HIS A 7 11.438 -12.123 -1.768 1.00 0.00 O ATOM 107 CB HIS A 7 13.863 -14.426 -1.291 1.00 0.00 C ATOM 108 CG HIS A 7 14.492 -13.146 -0.790 1.00 0.00 C ATOM 109 ND1 HIS A 7 15.456 -12.404 -1.436 1.00 0.00 N ATOM 110 CD2 HIS A 7 14.213 -12.503 0.388 1.00 0.00 C ATOM 111 CE1 HIS A 7 15.747 -11.340 -0.669 1.00 0.00 C ATOM 112 NE2 HIS A 7 15.015 -11.354 0.461 1.00 0.00 N ATOM 0 H HIS A 7 12.623 -16.240 -2.327 1.00 0.00 H new ATOM 0 HA HIS A 7 11.850 -14.196 -0.512 1.00 0.00 H new ATOM 0 HB2 HIS A 7 14.089 -15.229 -0.590 1.00 0.00 H new ATOM 0 HB3 HIS A 7 14.320 -14.696 -2.243 1.00 0.00 H new ATOM 0 HD2 HIS A 7 13.499 -12.825 1.132 1.00 0.00 H new ATOM 0 HE1 HIS A 7 16.469 -10.578 -0.924 1.00 0.00 H new ATOM 0 HE2 HIS A 7 15.039 -10.669 1.216 1.00 0.00 H new ATOM 120 N VAL A 8 12.116 -13.174 -3.646 1.00 0.00 N ATOM 121 CA VAL A 8 11.786 -12.096 -4.600 1.00 0.00 C ATOM 122 C VAL A 8 11.817 -12.609 -6.047 1.00 0.00 C ATOM 123 O VAL A 8 12.684 -13.405 -6.406 1.00 0.00 O ATOM 124 CB VAL A 8 12.704 -10.852 -4.407 1.00 0.00 C ATOM 125 CG1 VAL A 8 14.098 -10.979 -5.047 1.00 0.00 C ATOM 126 CG2 VAL A 8 12.013 -9.576 -4.904 1.00 0.00 C ATOM 0 H VAL A 8 12.505 -14.000 -4.102 1.00 0.00 H new ATOM 0 HA VAL A 8 10.767 -11.771 -4.389 1.00 0.00 H new ATOM 0 HB VAL A 8 12.871 -10.791 -3.332 1.00 0.00 H new ATOM 0 HG11 VAL A 8 14.667 -10.068 -4.863 1.00 0.00 H new ATOM 0 HG12 VAL A 8 14.623 -11.829 -4.611 1.00 0.00 H new ATOM 0 HG13 VAL A 8 13.993 -11.130 -6.121 1.00 0.00 H new ATOM 0 HG21 VAL A 8 12.675 -8.723 -4.758 1.00 0.00 H new ATOM 0 HG22 VAL A 8 11.781 -9.677 -5.964 1.00 0.00 H new ATOM 0 HG23 VAL A 8 11.091 -9.420 -4.344 1.00 0.00 H new ATOM 136 N ALA A 9 10.883 -12.141 -6.882 1.00 0.00 N ATOM 137 CA ALA A 9 10.928 -12.319 -8.338 1.00 0.00 C ATOM 138 C ALA A 9 11.777 -11.202 -8.994 1.00 0.00 C ATOM 139 O ALA A 9 11.736 -10.065 -8.511 1.00 0.00 O ATOM 140 CB ALA A 9 9.488 -12.325 -8.870 1.00 0.00 C ATOM 0 H ALA A 9 10.065 -11.622 -6.562 1.00 0.00 H new ATOM 0 HA ALA A 9 11.403 -13.267 -8.589 1.00 0.00 H new ATOM 0 HB1 ALA A 9 9.500 -12.456 -9.952 1.00 0.00 H new ATOM 0 HB2 ALA A 9 8.934 -13.144 -8.411 1.00 0.00 H new ATOM 0 HB3 ALA A 9 9.006 -11.379 -8.625 1.00 0.00 H new ATOM 146 N PRO A 10 12.526 -11.480 -10.083 1.00 0.00 N ATOM 147 CA PRO A 10 13.361 -10.480 -10.745 1.00 0.00 C ATOM 148 C PRO A 10 12.514 -9.386 -11.412 1.00 0.00 C ATOM 149 O PRO A 10 11.336 -9.581 -11.718 1.00 0.00 O ATOM 150 CB PRO A 10 14.217 -11.251 -11.754 1.00 0.00 C ATOM 151 CG PRO A 10 13.355 -12.468 -12.086 1.00 0.00 C ATOM 152 CD PRO A 10 12.645 -12.763 -10.764 1.00 0.00 C ATOM 0 HA PRO A 10 13.990 -9.949 -10.031 1.00 0.00 H new ATOM 0 HB2 PRO A 10 14.429 -10.654 -12.641 1.00 0.00 H new ATOM 0 HB3 PRO A 10 15.177 -11.542 -11.328 1.00 0.00 H new ATOM 0 HG2 PRO A 10 12.646 -12.253 -12.885 1.00 0.00 H new ATOM 0 HG3 PRO A 10 13.960 -13.313 -12.415 1.00 0.00 H new ATOM 0 HD2 PRO A 10 11.664 -13.206 -10.937 1.00 0.00 H new ATOM 0 HD3 PRO A 10 13.214 -13.473 -10.164 1.00 0.00 H new ATOM 160 N GLN A 11 13.135 -8.227 -11.642 1.00 0.00 N ATOM 161 CA GLN A 11 12.482 -7.016 -12.147 1.00 0.00 C ATOM 162 C GLN A 11 13.454 -6.138 -12.952 1.00 0.00 C ATOM 163 O GLN A 11 14.673 -6.223 -12.793 1.00 0.00 O ATOM 164 CB GLN A 11 11.805 -6.239 -10.994 1.00 0.00 C ATOM 165 CG GLN A 11 12.736 -5.526 -9.991 1.00 0.00 C ATOM 166 CD GLN A 11 13.498 -6.469 -9.052 1.00 0.00 C ATOM 167 OE1 GLN A 11 13.001 -6.885 -8.014 1.00 0.00 O ATOM 168 NE2 GLN A 11 14.732 -6.832 -9.356 1.00 0.00 N ATOM 0 H GLN A 11 14.134 -8.101 -11.478 1.00 0.00 H new ATOM 0 HA GLN A 11 11.698 -7.319 -12.841 1.00 0.00 H new ATOM 0 HB2 GLN A 11 11.142 -5.492 -11.431 1.00 0.00 H new ATOM 0 HB3 GLN A 11 11.177 -6.936 -10.438 1.00 0.00 H new ATOM 0 HG2 GLN A 11 13.457 -4.926 -10.547 1.00 0.00 H new ATOM 0 HG3 GLN A 11 12.143 -4.836 -9.390 1.00 0.00 H new ATOM 0 HE21 GLN A 11 15.165 -6.497 -10.216 1.00 0.00 H new ATOM 0 HE22 GLN A 11 15.251 -7.448 -8.730 1.00 0.00 H new ATOM 177 N ASN A 12 12.906 -5.271 -13.807 1.00 0.00 N ATOM 178 CA ASN A 12 13.629 -4.462 -14.800 1.00 0.00 C ATOM 179 C ASN A 12 14.279 -3.190 -14.215 1.00 0.00 C ATOM 180 O ASN A 12 13.987 -2.063 -14.620 1.00 0.00 O ATOM 181 CB ASN A 12 12.689 -4.191 -15.986 1.00 0.00 C ATOM 182 CG ASN A 12 11.316 -3.646 -15.581 1.00 0.00 C ATOM 183 OD1 ASN A 12 10.295 -4.298 -15.760 1.00 0.00 O ATOM 184 ND2 ASN A 12 11.251 -2.480 -14.964 1.00 0.00 N ATOM 0 H ASN A 12 11.900 -5.104 -13.829 1.00 0.00 H new ATOM 0 HA ASN A 12 14.489 -5.030 -15.156 1.00 0.00 H new ATOM 0 HB2 ASN A 12 13.167 -3.480 -16.660 1.00 0.00 H new ATOM 0 HB3 ASN A 12 12.551 -5.116 -16.545 1.00 0.00 H new ATOM 0 HD21 ASN A 12 10.352 -2.125 -14.638 1.00 0.00 H new ATOM 0 HD22 ASN A 12 12.100 -1.935 -14.813 1.00 0.00 H new ATOM 191 N THR A 13 15.176 -3.382 -13.252 1.00 0.00 N ATOM 192 CA THR A 13 15.889 -2.344 -12.471 1.00 0.00 C ATOM 193 C THR A 13 16.536 -1.256 -13.329 1.00 0.00 C ATOM 194 O THR A 13 16.510 -0.087 -12.950 1.00 0.00 O ATOM 195 CB THR A 13 16.965 -2.974 -11.576 1.00 0.00 C ATOM 196 OG1 THR A 13 17.829 -3.764 -12.369 1.00 0.00 O ATOM 197 CG2 THR A 13 16.353 -3.866 -10.498 1.00 0.00 C ATOM 0 H THR A 13 15.450 -4.323 -12.969 1.00 0.00 H new ATOM 0 HA THR A 13 15.119 -1.865 -11.866 1.00 0.00 H new ATOM 0 HB THR A 13 17.508 -2.163 -11.091 1.00 0.00 H new ATOM 0 HG1 THR A 13 18.518 -4.166 -11.800 1.00 0.00 H new ATOM 0 HG21 THR A 13 17.147 -4.293 -9.885 1.00 0.00 H new ATOM 0 HG22 THR A 13 15.689 -3.273 -9.869 1.00 0.00 H new ATOM 0 HG23 THR A 13 15.786 -4.669 -10.969 1.00 0.00 H new ATOM 205 N PHE A 14 17.070 -1.615 -14.501 1.00 0.00 N ATOM 206 CA PHE A 14 17.660 -0.667 -15.449 1.00 0.00 C ATOM 207 C PHE A 14 16.610 0.290 -16.027 1.00 0.00 C ATOM 208 O PHE A 14 16.787 1.506 -15.999 1.00 0.00 O ATOM 209 CB PHE A 14 18.348 -1.451 -16.573 1.00 0.00 C ATOM 210 CG PHE A 14 19.347 -0.623 -17.361 1.00 0.00 C ATOM 211 CD1 PHE A 14 18.913 0.198 -18.422 1.00 0.00 C ATOM 212 CD2 PHE A 14 20.712 -0.648 -17.014 1.00 0.00 C ATOM 213 CE1 PHE A 14 19.839 0.983 -19.133 1.00 0.00 C ATOM 214 CE2 PHE A 14 21.637 0.136 -17.728 1.00 0.00 C ATOM 215 CZ PHE A 14 21.202 0.950 -18.788 1.00 0.00 C ATOM 0 H PHE A 14 17.105 -2.583 -14.821 1.00 0.00 H new ATOM 0 HA PHE A 14 18.391 -0.055 -14.920 1.00 0.00 H new ATOM 0 HB2 PHE A 14 18.859 -2.313 -16.144 1.00 0.00 H new ATOM 0 HB3 PHE A 14 17.589 -1.837 -17.254 1.00 0.00 H new ATOM 0 HD1 PHE A 14 17.867 0.224 -18.690 1.00 0.00 H new ATOM 0 HD2 PHE A 14 21.049 -1.270 -16.198 1.00 0.00 H new ATOM 0 HE1 PHE A 14 19.503 1.611 -19.944 1.00 0.00 H new ATOM 0 HE2 PHE A 14 22.683 0.112 -17.461 1.00 0.00 H new ATOM 0 HZ PHE A 14 21.913 1.549 -19.337 1.00 0.00 H new ATOM 225 N LEU A 15 15.495 -0.264 -16.520 1.00 0.00 N ATOM 226 CA LEU A 15 14.356 0.490 -17.050 1.00 0.00 C ATOM 227 C LEU A 15 13.679 1.319 -15.954 1.00 0.00 C ATOM 228 O LEU A 15 13.265 2.445 -16.206 1.00 0.00 O ATOM 229 CB LEU A 15 13.373 -0.498 -17.706 1.00 0.00 C ATOM 230 CG LEU A 15 12.083 0.159 -18.236 1.00 0.00 C ATOM 231 CD1 LEU A 15 12.356 1.140 -19.386 1.00 0.00 C ATOM 232 CD2 LEU A 15 11.105 -0.926 -18.705 1.00 0.00 C ATOM 0 H LEU A 15 15.358 -1.274 -16.562 1.00 0.00 H new ATOM 0 HA LEU A 15 14.705 1.199 -17.801 1.00 0.00 H new ATOM 0 HB2 LEU A 15 13.877 -1.002 -18.531 1.00 0.00 H new ATOM 0 HB3 LEU A 15 13.106 -1.265 -16.979 1.00 0.00 H new ATOM 0 HG LEU A 15 11.648 0.730 -17.416 1.00 0.00 H new ATOM 0 HD11 LEU A 15 11.416 1.576 -19.724 1.00 0.00 H new ATOM 0 HD12 LEU A 15 13.019 1.932 -19.039 1.00 0.00 H new ATOM 0 HD13 LEU A 15 12.827 0.609 -20.213 1.00 0.00 H new ATOM 0 HD21 LEU A 15 10.194 -0.458 -19.079 1.00 0.00 H new ATOM 0 HD22 LEU A 15 11.565 -1.511 -19.501 1.00 0.00 H new ATOM 0 HD23 LEU A 15 10.859 -1.581 -17.869 1.00 0.00 H new ATOM 244 N ASP A 16 13.611 0.805 -14.727 1.00 0.00 N ATOM 245 CA ASP A 16 13.033 1.513 -13.576 1.00 0.00 C ATOM 246 C ASP A 16 13.760 2.834 -13.267 1.00 0.00 C ATOM 247 O ASP A 16 13.135 3.811 -12.845 1.00 0.00 O ATOM 248 CB ASP A 16 13.077 0.582 -12.365 1.00 0.00 C ATOM 249 CG ASP A 16 12.247 1.140 -11.198 1.00 0.00 C ATOM 250 OD1 ASP A 16 10.997 1.098 -11.284 1.00 0.00 O ATOM 251 OD2 ASP A 16 12.848 1.606 -10.201 1.00 0.00 O ATOM 0 H ASP A 16 13.959 -0.126 -14.497 1.00 0.00 H new ATOM 0 HA ASP A 16 12.004 1.781 -13.818 1.00 0.00 H new ATOM 0 HB2 ASP A 16 12.698 -0.401 -12.646 1.00 0.00 H new ATOM 0 HB3 ASP A 16 14.110 0.446 -12.046 1.00 0.00 H new ATOM 256 N THR A 17 15.065 2.874 -13.566 1.00 0.00 N ATOM 257 CA THR A 17 15.913 4.075 -13.471 1.00 0.00 C ATOM 258 C THR A 17 15.580 5.083 -14.569 1.00 0.00 C ATOM 259 O THR A 17 15.785 6.276 -14.377 1.00 0.00 O ATOM 260 CB THR A 17 17.398 3.680 -13.467 1.00 0.00 C ATOM 261 OG1 THR A 17 17.639 2.974 -12.266 1.00 0.00 O ATOM 262 CG2 THR A 17 18.366 4.866 -13.501 1.00 0.00 C ATOM 0 H THR A 17 15.576 2.052 -13.889 1.00 0.00 H new ATOM 0 HA THR A 17 15.704 4.574 -12.525 1.00 0.00 H new ATOM 0 HB THR A 17 17.577 3.097 -14.370 1.00 0.00 H new ATOM 0 HG1 THR A 17 17.335 2.047 -12.365 1.00 0.00 H new ATOM 0 HG21 THR A 17 19.392 4.498 -13.496 1.00 0.00 H new ATOM 0 HG22 THR A 17 18.194 5.450 -14.405 1.00 0.00 H new ATOM 0 HG23 THR A 17 18.202 5.495 -12.626 1.00 0.00 H new ATOM 270 N ILE A 18 15.011 4.641 -15.692 1.00 0.00 N ATOM 271 CA ILE A 18 14.511 5.516 -16.768 1.00 0.00 C ATOM 272 C ILE A 18 13.096 5.999 -16.449 1.00 0.00 C ATOM 273 O ILE A 18 12.810 7.186 -16.565 1.00 0.00 O ATOM 274 CB ILE A 18 14.552 4.792 -18.135 1.00 0.00 C ATOM 275 CG1 ILE A 18 15.840 3.965 -18.346 1.00 0.00 C ATOM 276 CG2 ILE A 18 14.355 5.798 -19.282 1.00 0.00 C ATOM 277 CD1 ILE A 18 17.159 4.738 -18.219 1.00 0.00 C ATOM 0 H ILE A 18 14.880 3.649 -15.888 1.00 0.00 H new ATOM 0 HA ILE A 18 15.164 6.386 -16.832 1.00 0.00 H new ATOM 0 HB ILE A 18 13.727 4.079 -18.136 1.00 0.00 H new ATOM 0 HG12 ILE A 18 15.848 3.149 -17.623 1.00 0.00 H new ATOM 0 HG13 ILE A 18 15.800 3.512 -19.337 1.00 0.00 H new ATOM 0 HG21 ILE A 18 14.387 5.272 -20.236 1.00 0.00 H new ATOM 0 HG22 ILE A 18 13.389 6.292 -19.171 1.00 0.00 H new ATOM 0 HG23 ILE A 18 15.149 6.544 -19.252 1.00 0.00 H new ATOM 0 HD11 ILE A 18 17.996 4.060 -18.386 1.00 0.00 H new ATOM 0 HD12 ILE A 18 17.186 5.536 -18.961 1.00 0.00 H new ATOM 0 HD13 ILE A 18 17.234 5.168 -17.220 1.00 0.00 H new ATOM 289 N ILE A 19 12.218 5.109 -15.977 1.00 0.00 N ATOM 290 CA ILE A 19 10.841 5.453 -15.574 1.00 0.00 C ATOM 291 C ILE A 19 10.850 6.592 -14.542 1.00 0.00 C ATOM 292 O ILE A 19 10.151 7.588 -14.733 1.00 0.00 O ATOM 293 CB ILE A 19 10.097 4.186 -15.078 1.00 0.00 C ATOM 294 CG1 ILE A 19 9.868 3.207 -16.257 1.00 0.00 C ATOM 295 CG2 ILE A 19 8.748 4.547 -14.423 1.00 0.00 C ATOM 296 CD1 ILE A 19 9.416 1.803 -15.832 1.00 0.00 C ATOM 0 H ILE A 19 12.440 4.120 -15.861 1.00 0.00 H new ATOM 0 HA ILE A 19 10.289 5.825 -16.437 1.00 0.00 H new ATOM 0 HB ILE A 19 10.720 3.704 -14.324 1.00 0.00 H new ATOM 0 HG12 ILE A 19 9.119 3.631 -16.926 1.00 0.00 H new ATOM 0 HG13 ILE A 19 10.793 3.121 -16.828 1.00 0.00 H new ATOM 0 HG21 ILE A 19 8.252 3.637 -14.086 1.00 0.00 H new ATOM 0 HG22 ILE A 19 8.922 5.203 -13.570 1.00 0.00 H new ATOM 0 HG23 ILE A 19 8.116 5.057 -15.150 1.00 0.00 H new ATOM 0 HD11 ILE A 19 9.279 1.182 -16.717 1.00 0.00 H new ATOM 0 HD12 ILE A 19 10.174 1.356 -15.189 1.00 0.00 H new ATOM 0 HD13 ILE A 19 8.474 1.873 -15.288 1.00 0.00 H new ATOM 308 N ARG A 20 11.690 6.513 -13.503 1.00 0.00 N ATOM 309 CA ARG A 20 11.745 7.533 -12.443 1.00 0.00 C ATOM 310 C ARG A 20 12.327 8.891 -12.893 1.00 0.00 C ATOM 311 O ARG A 20 12.196 9.877 -12.168 1.00 0.00 O ATOM 312 CB ARG A 20 12.469 6.968 -11.209 1.00 0.00 C ATOM 313 CG ARG A 20 13.991 6.871 -11.387 1.00 0.00 C ATOM 314 CD ARG A 20 14.644 6.104 -10.233 1.00 0.00 C ATOM 315 NE ARG A 20 16.115 6.167 -10.321 1.00 0.00 N ATOM 316 CZ ARG A 20 16.980 5.389 -9.677 1.00 0.00 C ATOM 317 NH1 ARG A 20 16.588 4.397 -8.905 1.00 0.00 N ATOM 318 NH2 ARG A 20 18.271 5.612 -9.795 1.00 0.00 N ATOM 0 H ARG A 20 12.349 5.745 -13.371 1.00 0.00 H new ATOM 0 HA ARG A 20 10.713 7.763 -12.177 1.00 0.00 H new ATOM 0 HB2 ARG A 20 12.251 7.600 -10.348 1.00 0.00 H new ATOM 0 HB3 ARG A 20 12.073 5.977 -10.986 1.00 0.00 H new ATOM 0 HG2 ARG A 20 14.217 6.373 -12.330 1.00 0.00 H new ATOM 0 HG3 ARG A 20 14.416 7.873 -11.446 1.00 0.00 H new ATOM 0 HD2 ARG A 20 14.315 6.522 -9.282 1.00 0.00 H new ATOM 0 HD3 ARG A 20 14.319 5.064 -10.253 1.00 0.00 H new ATOM 0 HE ARG A 20 16.508 6.878 -10.937 1.00 0.00 H new ATOM 0 HH11 ARG A 20 15.593 4.206 -8.786 1.00 0.00 H new ATOM 0 HH12 ARG A 20 17.279 3.820 -8.426 1.00 0.00 H new ATOM 0 HH21 ARG A 20 18.605 6.379 -10.379 1.00 0.00 H new ATOM 0 HH22 ARG A 20 18.938 5.018 -9.303 1.00 0.00 H new ATOM 332 N LYS A 21 12.949 8.971 -14.079 1.00 0.00 N ATOM 333 CA LYS A 21 13.370 10.230 -14.715 1.00 0.00 C ATOM 334 C LYS A 21 12.216 10.903 -15.487 1.00 0.00 C ATOM 335 O LYS A 21 12.127 12.134 -15.509 1.00 0.00 O ATOM 336 CB LYS A 21 14.549 9.934 -15.657 1.00 0.00 C ATOM 337 CG LYS A 21 15.827 9.555 -14.893 1.00 0.00 C ATOM 338 CD LYS A 21 16.936 9.017 -15.807 1.00 0.00 C ATOM 339 CE LYS A 21 17.328 10.042 -16.881 1.00 0.00 C ATOM 340 NZ LYS A 21 18.550 9.633 -17.627 1.00 0.00 N ATOM 0 H LYS A 21 13.178 8.147 -14.634 1.00 0.00 H new ATOM 0 HA LYS A 21 13.676 10.929 -13.937 1.00 0.00 H new ATOM 0 HB2 LYS A 21 14.277 9.122 -16.331 1.00 0.00 H new ATOM 0 HB3 LYS A 21 14.745 10.810 -16.276 1.00 0.00 H new ATOM 0 HG2 LYS A 21 16.197 10.430 -14.359 1.00 0.00 H new ATOM 0 HG3 LYS A 21 15.585 8.802 -14.143 1.00 0.00 H new ATOM 0 HD2 LYS A 21 17.811 8.763 -15.208 1.00 0.00 H new ATOM 0 HD3 LYS A 21 16.600 8.097 -16.286 1.00 0.00 H new ATOM 0 HE2 LYS A 21 16.502 10.167 -17.581 1.00 0.00 H new ATOM 0 HE3 LYS A 21 17.498 11.011 -16.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 18.778 10.354 -18.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 19.346 9.538 -16.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 18.381 8.721 -18.097 1.00 0.00 H new ATOM 354 N PHE A 22 11.325 10.107 -16.094 1.00 0.00 N ATOM 355 CA PHE A 22 10.096 10.584 -16.740 1.00 0.00 C ATOM 356 C PHE A 22 8.982 10.893 -15.722 1.00 0.00 C ATOM 357 O PHE A 22 8.217 11.837 -15.930 1.00 0.00 O ATOM 358 CB PHE A 22 9.636 9.555 -17.786 1.00 0.00 C ATOM 359 CG PHE A 22 10.363 9.668 -19.115 1.00 0.00 C ATOM 360 CD1 PHE A 22 11.610 9.045 -19.305 1.00 0.00 C ATOM 361 CD2 PHE A 22 9.794 10.414 -20.166 1.00 0.00 C ATOM 362 CE1 PHE A 22 12.285 9.163 -20.534 1.00 0.00 C ATOM 363 CE2 PHE A 22 10.466 10.532 -21.396 1.00 0.00 C ATOM 364 CZ PHE A 22 11.712 9.907 -21.581 1.00 0.00 C ATOM 0 H PHE A 22 11.441 9.095 -16.150 1.00 0.00 H new ATOM 0 HA PHE A 22 10.316 11.527 -17.240 1.00 0.00 H new ATOM 0 HB2 PHE A 22 9.784 8.552 -17.385 1.00 0.00 H new ATOM 0 HB3 PHE A 22 8.566 9.676 -17.956 1.00 0.00 H new ATOM 0 HD1 PHE A 22 12.052 8.473 -18.503 1.00 0.00 H new ATOM 0 HD2 PHE A 22 8.838 10.897 -20.027 1.00 0.00 H new ATOM 0 HE1 PHE A 22 13.242 8.683 -20.673 1.00 0.00 H new ATOM 0 HE2 PHE A 22 10.025 11.103 -22.199 1.00 0.00 H new ATOM 0 HZ PHE A 22 12.228 9.998 -22.525 1.00 0.00 H new ATOM 374 N GLU A 23 8.901 10.142 -14.617 1.00 0.00 N ATOM 375 CA GLU A 23 7.982 10.430 -13.509 1.00 0.00 C ATOM 376 C GLU A 23 8.429 11.660 -12.695 1.00 0.00 C ATOM 377 O GLU A 23 9.616 11.840 -12.411 1.00 0.00 O ATOM 378 CB GLU A 23 7.841 9.225 -12.562 1.00 0.00 C ATOM 379 CG GLU A 23 7.136 8.024 -13.200 1.00 0.00 C ATOM 380 CD GLU A 23 6.717 6.989 -12.143 1.00 0.00 C ATOM 381 OE1 GLU A 23 7.577 6.514 -11.364 1.00 0.00 O ATOM 382 OE2 GLU A 23 5.511 6.645 -12.085 1.00 0.00 O ATOM 0 H GLU A 23 9.475 9.312 -14.466 1.00 0.00 H new ATOM 0 HA GLU A 23 7.015 10.642 -13.965 1.00 0.00 H new ATOM 0 HB2 GLU A 23 8.832 8.918 -12.227 1.00 0.00 H new ATOM 0 HB3 GLU A 23 7.286 9.533 -11.676 1.00 0.00 H new ATOM 0 HG2 GLU A 23 6.256 8.365 -13.745 1.00 0.00 H new ATOM 0 HG3 GLU A 23 7.800 7.555 -13.927 1.00 0.00 H new ATOM 389 N GLY A 24 7.459 12.479 -12.264 1.00 0.00 N ATOM 390 CA GLY A 24 7.663 13.609 -11.337 1.00 0.00 C ATOM 391 C GLY A 24 7.292 13.300 -9.881 1.00 0.00 C ATOM 392 O GLY A 24 7.534 14.124 -8.999 1.00 0.00 O ATOM 0 H GLY A 24 6.487 12.374 -12.555 1.00 0.00 H new ATOM 0 HA2 GLY A 24 8.709 13.914 -11.377 1.00 0.00 H new ATOM 0 HA3 GLY A 24 7.070 14.457 -11.679 1.00 0.00 H new ATOM 396 N GLN A 25 6.706 12.129 -9.608 1.00 0.00 N ATOM 397 CA GLN A 25 6.154 11.744 -8.305 1.00 0.00 C ATOM 398 C GLN A 25 7.231 11.054 -7.440 1.00 0.00 C ATOM 399 O GLN A 25 7.117 9.888 -7.071 1.00 0.00 O ATOM 400 CB GLN A 25 4.879 10.897 -8.520 1.00 0.00 C ATOM 401 CG GLN A 25 4.013 10.831 -7.249 1.00 0.00 C ATOM 402 CD GLN A 25 2.850 9.842 -7.361 1.00 0.00 C ATOM 403 OE1 GLN A 25 2.815 8.815 -6.695 1.00 0.00 O ATOM 404 NE2 GLN A 25 1.856 10.100 -8.189 1.00 0.00 N ATOM 0 H GLN A 25 6.600 11.399 -10.312 1.00 0.00 H new ATOM 0 HA GLN A 25 5.854 12.627 -7.741 1.00 0.00 H new ATOM 0 HB2 GLN A 25 4.294 11.322 -9.336 1.00 0.00 H new ATOM 0 HB3 GLN A 25 5.160 9.888 -8.821 1.00 0.00 H new ATOM 0 HG2 GLN A 25 4.641 10.549 -6.404 1.00 0.00 H new ATOM 0 HG3 GLN A 25 3.618 11.824 -7.035 1.00 0.00 H new ATOM 0 HE21 GLN A 25 1.869 10.951 -8.752 1.00 0.00 H new ATOM 0 HE22 GLN A 25 1.075 9.449 -8.267 1.00 0.00 H new ATOM 413 N SER A 26 8.294 11.786 -7.096 1.00 0.00 N ATOM 414 CA SER A 26 9.422 11.316 -6.253 1.00 0.00 C ATOM 415 C SER A 26 9.069 11.275 -4.741 1.00 0.00 C ATOM 416 O SER A 26 9.832 11.687 -3.861 1.00 0.00 O ATOM 417 CB SER A 26 10.676 12.150 -6.573 1.00 0.00 C ATOM 418 OG SER A 26 11.866 11.457 -6.209 1.00 0.00 O ATOM 0 H SER A 26 8.407 12.753 -7.400 1.00 0.00 H new ATOM 0 HA SER A 26 9.638 10.277 -6.500 1.00 0.00 H new ATOM 0 HB2 SER A 26 10.699 12.382 -7.638 1.00 0.00 H new ATOM 0 HB3 SER A 26 10.629 13.100 -6.041 1.00 0.00 H new ATOM 0 HG SER A 26 12.646 12.010 -6.425 1.00 0.00 H new ATOM 424 N ARG A 27 7.845 10.815 -4.456 1.00 0.00 N ATOM 425 CA ARG A 27 7.228 10.602 -3.136 1.00 0.00 C ATOM 426 C ARG A 27 7.482 9.159 -2.651 1.00 0.00 C ATOM 427 O ARG A 27 8.352 8.448 -3.149 1.00 0.00 O ATOM 428 CB ARG A 27 5.722 10.957 -3.267 1.00 0.00 C ATOM 429 CG ARG A 27 5.408 12.453 -3.073 1.00 0.00 C ATOM 430 CD ARG A 27 6.114 13.404 -4.051 1.00 0.00 C ATOM 431 NE ARG A 27 5.639 14.789 -3.882 1.00 0.00 N ATOM 432 CZ ARG A 27 6.105 15.872 -4.499 1.00 0.00 C ATOM 433 NH1 ARG A 27 7.093 15.817 -5.370 1.00 0.00 N ATOM 434 NH2 ARG A 27 5.571 17.046 -4.242 1.00 0.00 N ATOM 0 H ARG A 27 7.203 10.559 -5.206 1.00 0.00 H new ATOM 0 HA ARG A 27 7.670 11.244 -2.374 1.00 0.00 H new ATOM 0 HB2 ARG A 27 5.371 10.648 -4.252 1.00 0.00 H new ATOM 0 HB3 ARG A 27 5.159 10.381 -2.533 1.00 0.00 H new ATOM 0 HG2 ARG A 27 4.331 12.596 -3.166 1.00 0.00 H new ATOM 0 HG3 ARG A 27 5.681 12.736 -2.056 1.00 0.00 H new ATOM 0 HD2 ARG A 27 7.191 13.363 -3.889 1.00 0.00 H new ATOM 0 HD3 ARG A 27 5.934 13.077 -5.075 1.00 0.00 H new ATOM 0 HE ARG A 27 4.873 14.932 -3.224 1.00 0.00 H new ATOM 0 HH11 ARG A 27 7.528 14.922 -5.592 1.00 0.00 H new ATOM 0 HH12 ARG A 27 7.422 16.670 -5.822 1.00 0.00 H new ATOM 0 HH21 ARG A 27 4.805 17.122 -3.573 1.00 0.00 H new ATOM 0 HH22 ARG A 27 5.923 17.880 -4.711 1.00 0.00 H new ATOM 448 N LYS A 28 6.723 8.713 -1.649 1.00 0.00 N ATOM 449 CA LYS A 28 6.834 7.388 -1.033 1.00 0.00 C ATOM 450 C LYS A 28 5.996 6.366 -1.822 1.00 0.00 C ATOM 451 O LYS A 28 4.832 6.624 -2.120 1.00 0.00 O ATOM 452 CB LYS A 28 6.374 7.493 0.437 1.00 0.00 C ATOM 453 CG LYS A 28 7.038 8.638 1.227 1.00 0.00 C ATOM 454 CD LYS A 28 6.133 9.882 1.344 1.00 0.00 C ATOM 455 CE LYS A 28 6.955 11.044 1.918 1.00 0.00 C ATOM 456 NZ LYS A 28 6.206 12.333 1.978 1.00 0.00 N ATOM 0 H LYS A 28 5.989 9.283 -1.229 1.00 0.00 H new ATOM 0 HA LYS A 28 7.867 7.041 -1.055 1.00 0.00 H new ATOM 0 HB2 LYS A 28 5.293 7.631 0.459 1.00 0.00 H new ATOM 0 HB3 LYS A 28 6.585 6.549 0.940 1.00 0.00 H new ATOM 0 HG2 LYS A 28 7.294 8.284 2.226 1.00 0.00 H new ATOM 0 HG3 LYS A 28 7.972 8.917 0.739 1.00 0.00 H new ATOM 0 HD2 LYS A 28 5.733 10.150 0.366 1.00 0.00 H new ATOM 0 HD3 LYS A 28 5.281 9.669 1.989 1.00 0.00 H new ATOM 0 HE2 LYS A 28 7.289 10.781 2.921 1.00 0.00 H new ATOM 0 HE3 LYS A 28 7.849 11.181 1.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 6.820 13.073 2.375 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 5.909 12.607 1.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 5.367 12.219 2.581 1.00 0.00 H new ATOM 470 N PHE A 29 6.563 5.202 -2.136 1.00 0.00 N ATOM 471 CA PHE A 29 5.893 4.132 -2.883 1.00 0.00 C ATOM 472 C PHE A 29 6.588 2.768 -2.764 1.00 0.00 C ATOM 473 O PHE A 29 7.752 2.672 -2.374 1.00 0.00 O ATOM 474 CB PHE A 29 5.713 4.547 -4.356 1.00 0.00 C ATOM 475 CG PHE A 29 6.988 4.925 -5.088 1.00 0.00 C ATOM 476 CD1 PHE A 29 7.847 3.925 -5.585 1.00 0.00 C ATOM 477 CD2 PHE A 29 7.312 6.283 -5.280 1.00 0.00 C ATOM 478 CE1 PHE A 29 9.031 4.281 -6.255 1.00 0.00 C ATOM 479 CE2 PHE A 29 8.491 6.637 -5.958 1.00 0.00 C ATOM 480 CZ PHE A 29 9.353 5.637 -6.442 1.00 0.00 C ATOM 0 H PHE A 29 7.521 4.969 -1.874 1.00 0.00 H new ATOM 0 HA PHE A 29 4.913 3.995 -2.426 1.00 0.00 H new ATOM 0 HB2 PHE A 29 5.237 3.725 -4.891 1.00 0.00 H new ATOM 0 HB3 PHE A 29 5.027 5.393 -4.396 1.00 0.00 H new ATOM 0 HD1 PHE A 29 7.596 2.883 -5.451 1.00 0.00 H new ATOM 0 HD2 PHE A 29 6.653 7.053 -4.906 1.00 0.00 H new ATOM 0 HE1 PHE A 29 9.693 3.513 -6.626 1.00 0.00 H new ATOM 0 HE2 PHE A 29 8.735 7.678 -6.107 1.00 0.00 H new ATOM 0 HZ PHE A 29 10.262 5.910 -6.957 1.00 0.00 H new ATOM 490 N ILE A 30 5.860 1.715 -3.140 1.00 0.00 N ATOM 491 CA ILE A 30 6.299 0.308 -3.179 1.00 0.00 C ATOM 492 C ILE A 30 5.663 -0.421 -4.371 1.00 0.00 C ATOM 493 O ILE A 30 4.596 -0.024 -4.829 1.00 0.00 O ATOM 494 CB ILE A 30 5.955 -0.410 -1.850 1.00 0.00 C ATOM 495 CG1 ILE A 30 4.447 -0.354 -1.534 1.00 0.00 C ATOM 496 CG2 ILE A 30 6.748 0.170 -0.674 1.00 0.00 C ATOM 497 CD1 ILE A 30 4.061 -1.078 -0.244 1.00 0.00 C ATOM 0 H ILE A 30 4.892 1.821 -3.444 1.00 0.00 H new ATOM 0 HA ILE A 30 7.382 0.290 -3.304 1.00 0.00 H new ATOM 0 HB ILE A 30 6.238 -1.454 -1.986 1.00 0.00 H new ATOM 0 HG12 ILE A 30 4.139 0.689 -1.461 1.00 0.00 H new ATOM 0 HG13 ILE A 30 3.894 -0.792 -2.365 1.00 0.00 H new ATOM 0 HG21 ILE A 30 6.480 -0.358 0.241 1.00 0.00 H new ATOM 0 HG22 ILE A 30 7.815 0.053 -0.862 1.00 0.00 H new ATOM 0 HG23 ILE A 30 6.513 1.229 -0.564 1.00 0.00 H new ATOM 0 HD11 ILE A 30 2.985 -0.995 -0.088 1.00 0.00 H new ATOM 0 HD12 ILE A 30 4.337 -2.130 -0.321 1.00 0.00 H new ATOM 0 HD13 ILE A 30 4.585 -0.626 0.598 1.00 0.00 H new ATOM 509 N ILE A 31 6.296 -1.483 -4.873 1.00 0.00 N ATOM 510 CA ILE A 31 5.855 -2.286 -6.026 1.00 0.00 C ATOM 511 C ILE A 31 5.637 -3.734 -5.583 1.00 0.00 C ATOM 512 O ILE A 31 6.527 -4.348 -4.994 1.00 0.00 O ATOM 513 CB ILE A 31 6.898 -2.258 -7.172 1.00 0.00 C ATOM 514 CG1 ILE A 31 7.399 -0.821 -7.459 1.00 0.00 C ATOM 515 CG2 ILE A 31 6.294 -2.931 -8.429 1.00 0.00 C ATOM 516 CD1 ILE A 31 8.398 -0.706 -8.615 1.00 0.00 C ATOM 0 H ILE A 31 7.169 -1.826 -4.473 1.00 0.00 H new ATOM 0 HA ILE A 31 4.925 -1.857 -6.399 1.00 0.00 H new ATOM 0 HB ILE A 31 7.778 -2.823 -6.865 1.00 0.00 H new ATOM 0 HG12 ILE A 31 6.539 -0.188 -7.677 1.00 0.00 H new ATOM 0 HG13 ILE A 31 7.864 -0.426 -6.555 1.00 0.00 H new ATOM 0 HG21 ILE A 31 7.025 -2.913 -9.238 1.00 0.00 H new ATOM 0 HG22 ILE A 31 6.033 -3.964 -8.199 1.00 0.00 H new ATOM 0 HG23 ILE A 31 5.399 -2.390 -8.737 1.00 0.00 H new ATOM 0 HD11 ILE A 31 8.691 0.336 -8.740 1.00 0.00 H new ATOM 0 HD12 ILE A 31 9.280 -1.307 -8.395 1.00 0.00 H new ATOM 0 HD13 ILE A 31 7.934 -1.065 -9.534 1.00 0.00 H new ATOM 528 N ALA A 32 4.487 -4.301 -5.935 1.00 0.00 N ATOM 529 CA ALA A 32 4.139 -5.691 -5.674 1.00 0.00 C ATOM 530 C ALA A 32 3.619 -6.384 -6.936 1.00 0.00 C ATOM 531 O ALA A 32 2.938 -5.771 -7.760 1.00 0.00 O ATOM 532 CB ALA A 32 3.100 -5.684 -4.557 1.00 0.00 C ATOM 0 H ALA A 32 3.752 -3.790 -6.424 1.00 0.00 H new ATOM 0 HA ALA A 32 5.017 -6.260 -5.369 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.807 -6.708 -4.326 1.00 0.00 H new ATOM 0 HB2 ALA A 32 3.525 -5.219 -3.668 1.00 0.00 H new ATOM 0 HB3 ALA A 32 2.224 -5.120 -4.878 1.00 0.00 H new ATOM 538 N ASN A 33 3.924 -7.674 -7.089 1.00 0.00 N ATOM 539 CA ASN A 33 3.424 -8.466 -8.209 1.00 0.00 C ATOM 540 C ASN A 33 1.912 -8.729 -8.073 1.00 0.00 C ATOM 541 O ASN A 33 1.458 -9.255 -7.057 1.00 0.00 O ATOM 542 CB ASN A 33 4.233 -9.765 -8.319 1.00 0.00 C ATOM 543 CG ASN A 33 4.099 -10.341 -9.721 1.00 0.00 C ATOM 544 OD1 ASN A 33 3.099 -10.956 -10.068 1.00 0.00 O ATOM 545 ND2 ASN A 33 5.071 -10.082 -10.572 1.00 0.00 N ATOM 0 H ASN A 33 4.520 -8.194 -6.445 1.00 0.00 H new ATOM 0 HA ASN A 33 3.556 -7.905 -9.134 1.00 0.00 H new ATOM 0 HB2 ASN A 33 5.282 -9.571 -8.095 1.00 0.00 H new ATOM 0 HB3 ASN A 33 3.879 -10.488 -7.584 1.00 0.00 H new ATOM 0 HD21 ASN A 33 4.998 -10.395 -11.540 1.00 0.00 H new ATOM 0 HD22 ASN A 33 5.896 -9.568 -10.263 1.00 0.00 H new ATOM 552 N ALA A 34 1.131 -8.378 -9.102 1.00 0.00 N ATOM 553 CA ALA A 34 -0.332 -8.525 -9.087 1.00 0.00 C ATOM 554 C ALA A 34 -0.783 -9.997 -9.155 1.00 0.00 C ATOM 555 O ALA A 34 -1.809 -10.365 -8.584 1.00 0.00 O ATOM 556 CB ALA A 34 -0.915 -7.717 -10.255 1.00 0.00 C ATOM 0 H ALA A 34 1.495 -7.984 -9.970 1.00 0.00 H new ATOM 0 HA ALA A 34 -0.707 -8.142 -8.138 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -2.001 -7.815 -10.259 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -0.646 -6.667 -10.141 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -0.513 -8.095 -11.195 1.00 0.00 H new ATOM 562 N ARG A 35 0.006 -10.867 -9.801 1.00 0.00 N ATOM 563 CA ARG A 35 -0.331 -12.271 -10.106 1.00 0.00 C ATOM 564 C ARG A 35 -0.127 -13.215 -8.896 1.00 0.00 C ATOM 565 O ARG A 35 0.349 -14.341 -9.045 1.00 0.00 O ATOM 566 CB ARG A 35 0.457 -12.728 -11.354 1.00 0.00 C ATOM 567 CG ARG A 35 0.365 -11.738 -12.537 1.00 0.00 C ATOM 568 CD ARG A 35 1.011 -12.273 -13.820 1.00 0.00 C ATOM 569 NE ARG A 35 2.444 -12.579 -13.634 1.00 0.00 N ATOM 570 CZ ARG A 35 3.192 -13.353 -14.415 1.00 0.00 C ATOM 571 NH1 ARG A 35 2.718 -13.909 -15.512 1.00 0.00 N ATOM 572 NH2 ARG A 35 4.448 -13.584 -14.098 1.00 0.00 N ATOM 0 H ARG A 35 0.932 -10.606 -10.140 1.00 0.00 H new ATOM 0 HA ARG A 35 -1.397 -12.327 -10.327 1.00 0.00 H new ATOM 0 HB2 ARG A 35 1.504 -12.863 -11.084 1.00 0.00 H new ATOM 0 HB3 ARG A 35 0.083 -13.700 -11.674 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -0.683 -11.511 -12.732 1.00 0.00 H new ATOM 0 HG3 ARG A 35 0.847 -10.801 -12.258 1.00 0.00 H new ATOM 0 HD2 ARG A 35 0.487 -13.173 -14.141 1.00 0.00 H new ATOM 0 HD3 ARG A 35 0.898 -11.537 -14.616 1.00 0.00 H new ATOM 0 HE ARG A 35 2.905 -12.156 -12.828 1.00 0.00 H new ATOM 0 HH11 ARG A 35 1.748 -13.751 -15.786 1.00 0.00 H new ATOM 0 HH12 ARG A 35 3.321 -14.497 -16.087 1.00 0.00 H new ATOM 0 HH21 ARG A 35 4.846 -13.170 -13.255 1.00 0.00 H new ATOM 0 HH22 ARG A 35 5.024 -14.177 -14.695 1.00 0.00 H new ATOM 586 N VAL A 36 -0.427 -12.732 -7.686 1.00 0.00 N ATOM 587 CA VAL A 36 -0.116 -13.354 -6.381 1.00 0.00 C ATOM 588 C VAL A 36 -1.253 -13.042 -5.399 1.00 0.00 C ATOM 589 O VAL A 36 -1.691 -11.897 -5.324 1.00 0.00 O ATOM 590 CB VAL A 36 1.234 -12.834 -5.808 1.00 0.00 C ATOM 591 CG1 VAL A 36 1.586 -13.494 -4.463 1.00 0.00 C ATOM 592 CG2 VAL A 36 2.417 -13.049 -6.768 1.00 0.00 C ATOM 0 H VAL A 36 -0.921 -11.847 -7.577 1.00 0.00 H new ATOM 0 HA VAL A 36 -0.022 -14.431 -6.522 1.00 0.00 H new ATOM 0 HB VAL A 36 1.080 -11.764 -5.668 1.00 0.00 H new ATOM 0 HG11 VAL A 36 2.536 -13.100 -4.102 1.00 0.00 H new ATOM 0 HG12 VAL A 36 0.804 -13.278 -3.736 1.00 0.00 H new ATOM 0 HG13 VAL A 36 1.668 -14.573 -4.597 1.00 0.00 H new ATOM 0 HG21 VAL A 36 3.330 -12.666 -6.312 1.00 0.00 H new ATOM 0 HG22 VAL A 36 2.532 -14.114 -6.971 1.00 0.00 H new ATOM 0 HG23 VAL A 36 2.228 -12.520 -7.702 1.00 0.00 H new ATOM 602 N GLU A 37 -1.706 -14.042 -4.633 1.00 0.00 N ATOM 603 CA GLU A 37 -2.866 -13.932 -3.729 1.00 0.00 C ATOM 604 C GLU A 37 -2.687 -12.834 -2.661 1.00 0.00 C ATOM 605 O GLU A 37 -3.585 -12.020 -2.437 1.00 0.00 O ATOM 606 CB GLU A 37 -3.098 -15.305 -3.069 1.00 0.00 C ATOM 607 CG GLU A 37 -4.406 -15.419 -2.273 1.00 0.00 C ATOM 608 CD GLU A 37 -5.646 -15.364 -3.181 1.00 0.00 C ATOM 609 OE1 GLU A 37 -5.901 -16.341 -3.926 1.00 0.00 O ATOM 610 OE2 GLU A 37 -6.391 -14.356 -3.146 1.00 0.00 O ATOM 0 H GLU A 37 -1.273 -14.966 -4.621 1.00 0.00 H new ATOM 0 HA GLU A 37 -3.736 -13.639 -4.316 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -3.092 -16.072 -3.844 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -2.263 -15.519 -2.402 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -4.409 -16.355 -1.714 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -4.456 -14.611 -1.543 1.00 0.00 H new ATOM 617 N ASN A 38 -1.508 -12.775 -2.030 1.00 0.00 N ATOM 618 CA ASN A 38 -1.176 -11.782 -0.994 1.00 0.00 C ATOM 619 C ASN A 38 -0.712 -10.423 -1.562 1.00 0.00 C ATOM 620 O ASN A 38 -0.581 -9.468 -0.797 1.00 0.00 O ATOM 621 CB ASN A 38 -0.090 -12.374 -0.077 1.00 0.00 C ATOM 622 CG ASN A 38 -0.561 -13.630 0.657 1.00 0.00 C ATOM 623 OD1 ASN A 38 -1.545 -13.616 1.387 1.00 0.00 O ATOM 624 ND2 ASN A 38 0.120 -14.750 0.483 1.00 0.00 N ATOM 0 H ASN A 38 -0.745 -13.423 -2.225 1.00 0.00 H new ATOM 0 HA ASN A 38 -2.089 -11.573 -0.437 1.00 0.00 H new ATOM 0 HB2 ASN A 38 0.791 -12.614 -0.672 1.00 0.00 H new ATOM 0 HB3 ASN A 38 0.213 -11.623 0.653 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -0.174 -15.604 0.957 1.00 0.00 H new ATOM 0 HD22 ASN A 38 0.939 -14.760 -0.125 1.00 0.00 H new ATOM 631 N CYS A 39 -0.402 -10.335 -2.868 1.00 0.00 N ATOM 632 CA CYS A 39 0.296 -9.200 -3.507 1.00 0.00 C ATOM 633 C CYS A 39 1.561 -8.803 -2.716 1.00 0.00 C ATOM 634 O CYS A 39 1.636 -7.717 -2.145 1.00 0.00 O ATOM 635 CB CYS A 39 -0.692 -8.035 -3.719 1.00 0.00 C ATOM 636 SG CYS A 39 -1.889 -8.469 -5.017 1.00 0.00 S ATOM 0 H CYS A 39 -0.637 -11.074 -3.530 1.00 0.00 H new ATOM 0 HA CYS A 39 0.654 -9.498 -4.492 1.00 0.00 H new ATOM 0 HB2 CYS A 39 -1.215 -7.816 -2.788 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -0.149 -7.132 -4.000 1.00 0.00 H new ATOM 0 HG CYS A 39 -1.880 -9.756 -5.203 1.00 0.00 H new ATOM 642 N ALA A 40 2.537 -9.713 -2.619 1.00 0.00 N ATOM 643 CA ALA A 40 3.769 -9.494 -1.852 1.00 0.00 C ATOM 644 C ALA A 40 4.649 -8.387 -2.479 1.00 0.00 C ATOM 645 O ALA A 40 4.840 -8.378 -3.696 1.00 0.00 O ATOM 646 CB ALA A 40 4.519 -10.828 -1.723 1.00 0.00 C ATOM 0 H ALA A 40 2.494 -10.626 -3.072 1.00 0.00 H new ATOM 0 HA ALA A 40 3.512 -9.137 -0.855 1.00 0.00 H new ATOM 0 HB1 ALA A 40 5.436 -10.676 -1.154 1.00 0.00 H new ATOM 0 HB2 ALA A 40 3.888 -11.552 -1.207 1.00 0.00 H new ATOM 0 HB3 ALA A 40 4.766 -11.204 -2.716 1.00 0.00 H new ATOM 652 N VAL A 41 5.202 -7.483 -1.659 1.00 0.00 N ATOM 653 CA VAL A 41 6.124 -6.422 -2.131 1.00 0.00 C ATOM 654 C VAL A 41 7.402 -7.054 -2.691 1.00 0.00 C ATOM 655 O VAL A 41 8.058 -7.843 -2.009 1.00 0.00 O ATOM 656 CB VAL A 41 6.494 -5.373 -1.046 1.00 0.00 C ATOM 657 CG1 VAL A 41 7.274 -4.200 -1.650 1.00 0.00 C ATOM 658 CG2 VAL A 41 5.232 -4.796 -0.380 1.00 0.00 C ATOM 0 H VAL A 41 5.029 -7.460 -0.654 1.00 0.00 H new ATOM 0 HA VAL A 41 5.586 -5.881 -2.909 1.00 0.00 H new ATOM 0 HB VAL A 41 7.107 -5.892 -0.309 1.00 0.00 H new ATOM 0 HG11 VAL A 41 7.518 -3.483 -0.866 1.00 0.00 H new ATOM 0 HG12 VAL A 41 8.194 -4.570 -2.103 1.00 0.00 H new ATOM 0 HG13 VAL A 41 6.665 -3.712 -2.411 1.00 0.00 H new ATOM 0 HG21 VAL A 41 5.521 -4.065 0.375 1.00 0.00 H new ATOM 0 HG22 VAL A 41 4.611 -4.313 -1.134 1.00 0.00 H new ATOM 0 HG23 VAL A 41 4.669 -5.601 0.092 1.00 0.00 H new ATOM 668 N ILE A 42 7.749 -6.690 -3.929 1.00 0.00 N ATOM 669 CA ILE A 42 9.000 -7.094 -4.602 1.00 0.00 C ATOM 670 C ILE A 42 10.031 -5.962 -4.651 1.00 0.00 C ATOM 671 O ILE A 42 11.227 -6.231 -4.746 1.00 0.00 O ATOM 672 CB ILE A 42 8.733 -7.637 -6.025 1.00 0.00 C ATOM 673 CG1 ILE A 42 8.012 -6.621 -6.941 1.00 0.00 C ATOM 674 CG2 ILE A 42 7.963 -8.966 -5.936 1.00 0.00 C ATOM 675 CD1 ILE A 42 7.966 -7.048 -8.410 1.00 0.00 C ATOM 0 H ILE A 42 7.159 -6.093 -4.509 1.00 0.00 H new ATOM 0 HA ILE A 42 9.421 -7.898 -3.998 1.00 0.00 H new ATOM 0 HB ILE A 42 9.701 -7.813 -6.495 1.00 0.00 H new ATOM 0 HG12 ILE A 42 6.993 -6.478 -6.580 1.00 0.00 H new ATOM 0 HG13 ILE A 42 8.515 -5.657 -6.867 1.00 0.00 H new ATOM 0 HG21 ILE A 42 7.776 -9.346 -6.940 1.00 0.00 H new ATOM 0 HG22 ILE A 42 8.554 -9.692 -5.377 1.00 0.00 H new ATOM 0 HG23 ILE A 42 7.013 -8.803 -5.427 1.00 0.00 H new ATOM 0 HD11 ILE A 42 7.446 -6.288 -8.994 1.00 0.00 H new ATOM 0 HD12 ILE A 42 8.982 -7.163 -8.787 1.00 0.00 H new ATOM 0 HD13 ILE A 42 7.437 -7.997 -8.497 1.00 0.00 H new ATOM 687 N TYR A 43 9.586 -4.704 -4.557 1.00 0.00 N ATOM 688 CA TYR A 43 10.463 -3.534 -4.568 1.00 0.00 C ATOM 689 C TYR A 43 9.898 -2.405 -3.699 1.00 0.00 C ATOM 690 O TYR A 43 8.697 -2.152 -3.700 1.00 0.00 O ATOM 691 CB TYR A 43 10.677 -3.067 -6.014 1.00 0.00 C ATOM 692 CG TYR A 43 11.965 -2.290 -6.196 1.00 0.00 C ATOM 693 CD1 TYR A 43 13.186 -2.973 -6.356 1.00 0.00 C ATOM 694 CD2 TYR A 43 11.947 -0.883 -6.152 1.00 0.00 C ATOM 695 CE1 TYR A 43 14.389 -2.251 -6.476 1.00 0.00 C ATOM 696 CE2 TYR A 43 13.147 -0.155 -6.273 1.00 0.00 C ATOM 697 CZ TYR A 43 14.375 -0.839 -6.437 1.00 0.00 C ATOM 698 OH TYR A 43 15.553 -0.159 -6.532 1.00 0.00 O ATOM 0 H TYR A 43 8.597 -4.470 -4.470 1.00 0.00 H new ATOM 0 HA TYR A 43 11.426 -3.814 -4.141 1.00 0.00 H new ATOM 0 HB2 TYR A 43 10.685 -3.935 -6.674 1.00 0.00 H new ATOM 0 HB3 TYR A 43 9.836 -2.444 -6.318 1.00 0.00 H new ATOM 0 HD1 TYR A 43 13.200 -4.052 -6.387 1.00 0.00 H new ATOM 0 HD2 TYR A 43 11.011 -0.360 -6.025 1.00 0.00 H new ATOM 0 HE1 TYR A 43 15.324 -2.778 -6.598 1.00 0.00 H new ATOM 0 HE2 TYR A 43 13.130 0.924 -6.241 1.00 0.00 H new ATOM 0 HH TYR A 43 15.379 0.805 -6.491 1.00 0.00 H new ATOM 708 N CYS A 44 10.761 -1.702 -2.968 1.00 0.00 N ATOM 709 CA CYS A 44 10.375 -0.620 -2.053 1.00 0.00 C ATOM 710 C CYS A 44 11.236 0.636 -2.268 1.00 0.00 C ATOM 711 O CYS A 44 12.419 0.492 -2.575 1.00 0.00 O ATOM 712 CB CYS A 44 10.482 -1.108 -0.591 1.00 0.00 C ATOM 713 SG CYS A 44 10.117 -2.870 -0.315 1.00 0.00 S ATOM 0 H CYS A 44 11.767 -1.868 -2.993 1.00 0.00 H new ATOM 0 HA CYS A 44 9.341 -0.347 -2.266 1.00 0.00 H new ATOM 0 HB2 CYS A 44 11.491 -0.905 -0.233 1.00 0.00 H new ATOM 0 HB3 CYS A 44 9.802 -0.515 0.021 1.00 0.00 H new ATOM 0 HG CYS A 44 10.245 -3.147 0.949 1.00 0.00 H new ATOM 719 N ASN A 45 10.694 1.843 -2.066 1.00 0.00 N ATOM 720 CA ASN A 45 11.519 3.069 -2.096 1.00 0.00 C ATOM 721 C ASN A 45 12.315 3.260 -0.775 1.00 0.00 C ATOM 722 O ASN A 45 12.281 2.414 0.116 1.00 0.00 O ATOM 723 CB ASN A 45 10.632 4.286 -2.457 1.00 0.00 C ATOM 724 CG ASN A 45 11.396 5.478 -3.050 1.00 0.00 C ATOM 725 OD1 ASN A 45 12.609 5.461 -3.211 1.00 0.00 O ATOM 726 ND2 ASN A 45 10.726 6.571 -3.362 1.00 0.00 N ATOM 0 H ASN A 45 9.703 2.002 -1.882 1.00 0.00 H new ATOM 0 HA ASN A 45 12.275 2.972 -2.875 1.00 0.00 H new ATOM 0 HB2 ASN A 45 9.872 3.967 -3.170 1.00 0.00 H new ATOM 0 HB3 ASN A 45 10.108 4.616 -1.560 1.00 0.00 H new ATOM 0 HD21 ASN A 45 11.220 7.384 -3.731 1.00 0.00 H new ATOM 0 HD22 ASN A 45 9.715 6.603 -3.234 1.00 0.00 H new ATOM 733 N ASP A 46 12.994 4.397 -0.612 1.00 0.00 N ATOM 734 CA ASP A 46 13.651 4.818 0.638 1.00 0.00 C ATOM 735 C ASP A 46 12.796 5.815 1.442 1.00 0.00 C ATOM 736 O ASP A 46 12.947 5.913 2.659 1.00 0.00 O ATOM 737 CB ASP A 46 15.011 5.448 0.301 1.00 0.00 C ATOM 738 CG ASP A 46 16.007 4.421 -0.263 1.00 0.00 C ATOM 739 OD1 ASP A 46 16.557 3.620 0.532 1.00 0.00 O ATOM 740 OD2 ASP A 46 16.259 4.434 -1.491 1.00 0.00 O ATOM 0 H ASP A 46 13.108 5.074 -1.366 1.00 0.00 H new ATOM 0 HA ASP A 46 13.784 3.935 1.262 1.00 0.00 H new ATOM 0 HB2 ASP A 46 14.868 6.249 -0.425 1.00 0.00 H new ATOM 0 HB3 ASP A 46 15.431 5.903 1.198 1.00 0.00 H new ATOM 745 N GLY A 47 11.867 6.526 0.785 1.00 0.00 N ATOM 746 CA GLY A 47 11.026 7.543 1.424 1.00 0.00 C ATOM 747 C GLY A 47 9.949 6.932 2.317 1.00 0.00 C ATOM 748 O GLY A 47 9.688 7.433 3.409 1.00 0.00 O ATOM 0 H GLY A 47 11.679 6.409 -0.211 1.00 0.00 H new ATOM 0 HA2 GLY A 47 11.653 8.207 2.019 1.00 0.00 H new ATOM 0 HA3 GLY A 47 10.553 8.154 0.655 1.00 0.00 H new ATOM 752 N PHE A 48 9.345 5.821 1.870 1.00 0.00 N ATOM 753 CA PHE A 48 8.281 5.128 2.611 1.00 0.00 C ATOM 754 C PHE A 48 8.803 4.519 3.933 1.00 0.00 C ATOM 755 O PHE A 48 8.084 4.532 4.929 1.00 0.00 O ATOM 756 CB PHE A 48 7.577 4.108 1.688 1.00 0.00 C ATOM 757 CG PHE A 48 8.065 2.693 1.817 1.00 0.00 C ATOM 758 CD1 PHE A 48 9.376 2.346 1.458 1.00 0.00 C ATOM 759 CD2 PHE A 48 7.224 1.745 2.414 1.00 0.00 C ATOM 760 CE1 PHE A 48 9.873 1.077 1.796 1.00 0.00 C ATOM 761 CE2 PHE A 48 7.710 0.473 2.715 1.00 0.00 C ATOM 762 CZ PHE A 48 9.043 0.138 2.431 1.00 0.00 C ATOM 0 H PHE A 48 9.581 5.377 0.983 1.00 0.00 H new ATOM 0 HA PHE A 48 7.527 5.853 2.918 1.00 0.00 H new ATOM 0 HB2 PHE A 48 6.508 4.128 1.898 1.00 0.00 H new ATOM 0 HB3 PHE A 48 7.705 4.428 0.654 1.00 0.00 H new ATOM 0 HD1 PHE A 48 9.998 3.050 0.926 1.00 0.00 H new ATOM 0 HD2 PHE A 48 6.199 1.999 2.641 1.00 0.00 H new ATOM 0 HE1 PHE A 48 10.897 0.822 1.567 1.00 0.00 H new ATOM 0 HE2 PHE A 48 7.057 -0.258 3.169 1.00 0.00 H new ATOM 0 HZ PHE A 48 9.428 -0.835 2.699 1.00 0.00 H new ATOM 772 N CYS A 49 10.075 4.081 3.970 1.00 0.00 N ATOM 773 CA CYS A 49 10.767 3.586 5.168 1.00 0.00 C ATOM 774 C CYS A 49 10.646 4.574 6.340 1.00 0.00 C ATOM 775 O CYS A 49 10.141 4.224 7.405 1.00 0.00 O ATOM 776 CB CYS A 49 12.250 3.320 4.833 1.00 0.00 C ATOM 777 SG CYS A 49 12.462 1.952 3.659 1.00 0.00 S ATOM 0 H CYS A 49 10.666 4.062 3.139 1.00 0.00 H new ATOM 0 HA CYS A 49 10.293 2.655 5.480 1.00 0.00 H new ATOM 0 HB2 CYS A 49 12.693 4.224 4.416 1.00 0.00 H new ATOM 0 HB3 CYS A 49 12.792 3.094 5.751 1.00 0.00 H new ATOM 0 HG CYS A 49 11.310 1.639 3.145 1.00 0.00 H new ATOM 783 N GLU A 50 11.058 5.825 6.114 1.00 0.00 N ATOM 784 CA GLU A 50 11.029 6.892 7.124 1.00 0.00 C ATOM 785 C GLU A 50 9.606 7.383 7.440 1.00 0.00 C ATOM 786 O GLU A 50 9.376 7.920 8.524 1.00 0.00 O ATOM 787 CB GLU A 50 11.899 8.074 6.667 1.00 0.00 C ATOM 788 CG GLU A 50 13.373 7.680 6.520 1.00 0.00 C ATOM 789 CD GLU A 50 14.254 8.919 6.307 1.00 0.00 C ATOM 790 OE1 GLU A 50 14.368 9.401 5.154 1.00 0.00 O ATOM 791 OE2 GLU A 50 14.847 9.423 7.291 1.00 0.00 O ATOM 0 H GLU A 50 11.426 6.131 5.213 1.00 0.00 H new ATOM 0 HA GLU A 50 11.429 6.465 8.043 1.00 0.00 H new ATOM 0 HB2 GLU A 50 11.528 8.450 5.714 1.00 0.00 H new ATOM 0 HB3 GLU A 50 11.811 8.888 7.387 1.00 0.00 H new ATOM 0 HG2 GLU A 50 13.701 7.145 7.411 1.00 0.00 H new ATOM 0 HG3 GLU A 50 13.489 6.998 5.678 1.00 0.00 H new ATOM 798 N LEU A 51 8.650 7.177 6.521 1.00 0.00 N ATOM 799 CA LEU A 51 7.238 7.555 6.671 1.00 0.00 C ATOM 800 C LEU A 51 6.593 6.808 7.851 1.00 0.00 C ATOM 801 O LEU A 51 6.035 7.442 8.743 1.00 0.00 O ATOM 802 CB LEU A 51 6.494 7.272 5.341 1.00 0.00 C ATOM 803 CG LEU A 51 5.397 8.264 4.896 1.00 0.00 C ATOM 804 CD1 LEU A 51 4.479 7.574 3.874 1.00 0.00 C ATOM 805 CD2 LEU A 51 4.531 8.841 6.017 1.00 0.00 C ATOM 0 H LEU A 51 8.845 6.729 5.626 1.00 0.00 H new ATOM 0 HA LEU A 51 7.167 8.620 6.893 1.00 0.00 H new ATOM 0 HB2 LEU A 51 7.239 7.220 4.547 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.040 6.284 5.417 1.00 0.00 H new ATOM 0 HG LEU A 51 5.935 9.112 4.473 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.702 8.269 3.556 1.00 0.00 H new ATOM 0 HD12 LEU A 51 5.066 7.264 3.009 1.00 0.00 H new ATOM 0 HD13 LEU A 51 4.018 6.699 4.332 1.00 0.00 H new ATOM 0 HD21 LEU A 51 3.795 9.524 5.593 1.00 0.00 H new ATOM 0 HD22 LEU A 51 4.018 8.030 6.534 1.00 0.00 H new ATOM 0 HD23 LEU A 51 5.162 9.380 6.723 1.00 0.00 H new ATOM 817 N CYS A 52 6.704 5.473 7.886 1.00 0.00 N ATOM 818 CA CYS A 52 6.119 4.632 8.949 1.00 0.00 C ATOM 819 C CYS A 52 7.121 4.216 10.047 1.00 0.00 C ATOM 820 O CYS A 52 6.703 3.870 11.153 1.00 0.00 O ATOM 821 CB CYS A 52 5.450 3.412 8.297 1.00 0.00 C ATOM 822 SG CYS A 52 4.075 3.968 7.246 1.00 0.00 S ATOM 0 H CYS A 52 7.204 4.939 7.175 1.00 0.00 H new ATOM 0 HA CYS A 52 5.377 5.232 9.476 1.00 0.00 H new ATOM 0 HB2 CYS A 52 6.177 2.860 7.702 1.00 0.00 H new ATOM 0 HB3 CYS A 52 5.083 2.731 9.065 1.00 0.00 H new ATOM 0 HG CYS A 52 3.645 2.971 6.531 1.00 0.00 H new ATOM 828 N GLY A 53 8.429 4.245 9.769 1.00 0.00 N ATOM 829 CA GLY A 53 9.502 3.897 10.715 1.00 0.00 C ATOM 830 C GLY A 53 10.028 2.464 10.575 1.00 0.00 C ATOM 831 O GLY A 53 10.899 2.066 11.348 1.00 0.00 O ATOM 0 H GLY A 53 8.784 4.519 8.853 1.00 0.00 H new ATOM 0 HA2 GLY A 53 10.331 4.591 10.577 1.00 0.00 H new ATOM 0 HA3 GLY A 53 9.134 4.039 11.731 1.00 0.00 H new ATOM 835 N TYR A 54 9.519 1.691 9.608 1.00 0.00 N ATOM 836 CA TYR A 54 10.045 0.375 9.230 1.00 0.00 C ATOM 837 C TYR A 54 11.200 0.482 8.197 1.00 0.00 C ATOM 838 O TYR A 54 11.902 1.493 8.132 1.00 0.00 O ATOM 839 CB TYR A 54 8.861 -0.521 8.809 1.00 0.00 C ATOM 840 CG TYR A 54 7.874 -0.030 7.757 1.00 0.00 C ATOM 841 CD1 TYR A 54 8.219 0.934 6.789 1.00 0.00 C ATOM 842 CD2 TYR A 54 6.575 -0.576 7.750 1.00 0.00 C ATOM 843 CE1 TYR A 54 7.273 1.357 5.841 1.00 0.00 C ATOM 844 CE2 TYR A 54 5.625 -0.163 6.796 1.00 0.00 C ATOM 845 CZ TYR A 54 5.970 0.812 5.837 1.00 0.00 C ATOM 846 OH TYR A 54 5.060 1.220 4.911 1.00 0.00 O ATOM 0 H TYR A 54 8.710 1.971 9.053 1.00 0.00 H new ATOM 0 HA TYR A 54 10.524 -0.108 10.082 1.00 0.00 H new ATOM 0 HB2 TYR A 54 9.278 -1.462 8.449 1.00 0.00 H new ATOM 0 HB3 TYR A 54 8.290 -0.749 9.709 1.00 0.00 H new ATOM 0 HD1 TYR A 54 9.216 1.350 6.776 1.00 0.00 H new ATOM 0 HD2 TYR A 54 6.305 -1.320 8.485 1.00 0.00 H new ATOM 0 HE1 TYR A 54 7.544 2.104 5.110 1.00 0.00 H new ATOM 0 HE2 TYR A 54 4.634 -0.592 6.799 1.00 0.00 H new ATOM 0 HH TYR A 54 5.444 1.131 4.014 1.00 0.00 H new ATOM 856 N SER A 55 11.402 -0.537 7.360 1.00 0.00 N ATOM 857 CA SER A 55 12.454 -0.580 6.330 1.00 0.00 C ATOM 858 C SER A 55 12.109 -1.558 5.199 1.00 0.00 C ATOM 859 O SER A 55 11.224 -2.408 5.364 1.00 0.00 O ATOM 860 CB SER A 55 13.788 -0.996 6.970 1.00 0.00 C ATOM 861 OG SER A 55 13.756 -2.363 7.369 1.00 0.00 O ATOM 0 H SER A 55 10.827 -1.379 7.376 1.00 0.00 H new ATOM 0 HA SER A 55 12.535 0.418 5.900 1.00 0.00 H new ATOM 0 HB2 SER A 55 14.601 -0.839 6.261 1.00 0.00 H new ATOM 0 HB3 SER A 55 13.993 -0.365 7.835 1.00 0.00 H new ATOM 0 HG SER A 55 14.616 -2.606 7.772 1.00 0.00 H new ATOM 867 N ARG A 56 12.867 -1.526 4.089 1.00 0.00 N ATOM 868 CA ARG A 56 12.799 -2.565 3.046 1.00 0.00 C ATOM 869 C ARG A 56 12.963 -3.958 3.665 1.00 0.00 C ATOM 870 O ARG A 56 12.100 -4.800 3.470 1.00 0.00 O ATOM 871 CB ARG A 56 13.832 -2.306 1.925 1.00 0.00 C ATOM 872 CG ARG A 56 13.817 -3.434 0.867 1.00 0.00 C ATOM 873 CD ARG A 56 14.838 -3.263 -0.262 1.00 0.00 C ATOM 874 NE ARG A 56 14.443 -2.239 -1.249 1.00 0.00 N ATOM 875 CZ ARG A 56 15.233 -1.793 -2.228 1.00 0.00 C ATOM 876 NH1 ARG A 56 16.432 -2.296 -2.440 1.00 0.00 N ATOM 877 NH2 ARG A 56 14.838 -0.827 -3.025 1.00 0.00 N ATOM 0 H ARG A 56 13.539 -0.785 3.890 1.00 0.00 H new ATOM 0 HA ARG A 56 11.814 -2.522 2.582 1.00 0.00 H new ATOM 0 HB2 ARG A 56 13.617 -1.352 1.444 1.00 0.00 H new ATOM 0 HB3 ARG A 56 14.829 -2.226 2.359 1.00 0.00 H new ATOM 0 HG2 ARG A 56 14.003 -4.385 1.366 1.00 0.00 H new ATOM 0 HG3 ARG A 56 12.820 -3.492 0.431 1.00 0.00 H new ATOM 0 HD2 ARG A 56 15.803 -2.993 0.167 1.00 0.00 H new ATOM 0 HD3 ARG A 56 14.971 -4.218 -0.771 1.00 0.00 H new ATOM 0 HE ARG A 56 13.504 -1.846 -1.178 1.00 0.00 H new ATOM 0 HH11 ARG A 56 16.781 -3.049 -1.847 1.00 0.00 H new ATOM 0 HH12 ARG A 56 17.011 -1.933 -3.197 1.00 0.00 H new ATOM 0 HH21 ARG A 56 13.917 -0.407 -2.900 1.00 0.00 H new ATOM 0 HH22 ARG A 56 15.452 -0.496 -3.769 1.00 0.00 H new ATOM 891 N ALA A 57 14.003 -4.200 4.471 1.00 0.00 N ATOM 892 CA ALA A 57 14.252 -5.502 5.110 1.00 0.00 C ATOM 893 C ALA A 57 13.049 -6.029 5.926 1.00 0.00 C ATOM 894 O ALA A 57 12.819 -7.239 5.964 1.00 0.00 O ATOM 895 CB ALA A 57 15.508 -5.373 5.981 1.00 0.00 C ATOM 0 H ALA A 57 14.702 -3.494 4.701 1.00 0.00 H new ATOM 0 HA ALA A 57 14.404 -6.245 4.327 1.00 0.00 H new ATOM 0 HB1 ALA A 57 15.714 -6.327 6.466 1.00 0.00 H new ATOM 0 HB2 ALA A 57 16.356 -5.093 5.357 1.00 0.00 H new ATOM 0 HB3 ALA A 57 15.347 -4.607 6.740 1.00 0.00 H new ATOM 901 N GLU A 58 12.261 -5.130 6.529 1.00 0.00 N ATOM 902 CA GLU A 58 11.053 -5.476 7.292 1.00 0.00 C ATOM 903 C GLU A 58 9.796 -5.595 6.418 1.00 0.00 C ATOM 904 O GLU A 58 8.982 -6.484 6.658 1.00 0.00 O ATOM 905 CB GLU A 58 10.810 -4.416 8.375 1.00 0.00 C ATOM 906 CG GLU A 58 11.929 -4.415 9.416 1.00 0.00 C ATOM 907 CD GLU A 58 11.880 -5.651 10.329 1.00 0.00 C ATOM 908 OE1 GLU A 58 10.921 -5.783 11.126 1.00 0.00 O ATOM 909 OE2 GLU A 58 12.804 -6.497 10.265 1.00 0.00 O ATOM 0 H GLU A 58 12.446 -4.127 6.501 1.00 0.00 H new ATOM 0 HA GLU A 58 11.232 -6.456 7.734 1.00 0.00 H new ATOM 0 HB2 GLU A 58 10.740 -3.431 7.913 1.00 0.00 H new ATOM 0 HB3 GLU A 58 9.855 -4.607 8.865 1.00 0.00 H new ATOM 0 HG2 GLU A 58 12.893 -4.379 8.909 1.00 0.00 H new ATOM 0 HG3 GLU A 58 11.855 -3.514 10.025 1.00 0.00 H new ATOM 916 N VAL A 59 9.624 -4.716 5.423 1.00 0.00 N ATOM 917 CA VAL A 59 8.465 -4.702 4.503 1.00 0.00 C ATOM 918 C VAL A 59 8.618 -5.751 3.377 1.00 0.00 C ATOM 919 O VAL A 59 7.646 -6.097 2.706 1.00 0.00 O ATOM 920 CB VAL A 59 8.207 -3.259 3.977 1.00 0.00 C ATOM 921 CG1 VAL A 59 7.095 -3.219 2.910 1.00 0.00 C ATOM 922 CG2 VAL A 59 7.808 -2.378 5.174 1.00 0.00 C ATOM 0 H VAL A 59 10.298 -3.976 5.225 1.00 0.00 H new ATOM 0 HA VAL A 59 7.574 -4.999 5.056 1.00 0.00 H new ATOM 0 HB VAL A 59 9.118 -2.892 3.504 1.00 0.00 H new ATOM 0 HG11 VAL A 59 6.951 -2.192 2.573 1.00 0.00 H new ATOM 0 HG12 VAL A 59 7.381 -3.842 2.063 1.00 0.00 H new ATOM 0 HG13 VAL A 59 6.166 -3.594 3.339 1.00 0.00 H new ATOM 0 HG21 VAL A 59 7.622 -1.360 4.831 1.00 0.00 H new ATOM 0 HG22 VAL A 59 6.904 -2.777 5.634 1.00 0.00 H new ATOM 0 HG23 VAL A 59 8.615 -2.372 5.906 1.00 0.00 H new ATOM 932 N MET A 60 9.808 -6.330 3.196 1.00 0.00 N ATOM 933 CA MET A 60 10.018 -7.438 2.248 1.00 0.00 C ATOM 934 C MET A 60 9.264 -8.702 2.692 1.00 0.00 C ATOM 935 O MET A 60 9.238 -9.035 3.877 1.00 0.00 O ATOM 936 CB MET A 60 11.518 -7.707 2.041 1.00 0.00 C ATOM 937 CG MET A 60 12.108 -6.733 1.009 1.00 0.00 C ATOM 938 SD MET A 60 11.603 -6.989 -0.716 1.00 0.00 S ATOM 939 CE MET A 60 12.505 -8.515 -1.088 1.00 0.00 C ATOM 0 H MET A 60 10.651 -6.049 3.697 1.00 0.00 H new ATOM 0 HA MET A 60 9.604 -7.142 1.284 1.00 0.00 H new ATOM 0 HB2 MET A 60 12.045 -7.603 2.989 1.00 0.00 H new ATOM 0 HB3 MET A 60 11.665 -8.733 1.705 1.00 0.00 H new ATOM 0 HG2 MET A 60 11.834 -5.719 1.299 1.00 0.00 H new ATOM 0 HG3 MET A 60 13.195 -6.796 1.061 1.00 0.00 H new ATOM 0 HE1 MET A 60 12.421 -8.737 -2.152 1.00 0.00 H new ATOM 0 HE2 MET A 60 13.556 -8.390 -0.826 1.00 0.00 H new ATOM 0 HE3 MET A 60 12.082 -9.337 -0.511 1.00 0.00 H new ATOM 949 N GLN A 61 8.623 -9.372 1.723 1.00 0.00 N ATOM 950 CA GLN A 61 7.768 -10.569 1.882 1.00 0.00 C ATOM 951 C GLN A 61 6.360 -10.253 2.447 1.00 0.00 C ATOM 952 O GLN A 61 5.567 -11.165 2.687 1.00 0.00 O ATOM 953 CB GLN A 61 8.499 -11.665 2.700 1.00 0.00 C ATOM 954 CG GLN A 61 8.090 -13.120 2.392 1.00 0.00 C ATOM 955 CD GLN A 61 8.802 -13.692 1.164 1.00 0.00 C ATOM 956 OE1 GLN A 61 9.941 -14.137 1.229 1.00 0.00 O ATOM 957 NE2 GLN A 61 8.172 -13.712 0.007 1.00 0.00 N ATOM 0 H GLN A 61 8.688 -9.080 0.748 1.00 0.00 H new ATOM 0 HA GLN A 61 7.588 -10.960 0.880 1.00 0.00 H new ATOM 0 HB2 GLN A 61 9.571 -11.565 2.528 1.00 0.00 H new ATOM 0 HB3 GLN A 61 8.327 -11.476 3.760 1.00 0.00 H new ATOM 0 HG2 GLN A 61 8.311 -13.745 3.257 1.00 0.00 H new ATOM 0 HG3 GLN A 61 7.012 -13.163 2.234 1.00 0.00 H new ATOM 0 HE21 GLN A 61 7.223 -13.345 -0.063 1.00 0.00 H new ATOM 0 HE22 GLN A 61 8.633 -14.094 -0.818 1.00 0.00 H new ATOM 966 N ARG A 62 6.026 -8.971 2.637 1.00 0.00 N ATOM 967 CA ARG A 62 4.729 -8.522 3.180 1.00 0.00 C ATOM 968 C ARG A 62 3.704 -8.231 2.079 1.00 0.00 C ATOM 969 O ARG A 62 4.113 -7.888 0.961 1.00 0.00 O ATOM 970 CB ARG A 62 4.878 -7.266 4.055 1.00 0.00 C ATOM 971 CG ARG A 62 5.677 -7.550 5.328 1.00 0.00 C ATOM 972 CD ARG A 62 5.289 -6.534 6.403 1.00 0.00 C ATOM 973 NE ARG A 62 6.289 -6.500 7.479 1.00 0.00 N ATOM 974 CZ ARG A 62 6.105 -6.205 8.758 1.00 0.00 C ATOM 975 NH1 ARG A 62 4.936 -5.825 9.234 1.00 0.00 N ATOM 976 NH2 ARG A 62 7.124 -6.290 9.583 1.00 0.00 N ATOM 0 H ARG A 62 6.657 -8.200 2.416 1.00 0.00 H new ATOM 0 HA ARG A 62 4.368 -9.350 3.790 1.00 0.00 H new ATOM 0 HB2 ARG A 62 5.373 -6.481 3.483 1.00 0.00 H new ATOM 0 HB3 ARG A 62 3.890 -6.890 4.322 1.00 0.00 H new ATOM 0 HG2 ARG A 62 5.477 -8.563 5.679 1.00 0.00 H new ATOM 0 HG3 ARG A 62 6.746 -7.489 5.122 1.00 0.00 H new ATOM 0 HD2 ARG A 62 5.196 -5.544 5.956 1.00 0.00 H new ATOM 0 HD3 ARG A 62 4.313 -6.790 6.816 1.00 0.00 H new ATOM 0 HE ARG A 62 7.244 -6.733 7.208 1.00 0.00 H new ATOM 0 HH11 ARG A 62 4.132 -5.749 8.611 1.00 0.00 H new ATOM 0 HH12 ARG A 62 4.836 -5.607 10.225 1.00 0.00 H new ATOM 0 HH21 ARG A 62 8.038 -6.579 9.236 1.00 0.00 H new ATOM 0 HH22 ARG A 62 7.001 -6.067 10.571 1.00 0.00 H new ATOM 990 N PRO A 63 2.393 -8.292 2.394 1.00 0.00 N ATOM 991 CA PRO A 63 1.325 -7.851 1.503 1.00 0.00 C ATOM 992 C PRO A 63 1.371 -6.329 1.318 1.00 0.00 C ATOM 993 O PRO A 63 1.513 -5.572 2.278 1.00 0.00 O ATOM 994 CB PRO A 63 0.023 -8.311 2.168 1.00 0.00 C ATOM 995 CG PRO A 63 0.370 -8.329 3.656 1.00 0.00 C ATOM 996 CD PRO A 63 1.829 -8.769 3.656 1.00 0.00 C ATOM 0 HA PRO A 63 1.420 -8.273 0.503 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -0.799 -7.628 1.956 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -0.282 -9.296 1.815 1.00 0.00 H new ATOM 0 HG2 PRO A 63 0.243 -7.348 4.113 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -0.262 -9.023 4.211 1.00 0.00 H new ATOM 0 HD2 PRO A 63 2.364 -8.347 4.507 1.00 0.00 H new ATOM 0 HD3 PRO A 63 1.910 -9.853 3.735 1.00 0.00 H new ATOM 1004 N CYS A 64 1.234 -5.882 0.067 1.00 0.00 N ATOM 1005 CA CYS A 64 1.380 -4.476 -0.333 1.00 0.00 C ATOM 1006 C CYS A 64 0.284 -3.544 0.224 1.00 0.00 C ATOM 1007 O CYS A 64 0.484 -2.330 0.312 1.00 0.00 O ATOM 1008 CB CYS A 64 1.422 -4.476 -1.863 1.00 0.00 C ATOM 1009 SG CYS A 64 2.220 -2.978 -2.483 1.00 0.00 S ATOM 0 H CYS A 64 1.014 -6.499 -0.715 1.00 0.00 H new ATOM 0 HA CYS A 64 2.294 -4.064 0.095 1.00 0.00 H new ATOM 0 HB2 CYS A 64 1.962 -5.354 -2.216 1.00 0.00 H new ATOM 0 HB3 CYS A 64 0.409 -4.544 -2.259 1.00 0.00 H new ATOM 0 HG CYS A 64 2.244 -3.005 -3.782 1.00 0.00 H new ATOM 1015 N THR A 65 -0.849 -4.116 0.658 1.00 0.00 N ATOM 1016 CA THR A 65 -1.941 -3.418 1.359 1.00 0.00 C ATOM 1017 C THR A 65 -1.461 -2.701 2.619 1.00 0.00 C ATOM 1018 O THR A 65 -2.050 -1.685 2.988 1.00 0.00 O ATOM 1019 CB THR A 65 -3.045 -4.405 1.757 1.00 0.00 C ATOM 1020 OG1 THR A 65 -2.452 -5.460 2.486 1.00 0.00 O ATOM 1021 CG2 THR A 65 -3.767 -4.996 0.546 1.00 0.00 C ATOM 0 H THR A 65 -1.038 -5.110 0.527 1.00 0.00 H new ATOM 0 HA THR A 65 -2.326 -2.675 0.661 1.00 0.00 H new ATOM 0 HB THR A 65 -3.783 -3.864 2.349 1.00 0.00 H new ATOM 0 HG1 THR A 65 -3.143 -6.102 2.752 1.00 0.00 H new ATOM 0 HG21 THR A 65 -4.538 -5.688 0.884 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.227 -4.194 -0.031 1.00 0.00 H new ATOM 0 HG23 THR A 65 -3.051 -5.529 -0.080 1.00 0.00 H new ATOM 1029 N CYS A 66 -0.413 -3.231 3.271 1.00 0.00 N ATOM 1030 CA CYS A 66 0.147 -2.723 4.529 1.00 0.00 C ATOM 1031 C CYS A 66 -0.921 -2.594 5.638 1.00 0.00 C ATOM 1032 O CYS A 66 -0.887 -1.669 6.450 1.00 0.00 O ATOM 1033 CB CYS A 66 0.955 -1.440 4.264 1.00 0.00 C ATOM 1034 SG CYS A 66 2.328 -1.786 3.124 1.00 0.00 S ATOM 0 H CYS A 66 0.082 -4.052 2.923 1.00 0.00 H new ATOM 0 HA CYS A 66 0.849 -3.455 4.928 1.00 0.00 H new ATOM 0 HB2 CYS A 66 0.306 -0.674 3.841 1.00 0.00 H new ATOM 0 HB3 CYS A 66 1.343 -1.046 5.203 1.00 0.00 H new ATOM 0 HG CYS A 66 1.856 -2.036 1.939 1.00 0.00 H new ATOM 1040 N ASP A 67 -1.867 -3.540 5.680 1.00 0.00 N ATOM 1041 CA ASP A 67 -3.005 -3.549 6.610 1.00 0.00 C ATOM 1042 C ASP A 67 -2.561 -3.506 8.083 1.00 0.00 C ATOM 1043 O ASP A 67 -3.228 -2.898 8.920 1.00 0.00 O ATOM 1044 CB ASP A 67 -3.847 -4.801 6.328 1.00 0.00 C ATOM 1045 CG ASP A 67 -5.076 -4.895 7.246 1.00 0.00 C ATOM 1046 OD1 ASP A 67 -6.040 -4.120 7.041 1.00 0.00 O ATOM 1047 OD2 ASP A 67 -5.086 -5.766 8.150 1.00 0.00 O ATOM 0 H ASP A 67 -1.863 -4.343 5.051 1.00 0.00 H new ATOM 0 HA ASP A 67 -3.597 -2.649 6.448 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -4.173 -4.791 5.288 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -3.229 -5.689 6.459 1.00 0.00 H new ATOM 1052 N PHE A 68 -1.388 -4.078 8.381 1.00 0.00 N ATOM 1053 CA PHE A 68 -0.759 -4.059 9.701 1.00 0.00 C ATOM 1054 C PHE A 68 -0.476 -2.640 10.248 1.00 0.00 C ATOM 1055 O PHE A 68 -0.247 -2.493 11.451 1.00 0.00 O ATOM 1056 CB PHE A 68 0.521 -4.912 9.645 1.00 0.00 C ATOM 1057 CG PHE A 68 1.580 -4.410 8.678 1.00 0.00 C ATOM 1058 CD1 PHE A 68 2.466 -3.392 9.077 1.00 0.00 C ATOM 1059 CD2 PHE A 68 1.676 -4.950 7.381 1.00 0.00 C ATOM 1060 CE1 PHE A 68 3.431 -2.907 8.180 1.00 0.00 C ATOM 1061 CE2 PHE A 68 2.643 -4.462 6.484 1.00 0.00 C ATOM 1062 CZ PHE A 68 3.517 -3.435 6.880 1.00 0.00 C ATOM 0 H PHE A 68 -0.836 -4.581 7.687 1.00 0.00 H new ATOM 0 HA PHE A 68 -1.468 -4.484 10.411 1.00 0.00 H new ATOM 0 HB2 PHE A 68 0.954 -4.958 10.644 1.00 0.00 H new ATOM 0 HB3 PHE A 68 0.250 -5.931 9.368 1.00 0.00 H new ATOM 0 HD1 PHE A 68 2.404 -2.983 10.075 1.00 0.00 H new ATOM 0 HD2 PHE A 68 1.006 -5.740 7.075 1.00 0.00 H new ATOM 0 HE1 PHE A 68 4.109 -2.126 8.490 1.00 0.00 H new ATOM 0 HE2 PHE A 68 2.714 -4.877 5.489 1.00 0.00 H new ATOM 0 HZ PHE A 68 4.252 -3.053 6.188 1.00 0.00 H new ATOM 1072 N LEU A 69 -0.518 -1.596 9.404 1.00 0.00 N ATOM 1073 CA LEU A 69 -0.435 -0.187 9.815 1.00 0.00 C ATOM 1074 C LEU A 69 -1.731 0.349 10.455 1.00 0.00 C ATOM 1075 O LEU A 69 -1.728 1.482 10.937 1.00 0.00 O ATOM 1076 CB LEU A 69 -0.028 0.690 8.611 1.00 0.00 C ATOM 1077 CG LEU A 69 1.357 0.377 8.009 1.00 0.00 C ATOM 1078 CD1 LEU A 69 1.567 1.254 6.769 1.00 0.00 C ATOM 1079 CD2 LEU A 69 2.493 0.633 9.012 1.00 0.00 C ATOM 0 H LEU A 69 -0.613 -1.712 8.395 1.00 0.00 H new ATOM 0 HA LEU A 69 0.328 -0.135 10.591 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.780 0.578 7.830 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -0.044 1.735 8.921 1.00 0.00 H new ATOM 0 HG LEU A 69 1.382 -0.680 7.746 1.00 0.00 H new ATOM 0 HD11 LEU A 69 2.544 1.042 6.334 1.00 0.00 H new ATOM 0 HD12 LEU A 69 0.789 1.040 6.036 1.00 0.00 H new ATOM 0 HD13 LEU A 69 1.518 2.305 7.054 1.00 0.00 H new ATOM 0 HD21 LEU A 69 3.450 0.399 8.545 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.483 1.680 9.314 1.00 0.00 H new ATOM 0 HD23 LEU A 69 2.353 0.001 9.889 1.00 0.00 H new ATOM 1091 N HIS A 70 -2.830 -0.413 10.478 1.00 0.00 N ATOM 1092 CA HIS A 70 -4.041 -0.012 11.192 1.00 0.00 C ATOM 1093 C HIS A 70 -3.832 0.049 12.725 1.00 0.00 C ATOM 1094 O HIS A 70 -3.093 -0.749 13.314 1.00 0.00 O ATOM 1095 CB HIS A 70 -5.239 -0.907 10.798 1.00 0.00 C ATOM 1096 CG HIS A 70 -5.542 -2.077 11.709 1.00 0.00 C ATOM 1097 ND1 HIS A 70 -6.231 -2.011 12.903 1.00 0.00 N ATOM 1098 CD2 HIS A 70 -5.282 -3.402 11.471 1.00 0.00 C ATOM 1099 CE1 HIS A 70 -6.357 -3.262 13.381 1.00 0.00 C ATOM 1100 NE2 HIS A 70 -5.795 -4.151 12.541 1.00 0.00 N ATOM 0 H HIS A 70 -2.903 -1.315 10.007 1.00 0.00 H new ATOM 0 HA HIS A 70 -4.277 1.006 10.883 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -6.129 -0.280 10.743 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -5.059 -1.294 9.795 1.00 0.00 H new ATOM 0 HD1 HIS A 70 -6.583 -1.162 13.346 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -4.770 -3.801 10.608 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -6.842 -3.518 14.311 1.00 0.00 H new ATOM 1108 N GLY A 71 -4.549 0.973 13.373 1.00 0.00 N ATOM 1109 CA GLY A 71 -4.754 1.035 14.825 1.00 0.00 C ATOM 1110 C GLY A 71 -6.251 1.088 15.170 1.00 0.00 C ATOM 1111 O GLY A 71 -7.061 0.627 14.359 1.00 0.00 O ATOM 0 H GLY A 71 -5.022 1.730 12.880 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -4.299 0.164 15.297 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -4.253 1.915 15.229 1.00 0.00 H new ATOM 1115 N PRO A 72 -6.638 1.636 16.340 1.00 0.00 N ATOM 1116 CA PRO A 72 -8.041 1.748 16.746 1.00 0.00 C ATOM 1117 C PRO A 72 -8.829 2.812 15.962 1.00 0.00 C ATOM 1118 O PRO A 72 -10.043 2.666 15.822 1.00 0.00 O ATOM 1119 CB PRO A 72 -8.001 2.071 18.245 1.00 0.00 C ATOM 1120 CG PRO A 72 -6.663 2.783 18.429 1.00 0.00 C ATOM 1121 CD PRO A 72 -5.762 2.067 17.424 1.00 0.00 C ATOM 0 HA PRO A 72 -8.571 0.820 16.532 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -8.836 2.707 18.540 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -8.059 1.167 18.851 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -6.739 3.849 18.217 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -6.290 2.687 19.448 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -4.982 2.733 17.055 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -5.262 1.215 17.885 1.00 0.00 H new ATOM 1129 N ARG A 73 -8.174 3.863 15.437 1.00 0.00 N ATOM 1130 CA ARG A 73 -8.845 4.965 14.724 1.00 0.00 C ATOM 1131 C ARG A 73 -9.031 4.687 13.218 1.00 0.00 C ATOM 1132 O ARG A 73 -9.812 5.375 12.555 1.00 0.00 O ATOM 1133 CB ARG A 73 -8.051 6.261 14.984 1.00 0.00 C ATOM 1134 CG ARG A 73 -8.854 7.545 14.713 1.00 0.00 C ATOM 1135 CD ARG A 73 -8.091 8.812 15.129 1.00 0.00 C ATOM 1136 NE ARG A 73 -7.823 8.864 16.581 1.00 0.00 N ATOM 1137 CZ ARG A 73 -8.674 9.202 17.547 1.00 0.00 C ATOM 1138 NH1 ARG A 73 -9.920 9.552 17.300 1.00 0.00 N ATOM 1139 NH2 ARG A 73 -8.272 9.189 18.800 1.00 0.00 N ATOM 0 H ARG A 73 -7.162 3.972 15.495 1.00 0.00 H new ATOM 0 HA ARG A 73 -9.859 5.069 15.111 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -7.712 6.267 16.020 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -7.159 6.262 14.357 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -9.096 7.602 13.652 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -9.800 7.500 15.253 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -7.146 8.857 14.587 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -8.667 9.690 14.838 1.00 0.00 H new ATOM 0 HE ARG A 73 -6.880 8.613 16.876 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -10.264 9.571 16.340 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -10.541 9.804 18.069 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -7.314 8.921 19.025 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -8.918 9.447 19.546 1.00 0.00 H new ATOM 1153 N THR A 74 -8.322 3.688 12.666 1.00 0.00 N ATOM 1154 CA THR A 74 -8.325 3.330 11.236 1.00 0.00 C ATOM 1155 C THR A 74 -9.704 2.828 10.801 1.00 0.00 C ATOM 1156 O THR A 74 -10.313 2.016 11.498 1.00 0.00 O ATOM 1157 CB THR A 74 -7.247 2.276 10.959 1.00 0.00 C ATOM 1158 OG1 THR A 74 -6.036 2.708 11.527 1.00 0.00 O ATOM 1159 CG2 THR A 74 -7.021 2.086 9.464 1.00 0.00 C ATOM 0 H THR A 74 -7.711 3.088 13.220 1.00 0.00 H new ATOM 0 HA THR A 74 -8.099 4.223 10.653 1.00 0.00 H new ATOM 0 HB THR A 74 -7.580 1.331 11.389 1.00 0.00 H new ATOM 0 HG1 THR A 74 -5.522 3.209 10.860 1.00 0.00 H new ATOM 0 HG21 THR A 74 -6.250 1.332 9.306 1.00 0.00 H new ATOM 0 HG22 THR A 74 -7.949 1.761 8.994 1.00 0.00 H new ATOM 0 HG23 THR A 74 -6.702 3.030 9.022 1.00 0.00 H new ATOM 1167 N GLN A 75 -10.198 3.304 9.652 1.00 0.00 N ATOM 1168 CA GLN A 75 -11.540 2.965 9.161 1.00 0.00 C ATOM 1169 C GLN A 75 -11.569 1.681 8.326 1.00 0.00 C ATOM 1170 O GLN A 75 -10.883 1.578 7.308 1.00 0.00 O ATOM 1171 CB GLN A 75 -12.225 4.144 8.465 1.00 0.00 C ATOM 1172 CG GLN A 75 -11.567 4.676 7.224 1.00 0.00 C ATOM 1173 CD GLN A 75 -12.112 6.045 6.801 1.00 0.00 C ATOM 1174 OE1 GLN A 75 -12.832 6.182 5.821 1.00 0.00 O ATOM 1175 NE2 GLN A 75 -11.813 7.099 7.536 1.00 0.00 N ATOM 0 H GLN A 75 -9.681 3.933 9.038 1.00 0.00 H new ATOM 0 HA GLN A 75 -12.136 2.748 10.047 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -13.241 3.843 8.208 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -12.307 4.961 9.182 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -10.493 4.754 7.393 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -11.710 3.966 6.410 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -11.214 6.996 8.355 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -12.181 8.017 7.285 1.00 0.00 H new ATOM 1184 N ARG A 76 -12.429 0.730 8.710 1.00 0.00 N ATOM 1185 CA ARG A 76 -12.563 -0.580 8.051 1.00 0.00 C ATOM 1186 C ARG A 76 -12.970 -0.455 6.573 1.00 0.00 C ATOM 1187 O ARG A 76 -12.461 -1.194 5.732 1.00 0.00 O ATOM 1188 CB ARG A 76 -13.564 -1.433 8.856 1.00 0.00 C ATOM 1189 CG ARG A 76 -13.544 -2.937 8.521 1.00 0.00 C ATOM 1190 CD ARG A 76 -12.213 -3.648 8.827 1.00 0.00 C ATOM 1191 NE ARG A 76 -11.777 -3.457 10.226 1.00 0.00 N ATOM 1192 CZ ARG A 76 -12.237 -4.080 11.307 1.00 0.00 C ATOM 1193 NH1 ARG A 76 -13.176 -5.004 11.243 1.00 0.00 N ATOM 1194 NH2 ARG A 76 -11.751 -3.776 12.491 1.00 0.00 N ATOM 0 H ARG A 76 -13.063 0.849 9.500 1.00 0.00 H new ATOM 0 HA ARG A 76 -11.591 -1.073 8.041 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -13.354 -1.309 9.918 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -14.569 -1.049 8.682 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -14.340 -3.430 9.079 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -13.772 -3.062 7.463 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -12.320 -4.714 8.626 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -11.441 -3.272 8.155 1.00 0.00 H new ATOM 0 HE ARG A 76 -11.040 -2.769 10.380 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -13.576 -5.263 10.341 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -13.502 -5.459 12.095 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -11.025 -3.065 12.577 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -12.101 -4.251 13.323 1.00 0.00 H new ATOM 1208 N ARG A 77 -13.806 0.537 6.233 1.00 0.00 N ATOM 1209 CA ARG A 77 -14.197 0.859 4.846 1.00 0.00 C ATOM 1210 C ARG A 77 -12.980 1.232 3.984 1.00 0.00 C ATOM 1211 O ARG A 77 -12.800 0.691 2.899 1.00 0.00 O ATOM 1212 CB ARG A 77 -15.259 1.981 4.871 1.00 0.00 C ATOM 1213 CG ARG A 77 -15.931 2.261 3.511 1.00 0.00 C ATOM 1214 CD ARG A 77 -16.824 1.119 2.999 1.00 0.00 C ATOM 1215 NE ARG A 77 -17.988 0.900 3.881 1.00 0.00 N ATOM 1216 CZ ARG A 77 -18.818 -0.138 3.860 1.00 0.00 C ATOM 1217 NH1 ARG A 77 -18.684 -1.128 3.001 1.00 0.00 N ATOM 1218 NH2 ARG A 77 -19.813 -0.193 4.719 1.00 0.00 N ATOM 0 H ARG A 77 -14.239 1.151 6.923 1.00 0.00 H new ATOM 0 HA ARG A 77 -14.632 -0.026 4.381 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -16.030 1.717 5.595 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -14.790 2.899 5.225 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -16.532 3.166 3.596 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -15.156 2.461 2.771 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -17.169 1.350 1.991 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -16.239 0.201 2.933 1.00 0.00 H new ATOM 0 HE ARG A 77 -18.174 1.620 4.579 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -17.923 -1.114 2.322 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -19.341 -1.908 3.015 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -19.944 0.558 5.396 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -20.453 -0.987 4.708 1.00 0.00 H new ATOM 1232 N ALA A 78 -12.088 2.091 4.481 1.00 0.00 N ATOM 1233 CA ALA A 78 -10.846 2.462 3.788 1.00 0.00 C ATOM 1234 C ALA A 78 -9.847 1.299 3.738 1.00 0.00 C ATOM 1235 O ALA A 78 -9.284 1.015 2.681 1.00 0.00 O ATOM 1236 CB ALA A 78 -10.249 3.682 4.492 1.00 0.00 C ATOM 0 H ALA A 78 -12.205 2.554 5.382 1.00 0.00 H new ATOM 0 HA ALA A 78 -11.073 2.708 2.751 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -9.325 3.974 3.993 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -10.959 4.508 4.454 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -10.037 3.434 5.532 1.00 0.00 H new ATOM 1242 N ALA A 79 -9.696 0.569 4.849 1.00 0.00 N ATOM 1243 CA ALA A 79 -8.868 -0.649 4.883 1.00 0.00 C ATOM 1244 C ALA A 79 -9.291 -1.680 3.809 1.00 0.00 C ATOM 1245 O ALA A 79 -8.443 -2.328 3.193 1.00 0.00 O ATOM 1246 CB ALA A 79 -8.922 -1.234 6.299 1.00 0.00 C ATOM 0 H ALA A 79 -10.136 0.799 5.740 1.00 0.00 H new ATOM 0 HA ALA A 79 -7.838 -0.388 4.639 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -8.314 -2.138 6.343 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -8.537 -0.503 7.010 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -9.954 -1.478 6.553 1.00 0.00 H new ATOM 1252 N ALA A 80 -10.597 -1.765 3.527 1.00 0.00 N ATOM 1253 CA ALA A 80 -11.182 -2.580 2.459 1.00 0.00 C ATOM 1254 C ALA A 80 -10.963 -1.987 1.067 1.00 0.00 C ATOM 1255 O ALA A 80 -10.596 -2.720 0.152 1.00 0.00 O ATOM 1256 CB ALA A 80 -12.684 -2.696 2.726 1.00 0.00 C ATOM 0 H ALA A 80 -11.299 -1.249 4.056 1.00 0.00 H new ATOM 0 HA ALA A 80 -10.690 -3.553 2.467 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -13.147 -3.299 1.945 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -12.846 -3.170 3.694 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -13.131 -1.702 2.730 1.00 0.00 H new ATOM 1262 N GLN A 81 -11.168 -0.677 0.883 1.00 0.00 N ATOM 1263 CA GLN A 81 -10.985 -0.035 -0.423 1.00 0.00 C ATOM 1264 C GLN A 81 -9.549 -0.211 -0.942 1.00 0.00 C ATOM 1265 O GLN A 81 -9.376 -0.411 -2.139 1.00 0.00 O ATOM 1266 CB GLN A 81 -11.374 1.452 -0.381 1.00 0.00 C ATOM 1267 CG GLN A 81 -12.880 1.737 -0.233 1.00 0.00 C ATOM 1268 CD GLN A 81 -13.302 2.969 -1.038 1.00 0.00 C ATOM 1269 OE1 GLN A 81 -13.411 2.934 -2.259 1.00 0.00 O ATOM 1270 NE2 GLN A 81 -13.520 4.108 -0.412 1.00 0.00 N ATOM 0 H GLN A 81 -11.461 -0.040 1.624 1.00 0.00 H new ATOM 0 HA GLN A 81 -11.656 -0.535 -1.122 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -10.849 1.924 0.449 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -11.019 1.929 -1.295 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -13.450 0.870 -0.568 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -13.120 1.889 0.819 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -13.434 4.157 0.603 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -13.775 4.941 -0.943 1.00 0.00 H new ATOM 1279 N ILE A 82 -8.520 -0.219 -0.079 1.00 0.00 N ATOM 1280 CA ILE A 82 -7.138 -0.539 -0.508 1.00 0.00 C ATOM 1281 C ILE A 82 -7.018 -1.968 -1.062 1.00 0.00 C ATOM 1282 O ILE A 82 -6.316 -2.171 -2.049 1.00 0.00 O ATOM 1283 CB ILE A 82 -6.144 -0.262 0.646 1.00 0.00 C ATOM 1284 CG1 ILE A 82 -6.091 1.262 0.874 1.00 0.00 C ATOM 1285 CG2 ILE A 82 -4.728 -0.793 0.343 1.00 0.00 C ATOM 1286 CD1 ILE A 82 -5.428 1.675 2.184 1.00 0.00 C ATOM 0 H ILE A 82 -8.612 -0.010 0.915 1.00 0.00 H new ATOM 0 HA ILE A 82 -6.877 0.118 -1.337 1.00 0.00 H new ATOM 0 HB ILE A 82 -6.492 -0.784 1.537 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.553 1.724 0.046 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -7.107 1.657 0.854 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -4.070 -0.573 1.183 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -4.769 -1.871 0.186 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -4.343 -0.310 -0.555 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -5.432 2.762 2.267 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -5.978 1.245 3.021 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -4.400 1.313 2.201 1.00 0.00 H new ATOM 1298 N ALA A 83 -7.725 -2.948 -0.491 1.00 0.00 N ATOM 1299 CA ALA A 83 -7.768 -4.313 -1.023 1.00 0.00 C ATOM 1300 C ALA A 83 -8.586 -4.403 -2.328 1.00 0.00 C ATOM 1301 O ALA A 83 -8.170 -5.074 -3.272 1.00 0.00 O ATOM 1302 CB ALA A 83 -8.307 -5.248 0.069 1.00 0.00 C ATOM 0 H ALA A 83 -8.283 -2.817 0.353 1.00 0.00 H new ATOM 0 HA ALA A 83 -6.759 -4.626 -1.293 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -8.345 -6.269 -0.312 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -7.650 -5.209 0.938 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -9.309 -4.931 0.357 1.00 0.00 H new ATOM 1308 N GLN A 84 -9.715 -3.687 -2.417 1.00 0.00 N ATOM 1309 CA GLN A 84 -10.531 -3.603 -3.637 1.00 0.00 C ATOM 1310 C GLN A 84 -9.777 -2.908 -4.784 1.00 0.00 C ATOM 1311 O GLN A 84 -9.944 -3.291 -5.940 1.00 0.00 O ATOM 1312 CB GLN A 84 -11.851 -2.859 -3.354 1.00 0.00 C ATOM 1313 CG GLN A 84 -12.805 -3.577 -2.380 1.00 0.00 C ATOM 1314 CD GLN A 84 -13.331 -4.913 -2.913 1.00 0.00 C ATOM 1315 OE1 GLN A 84 -13.913 -5.003 -3.987 1.00 0.00 O ATOM 1316 NE2 GLN A 84 -13.138 -6.007 -2.200 1.00 0.00 N ATOM 0 H GLN A 84 -10.091 -3.145 -1.639 1.00 0.00 H new ATOM 0 HA GLN A 84 -10.751 -4.624 -3.949 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -11.617 -1.874 -2.950 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -12.371 -2.700 -4.299 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -12.286 -3.750 -1.437 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -13.650 -2.923 -2.164 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -12.655 -5.953 -1.303 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -13.471 -6.907 -2.546 1.00 0.00 H new ATOM 1325 N ALA A 85 -8.898 -1.941 -4.490 1.00 0.00 N ATOM 1326 CA ALA A 85 -8.071 -1.262 -5.491 1.00 0.00 C ATOM 1327 C ALA A 85 -7.116 -2.225 -6.237 1.00 0.00 C ATOM 1328 O ALA A 85 -6.727 -1.937 -7.369 1.00 0.00 O ATOM 1329 CB ALA A 85 -7.319 -0.119 -4.800 1.00 0.00 C ATOM 0 H ALA A 85 -8.741 -1.606 -3.540 1.00 0.00 H new ATOM 0 HA ALA A 85 -8.719 -0.857 -6.268 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -6.697 0.400 -5.529 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -8.036 0.581 -4.371 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -6.689 -0.524 -4.008 1.00 0.00 H new ATOM 1335 N LEU A 86 -6.778 -3.379 -5.638 1.00 0.00 N ATOM 1336 CA LEU A 86 -5.983 -4.454 -6.257 1.00 0.00 C ATOM 1337 C LEU A 86 -6.833 -5.443 -7.081 1.00 0.00 C ATOM 1338 O LEU A 86 -6.287 -6.227 -7.858 1.00 0.00 O ATOM 1339 CB LEU A 86 -5.221 -5.226 -5.164 1.00 0.00 C ATOM 1340 CG LEU A 86 -4.467 -4.363 -4.133 1.00 0.00 C ATOM 1341 CD1 LEU A 86 -3.798 -5.273 -3.100 1.00 0.00 C ATOM 1342 CD2 LEU A 86 -3.424 -3.431 -4.760 1.00 0.00 C ATOM 0 H LEU A 86 -7.058 -3.596 -4.682 1.00 0.00 H new ATOM 0 HA LEU A 86 -5.291 -3.974 -6.949 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -5.931 -5.858 -4.630 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -4.504 -5.890 -5.647 1.00 0.00 H new ATOM 0 HG LEU A 86 -5.207 -3.719 -3.658 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -3.264 -4.664 -2.370 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -4.558 -5.866 -2.591 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -3.095 -5.938 -3.602 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -2.933 -2.855 -3.976 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -2.681 -4.023 -5.294 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -3.915 -2.751 -5.456 1.00 0.00 H new ATOM 1354 N LEU A 87 -8.161 -5.423 -6.924 1.00 0.00 N ATOM 1355 CA LEU A 87 -9.103 -6.174 -7.767 1.00 0.00 C ATOM 1356 C LEU A 87 -9.538 -5.363 -9.002 1.00 0.00 C ATOM 1357 O LEU A 87 -10.027 -5.940 -9.977 1.00 0.00 O ATOM 1358 CB LEU A 87 -10.321 -6.604 -6.924 1.00 0.00 C ATOM 1359 CG LEU A 87 -9.992 -7.457 -5.679 1.00 0.00 C ATOM 1360 CD1 LEU A 87 -11.294 -7.806 -4.946 1.00 0.00 C ATOM 1361 CD2 LEU A 87 -9.239 -8.749 -6.028 1.00 0.00 C ATOM 0 H LEU A 87 -8.621 -4.876 -6.196 1.00 0.00 H new ATOM 0 HA LEU A 87 -8.597 -7.064 -8.140 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -10.853 -5.709 -6.601 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -11.003 -7.168 -7.561 1.00 0.00 H new ATOM 0 HG LEU A 87 -9.336 -6.864 -5.041 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -11.066 -8.408 -4.066 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -11.795 -6.888 -4.638 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -11.947 -8.370 -5.612 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -9.034 -9.309 -5.115 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -9.849 -9.356 -6.697 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -8.299 -8.500 -6.520 1.00 0.00 H new ATOM 1373 N GLY A 88 -9.336 -4.038 -8.980 1.00 0.00 N ATOM 1374 CA GLY A 88 -9.595 -3.122 -10.097 1.00 0.00 C ATOM 1375 C GLY A 88 -8.433 -3.062 -11.094 1.00 0.00 C ATOM 1376 O GLY A 88 -7.271 -3.248 -10.729 1.00 0.00 O ATOM 0 H GLY A 88 -8.975 -3.559 -8.155 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -10.499 -3.437 -10.618 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -9.784 -2.123 -9.706 1.00 0.00 H new ATOM 1380 N ALA A 89 -8.751 -2.762 -12.359 1.00 0.00 N ATOM 1381 CA ALA A 89 -7.790 -2.668 -13.469 1.00 0.00 C ATOM 1382 C ALA A 89 -7.370 -1.217 -13.813 1.00 0.00 C ATOM 1383 O ALA A 89 -6.763 -0.978 -14.859 1.00 0.00 O ATOM 1384 CB ALA A 89 -8.402 -3.404 -14.671 1.00 0.00 C ATOM 0 H ALA A 89 -9.710 -2.572 -12.649 1.00 0.00 H new ATOM 0 HA ALA A 89 -6.854 -3.140 -13.169 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -7.715 -3.355 -15.516 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -8.579 -4.447 -14.407 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -9.346 -2.933 -14.944 1.00 0.00 H new ATOM 1390 N GLU A 90 -7.708 -0.251 -12.954 1.00 0.00 N ATOM 1391 CA GLU A 90 -7.488 1.190 -13.145 1.00 0.00 C ATOM 1392 C GLU A 90 -6.986 1.870 -11.854 1.00 0.00 C ATOM 1393 O GLU A 90 -7.069 1.302 -10.762 1.00 0.00 O ATOM 1394 CB GLU A 90 -8.774 1.850 -13.683 1.00 0.00 C ATOM 1395 CG GLU A 90 -9.970 1.798 -12.721 1.00 0.00 C ATOM 1396 CD GLU A 90 -11.219 2.404 -13.375 1.00 0.00 C ATOM 1397 OE1 GLU A 90 -11.394 3.646 -13.332 1.00 0.00 O ATOM 1398 OE2 GLU A 90 -12.043 1.644 -13.938 1.00 0.00 O ATOM 0 H GLU A 90 -8.163 -0.459 -12.065 1.00 0.00 H new ATOM 0 HA GLU A 90 -6.699 1.324 -13.885 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -8.560 2.892 -13.920 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -9.054 1.362 -14.617 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -10.168 0.765 -12.435 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -9.732 2.342 -11.807 1.00 0.00 H new ATOM 1405 N GLU A 91 -6.437 3.084 -11.988 1.00 0.00 N ATOM 1406 CA GLU A 91 -5.901 3.878 -10.873 1.00 0.00 C ATOM 1407 C GLU A 91 -6.984 4.186 -9.817 1.00 0.00 C ATOM 1408 O GLU A 91 -8.129 4.503 -10.163 1.00 0.00 O ATOM 1409 CB GLU A 91 -5.247 5.150 -11.444 1.00 0.00 C ATOM 1410 CG GLU A 91 -4.567 6.052 -10.405 1.00 0.00 C ATOM 1411 CD GLU A 91 -5.348 7.359 -10.187 1.00 0.00 C ATOM 1412 OE1 GLU A 91 -6.338 7.368 -9.420 1.00 0.00 O ATOM 1413 OE2 GLU A 91 -4.989 8.388 -10.810 1.00 0.00 O ATOM 0 H GLU A 91 -6.351 3.551 -12.891 1.00 0.00 H new ATOM 0 HA GLU A 91 -5.140 3.303 -10.345 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -4.507 4.857 -12.189 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -6.009 5.730 -11.964 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -4.482 5.517 -9.459 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -3.554 6.284 -10.732 1.00 0.00 H new ATOM 1420 N ARG A 92 -6.617 4.075 -8.529 1.00 0.00 N ATOM 1421 CA ARG A 92 -7.533 4.237 -7.389 1.00 0.00 C ATOM 1422 C ARG A 92 -6.803 4.812 -6.166 1.00 0.00 C ATOM 1423 O ARG A 92 -5.830 4.228 -5.679 1.00 0.00 O ATOM 1424 CB ARG A 92 -8.211 2.879 -7.074 1.00 0.00 C ATOM 1425 CG ARG A 92 -9.693 2.949 -6.656 1.00 0.00 C ATOM 1426 CD ARG A 92 -9.972 3.757 -5.380 1.00 0.00 C ATOM 1427 NE ARG A 92 -11.375 3.642 -4.939 1.00 0.00 N ATOM 1428 CZ ARG A 92 -12.429 4.305 -5.410 1.00 0.00 C ATOM 1429 NH1 ARG A 92 -12.361 5.110 -6.451 1.00 0.00 N ATOM 1430 NH2 ARG A 92 -13.592 4.160 -4.816 1.00 0.00 N ATOM 0 H ARG A 92 -5.659 3.867 -8.247 1.00 0.00 H new ATOM 0 HA ARG A 92 -8.309 4.956 -7.653 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -8.131 2.242 -7.955 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -7.651 2.391 -6.276 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -10.265 3.384 -7.475 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -10.062 1.934 -6.513 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -9.314 3.412 -4.583 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -9.734 4.806 -5.558 1.00 0.00 H new ATOM 0 HE ARG A 92 -11.559 2.978 -4.187 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -11.472 5.247 -6.933 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -13.197 5.597 -6.775 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -13.678 3.546 -4.006 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -14.409 4.661 -5.165 1.00 0.00 H new ATOM 1444 N LYS A 93 -7.312 5.927 -5.627 1.00 0.00 N ATOM 1445 CA LYS A 93 -6.879 6.529 -4.356 1.00 0.00 C ATOM 1446 C LYS A 93 -7.842 6.197 -3.192 1.00 0.00 C ATOM 1447 O LYS A 93 -9.057 6.193 -3.376 1.00 0.00 O ATOM 1448 CB LYS A 93 -6.722 8.055 -4.523 1.00 0.00 C ATOM 1449 CG LYS A 93 -5.816 8.425 -5.712 1.00 0.00 C ATOM 1450 CD LYS A 93 -5.342 9.885 -5.708 1.00 0.00 C ATOM 1451 CE LYS A 93 -6.523 10.869 -5.700 1.00 0.00 C ATOM 1452 NZ LYS A 93 -6.077 12.280 -5.876 1.00 0.00 N ATOM 0 H LYS A 93 -8.061 6.453 -6.077 1.00 0.00 H new ATOM 0 HA LYS A 93 -5.913 6.096 -4.096 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -7.705 8.505 -4.664 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -6.307 8.477 -3.608 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -4.944 7.771 -5.708 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -6.355 8.232 -6.640 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -4.716 10.061 -4.833 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -4.722 10.068 -6.586 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -7.218 10.607 -6.497 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -7.066 10.775 -4.760 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -6.905 12.910 -5.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -5.434 12.540 -5.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -5.581 12.377 -6.785 1.00 0.00 H new ATOM 1466 N VAL A 94 -7.300 5.936 -1.997 1.00 0.00 N ATOM 1467 CA VAL A 94 -8.041 5.690 -0.737 1.00 0.00 C ATOM 1468 C VAL A 94 -7.353 6.460 0.389 1.00 0.00 C ATOM 1469 O VAL A 94 -6.126 6.448 0.470 1.00 0.00 O ATOM 1470 CB VAL A 94 -8.095 4.182 -0.369 1.00 0.00 C ATOM 1471 CG1 VAL A 94 -8.938 3.950 0.889 1.00 0.00 C ATOM 1472 CG2 VAL A 94 -8.633 3.361 -1.536 1.00 0.00 C ATOM 0 H VAL A 94 -6.290 5.886 -1.867 1.00 0.00 H new ATOM 0 HA VAL A 94 -9.068 6.028 -0.876 1.00 0.00 H new ATOM 0 HB VAL A 94 -7.078 3.853 -0.157 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -8.958 2.885 1.122 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -8.502 4.497 1.725 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -9.955 4.302 0.716 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -8.662 2.308 -1.257 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -9.639 3.699 -1.785 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -7.983 3.489 -2.401 1.00 0.00 H new ATOM 1482 N GLU A 95 -8.127 7.120 1.250 1.00 0.00 N ATOM 1483 CA GLU A 95 -7.617 7.874 2.398 1.00 0.00 C ATOM 1484 C GLU A 95 -7.822 7.082 3.702 1.00 0.00 C ATOM 1485 O GLU A 95 -8.928 6.615 3.975 1.00 0.00 O ATOM 1486 CB GLU A 95 -8.321 9.241 2.425 1.00 0.00 C ATOM 1487 CG GLU A 95 -7.836 10.164 3.544 1.00 0.00 C ATOM 1488 CD GLU A 95 -8.563 11.516 3.487 1.00 0.00 C ATOM 1489 OE1 GLU A 95 -8.277 12.330 2.578 1.00 0.00 O ATOM 1490 OE2 GLU A 95 -9.438 11.772 4.349 1.00 0.00 O ATOM 0 H GLU A 95 -9.143 7.147 1.169 1.00 0.00 H new ATOM 0 HA GLU A 95 -6.543 8.034 2.305 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -8.168 9.737 1.466 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -9.394 9.084 2.536 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -8.009 9.693 4.511 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -6.761 10.320 3.453 1.00 0.00 H new ATOM 1497 N ILE A 96 -6.767 6.914 4.513 1.00 0.00 N ATOM 1498 CA ILE A 96 -6.745 5.992 5.667 1.00 0.00 C ATOM 1499 C ILE A 96 -5.781 6.465 6.772 1.00 0.00 C ATOM 1500 O ILE A 96 -4.772 7.103 6.483 1.00 0.00 O ATOM 1501 CB ILE A 96 -6.412 4.561 5.156 1.00 0.00 C ATOM 1502 CG1 ILE A 96 -6.580 3.511 6.274 1.00 0.00 C ATOM 1503 CG2 ILE A 96 -5.015 4.481 4.512 1.00 0.00 C ATOM 1504 CD1 ILE A 96 -6.576 2.062 5.778 1.00 0.00 C ATOM 0 H ILE A 96 -5.891 7.420 4.387 1.00 0.00 H new ATOM 0 HA ILE A 96 -7.729 5.979 6.135 1.00 0.00 H new ATOM 0 HB ILE A 96 -7.133 4.330 4.372 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -5.777 3.637 7.000 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -7.516 3.701 6.799 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -4.829 3.462 4.171 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -4.966 5.162 3.663 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.259 4.761 5.246 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -6.699 1.387 6.625 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -7.396 1.916 5.075 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -5.630 1.851 5.280 1.00 0.00 H new ATOM 1516 N ALA A 97 -6.064 6.166 8.046 1.00 0.00 N ATOM 1517 CA ALA A 97 -5.142 6.460 9.149 1.00 0.00 C ATOM 1518 C ALA A 97 -4.088 5.349 9.315 1.00 0.00 C ATOM 1519 O ALA A 97 -4.431 4.211 9.640 1.00 0.00 O ATOM 1520 CB ALA A 97 -5.937 6.715 10.438 1.00 0.00 C ATOM 0 H ALA A 97 -6.932 5.717 8.339 1.00 0.00 H new ATOM 0 HA ALA A 97 -4.587 7.368 8.914 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -5.248 6.933 11.254 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -6.605 7.564 10.291 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -6.523 5.830 10.685 1.00 0.00 H new ATOM 1526 N PHE A 98 -2.814 5.694 9.115 1.00 0.00 N ATOM 1527 CA PHE A 98 -1.654 4.826 9.337 1.00 0.00 C ATOM 1528 C PHE A 98 -0.936 5.189 10.643 1.00 0.00 C ATOM 1529 O PHE A 98 -0.772 6.365 10.978 1.00 0.00 O ATOM 1530 CB PHE A 98 -0.682 4.948 8.147 1.00 0.00 C ATOM 1531 CG PHE A 98 -1.002 4.182 6.869 1.00 0.00 C ATOM 1532 CD1 PHE A 98 -2.115 3.321 6.756 1.00 0.00 C ATOM 1533 CD2 PHE A 98 -0.110 4.295 5.785 1.00 0.00 C ATOM 1534 CE1 PHE A 98 -2.305 2.559 5.588 1.00 0.00 C ATOM 1535 CE2 PHE A 98 -0.308 3.548 4.611 1.00 0.00 C ATOM 1536 CZ PHE A 98 -1.401 2.669 4.517 1.00 0.00 C ATOM 0 H PHE A 98 -2.551 6.621 8.781 1.00 0.00 H new ATOM 0 HA PHE A 98 -2.002 3.796 9.419 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -0.603 6.004 7.890 1.00 0.00 H new ATOM 0 HB3 PHE A 98 0.303 4.628 8.488 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -2.823 3.247 7.568 1.00 0.00 H new ATOM 0 HD2 PHE A 98 0.736 4.963 5.857 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -3.148 1.888 5.514 1.00 0.00 H new ATOM 0 HE2 PHE A 98 0.378 3.649 3.783 1.00 0.00 H new ATOM 0 HZ PHE A 98 -1.546 2.079 3.624 1.00 0.00 H new ATOM 1546 N TYR A 99 -0.478 4.163 11.364 1.00 0.00 N ATOM 1547 CA TYR A 99 0.271 4.273 12.618 1.00 0.00 C ATOM 1548 C TYR A 99 1.770 3.974 12.418 1.00 0.00 C ATOM 1549 O TYR A 99 2.144 2.973 11.798 1.00 0.00 O ATOM 1550 CB TYR A 99 -0.342 3.326 13.663 1.00 0.00 C ATOM 1551 CG TYR A 99 -1.651 3.811 14.266 1.00 0.00 C ATOM 1552 CD1 TYR A 99 -2.829 3.876 13.490 1.00 0.00 C ATOM 1553 CD2 TYR A 99 -1.686 4.214 15.616 1.00 0.00 C ATOM 1554 CE1 TYR A 99 -4.025 4.361 14.050 1.00 0.00 C ATOM 1555 CE2 TYR A 99 -2.882 4.690 16.185 1.00 0.00 C ATOM 1556 CZ TYR A 99 -4.054 4.767 15.403 1.00 0.00 C ATOM 1557 OH TYR A 99 -5.219 5.201 15.957 1.00 0.00 O ATOM 0 H TYR A 99 -0.625 3.195 11.079 1.00 0.00 H new ATOM 0 HA TYR A 99 0.199 5.301 12.974 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -0.509 2.354 13.199 1.00 0.00 H new ATOM 0 HB3 TYR A 99 0.380 3.177 14.466 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -2.812 3.551 12.460 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -0.790 4.157 16.217 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -4.919 4.423 13.447 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -2.903 4.996 17.220 1.00 0.00 H new ATOM 0 HH TYR A 99 -5.066 5.441 16.895 1.00 0.00 H new ATOM 1567 N ARG A 100 2.627 4.836 12.977 1.00 0.00 N ATOM 1568 CA ARG A 100 4.088 4.701 12.993 1.00 0.00 C ATOM 1569 C ARG A 100 4.567 3.682 14.038 1.00 0.00 C ATOM 1570 O ARG A 100 3.871 3.378 15.008 1.00 0.00 O ATOM 1571 CB ARG A 100 4.737 6.074 13.267 1.00 0.00 C ATOM 1572 CG ARG A 100 4.685 7.009 12.050 1.00 0.00 C ATOM 1573 CD ARG A 100 5.279 8.397 12.336 1.00 0.00 C ATOM 1574 NE ARG A 100 6.661 8.342 12.859 1.00 0.00 N ATOM 1575 CZ ARG A 100 7.781 8.224 12.150 1.00 0.00 C ATOM 1576 NH1 ARG A 100 7.766 8.067 10.846 1.00 0.00 N ATOM 1577 NH2 ARG A 100 8.950 8.264 12.752 1.00 0.00 N ATOM 0 H ARG A 100 2.308 5.682 13.450 1.00 0.00 H new ATOM 0 HA ARG A 100 4.393 4.333 12.013 1.00 0.00 H new ATOM 0 HB2 ARG A 100 4.230 6.549 14.107 1.00 0.00 H new ATOM 0 HB3 ARG A 100 5.776 5.927 13.563 1.00 0.00 H new ATOM 0 HG2 ARG A 100 5.227 6.551 11.223 1.00 0.00 H new ATOM 0 HG3 ARG A 100 3.650 7.122 11.729 1.00 0.00 H new ATOM 0 HD2 ARG A 100 5.268 8.986 11.419 1.00 0.00 H new ATOM 0 HD3 ARG A 100 4.645 8.915 13.056 1.00 0.00 H new ATOM 0 HE ARG A 100 6.767 8.401 13.872 1.00 0.00 H new ATOM 0 HH11 ARG A 100 6.877 8.032 10.347 1.00 0.00 H new ATOM 0 HH12 ARG A 100 8.643 7.980 10.333 1.00 0.00 H new ATOM 0 HH21 ARG A 100 8.999 8.386 13.764 1.00 0.00 H new ATOM 0 HH22 ARG A 100 9.808 8.173 12.207 1.00 0.00 H new ATOM 1591 N LYS A 101 5.818 3.234 13.898 1.00 0.00 N ATOM 1592 CA LYS A 101 6.515 2.364 14.870 1.00 0.00 C ATOM 1593 C LYS A 101 6.762 3.046 16.235 1.00 0.00 C ATOM 1594 O LYS A 101 6.868 2.368 17.257 1.00 0.00 O ATOM 1595 CB LYS A 101 7.838 1.861 14.245 1.00 0.00 C ATOM 1596 CG LYS A 101 7.727 0.453 13.645 1.00 0.00 C ATOM 1597 CD LYS A 101 6.938 0.430 12.326 1.00 0.00 C ATOM 1598 CE LYS A 101 6.618 -1.000 11.863 1.00 0.00 C ATOM 1599 NZ LYS A 101 5.617 -1.686 12.733 1.00 0.00 N ATOM 0 H LYS A 101 6.394 3.468 13.089 1.00 0.00 H new ATOM 0 HA LYS A 101 5.862 1.518 15.084 1.00 0.00 H new ATOM 0 HB2 LYS A 101 8.152 2.557 13.467 1.00 0.00 H new ATOM 0 HB3 LYS A 101 8.617 1.863 15.008 1.00 0.00 H new ATOM 0 HG2 LYS A 101 8.727 0.057 13.472 1.00 0.00 H new ATOM 0 HG3 LYS A 101 7.243 -0.207 14.365 1.00 0.00 H new ATOM 0 HD2 LYS A 101 6.009 0.986 12.451 1.00 0.00 H new ATOM 0 HD3 LYS A 101 7.512 0.940 11.553 1.00 0.00 H new ATOM 0 HE2 LYS A 101 6.241 -0.969 10.841 1.00 0.00 H new ATOM 0 HE3 LYS A 101 7.538 -1.585 11.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 5.341 -2.590 12.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 6.035 -1.865 13.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 4.777 -1.082 12.839 1.00 0.00 H new ATOM 1613 N ASP A 102 6.798 4.384 16.264 1.00 0.00 N ATOM 1614 CA ASP A 102 6.917 5.197 17.488 1.00 0.00 C ATOM 1615 C ASP A 102 5.593 5.322 18.280 1.00 0.00 C ATOM 1616 O ASP A 102 5.582 5.854 19.392 1.00 0.00 O ATOM 1617 CB ASP A 102 7.463 6.576 17.084 1.00 0.00 C ATOM 1618 CG ASP A 102 7.935 7.413 18.286 1.00 0.00 C ATOM 1619 OD1 ASP A 102 8.833 6.949 19.030 1.00 0.00 O ATOM 1620 OD2 ASP A 102 7.443 8.554 18.458 1.00 0.00 O ATOM 0 H ASP A 102 6.744 4.949 15.416 1.00 0.00 H new ATOM 0 HA ASP A 102 7.601 4.695 18.172 1.00 0.00 H new ATOM 0 HB2 ASP A 102 8.295 6.443 16.392 1.00 0.00 H new ATOM 0 HB3 ASP A 102 6.688 7.125 16.548 1.00 0.00 H new ATOM 1625 N GLY A 103 4.475 4.837 17.716 1.00 0.00 N ATOM 1626 CA GLY A 103 3.131 4.871 18.318 1.00 0.00 C ATOM 1627 C GLY A 103 2.277 6.074 17.903 1.00 0.00 C ATOM 1628 O GLY A 103 1.120 6.171 18.314 1.00 0.00 O ATOM 0 H GLY A 103 4.482 4.395 16.797 1.00 0.00 H new ATOM 0 HA2 GLY A 103 2.603 3.957 18.048 1.00 0.00 H new ATOM 0 HA3 GLY A 103 3.233 4.871 19.403 1.00 0.00 H new ATOM 1632 N SER A 104 2.816 6.982 17.088 1.00 0.00 N ATOM 1633 CA SER A 104 2.078 8.130 16.525 1.00 0.00 C ATOM 1634 C SER A 104 1.222 7.719 15.311 1.00 0.00 C ATOM 1635 O SER A 104 1.409 6.636 14.754 1.00 0.00 O ATOM 1636 CB SER A 104 3.059 9.246 16.124 1.00 0.00 C ATOM 1637 OG SER A 104 3.815 9.697 17.244 1.00 0.00 O ATOM 0 H SER A 104 3.791 6.946 16.792 1.00 0.00 H new ATOM 0 HA SER A 104 1.404 8.500 17.298 1.00 0.00 H new ATOM 0 HB2 SER A 104 3.734 8.879 15.351 1.00 0.00 H new ATOM 0 HB3 SER A 104 2.507 10.082 15.695 1.00 0.00 H new ATOM 0 HG SER A 104 4.431 10.404 16.960 1.00 0.00 H new ATOM 1643 N CYS A 105 0.310 8.583 14.846 1.00 0.00 N ATOM 1644 CA CYS A 105 -0.504 8.332 13.647 1.00 0.00 C ATOM 1645 C CYS A 105 -0.865 9.612 12.875 1.00 0.00 C ATOM 1646 O CYS A 105 -0.643 10.730 13.347 1.00 0.00 O ATOM 1647 CB CYS A 105 -1.743 7.504 14.036 1.00 0.00 C ATOM 1648 SG CYS A 105 -2.907 8.477 15.037 1.00 0.00 S ATOM 0 H CYS A 105 0.115 9.479 15.292 1.00 0.00 H new ATOM 0 HA CYS A 105 0.098 7.755 12.945 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -2.244 7.151 13.134 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -1.431 6.621 14.594 1.00 0.00 H new ATOM 0 HG CYS A 105 -3.936 7.743 15.341 1.00 0.00 H new ATOM 1654 N PHE A 106 -1.427 9.422 11.679 1.00 0.00 N ATOM 1655 CA PHE A 106 -1.833 10.468 10.736 1.00 0.00 C ATOM 1656 C PHE A 106 -2.656 9.886 9.581 1.00 0.00 C ATOM 1657 O PHE A 106 -2.677 8.672 9.372 1.00 0.00 O ATOM 1658 CB PHE A 106 -0.607 11.267 10.239 1.00 0.00 C ATOM 1659 CG PHE A 106 0.653 10.488 9.890 1.00 0.00 C ATOM 1660 CD1 PHE A 106 0.617 9.348 9.060 1.00 0.00 C ATOM 1661 CD2 PHE A 106 1.891 10.941 10.385 1.00 0.00 C ATOM 1662 CE1 PHE A 106 1.798 8.652 8.761 1.00 0.00 C ATOM 1663 CE2 PHE A 106 3.076 10.263 10.062 1.00 0.00 C ATOM 1664 CZ PHE A 106 3.027 9.112 9.260 1.00 0.00 C ATOM 0 H PHE A 106 -1.621 8.486 11.323 1.00 0.00 H new ATOM 0 HA PHE A 106 -2.482 11.169 11.261 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -0.909 11.829 9.355 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -0.348 11.996 11.007 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -0.324 9.009 8.653 1.00 0.00 H new ATOM 0 HD2 PHE A 106 1.929 11.816 11.017 1.00 0.00 H new ATOM 0 HE1 PHE A 106 1.762 7.764 8.148 1.00 0.00 H new ATOM 0 HE2 PHE A 106 4.024 10.626 10.430 1.00 0.00 H new ATOM 0 HZ PHE A 106 3.937 8.579 9.026 1.00 0.00 H new ATOM 1674 N LEU A 107 -3.317 10.752 8.809 1.00 0.00 N ATOM 1675 CA LEU A 107 -3.963 10.351 7.552 1.00 0.00 C ATOM 1676 C LEU A 107 -2.943 10.234 6.423 1.00 0.00 C ATOM 1677 O LEU A 107 -2.305 11.211 6.039 1.00 0.00 O ATOM 1678 CB LEU A 107 -5.051 11.363 7.151 1.00 0.00 C ATOM 1679 CG LEU A 107 -6.489 11.097 7.640 1.00 0.00 C ATOM 1680 CD1 LEU A 107 -6.985 9.694 7.272 1.00 0.00 C ATOM 1681 CD2 LEU A 107 -6.626 11.300 9.150 1.00 0.00 C ATOM 0 H LEU A 107 -3.420 11.742 9.032 1.00 0.00 H new ATOM 0 HA LEU A 107 -4.421 9.376 7.717 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -4.748 12.344 7.516 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -5.072 11.421 6.063 1.00 0.00 H new ATOM 0 HG LEU A 107 -7.112 11.828 7.125 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -8.002 9.560 7.640 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -6.973 9.576 6.188 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -6.333 8.947 7.726 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -7.655 11.102 9.452 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -5.957 10.615 9.671 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -6.364 12.327 9.404 1.00 0.00 H new ATOM 1693 N CYS A 108 -2.886 9.055 5.818 1.00 0.00 N ATOM 1694 CA CYS A 108 -2.184 8.762 4.576 1.00 0.00 C ATOM 1695 C CYS A 108 -3.194 8.570 3.430 1.00 0.00 C ATOM 1696 O CYS A 108 -4.201 7.871 3.561 1.00 0.00 O ATOM 1697 CB CYS A 108 -1.348 7.498 4.802 1.00 0.00 C ATOM 1698 SG CYS A 108 0.245 7.971 5.530 1.00 0.00 S ATOM 0 H CYS A 108 -3.353 8.233 6.201 1.00 0.00 H new ATOM 0 HA CYS A 108 -1.531 9.588 4.294 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -1.875 6.810 5.463 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -1.191 6.976 3.858 1.00 0.00 H new ATOM 0 HG CYS A 108 0.065 8.346 6.762 1.00 0.00 H new ATOM 1704 N LEU A 109 -2.894 9.152 2.275 1.00 0.00 N ATOM 1705 CA LEU A 109 -3.488 8.814 0.990 1.00 0.00 C ATOM 1706 C LEU A 109 -2.678 7.655 0.395 1.00 0.00 C ATOM 1707 O LEU A 109 -1.466 7.780 0.233 1.00 0.00 O ATOM 1708 CB LEU A 109 -3.443 10.077 0.103 1.00 0.00 C ATOM 1709 CG LEU A 109 -4.339 10.043 -1.151 1.00 0.00 C ATOM 1710 CD1 LEU A 109 -5.833 9.981 -0.793 1.00 0.00 C ATOM 1711 CD2 LEU A 109 -4.074 11.309 -1.976 1.00 0.00 C ATOM 0 H LEU A 109 -2.204 9.900 2.207 1.00 0.00 H new ATOM 0 HA LEU A 109 -4.527 8.497 1.076 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -3.731 10.936 0.710 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -2.413 10.241 -0.213 1.00 0.00 H new ATOM 0 HG LEU A 109 -4.096 9.144 -1.718 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -6.426 9.959 -1.708 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -6.031 9.081 -0.211 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -6.103 10.859 -0.207 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -4.701 11.300 -2.868 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -4.308 12.189 -1.377 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -3.025 11.338 -2.270 1.00 0.00 H new ATOM 1723 N VAL A 110 -3.342 6.542 0.086 1.00 0.00 N ATOM 1724 CA VAL A 110 -2.781 5.419 -0.681 1.00 0.00 C ATOM 1725 C VAL A 110 -3.346 5.496 -2.098 1.00 0.00 C ATOM 1726 O VAL A 110 -4.557 5.403 -2.275 1.00 0.00 O ATOM 1727 CB VAL A 110 -3.112 4.054 -0.037 1.00 0.00 C ATOM 1728 CG1 VAL A 110 -2.552 2.898 -0.856 1.00 0.00 C ATOM 1729 CG2 VAL A 110 -2.585 3.985 1.405 1.00 0.00 C ATOM 0 H VAL A 110 -4.310 6.388 0.367 1.00 0.00 H new ATOM 0 HA VAL A 110 -1.694 5.497 -0.693 1.00 0.00 H new ATOM 0 HB VAL A 110 -4.198 3.960 -0.018 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.804 1.954 -0.373 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -2.982 2.919 -1.857 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -1.468 2.992 -0.925 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -2.831 3.015 1.836 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.503 4.118 1.404 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -3.047 4.773 1.999 1.00 0.00 H new ATOM 1739 N ASP A 111 -2.487 5.673 -3.097 1.00 0.00 N ATOM 1740 CA ASP A 111 -2.809 5.721 -4.519 1.00 0.00 C ATOM 1741 C ASP A 111 -2.212 4.485 -5.195 1.00 0.00 C ATOM 1742 O ASP A 111 -1.000 4.400 -5.360 1.00 0.00 O ATOM 1743 CB ASP A 111 -2.224 7.022 -5.087 1.00 0.00 C ATOM 1744 CG ASP A 111 -2.179 7.058 -6.623 1.00 0.00 C ATOM 1745 OD1 ASP A 111 -3.154 6.610 -7.268 1.00 0.00 O ATOM 1746 OD2 ASP A 111 -1.164 7.561 -7.162 1.00 0.00 O ATOM 0 H ASP A 111 -1.489 5.794 -2.925 1.00 0.00 H new ATOM 0 HA ASP A 111 -3.885 5.714 -4.696 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -2.817 7.864 -4.730 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -1.214 7.156 -4.699 1.00 0.00 H new ATOM 1751 N VAL A 112 -3.045 3.520 -5.579 1.00 0.00 N ATOM 1752 CA VAL A 112 -2.586 2.371 -6.373 1.00 0.00 C ATOM 1753 C VAL A 112 -2.500 2.810 -7.830 1.00 0.00 C ATOM 1754 O VAL A 112 -3.496 3.243 -8.411 1.00 0.00 O ATOM 1755 CB VAL A 112 -3.553 1.187 -6.284 1.00 0.00 C ATOM 1756 CG1 VAL A 112 -3.222 0.039 -7.252 1.00 0.00 C ATOM 1757 CG2 VAL A 112 -3.664 0.592 -4.879 1.00 0.00 C ATOM 0 H VAL A 112 -4.040 3.506 -5.356 1.00 0.00 H new ATOM 0 HA VAL A 112 -1.620 2.048 -5.984 1.00 0.00 H new ATOM 0 HB VAL A 112 -4.506 1.633 -6.568 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -3.951 -0.762 -7.129 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -3.256 0.407 -8.278 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -2.224 -0.343 -7.036 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -4.366 -0.242 -4.891 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -2.685 0.238 -4.556 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -4.020 1.356 -4.188 1.00 0.00 H new ATOM 1767 N VAL A 113 -1.330 2.613 -8.426 1.00 0.00 N ATOM 1768 CA VAL A 113 -1.098 2.765 -9.864 1.00 0.00 C ATOM 1769 C VAL A 113 -0.890 1.359 -10.440 1.00 0.00 C ATOM 1770 O VAL A 113 0.121 0.730 -10.114 1.00 0.00 O ATOM 1771 CB VAL A 113 0.099 3.707 -10.124 1.00 0.00 C ATOM 1772 CG1 VAL A 113 0.574 3.668 -11.587 1.00 0.00 C ATOM 1773 CG2 VAL A 113 -0.286 5.152 -9.777 1.00 0.00 C ATOM 0 H VAL A 113 -0.493 2.336 -7.913 1.00 0.00 H new ATOM 0 HA VAL A 113 -1.950 3.231 -10.360 1.00 0.00 H new ATOM 0 HB VAL A 113 0.915 3.358 -9.491 1.00 0.00 H new ATOM 0 HG11 VAL A 113 1.416 4.348 -11.714 1.00 0.00 H new ATOM 0 HG12 VAL A 113 0.884 2.655 -11.842 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -0.241 3.974 -12.243 1.00 0.00 H new ATOM 0 HG21 VAL A 113 0.563 5.809 -9.963 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -1.128 5.463 -10.396 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -0.567 5.211 -8.726 1.00 0.00 H new ATOM 1783 N PRO A 114 -1.830 0.830 -11.249 1.00 0.00 N ATOM 1784 CA PRO A 114 -1.669 -0.463 -11.895 1.00 0.00 C ATOM 1785 C PRO A 114 -0.673 -0.338 -13.049 1.00 0.00 C ATOM 1786 O PRO A 114 -0.770 0.571 -13.872 1.00 0.00 O ATOM 1787 CB PRO A 114 -3.062 -0.861 -12.386 1.00 0.00 C ATOM 1788 CG PRO A 114 -3.745 0.478 -12.637 1.00 0.00 C ATOM 1789 CD PRO A 114 -3.137 1.394 -11.575 1.00 0.00 C ATOM 0 HA PRO A 114 -1.273 -1.222 -11.220 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -3.011 -1.462 -13.294 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -3.597 -1.451 -11.642 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -3.549 0.846 -13.644 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -4.827 0.403 -12.530 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -3.039 2.413 -11.950 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -3.773 1.440 -10.691 1.00 0.00 H new ATOM 1797 N VAL A 115 0.275 -1.273 -13.108 1.00 0.00 N ATOM 1798 CA VAL A 115 1.224 -1.404 -14.224 1.00 0.00 C ATOM 1799 C VAL A 115 0.726 -2.519 -15.136 1.00 0.00 C ATOM 1800 O VAL A 115 0.597 -3.665 -14.704 1.00 0.00 O ATOM 1801 CB VAL A 115 2.650 -1.702 -13.715 1.00 0.00 C ATOM 1802 CG1 VAL A 115 3.647 -1.995 -14.849 1.00 0.00 C ATOM 1803 CG2 VAL A 115 3.180 -0.530 -12.876 1.00 0.00 C ATOM 0 H VAL A 115 0.411 -1.971 -12.376 1.00 0.00 H new ATOM 0 HA VAL A 115 1.278 -0.465 -14.775 1.00 0.00 H new ATOM 0 HB VAL A 115 2.569 -2.601 -13.104 1.00 0.00 H new ATOM 0 HG11 VAL A 115 4.631 -2.196 -14.425 1.00 0.00 H new ATOM 0 HG12 VAL A 115 3.310 -2.864 -15.414 1.00 0.00 H new ATOM 0 HG13 VAL A 115 3.707 -1.132 -15.512 1.00 0.00 H new ATOM 0 HG21 VAL A 115 4.187 -0.759 -12.526 1.00 0.00 H new ATOM 0 HG22 VAL A 115 3.205 0.373 -13.486 1.00 0.00 H new ATOM 0 HG23 VAL A 115 2.525 -0.371 -12.019 1.00 0.00 H new ATOM 1813 N LYS A 116 0.468 -2.186 -16.402 1.00 0.00 N ATOM 1814 CA LYS A 116 0.164 -3.162 -17.453 1.00 0.00 C ATOM 1815 C LYS A 116 1.411 -3.601 -18.232 1.00 0.00 C ATOM 1816 O LYS A 116 2.404 -2.876 -18.328 1.00 0.00 O ATOM 1817 CB LYS A 116 -0.917 -2.623 -18.404 1.00 0.00 C ATOM 1818 CG LYS A 116 -2.278 -2.520 -17.707 1.00 0.00 C ATOM 1819 CD LYS A 116 -3.380 -2.078 -18.679 1.00 0.00 C ATOM 1820 CE LYS A 116 -4.726 -2.623 -18.185 1.00 0.00 C ATOM 1821 NZ LYS A 116 -5.843 -2.251 -19.096 1.00 0.00 N ATOM 0 H LYS A 116 0.464 -1.221 -16.731 1.00 0.00 H new ATOM 0 HA LYS A 116 -0.222 -4.051 -16.954 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -0.621 -1.641 -18.774 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -1.000 -3.278 -19.271 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -2.540 -3.486 -17.275 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -2.212 -1.809 -16.883 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -3.414 -0.990 -18.741 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -3.169 -2.448 -19.682 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -4.670 -3.708 -18.103 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -4.929 -2.238 -17.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -6.735 -2.638 -18.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -5.913 -1.215 -19.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -5.662 -2.640 -20.044 1.00 0.00 H new ATOM 1835 N ASN A 117 1.330 -4.803 -18.807 1.00 0.00 N ATOM 1836 CA ASN A 117 2.353 -5.359 -19.695 1.00 0.00 C ATOM 1837 C ASN A 117 2.040 -5.068 -21.174 1.00 0.00 C ATOM 1838 O ASN A 117 1.063 -4.391 -21.504 1.00 0.00 O ATOM 1839 CB ASN A 117 2.530 -6.860 -19.390 1.00 0.00 C ATOM 1840 CG ASN A 117 1.490 -7.764 -20.037 1.00 0.00 C ATOM 1841 OD1 ASN A 117 1.770 -8.426 -21.023 1.00 0.00 O ATOM 1842 ND2 ASN A 117 0.260 -7.783 -19.558 1.00 0.00 N ATOM 0 H ASN A 117 0.537 -5.429 -18.666 1.00 0.00 H new ATOM 0 HA ASN A 117 3.308 -4.868 -19.505 1.00 0.00 H new ATOM 0 HB2 ASN A 117 3.520 -7.171 -19.723 1.00 0.00 H new ATOM 0 HB3 ASN A 117 2.497 -7.004 -18.310 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -0.455 -8.351 -20.012 1.00 0.00 H new ATOM 0 HD22 ASN A 117 0.025 -7.230 -18.734 1.00 0.00 H new ATOM 1849 N GLU A 118 2.845 -5.648 -22.059 1.00 0.00 N ATOM 1850 CA GLU A 118 2.715 -5.534 -23.521 1.00 0.00 C ATOM 1851 C GLU A 118 1.381 -6.079 -24.082 1.00 0.00 C ATOM 1852 O GLU A 118 0.961 -5.666 -25.166 1.00 0.00 O ATOM 1853 CB GLU A 118 3.915 -6.214 -24.205 1.00 0.00 C ATOM 1854 CG GLU A 118 4.101 -7.687 -23.814 1.00 0.00 C ATOM 1855 CD GLU A 118 5.187 -8.349 -24.674 1.00 0.00 C ATOM 1856 OE1 GLU A 118 6.382 -8.295 -24.296 1.00 0.00 O ATOM 1857 OE2 GLU A 118 4.859 -8.934 -25.734 1.00 0.00 O ATOM 0 H GLU A 118 3.633 -6.231 -21.777 1.00 0.00 H new ATOM 0 HA GLU A 118 2.709 -4.468 -23.749 1.00 0.00 H new ATOM 0 HB2 GLU A 118 3.790 -6.148 -25.286 1.00 0.00 H new ATOM 0 HB3 GLU A 118 4.823 -5.664 -23.955 1.00 0.00 H new ATOM 0 HG2 GLU A 118 4.373 -7.756 -22.761 1.00 0.00 H new ATOM 0 HG3 GLU A 118 3.159 -8.222 -23.936 1.00 0.00 H new ATOM 1864 N ASP A 119 0.689 -6.969 -23.357 1.00 0.00 N ATOM 1865 CA ASP A 119 -0.611 -7.543 -23.748 1.00 0.00 C ATOM 1866 C ASP A 119 -1.815 -6.719 -23.236 1.00 0.00 C ATOM 1867 O ASP A 119 -2.965 -7.024 -23.558 1.00 0.00 O ATOM 1868 CB ASP A 119 -0.669 -8.993 -23.238 1.00 0.00 C ATOM 1869 CG ASP A 119 -1.851 -9.792 -23.816 1.00 0.00 C ATOM 1870 OD1 ASP A 119 -1.921 -9.957 -25.058 1.00 0.00 O ATOM 1871 OD2 ASP A 119 -2.684 -10.292 -23.022 1.00 0.00 O ATOM 0 H ASP A 119 1.024 -7.320 -22.460 1.00 0.00 H new ATOM 0 HA ASP A 119 -0.688 -7.519 -24.835 1.00 0.00 H new ATOM 0 HB2 ASP A 119 0.262 -9.499 -23.493 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -0.741 -8.986 -22.150 1.00 0.00 H new ATOM 1876 N GLY A 120 -1.564 -5.678 -22.428 1.00 0.00 N ATOM 1877 CA GLY A 120 -2.597 -4.814 -21.840 1.00 0.00 C ATOM 1878 C GLY A 120 -3.298 -5.410 -20.614 1.00 0.00 C ATOM 1879 O GLY A 120 -4.391 -4.962 -20.271 1.00 0.00 O ATOM 0 H GLY A 120 -0.618 -5.408 -22.160 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -2.142 -3.865 -21.557 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -3.346 -4.594 -22.601 1.00 0.00 H new ATOM 1883 N ALA A 121 -2.682 -6.391 -19.942 1.00 0.00 N ATOM 1884 CA ALA A 121 -3.150 -6.964 -18.671 1.00 0.00 C ATOM 1885 C ALA A 121 -2.366 -6.348 -17.510 1.00 0.00 C ATOM 1886 O ALA A 121 -1.175 -6.072 -17.669 1.00 0.00 O ATOM 1887 CB ALA A 121 -2.981 -8.494 -18.684 1.00 0.00 C ATOM 0 H ALA A 121 -1.820 -6.821 -20.276 1.00 0.00 H new ATOM 0 HA ALA A 121 -4.208 -6.737 -18.543 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -3.331 -8.907 -17.738 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -3.564 -8.917 -19.502 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -1.929 -8.743 -18.821 1.00 0.00 H new ATOM 1893 N VAL A 122 -3.000 -6.165 -16.352 1.00 0.00 N ATOM 1894 CA VAL A 122 -2.335 -5.637 -15.144 1.00 0.00 C ATOM 1895 C VAL A 122 -1.490 -6.745 -14.508 1.00 0.00 C ATOM 1896 O VAL A 122 -1.984 -7.832 -14.215 1.00 0.00 O ATOM 1897 CB VAL A 122 -3.329 -5.038 -14.118 1.00 0.00 C ATOM 1898 CG1 VAL A 122 -2.602 -4.496 -12.875 1.00 0.00 C ATOM 1899 CG2 VAL A 122 -4.129 -3.885 -14.744 1.00 0.00 C ATOM 0 H VAL A 122 -3.989 -6.376 -16.217 1.00 0.00 H new ATOM 0 HA VAL A 122 -1.693 -4.812 -15.452 1.00 0.00 H new ATOM 0 HB VAL A 122 -3.999 -5.846 -13.823 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -3.331 -4.084 -12.178 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -2.055 -5.305 -12.392 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -1.904 -3.714 -13.174 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -4.821 -3.479 -14.006 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -3.444 -3.101 -15.069 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -4.690 -4.255 -15.602 1.00 0.00 H new ATOM 1909 N ILE A 123 -0.203 -6.450 -14.309 1.00 0.00 N ATOM 1910 CA ILE A 123 0.828 -7.414 -13.856 1.00 0.00 C ATOM 1911 C ILE A 123 1.526 -7.013 -12.544 1.00 0.00 C ATOM 1912 O ILE A 123 2.034 -7.871 -11.825 1.00 0.00 O ATOM 1913 CB ILE A 123 1.862 -7.617 -14.989 1.00 0.00 C ATOM 1914 CG1 ILE A 123 2.437 -6.267 -15.489 1.00 0.00 C ATOM 1915 CG2 ILE A 123 1.225 -8.406 -16.143 1.00 0.00 C ATOM 1916 CD1 ILE A 123 3.913 -6.301 -15.860 1.00 0.00 C ATOM 0 H ILE A 123 0.170 -5.513 -14.460 1.00 0.00 H new ATOM 0 HA ILE A 123 0.316 -8.350 -13.633 1.00 0.00 H new ATOM 0 HB ILE A 123 2.698 -8.190 -14.588 1.00 0.00 H new ATOM 0 HG12 ILE A 123 1.865 -5.944 -16.359 1.00 0.00 H new ATOM 0 HG13 ILE A 123 2.289 -5.515 -14.714 1.00 0.00 H new ATOM 0 HG21 ILE A 123 1.959 -8.545 -16.937 1.00 0.00 H new ATOM 0 HG22 ILE A 123 0.895 -9.379 -15.780 1.00 0.00 H new ATOM 0 HG23 ILE A 123 0.369 -7.854 -16.532 1.00 0.00 H new ATOM 0 HD11 ILE A 123 4.226 -5.313 -16.198 1.00 0.00 H new ATOM 0 HD12 ILE A 123 4.501 -6.589 -14.988 1.00 0.00 H new ATOM 0 HD13 ILE A 123 4.071 -7.025 -16.659 1.00 0.00 H new ATOM 1928 N MET A 124 1.504 -5.728 -12.185 1.00 0.00 N ATOM 1929 CA MET A 124 2.071 -5.172 -10.945 1.00 0.00 C ATOM 1930 C MET A 124 1.218 -4.008 -10.442 1.00 0.00 C ATOM 1931 O MET A 124 0.616 -3.280 -11.232 1.00 0.00 O ATOM 1932 CB MET A 124 3.519 -4.694 -11.176 1.00 0.00 C ATOM 1933 CG MET A 124 4.559 -5.807 -11.026 1.00 0.00 C ATOM 1934 SD MET A 124 6.255 -5.257 -11.345 1.00 0.00 S ATOM 1935 CE MET A 124 6.244 -5.238 -13.152 1.00 0.00 C ATOM 0 H MET A 124 1.074 -5.013 -12.772 1.00 0.00 H new ATOM 0 HA MET A 124 2.076 -5.960 -10.192 1.00 0.00 H new ATOM 0 HB2 MET A 124 3.597 -4.266 -12.176 1.00 0.00 H new ATOM 0 HB3 MET A 124 3.747 -3.896 -10.469 1.00 0.00 H new ATOM 0 HG2 MET A 124 4.501 -6.214 -10.017 1.00 0.00 H new ATOM 0 HG3 MET A 124 4.313 -6.618 -11.711 1.00 0.00 H new ATOM 0 HE1 MET A 124 7.124 -4.707 -13.516 1.00 0.00 H new ATOM 0 HE2 MET A 124 6.257 -6.261 -13.527 1.00 0.00 H new ATOM 0 HE3 MET A 124 5.345 -4.734 -13.505 1.00 0.00 H new ATOM 1945 N PHE A 125 1.223 -3.801 -9.129 1.00 0.00 N ATOM 1946 CA PHE A 125 0.664 -2.621 -8.473 1.00 0.00 C ATOM 1947 C PHE A 125 1.791 -1.833 -7.822 1.00 0.00 C ATOM 1948 O PHE A 125 2.589 -2.380 -7.064 1.00 0.00 O ATOM 1949 CB PHE A 125 -0.379 -3.060 -7.434 1.00 0.00 C ATOM 1950 CG PHE A 125 -1.604 -3.700 -8.053 1.00 0.00 C ATOM 1951 CD1 PHE A 125 -2.463 -2.924 -8.853 1.00 0.00 C ATOM 1952 CD2 PHE A 125 -1.878 -5.066 -7.846 1.00 0.00 C ATOM 1953 CE1 PHE A 125 -3.594 -3.511 -9.444 1.00 0.00 C ATOM 1954 CE2 PHE A 125 -3.005 -5.652 -8.448 1.00 0.00 C ATOM 1955 CZ PHE A 125 -3.852 -4.878 -9.259 1.00 0.00 C ATOM 0 H PHE A 125 1.627 -4.468 -8.472 1.00 0.00 H new ATOM 0 HA PHE A 125 0.169 -1.980 -9.203 1.00 0.00 H new ATOM 0 HB2 PHE A 125 0.081 -3.765 -6.742 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -0.686 -2.194 -6.848 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -2.253 -1.877 -9.013 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -1.224 -5.662 -7.226 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -4.265 -2.911 -10.041 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -3.220 -6.698 -8.287 1.00 0.00 H new ATOM 0 HZ PHE A 125 -4.703 -5.336 -9.741 1.00 0.00 H new ATOM 1965 N ILE A 126 1.827 -0.532 -8.101 1.00 0.00 N ATOM 1966 CA ILE A 126 2.636 0.427 -7.347 1.00 0.00 C ATOM 1967 C ILE A 126 1.684 1.100 -6.361 1.00 0.00 C ATOM 1968 O ILE A 126 0.721 1.731 -6.800 1.00 0.00 O ATOM 1969 CB ILE A 126 3.330 1.453 -8.271 1.00 0.00 C ATOM 1970 CG1 ILE A 126 4.060 0.777 -9.454 1.00 0.00 C ATOM 1971 CG2 ILE A 126 4.305 2.293 -7.426 1.00 0.00 C ATOM 1972 CD1 ILE A 126 4.638 1.768 -10.470 1.00 0.00 C ATOM 0 H ILE A 126 1.293 -0.110 -8.861 1.00 0.00 H new ATOM 0 HA ILE A 126 3.449 -0.076 -6.824 1.00 0.00 H new ATOM 0 HB ILE A 126 2.569 2.097 -8.713 1.00 0.00 H new ATOM 0 HG12 ILE A 126 4.868 0.157 -9.064 1.00 0.00 H new ATOM 0 HG13 ILE A 126 3.365 0.111 -9.965 1.00 0.00 H new ATOM 0 HG21 ILE A 126 4.804 3.023 -8.064 1.00 0.00 H new ATOM 0 HG22 ILE A 126 3.753 2.813 -6.643 1.00 0.00 H new ATOM 0 HG23 ILE A 126 5.050 1.639 -6.972 1.00 0.00 H new ATOM 0 HD11 ILE A 126 5.135 1.220 -11.271 1.00 0.00 H new ATOM 0 HD12 ILE A 126 3.832 2.371 -10.889 1.00 0.00 H new ATOM 0 HD13 ILE A 126 5.358 2.419 -9.974 1.00 0.00 H new ATOM 1984 N LEU A 127 1.912 0.943 -5.059 1.00 0.00 N ATOM 1985 CA LEU A 127 1.146 1.619 -4.012 1.00 0.00 C ATOM 1986 C LEU A 127 1.929 2.870 -3.649 1.00 0.00 C ATOM 1987 O LEU A 127 3.059 2.752 -3.176 1.00 0.00 O ATOM 1988 CB LEU A 127 1.005 0.707 -2.775 1.00 0.00 C ATOM 1989 CG LEU A 127 -0.118 -0.345 -2.797 1.00 0.00 C ATOM 1990 CD1 LEU A 127 -1.442 0.271 -2.361 1.00 0.00 C ATOM 1991 CD2 LEU A 127 -0.235 -1.095 -4.133 1.00 0.00 C ATOM 0 H LEU A 127 2.645 0.334 -4.695 1.00 0.00 H new ATOM 0 HA LEU A 127 0.141 1.863 -4.356 1.00 0.00 H new ATOM 0 HB2 LEU A 127 1.952 0.187 -2.630 1.00 0.00 H new ATOM 0 HB3 LEU A 127 0.854 1.343 -1.903 1.00 0.00 H new ATOM 0 HG LEU A 127 0.157 -1.110 -2.071 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -2.222 -0.490 -2.384 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -1.345 0.662 -1.348 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -1.707 1.082 -3.039 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -1.047 -1.820 -4.074 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -0.441 -0.384 -4.933 1.00 0.00 H new ATOM 0 HD23 LEU A 127 0.700 -1.615 -4.342 1.00 0.00 H new ATOM 2003 N ASN A 128 1.346 4.050 -3.865 1.00 0.00 N ATOM 2004 CA ASN A 128 2.005 5.308 -3.476 1.00 0.00 C ATOM 2005 C ASN A 128 1.379 5.901 -2.207 1.00 0.00 C ATOM 2006 O ASN A 128 0.167 6.092 -2.159 1.00 0.00 O ATOM 2007 CB ASN A 128 2.029 6.348 -4.603 1.00 0.00 C ATOM 2008 CG ASN A 128 2.210 5.758 -5.998 1.00 0.00 C ATOM 2009 OD1 ASN A 128 3.267 5.258 -6.359 1.00 0.00 O ATOM 2010 ND2 ASN A 128 1.182 5.789 -6.820 1.00 0.00 N ATOM 0 H ASN A 128 0.431 4.166 -4.301 1.00 0.00 H new ATOM 0 HA ASN A 128 3.042 5.048 -3.264 1.00 0.00 H new ATOM 0 HB2 ASN A 128 1.098 6.914 -4.579 1.00 0.00 H new ATOM 0 HB3 ASN A 128 2.837 7.054 -4.412 1.00 0.00 H new ATOM 0 HD21 ASN A 128 1.267 5.396 -7.758 1.00 0.00 H new ATOM 0 HD22 ASN A 128 0.301 6.206 -6.519 1.00 0.00 H new ATOM 2017 N PHE A 129 2.195 6.203 -1.194 1.00 0.00 N ATOM 2018 CA PHE A 129 1.777 6.760 0.094 1.00 0.00 C ATOM 2019 C PHE A 129 2.078 8.267 0.171 1.00 0.00 C ATOM 2020 O PHE A 129 3.179 8.708 -0.156 1.00 0.00 O ATOM 2021 CB PHE A 129 2.477 5.991 1.233 1.00 0.00 C ATOM 2022 CG PHE A 129 2.306 4.475 1.255 1.00 0.00 C ATOM 2023 CD1 PHE A 129 1.183 3.846 0.677 1.00 0.00 C ATOM 2024 CD2 PHE A 129 3.282 3.683 1.891 1.00 0.00 C ATOM 2025 CE1 PHE A 129 1.038 2.449 0.742 1.00 0.00 C ATOM 2026 CE2 PHE A 129 3.143 2.284 1.942 1.00 0.00 C ATOM 2027 CZ PHE A 129 2.020 1.668 1.369 1.00 0.00 C ATOM 0 H PHE A 129 3.203 6.061 -1.251 1.00 0.00 H new ATOM 0 HA PHE A 129 0.698 6.644 0.199 1.00 0.00 H new ATOM 0 HB2 PHE A 129 3.544 6.211 1.184 1.00 0.00 H new ATOM 0 HB3 PHE A 129 2.113 6.386 2.182 1.00 0.00 H new ATOM 0 HD1 PHE A 129 0.430 4.441 0.182 1.00 0.00 H new ATOM 0 HD2 PHE A 129 4.143 4.153 2.343 1.00 0.00 H new ATOM 0 HE1 PHE A 129 0.169 1.976 0.308 1.00 0.00 H new ATOM 0 HE2 PHE A 129 3.901 1.684 2.423 1.00 0.00 H new ATOM 0 HZ PHE A 129 1.912 0.594 1.411 1.00 0.00 H new ATOM 2037 N GLU A 130 1.118 9.058 0.651 1.00 0.00 N ATOM 2038 CA GLU A 130 1.257 10.501 0.870 1.00 0.00 C ATOM 2039 C GLU A 130 0.521 10.886 2.160 1.00 0.00 C ATOM 2040 O GLU A 130 -0.703 10.821 2.202 1.00 0.00 O ATOM 2041 CB GLU A 130 0.662 11.269 -0.328 1.00 0.00 C ATOM 2042 CG GLU A 130 1.631 11.352 -1.514 1.00 0.00 C ATOM 2043 CD GLU A 130 1.063 12.252 -2.621 1.00 0.00 C ATOM 2044 OE1 GLU A 130 1.277 13.487 -2.568 1.00 0.00 O ATOM 2045 OE2 GLU A 130 0.409 11.733 -3.556 1.00 0.00 O ATOM 0 H GLU A 130 0.196 8.704 0.906 1.00 0.00 H new ATOM 0 HA GLU A 130 2.312 10.760 0.964 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -0.258 10.779 -0.648 1.00 0.00 H new ATOM 0 HB3 GLU A 130 0.393 12.277 -0.012 1.00 0.00 H new ATOM 0 HG2 GLU A 130 2.591 11.743 -1.178 1.00 0.00 H new ATOM 0 HG3 GLU A 130 1.815 10.353 -1.910 1.00 0.00 H new ATOM 2052 N VAL A 131 1.229 11.300 3.216 1.00 0.00 N ATOM 2053 CA VAL A 131 0.581 11.822 4.438 1.00 0.00 C ATOM 2054 C VAL A 131 -0.169 13.121 4.103 1.00 0.00 C ATOM 2055 O VAL A 131 0.429 14.126 3.721 1.00 0.00 O ATOM 2056 CB VAL A 131 1.539 11.929 5.648 1.00 0.00 C ATOM 2057 CG1 VAL A 131 2.811 12.732 5.359 1.00 0.00 C ATOM 2058 CG2 VAL A 131 0.831 12.488 6.892 1.00 0.00 C ATOM 0 H VAL A 131 2.248 11.287 3.256 1.00 0.00 H new ATOM 0 HA VAL A 131 -0.157 11.095 4.778 1.00 0.00 H new ATOM 0 HB VAL A 131 1.851 10.904 5.850 1.00 0.00 H new ATOM 0 HG11 VAL A 131 3.433 12.763 6.254 1.00 0.00 H new ATOM 0 HG12 VAL A 131 3.365 12.257 4.549 1.00 0.00 H new ATOM 0 HG13 VAL A 131 2.542 13.748 5.068 1.00 0.00 H new ATOM 0 HG21 VAL A 131 1.539 12.547 7.718 1.00 0.00 H new ATOM 0 HG22 VAL A 131 0.444 13.484 6.674 1.00 0.00 H new ATOM 0 HG23 VAL A 131 0.006 11.831 7.167 1.00 0.00 H new ATOM 2068 N VAL A 132 -1.500 13.052 4.188 1.00 0.00 N ATOM 2069 CA VAL A 132 -2.445 14.061 3.673 1.00 0.00 C ATOM 2070 C VAL A 132 -2.952 15.019 4.763 1.00 0.00 C ATOM 2071 O VAL A 132 -3.250 16.174 4.461 1.00 0.00 O ATOM 2072 CB VAL A 132 -3.606 13.385 2.902 1.00 0.00 C ATOM 2073 CG1 VAL A 132 -4.635 12.673 3.774 1.00 0.00 C ATOM 2074 CG2 VAL A 132 -4.302 14.360 1.939 1.00 0.00 C ATOM 0 H VAL A 132 -1.972 12.265 4.633 1.00 0.00 H new ATOM 0 HA VAL A 132 -1.894 14.685 2.969 1.00 0.00 H new ATOM 0 HB VAL A 132 -3.115 12.600 2.326 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -5.406 12.233 3.141 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -4.144 11.887 4.348 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -5.091 13.390 4.457 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -5.109 13.844 1.419 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -4.711 15.199 2.503 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -3.580 14.730 1.211 1.00 0.00 H new ATOM 2084 N MET A 133 -2.976 14.577 6.030 1.00 0.00 N ATOM 2085 CA MET A 133 -3.160 15.430 7.216 1.00 0.00 C ATOM 2086 C MET A 133 -2.685 14.723 8.486 1.00 0.00 C ATOM 2087 O MET A 133 -2.701 13.496 8.552 1.00 0.00 O ATOM 2088 CB MET A 133 -4.608 15.944 7.359 1.00 0.00 C ATOM 2089 CG MET A 133 -5.638 14.855 7.679 1.00 0.00 C ATOM 2090 SD MET A 133 -7.322 15.445 7.994 1.00 0.00 S ATOM 2091 CE MET A 133 -7.802 15.915 6.312 1.00 0.00 C ATOM 0 H MET A 133 -2.865 13.591 6.265 1.00 0.00 H new ATOM 0 HA MET A 133 -2.535 16.311 7.070 1.00 0.00 H new ATOM 0 HB2 MET A 133 -4.637 16.697 8.146 1.00 0.00 H new ATOM 0 HB3 MET A 133 -4.898 16.440 6.433 1.00 0.00 H new ATOM 0 HG2 MET A 133 -5.668 14.151 6.847 1.00 0.00 H new ATOM 0 HG3 MET A 133 -5.296 14.301 8.553 1.00 0.00 H new ATOM 0 HE1 MET A 133 -8.844 16.236 6.307 1.00 0.00 H new ATOM 0 HE2 MET A 133 -7.169 16.733 5.968 1.00 0.00 H new ATOM 0 HE3 MET A 133 -7.683 15.059 5.647 1.00 0.00 H new ATOM 2101 N GLU A 134 -2.293 15.474 9.512 1.00 0.00 N ATOM 2102 CA GLU A 134 -1.925 14.885 10.800 1.00 0.00 C ATOM 2103 C GLU A 134 -3.166 14.472 11.613 1.00 0.00 C ATOM 2104 O GLU A 134 -4.267 15.009 11.450 1.00 0.00 O ATOM 2105 CB GLU A 134 -0.989 15.818 11.589 1.00 0.00 C ATOM 2106 CG GLU A 134 -1.734 16.927 12.340 1.00 0.00 C ATOM 2107 CD GLU A 134 -0.782 18.059 12.751 1.00 0.00 C ATOM 2108 OE1 GLU A 134 -0.159 17.974 13.836 1.00 0.00 O ATOM 2109 OE2 GLU A 134 -0.649 19.049 11.991 1.00 0.00 O ATOM 0 H GLU A 134 -2.221 16.491 9.478 1.00 0.00 H new ATOM 0 HA GLU A 134 -1.369 13.969 10.602 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -0.415 15.227 12.303 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -0.274 16.270 10.902 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -2.527 17.327 11.709 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -2.212 16.511 13.227 1.00 0.00 H new ATOM 2116 N LYS A 135 -2.959 13.524 12.524 1.00 0.00 N ATOM 2117 CA LYS A 135 -3.839 13.223 13.671 1.00 0.00 C ATOM 2118 C LYS A 135 -3.149 13.450 15.029 1.00 0.00 C ATOM 2119 O LYS A 135 -3.879 13.722 16.011 1.00 0.00 O ATOM 2120 CB LYS A 135 -4.376 11.786 13.565 1.00 0.00 C ATOM 2121 CG LYS A 135 -5.323 11.546 12.376 1.00 0.00 C ATOM 2122 CD LYS A 135 -6.795 11.845 12.697 1.00 0.00 C ATOM 2123 CE LYS A 135 -7.128 13.284 13.111 1.00 0.00 C ATOM 2124 NZ LYS A 135 -6.961 14.283 12.013 1.00 0.00 N ATOM 2125 OXT LYS A 135 -1.900 13.397 15.117 1.00 0.00 O ATOM 0 H LYS A 135 -2.142 12.914 12.490 1.00 0.00 H new ATOM 0 HA LYS A 135 -4.673 13.923 13.628 1.00 0.00 H new ATOM 0 HB2 LYS A 135 -3.532 11.101 13.485 1.00 0.00 H new ATOM 0 HB3 LYS A 135 -4.901 11.539 14.488 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -5.008 12.169 11.539 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -5.233 10.509 12.053 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -7.393 11.596 11.820 1.00 0.00 H new ATOM 0 HD3 LYS A 135 -7.111 11.178 13.499 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -8.157 13.320 13.468 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -6.490 13.568 13.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -7.464 15.159 12.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -5.950 14.489 11.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -7.353 13.897 11.130 1.00 0.00 H new TER 2139 LYS A 135