USER MOD reduce.3.24.130724 H: found=0, std=0, add=1857, rem=0, adj=56 USER MOD reduce.3.24.130724 removed 1853 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: B 27 TYR OH : rot 167:sc= 0.0374 USER MOD Set 1.2: B 132 LYS NZ :NH3+ -162:sc= 0.0381 (180deg=0) USER MOD Set 2.1: B 73 ASN : amide:sc= 1.05 K(o=0.91,f=-0.093) USER MOD Set 2.2: B 95 HIS : no HD1:sc= -0.143 X(o=0.91,f=0.91) USER MOD Set 3.1: B 61 ASN : amide:sc= 0.683 K(o=1.7,f=0.38) USER MOD Set 3.2: B 62 GLN : amide:sc= 0.984 K(o=1.7,f=-3.7!) USER MOD Set 4.1: B 14 SER OG : rot 180:sc= 0.314 USER MOD Set 4.2: B 45 ASN : amide:sc= 0.3 K(o=0.0043,f=-8.9!) USER MOD Set 4.3: B 47 ASN : amide:sc= -0.61 K(o=0.0043,f=-0.85) USER MOD Set 5.1: B 11 THR OG1 : rot -109:sc= 2.08 USER MOD Set 5.2: B 82 SER OG : rot -149:sc= 1.31 USER MOD Set 6.1: B 10 SER OG : rot -88:sc= 1.94 USER MOD Set 6.2: B 13 ASN : amide:sc= -1.98 K(o=2.4,f=-0.62!) USER MOD Set 6.3: B 17 SER OG : rot -74:sc= 0.612 USER MOD Set 6.4: B 18 GLN : amide:sc= 0.225 K(o=2.4,f=0.55) USER MOD Set 6.5: B 64 SER OG : rot 34:sc= 1.59 USER MOD Set 7.1: A 87 SER OG : rot 166:sc= 0.998 USER MOD Set 7.2: A 91 LYS NZ :NH3+ 171:sc= 2.46 (180deg=1.21) USER MOD Set 8.1: A 71 SER OG : rot 70:sc= 0.247 USER MOD Set 8.2: A 74 THR OG1 : rot 91:sc= 0.824 USER MOD Set 9.1: A 7 THR OG1 : rot 171:sc= 1.61 USER MOD Set 9.2: A 10 SER OG : rot 80:sc= 1.24 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 173:sc= 1.71 (180deg=1.62) USER MOD Single : A 5 LYS NZ :NH3+ 173:sc= 1.28 (180deg=1.25) USER MOD Single : A 9 GLN : amide:sc= 1.16 K(o=1.2,f=0) USER MOD Single : A 12 SER OG : rot 71:sc= 0.959 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0.0349 USER MOD Single : A 16 SER OG : rot 61:sc= 1.29 USER MOD Single : A 32 SER OG : rot 170:sc= 0.92 USER MOD Single : A 33 LYS NZ :NH3+ -154:sc= 1.94 (180deg=1.21) USER MOD Single : A 34 MET CE :methyl -179:sc= 0 (180deg=-0.00305) USER MOD Single : A 44 GLN : amide:sc= 0.606 K(o=0.61,f=0) USER MOD Single : A 46 MET CE :methyl -157:sc= -0.434 (180deg=-1.41) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 LYS NZ :NH3+ -169:sc= 2.38 (180deg=2.18) USER MOD Single : A 54 LYS NZ :NH3+ 138:sc= 1.27 (180deg=0.508) USER MOD Single : A 60 ASN : amide:sc= -0.216 X(o=-0.22,f=-0.51) USER MOD Single : A 61 GLN : amide:sc= -1.12 X(o=-1.1,f=-1.6) USER MOD Single : A 63 THR OG1 : rot 155:sc= 0.97 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 1.6 (180deg=1.6) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 MET CE :methyl -135:sc= -1.13 (180deg=-2.26) USER MOD Single : A 79 LYS NZ :NH3+ 165:sc= 1.01 (180deg=0.863) USER MOD Single : A 86 THR OG1 : rot 180:sc= -0.106 USER MOD Single : A 93 LYS NZ :NH3+ 161:sc= 2.35 (180deg=1.99) USER MOD Single : A 97 GLN : amide:sc= 1.39 K(o=1.4,f=-0.025) USER MOD Single : A 101 ASN : amide:sc= -0.0306 X(o=-0.031,f=-0.0093) USER MOD Single : A 102 LYS NZ :NH3+ -179:sc= 1.2 (180deg=1.19) USER MOD Single : A 103 HIS : no HE2:sc= -0.708 K(o=-0.71,f=-3.7!) USER MOD Single : B 1 MET CE :methyl -176:sc= 0 (180deg=-0.0192) USER MOD Single : B 1 MET N :NH3+ 155:sc= 1.27 (180deg=1.07) USER MOD Single : B 3 ASN : amide:sc= 0.0567 X(o=0.057,f=-0.11) USER MOD Single : B 4 LYS NZ :NH3+ 161:sc= 1.29 (180deg=1.16) USER MOD Single : B 7 TYR OH : rot 165:sc= 0 USER MOD Single : B 19 MET CE :methyl -160:sc= 0 (180deg=-0.283) USER MOD Single : B 25 LYS NZ :NH3+ 161:sc= 1.66 (180deg=1.22) USER MOD Single : B 26 GLN : amide:sc= 0.0739 X(o=0.074,f=-0.24) USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 35 TYR OH : rot 30:sc= -0.124 USER MOD Single : B 36 SER OG : rot -99:sc= 1.25 USER MOD Single : B 42 HIS : no HE2:sc= 0.164 K(o=0.16,f=-1.5) USER MOD Single : B 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 52 MET CE :methyl -137:sc= -0.733 (180deg=-3.72!) USER MOD Single : B 53 LYS NZ :NH3+ 142:sc= 1.24 (180deg=0.242) USER MOD Single : B 60 SER OG : rot 100:sc= 1.24 USER MOD Single : B 63 THR OG1 : rot 180:sc= 0 USER MOD Single : B 69 SER OG : rot -160:sc= 0.0142 USER MOD Single : B 74 ASN : amide:sc= 1.12 K(o=1.1,f=-0.093) USER MOD Single : B 80 THR OG1 : rot -70:sc= 0.465 USER MOD Single : B 88 LYS NZ :NH3+ 172:sc= 1.16 (180deg=1.11) USER MOD Single : B 91 MET CE :methyl 164:sc= -2.49 (180deg=-3.66!) USER MOD Single : B 92 THR OG1 : rot 37:sc= 0.729 USER MOD Single : B 97 LYS NZ :NH3+ -173:sc= 1.16 (180deg=0.972) USER MOD Single : B 100 HIS : no HE2:sc= 0.993 K(o=0.99,f=-3.9!) USER MOD Single : B 110 GLN : amide:sc= 0.546 K(o=0.55,f=0) USER MOD Single : B 112 THR OG1 : rot -160:sc= 0.456 USER MOD Single : B 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 121 GLN : amide:sc= 1.11 K(o=1.1,f=0) USER MOD Single : B 129 ASN : amide:sc= 1.05 K(o=1,f=0) USER MOD Single : B 137 THR OG1 : rot -88:sc= 1.22 USER MOD Single : B 139 LYS NZ :NH3+ -176:sc= 1.09 (180deg=1.08) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -23.873 -11.006 -7.778 1.00 0.00 N ATOM 2 CA MET A 1 -23.892 -12.025 -8.842 1.00 0.00 C ATOM 3 C MET A 1 -22.797 -11.695 -9.853 1.00 0.00 C ATOM 4 O MET A 1 -22.871 -10.658 -10.515 1.00 0.00 O ATOM 5 CB MET A 1 -25.280 -12.142 -9.499 1.00 0.00 C ATOM 6 CG MET A 1 -25.326 -13.257 -10.552 1.00 0.00 C ATOM 7 SD MET A 1 -24.844 -14.897 -9.939 1.00 0.00 S ATOM 8 CE MET A 1 -25.000 -15.849 -11.475 1.00 0.00 C ATOM 0 H1 MET A 1 -24.687 -11.148 -7.146 1.00 0.00 H new ATOM 0 H2 MET A 1 -22.992 -11.091 -7.232 1.00 0.00 H new ATOM 0 H3 MET A 1 -23.927 -10.059 -8.204 1.00 0.00 H new ATOM 0 HA MET A 1 -23.691 -13.005 -8.410 1.00 0.00 H new ATOM 0 HB2 MET A 1 -26.029 -12.337 -8.732 1.00 0.00 H new ATOM 0 HB3 MET A 1 -25.542 -11.192 -9.965 1.00 0.00 H new ATOM 0 HG2 MET A 1 -26.337 -13.317 -10.955 1.00 0.00 H new ATOM 0 HG3 MET A 1 -24.669 -12.985 -11.379 1.00 0.00 H new ATOM 0 HE1 MET A 1 -24.740 -16.890 -11.286 1.00 0.00 H new ATOM 0 HE2 MET A 1 -26.027 -15.791 -11.836 1.00 0.00 H new ATOM 0 HE3 MET A 1 -24.327 -15.438 -12.228 1.00 0.00 H new ATOM 20 N ALA A 2 -21.809 -12.588 -9.974 1.00 0.00 N ATOM 21 CA ALA A 2 -20.551 -12.434 -10.701 1.00 0.00 C ATOM 22 C ALA A 2 -19.673 -11.303 -10.143 1.00 0.00 C ATOM 23 O ALA A 2 -20.130 -10.406 -9.432 1.00 0.00 O ATOM 24 CB ALA A 2 -20.785 -12.319 -12.216 1.00 0.00 C ATOM 0 H ALA A 2 -21.876 -13.505 -9.532 1.00 0.00 H new ATOM 0 HA ALA A 2 -19.979 -13.348 -10.539 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -19.828 -12.206 -12.724 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -21.283 -13.219 -12.577 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -21.411 -11.451 -12.423 1.00 0.00 H new ATOM 30 N ILE A 3 -18.384 -11.364 -10.482 1.00 0.00 N ATOM 31 CA ILE A 3 -17.387 -10.358 -10.174 1.00 0.00 C ATOM 32 C ILE A 3 -17.304 -9.493 -11.440 1.00 0.00 C ATOM 33 O ILE A 3 -16.775 -9.917 -12.471 1.00 0.00 O ATOM 34 CB ILE A 3 -16.068 -11.039 -9.696 1.00 0.00 C ATOM 35 CG1 ILE A 3 -16.104 -11.416 -8.198 1.00 0.00 C ATOM 36 CG2 ILE A 3 -14.849 -10.121 -9.880 1.00 0.00 C ATOM 37 CD1 ILE A 3 -17.078 -12.519 -7.802 1.00 0.00 C ATOM 0 H ILE A 3 -17.998 -12.153 -11.001 1.00 0.00 H new ATOM 0 HA ILE A 3 -17.631 -9.706 -9.335 1.00 0.00 H new ATOM 0 HB ILE A 3 -15.982 -11.934 -10.312 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -15.102 -11.721 -7.898 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -16.350 -10.521 -7.626 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -13.952 -10.634 -9.535 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -14.739 -9.869 -10.935 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -14.990 -9.208 -9.301 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -17.012 -12.694 -6.728 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -18.093 -12.217 -8.059 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -16.826 -13.436 -8.335 1.00 0.00 H new ATOM 49 N VAL A 4 -17.923 -8.314 -11.381 1.00 0.00 N ATOM 50 CA VAL A 4 -17.916 -7.294 -12.424 1.00 0.00 C ATOM 51 C VAL A 4 -16.529 -6.636 -12.444 1.00 0.00 C ATOM 52 O VAL A 4 -15.739 -6.785 -11.509 1.00 0.00 O ATOM 53 CB VAL A 4 -19.092 -6.312 -12.168 1.00 0.00 C ATOM 54 CG1 VAL A 4 -19.281 -5.226 -13.242 1.00 0.00 C ATOM 55 CG2 VAL A 4 -20.427 -7.078 -12.061 1.00 0.00 C ATOM 0 H VAL A 4 -18.468 -8.033 -10.566 1.00 0.00 H new ATOM 0 HA VAL A 4 -18.078 -7.709 -13.419 1.00 0.00 H new ATOM 0 HB VAL A 4 -18.821 -5.815 -11.236 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -20.126 -4.592 -12.973 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -18.378 -4.619 -13.309 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -19.473 -5.697 -14.206 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -21.238 -6.372 -11.882 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -20.613 -7.616 -12.990 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -20.374 -7.788 -11.235 1.00 0.00 H new ATOM 65 N LYS A 5 -16.233 -5.875 -13.495 1.00 0.00 N ATOM 66 CA LYS A 5 -15.065 -5.014 -13.582 1.00 0.00 C ATOM 67 C LYS A 5 -15.541 -3.640 -14.043 1.00 0.00 C ATOM 68 O LYS A 5 -16.352 -3.555 -14.969 1.00 0.00 O ATOM 69 CB LYS A 5 -14.001 -5.629 -14.506 1.00 0.00 C ATOM 70 CG LYS A 5 -12.692 -4.819 -14.477 1.00 0.00 C ATOM 71 CD LYS A 5 -11.557 -5.449 -15.297 1.00 0.00 C ATOM 72 CE LYS A 5 -11.904 -5.537 -16.791 1.00 0.00 C ATOM 73 NZ LYS A 5 -10.751 -5.987 -17.605 1.00 0.00 N ATOM 0 H LYS A 5 -16.817 -5.842 -14.330 1.00 0.00 H new ATOM 0 HA LYS A 5 -14.578 -4.909 -12.612 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -13.801 -6.656 -14.200 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -14.383 -5.669 -15.526 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -12.888 -3.816 -14.855 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -12.365 -4.712 -13.443 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -10.649 -4.860 -15.170 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -11.345 -6.448 -14.915 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -12.736 -6.227 -16.929 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -12.237 -4.561 -17.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -11.059 -6.146 -18.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -10.009 -5.258 -17.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -10.374 -6.873 -17.212 1.00 0.00 H new ATOM 87 N ALA A 6 -15.068 -2.586 -13.385 1.00 0.00 N ATOM 88 CA ALA A 6 -15.409 -1.201 -13.677 1.00 0.00 C ATOM 89 C ALA A 6 -14.247 -0.512 -14.414 1.00 0.00 C ATOM 90 O ALA A 6 -13.172 -1.088 -14.593 1.00 0.00 O ATOM 91 CB ALA A 6 -15.780 -0.475 -12.379 1.00 0.00 C ATOM 0 H ALA A 6 -14.414 -2.678 -12.607 1.00 0.00 H new ATOM 0 HA ALA A 6 -16.276 -1.166 -14.337 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -16.035 0.561 -12.602 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -16.636 -0.968 -11.918 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -14.934 -0.501 -11.693 1.00 0.00 H new ATOM 97 N THR A 7 -14.464 0.741 -14.813 1.00 0.00 N ATOM 98 CA THR A 7 -13.517 1.593 -15.517 1.00 0.00 C ATOM 99 C THR A 7 -13.580 3.003 -14.935 1.00 0.00 C ATOM 100 O THR A 7 -14.279 3.249 -13.947 1.00 0.00 O ATOM 101 CB THR A 7 -13.841 1.614 -17.027 1.00 0.00 C ATOM 102 OG1 THR A 7 -15.071 2.280 -17.270 1.00 0.00 O ATOM 103 CG2 THR A 7 -13.940 0.223 -17.629 1.00 0.00 C ATOM 0 H THR A 7 -15.354 1.210 -14.643 1.00 0.00 H new ATOM 0 HA THR A 7 -12.508 1.200 -15.391 1.00 0.00 H new ATOM 0 HB THR A 7 -13.012 2.143 -17.498 1.00 0.00 H new ATOM 0 HG1 THR A 7 -15.187 2.411 -18.234 1.00 0.00 H new ATOM 0 HG21 THR A 7 -14.169 0.302 -18.692 1.00 0.00 H new ATOM 0 HG22 THR A 7 -12.991 -0.298 -17.500 1.00 0.00 H new ATOM 0 HG23 THR A 7 -14.731 -0.335 -17.128 1.00 0.00 H new ATOM 111 N ASP A 8 -12.900 3.920 -15.624 1.00 0.00 N ATOM 112 CA ASP A 8 -12.910 5.376 -15.440 1.00 0.00 C ATOM 113 C ASP A 8 -14.316 5.970 -15.244 1.00 0.00 C ATOM 114 O ASP A 8 -14.460 6.986 -14.560 1.00 0.00 O ATOM 115 CB ASP A 8 -12.237 6.006 -16.670 1.00 0.00 C ATOM 116 CG ASP A 8 -12.340 7.539 -16.715 1.00 0.00 C ATOM 117 OD1 ASP A 8 -11.875 8.213 -15.770 1.00 0.00 O ATOM 118 OD2 ASP A 8 -12.869 8.070 -17.718 1.00 0.00 O ATOM 0 H ASP A 8 -12.279 3.645 -16.385 1.00 0.00 H new ATOM 0 HA ASP A 8 -12.370 5.602 -14.521 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -11.185 5.721 -16.683 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -12.690 5.594 -17.572 1.00 0.00 H new ATOM 123 N GLN A 9 -15.350 5.357 -15.836 1.00 0.00 N ATOM 124 CA GLN A 9 -16.728 5.845 -15.808 1.00 0.00 C ATOM 125 C GLN A 9 -17.751 4.730 -15.595 1.00 0.00 C ATOM 126 O GLN A 9 -18.858 5.012 -15.127 1.00 0.00 O ATOM 127 CB GLN A 9 -17.059 6.562 -17.120 1.00 0.00 C ATOM 128 CG GLN A 9 -16.309 7.893 -17.285 1.00 0.00 C ATOM 129 CD GLN A 9 -16.309 8.389 -18.731 1.00 0.00 C ATOM 130 OE1 GLN A 9 -17.354 8.588 -19.348 1.00 0.00 O ATOM 131 NE2 GLN A 9 -15.135 8.597 -19.306 1.00 0.00 N ATOM 0 H GLN A 9 -15.245 4.488 -16.359 1.00 0.00 H new ATOM 0 HA GLN A 9 -16.793 6.529 -14.962 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -16.814 5.908 -17.957 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -18.132 6.748 -17.165 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -16.768 8.647 -16.646 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -15.280 7.771 -16.946 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -14.275 8.429 -18.785 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -15.091 8.926 -20.271 1.00 0.00 H new ATOM 140 N SER A 10 -17.416 3.473 -15.913 1.00 0.00 N ATOM 141 CA SER A 10 -18.271 2.355 -15.522 1.00 0.00 C ATOM 142 C SER A 10 -18.408 2.351 -13.998 1.00 0.00 C ATOM 143 O SER A 10 -19.495 2.060 -13.504 1.00 0.00 O ATOM 144 CB SER A 10 -17.796 1.006 -16.070 1.00 0.00 C ATOM 145 OG SER A 10 -17.520 1.079 -17.456 1.00 0.00 O ATOM 0 H SER A 10 -16.576 3.212 -16.429 1.00 0.00 H new ATOM 0 HA SER A 10 -19.253 2.499 -15.973 1.00 0.00 H new ATOM 0 HB2 SER A 10 -16.900 0.690 -15.535 1.00 0.00 H new ATOM 0 HB3 SER A 10 -18.559 0.249 -15.889 1.00 0.00 H new ATOM 0 HG SER A 10 -16.639 1.486 -17.593 1.00 0.00 H new ATOM 151 N PHE A 11 -17.362 2.705 -13.232 1.00 0.00 N ATOM 152 CA PHE A 11 -17.569 2.947 -11.816 1.00 0.00 C ATOM 153 C PHE A 11 -18.331 4.262 -11.765 1.00 0.00 C ATOM 154 O PHE A 11 -17.871 5.281 -12.287 1.00 0.00 O ATOM 155 CB PHE A 11 -16.287 3.063 -11.006 1.00 0.00 C ATOM 156 CG PHE A 11 -16.512 3.186 -9.509 1.00 0.00 C ATOM 157 CD1 PHE A 11 -16.882 4.432 -8.962 1.00 0.00 C ATOM 158 CD2 PHE A 11 -16.338 2.073 -8.656 1.00 0.00 C ATOM 159 CE1 PHE A 11 -17.064 4.579 -7.578 1.00 0.00 C ATOM 160 CE2 PHE A 11 -16.486 2.245 -7.267 1.00 0.00 C ATOM 161 CZ PHE A 11 -16.848 3.488 -6.726 1.00 0.00 C ATOM 0 H PHE A 11 -16.405 2.824 -13.563 1.00 0.00 H new ATOM 0 HA PHE A 11 -18.097 2.104 -11.370 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -15.667 2.188 -11.199 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -15.728 3.933 -11.352 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -17.027 5.281 -9.614 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -16.095 1.103 -9.064 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -17.370 5.531 -7.171 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -16.318 1.407 -6.607 1.00 0.00 H new ATOM 0 HZ PHE A 11 -16.960 3.603 -5.658 1.00 0.00 H new ATOM 171 N SER A 12 -19.488 4.176 -11.136 1.00 0.00 N ATOM 172 CA SER A 12 -20.606 5.105 -11.019 1.00 0.00 C ATOM 173 C SER A 12 -21.798 4.411 -11.657 1.00 0.00 C ATOM 174 O SER A 12 -22.785 4.113 -10.983 1.00 0.00 O ATOM 175 CB SER A 12 -20.413 6.480 -11.686 1.00 0.00 C ATOM 176 OG SER A 12 -19.332 7.189 -11.110 1.00 0.00 O ATOM 0 H SER A 12 -19.698 3.324 -10.616 1.00 0.00 H new ATOM 0 HA SER A 12 -20.728 5.333 -9.960 1.00 0.00 H new ATOM 0 HB2 SER A 12 -20.234 6.346 -12.753 1.00 0.00 H new ATOM 0 HB3 SER A 12 -21.327 7.065 -11.587 1.00 0.00 H new ATOM 0 HG SER A 12 -18.488 6.762 -11.366 1.00 0.00 H new ATOM 182 N ALA A 13 -21.691 4.092 -12.950 1.00 0.00 N ATOM 183 CA ALA A 13 -22.795 3.513 -13.689 1.00 0.00 C ATOM 184 C ALA A 13 -23.155 2.136 -13.121 1.00 0.00 C ATOM 185 O ALA A 13 -24.328 1.793 -12.980 1.00 0.00 O ATOM 186 CB ALA A 13 -22.412 3.411 -15.168 1.00 0.00 C ATOM 0 H ALA A 13 -20.843 4.229 -13.501 1.00 0.00 H new ATOM 0 HA ALA A 13 -23.673 4.152 -13.593 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -23.239 2.976 -15.729 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -22.193 4.406 -15.557 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -21.530 2.779 -15.273 1.00 0.00 H new ATOM 192 N GLU A 14 -22.127 1.364 -12.768 1.00 0.00 N ATOM 193 CA GLU A 14 -22.226 0.028 -12.210 1.00 0.00 C ATOM 194 C GLU A 14 -22.507 0.050 -10.702 1.00 0.00 C ATOM 195 O GLU A 14 -22.809 -1.007 -10.147 1.00 0.00 O ATOM 196 CB GLU A 14 -20.920 -0.750 -12.480 1.00 0.00 C ATOM 197 CG GLU A 14 -20.695 -1.033 -13.976 1.00 0.00 C ATOM 198 CD GLU A 14 -21.718 -1.992 -14.616 1.00 0.00 C ATOM 199 OE1 GLU A 14 -22.418 -2.733 -13.890 1.00 0.00 O ATOM 200 OE2 GLU A 14 -21.825 -2.012 -15.863 1.00 0.00 O ATOM 0 H GLU A 14 -21.161 1.674 -12.871 1.00 0.00 H new ATOM 0 HA GLU A 14 -23.066 -0.467 -12.697 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -20.076 -0.180 -12.091 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -20.945 -1.694 -11.936 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -20.718 -0.087 -14.517 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -19.697 -1.451 -14.106 1.00 0.00 H new ATOM 207 N THR A 15 -22.445 1.211 -10.035 1.00 0.00 N ATOM 208 CA THR A 15 -22.453 1.288 -8.575 1.00 0.00 C ATOM 209 C THR A 15 -23.583 2.143 -7.977 1.00 0.00 C ATOM 210 O THR A 15 -23.761 2.151 -6.756 1.00 0.00 O ATOM 211 CB THR A 15 -21.064 1.790 -8.136 1.00 0.00 C ATOM 212 OG1 THR A 15 -20.845 3.090 -8.640 1.00 0.00 O ATOM 213 CG2 THR A 15 -19.904 0.961 -8.694 1.00 0.00 C ATOM 0 H THR A 15 -22.388 2.119 -10.495 1.00 0.00 H new ATOM 0 HA THR A 15 -22.660 0.292 -8.185 1.00 0.00 H new ATOM 0 HB THR A 15 -21.076 1.732 -7.048 1.00 0.00 H new ATOM 0 HG1 THR A 15 -19.961 3.406 -8.357 1.00 0.00 H new ATOM 0 HG21 THR A 15 -18.959 1.375 -8.342 1.00 0.00 H new ATOM 0 HG22 THR A 15 -19.998 -0.071 -8.354 1.00 0.00 H new ATOM 0 HG23 THR A 15 -19.929 0.988 -9.783 1.00 0.00 H new ATOM 221 N SER A 16 -24.368 2.843 -8.801 1.00 0.00 N ATOM 222 CA SER A 16 -25.385 3.784 -8.329 1.00 0.00 C ATOM 223 C SER A 16 -26.682 3.098 -7.879 1.00 0.00 C ATOM 224 O SER A 16 -27.601 3.785 -7.434 1.00 0.00 O ATOM 225 CB SER A 16 -25.678 4.822 -9.419 1.00 0.00 C ATOM 226 OG SER A 16 -24.532 5.609 -9.686 1.00 0.00 O ATOM 0 H SER A 16 -24.315 2.772 -9.817 1.00 0.00 H new ATOM 0 HA SER A 16 -24.978 4.277 -7.446 1.00 0.00 H new ATOM 0 HB2 SER A 16 -25.999 4.318 -10.331 1.00 0.00 H new ATOM 0 HB3 SER A 16 -26.500 5.464 -9.104 1.00 0.00 H new ATOM 0 HG SER A 16 -23.807 5.033 -10.005 1.00 0.00 H new ATOM 232 N GLU A 17 -26.786 1.769 -7.978 1.00 0.00 N ATOM 233 CA GLU A 17 -27.987 1.019 -7.635 1.00 0.00 C ATOM 234 C GLU A 17 -27.601 -0.281 -6.925 1.00 0.00 C ATOM 235 O GLU A 17 -26.561 -0.870 -7.235 1.00 0.00 O ATOM 236 CB GLU A 17 -28.814 0.710 -8.897 1.00 0.00 C ATOM 237 CG GLU A 17 -29.420 1.957 -9.558 1.00 0.00 C ATOM 238 CD GLU A 17 -30.336 1.581 -10.737 1.00 0.00 C ATOM 239 OE1 GLU A 17 -29.851 1.477 -11.887 1.00 0.00 O ATOM 240 OE2 GLU A 17 -31.558 1.401 -10.532 1.00 0.00 O ATOM 0 H GLU A 17 -26.021 1.179 -8.305 1.00 0.00 H new ATOM 0 HA GLU A 17 -28.598 1.625 -6.966 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -28.179 0.198 -9.620 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -29.617 0.022 -8.635 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -29.989 2.522 -8.819 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -28.620 2.608 -9.910 1.00 0.00 H new ATOM 247 N GLY A 18 -28.453 -0.734 -5.997 1.00 0.00 N ATOM 248 CA GLY A 18 -28.197 -1.881 -5.137 1.00 0.00 C ATOM 249 C GLY A 18 -27.085 -1.596 -4.136 1.00 0.00 C ATOM 250 O GLY A 18 -26.592 -0.470 -4.037 1.00 0.00 O ATOM 0 H GLY A 18 -29.359 -0.298 -5.824 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -29.109 -2.146 -4.602 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -27.925 -2.741 -5.749 1.00 0.00 H new ATOM 254 N VAL A 19 -26.704 -2.621 -3.381 1.00 0.00 N ATOM 255 CA VAL A 19 -25.517 -2.587 -2.533 1.00 0.00 C ATOM 256 C VAL A 19 -24.409 -3.244 -3.352 1.00 0.00 C ATOM 257 O VAL A 19 -24.607 -4.311 -3.943 1.00 0.00 O ATOM 258 CB VAL A 19 -25.798 -3.154 -1.119 1.00 0.00 C ATOM 259 CG1 VAL A 19 -24.562 -2.935 -0.238 1.00 0.00 C ATOM 260 CG2 VAL A 19 -27.018 -2.444 -0.506 1.00 0.00 C ATOM 0 H VAL A 19 -27.213 -3.504 -3.340 1.00 0.00 H new ATOM 0 HA VAL A 19 -25.186 -1.579 -2.281 1.00 0.00 H new ATOM 0 HB VAL A 19 -26.012 -4.221 -1.185 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -24.751 -3.331 0.760 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -23.707 -3.449 -0.677 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -24.348 -1.868 -0.170 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -27.211 -2.846 0.488 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -26.818 -1.375 -0.432 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -27.890 -2.607 -1.139 1.00 0.00 H new ATOM 270 N VAL A 20 -23.265 -2.562 -3.433 1.00 0.00 N ATOM 271 CA VAL A 20 -22.183 -2.894 -4.338 1.00 0.00 C ATOM 272 C VAL A 20 -20.859 -2.798 -3.586 1.00 0.00 C ATOM 273 O VAL A 20 -20.470 -1.747 -3.078 1.00 0.00 O ATOM 274 CB VAL A 20 -22.217 -1.961 -5.571 1.00 0.00 C ATOM 275 CG1 VAL A 20 -21.200 -2.457 -6.604 1.00 0.00 C ATOM 276 CG2 VAL A 20 -23.608 -1.881 -6.224 1.00 0.00 C ATOM 0 H VAL A 20 -23.069 -1.746 -2.854 1.00 0.00 H new ATOM 0 HA VAL A 20 -22.296 -3.915 -4.703 1.00 0.00 H new ATOM 0 HB VAL A 20 -21.967 -0.958 -5.226 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -21.219 -1.803 -7.476 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -20.202 -2.448 -6.165 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -21.454 -3.473 -6.906 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -23.569 -1.212 -7.083 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -23.914 -2.875 -6.552 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -24.328 -1.500 -5.500 1.00 0.00 H new ATOM 286 N LEU A 21 -20.163 -3.925 -3.529 1.00 0.00 N ATOM 287 CA LEU A 21 -18.798 -4.043 -3.040 1.00 0.00 C ATOM 288 C LEU A 21 -17.869 -3.757 -4.219 1.00 0.00 C ATOM 289 O LEU A 21 -17.779 -4.591 -5.119 1.00 0.00 O ATOM 290 CB LEU A 21 -18.635 -5.475 -2.487 1.00 0.00 C ATOM 291 CG LEU A 21 -17.342 -5.829 -1.733 1.00 0.00 C ATOM 292 CD1 LEU A 21 -16.079 -5.792 -2.595 1.00 0.00 C ATOM 293 CD2 LEU A 21 -17.154 -4.935 -0.504 1.00 0.00 C ATOM 0 H LEU A 21 -20.550 -4.818 -3.835 1.00 0.00 H new ATOM 0 HA LEU A 21 -18.559 -3.341 -2.242 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -19.473 -5.669 -1.817 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -18.730 -6.166 -3.324 1.00 0.00 H new ATOM 0 HG LEU A 21 -17.475 -6.865 -1.422 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -15.214 -6.054 -1.985 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -16.176 -6.506 -3.413 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -15.946 -4.790 -3.002 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -16.232 -5.209 0.008 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -17.099 -3.893 -0.817 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -17.998 -5.066 0.174 1.00 0.00 H new ATOM 305 N ALA A 22 -17.192 -2.607 -4.258 1.00 0.00 N ATOM 306 CA ALA A 22 -16.139 -2.386 -5.240 1.00 0.00 C ATOM 307 C ALA A 22 -14.802 -2.681 -4.580 1.00 0.00 C ATOM 308 O ALA A 22 -14.599 -2.364 -3.407 1.00 0.00 O ATOM 309 CB ALA A 22 -16.168 -0.970 -5.819 1.00 0.00 C ATOM 0 H ALA A 22 -17.355 -1.824 -3.625 1.00 0.00 H new ATOM 0 HA ALA A 22 -16.298 -3.057 -6.084 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -15.363 -0.857 -6.545 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -17.126 -0.797 -6.309 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -16.035 -0.246 -5.015 1.00 0.00 H new ATOM 315 N ASP A 23 -13.887 -3.252 -5.351 1.00 0.00 N ATOM 316 CA ASP A 23 -12.583 -3.723 -4.918 1.00 0.00 C ATOM 317 C ASP A 23 -11.537 -3.284 -5.938 1.00 0.00 C ATOM 318 O ASP A 23 -11.849 -3.064 -7.106 1.00 0.00 O ATOM 319 CB ASP A 23 -12.601 -5.246 -4.775 1.00 0.00 C ATOM 320 CG ASP A 23 -11.185 -5.813 -4.602 1.00 0.00 C ATOM 321 OD1 ASP A 23 -10.523 -5.509 -3.589 1.00 0.00 O ATOM 322 OD2 ASP A 23 -10.741 -6.555 -5.505 1.00 0.00 O ATOM 0 H ASP A 23 -14.045 -3.406 -6.347 1.00 0.00 H new ATOM 0 HA ASP A 23 -12.334 -3.296 -3.946 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -13.213 -5.524 -3.917 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -13.066 -5.689 -5.655 1.00 0.00 H new ATOM 327 N PHE A 24 -10.300 -3.107 -5.498 1.00 0.00 N ATOM 328 CA PHE A 24 -9.229 -2.495 -6.256 1.00 0.00 C ATOM 329 C PHE A 24 -8.036 -3.427 -6.101 1.00 0.00 C ATOM 330 O PHE A 24 -7.534 -3.597 -4.984 1.00 0.00 O ATOM 331 CB PHE A 24 -8.972 -1.085 -5.705 1.00 0.00 C ATOM 332 CG PHE A 24 -10.065 -0.070 -6.021 1.00 0.00 C ATOM 333 CD1 PHE A 24 -11.336 -0.149 -5.417 1.00 0.00 C ATOM 334 CD2 PHE A 24 -9.824 0.944 -6.966 1.00 0.00 C ATOM 335 CE1 PHE A 24 -12.371 0.717 -5.809 1.00 0.00 C ATOM 336 CE2 PHE A 24 -10.850 1.833 -7.336 1.00 0.00 C ATOM 337 CZ PHE A 24 -12.128 1.713 -6.767 1.00 0.00 C ATOM 0 H PHE A 24 -10.008 -3.399 -4.565 1.00 0.00 H new ATOM 0 HA PHE A 24 -9.457 -2.369 -7.315 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -8.855 -1.148 -4.623 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -8.027 -0.719 -6.107 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -11.516 -0.883 -4.645 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -8.845 1.041 -7.411 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -13.354 0.616 -5.373 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -10.654 2.610 -8.060 1.00 0.00 H new ATOM 0 HZ PHE A 24 -12.920 2.384 -7.065 1.00 0.00 H new ATOM 347 N TRP A 25 -7.621 -4.039 -7.215 1.00 0.00 N ATOM 348 CA TRP A 25 -6.645 -5.124 -7.287 1.00 0.00 C ATOM 349 C TRP A 25 -5.680 -4.824 -8.440 1.00 0.00 C ATOM 350 O TRP A 25 -6.079 -4.162 -9.398 1.00 0.00 O ATOM 351 CB TRP A 25 -7.359 -6.464 -7.533 1.00 0.00 C ATOM 352 CG TRP A 25 -7.632 -6.777 -8.976 1.00 0.00 C ATOM 353 CD1 TRP A 25 -8.472 -6.086 -9.777 1.00 0.00 C ATOM 354 CD2 TRP A 25 -6.963 -7.737 -9.852 1.00 0.00 C ATOM 355 NE1 TRP A 25 -8.378 -6.542 -11.072 1.00 0.00 N ATOM 356 CE2 TRP A 25 -7.412 -7.521 -11.190 1.00 0.00 C ATOM 357 CE3 TRP A 25 -5.987 -8.740 -9.655 1.00 0.00 C ATOM 358 CZ2 TRP A 25 -6.874 -8.231 -12.277 1.00 0.00 C ATOM 359 CZ3 TRP A 25 -5.453 -9.464 -10.736 1.00 0.00 C ATOM 360 CH2 TRP A 25 -5.888 -9.204 -12.048 1.00 0.00 C ATOM 0 H TRP A 25 -7.976 -3.776 -8.134 1.00 0.00 H new ATOM 0 HA TRP A 25 -6.097 -5.197 -6.347 1.00 0.00 H new ATOM 0 HB2 TRP A 25 -6.753 -7.265 -7.110 1.00 0.00 H new ATOM 0 HB3 TRP A 25 -8.305 -6.460 -6.991 1.00 0.00 H new ATOM 0 HD1 TRP A 25 -9.124 -5.290 -9.448 1.00 0.00 H new ATOM 0 HE1 TRP A 25 -8.949 -6.200 -11.845 1.00 0.00 H new ATOM 0 HE3 TRP A 25 -5.644 -8.955 -8.654 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 -7.217 -8.030 -13.281 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 -4.706 -10.223 -10.558 1.00 0.00 H new ATOM 0 HH2 TRP A 25 -5.465 -9.751 -12.877 1.00 0.00 H new ATOM 371 N ALA A 26 -4.441 -5.312 -8.396 1.00 0.00 N ATOM 372 CA ALA A 26 -3.513 -5.274 -9.529 1.00 0.00 C ATOM 373 C ALA A 26 -2.295 -6.145 -9.211 1.00 0.00 C ATOM 374 O ALA A 26 -2.054 -6.427 -8.036 1.00 0.00 O ATOM 375 CB ALA A 26 -3.050 -3.838 -9.792 1.00 0.00 C ATOM 0 H ALA A 26 -4.047 -5.750 -7.563 1.00 0.00 H new ATOM 0 HA ALA A 26 -4.022 -5.650 -10.416 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -2.361 -3.827 -10.637 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -3.914 -3.213 -10.020 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -2.545 -3.451 -8.907 1.00 0.00 H new ATOM 381 N PRO A 27 -1.482 -6.534 -10.207 1.00 0.00 N ATOM 382 CA PRO A 27 -0.333 -7.413 -10.012 1.00 0.00 C ATOM 383 C PRO A 27 0.687 -6.979 -8.943 1.00 0.00 C ATOM 384 O PRO A 27 1.477 -7.824 -8.517 1.00 0.00 O ATOM 385 CB PRO A 27 0.327 -7.533 -11.391 1.00 0.00 C ATOM 386 CG PRO A 27 -0.825 -7.288 -12.364 1.00 0.00 C ATOM 387 CD PRO A 27 -1.678 -6.266 -11.628 1.00 0.00 C ATOM 0 HA PRO A 27 -0.693 -8.362 -9.613 1.00 0.00 H new ATOM 0 HB2 PRO A 27 1.123 -6.800 -11.520 1.00 0.00 H new ATOM 0 HB3 PRO A 27 0.773 -8.517 -11.538 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -0.471 -6.905 -13.321 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -1.380 -8.203 -12.572 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -1.375 -5.250 -11.880 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -2.728 -6.363 -11.903 1.00 0.00 H new ATOM 395 N TRP A 28 0.687 -5.714 -8.497 1.00 0.00 N ATOM 396 CA TRP A 28 1.685 -5.151 -7.585 1.00 0.00 C ATOM 397 C TRP A 28 1.817 -5.882 -6.248 1.00 0.00 C ATOM 398 O TRP A 28 2.901 -5.830 -5.670 1.00 0.00 O ATOM 399 CB TRP A 28 1.393 -3.666 -7.335 1.00 0.00 C ATOM 400 CG TRP A 28 1.036 -2.853 -8.543 1.00 0.00 C ATOM 401 CD1 TRP A 28 -0.191 -2.355 -8.785 1.00 0.00 C ATOM 402 CD2 TRP A 28 1.855 -2.441 -9.680 1.00 0.00 C ATOM 403 NE1 TRP A 28 -0.207 -1.659 -9.975 1.00 0.00 N ATOM 404 CE2 TRP A 28 1.033 -1.690 -10.578 1.00 0.00 C ATOM 405 CE3 TRP A 28 3.204 -2.632 -10.048 1.00 0.00 C ATOM 406 CZ2 TRP A 28 1.531 -1.164 -11.779 1.00 0.00 C ATOM 407 CZ3 TRP A 28 3.712 -2.103 -11.251 1.00 0.00 C ATOM 408 CH2 TRP A 28 2.878 -1.374 -12.117 1.00 0.00 C ATOM 0 H TRP A 28 -0.027 -5.039 -8.770 1.00 0.00 H new ATOM 0 HA TRP A 28 2.642 -5.280 -8.090 1.00 0.00 H new ATOM 0 HB2 TRP A 28 0.575 -3.593 -6.618 1.00 0.00 H new ATOM 0 HB3 TRP A 28 2.269 -3.218 -6.866 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -1.045 -2.483 -8.136 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -1.025 -1.185 -10.358 1.00 0.00 H new ATOM 0 HE3 TRP A 28 3.858 -3.193 -9.397 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 0.885 -0.603 -12.438 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 4.749 -2.259 -11.510 1.00 0.00 H new ATOM 0 HH2 TRP A 28 3.272 -0.976 -13.040 1.00 0.00 H new ATOM 419 N CYS A 29 0.764 -6.545 -5.748 1.00 0.00 N ATOM 420 CA CYS A 29 0.753 -7.071 -4.382 1.00 0.00 C ATOM 421 C CYS A 29 0.175 -8.478 -4.304 1.00 0.00 C ATOM 422 O CYS A 29 -0.561 -8.907 -5.193 1.00 0.00 O ATOM 423 CB CYS A 29 -0.036 -6.106 -3.478 1.00 0.00 C ATOM 424 SG CYS A 29 0.768 -5.624 -1.919 1.00 0.00 S ATOM 0 H CYS A 29 -0.091 -6.728 -6.273 1.00 0.00 H new ATOM 0 HA CYS A 29 1.785 -7.144 -4.038 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -0.249 -5.201 -4.047 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -0.995 -6.567 -3.240 1.00 0.00 H new ATOM 429 N GLY A 30 0.504 -9.187 -3.222 1.00 0.00 N ATOM 430 CA GLY A 30 -0.015 -10.514 -2.914 1.00 0.00 C ATOM 431 C GLY A 30 -1.527 -10.516 -2.678 1.00 0.00 C ATOM 432 O GLY A 30 -2.209 -11.329 -3.302 1.00 0.00 O ATOM 0 H GLY A 30 1.157 -8.841 -2.519 1.00 0.00 H new ATOM 0 HA2 GLY A 30 0.222 -11.192 -3.734 1.00 0.00 H new ATOM 0 HA3 GLY A 30 0.488 -10.900 -2.027 1.00 0.00 H new ATOM 436 N PRO A 31 -2.092 -9.611 -1.846 1.00 0.00 N ATOM 437 CA PRO A 31 -3.531 -9.503 -1.625 1.00 0.00 C ATOM 438 C PRO A 31 -4.384 -9.466 -2.882 1.00 0.00 C ATOM 439 O PRO A 31 -5.488 -9.995 -2.854 1.00 0.00 O ATOM 440 CB PRO A 31 -3.733 -8.234 -0.808 1.00 0.00 C ATOM 441 CG PRO A 31 -2.470 -8.199 0.048 1.00 0.00 C ATOM 442 CD PRO A 31 -1.400 -8.734 -0.906 1.00 0.00 C ATOM 0 HA PRO A 31 -3.867 -10.406 -1.116 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -3.820 -7.351 -1.441 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -4.636 -8.281 -0.200 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -2.240 -7.189 0.389 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -2.567 -8.821 0.938 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -0.903 -7.918 -1.430 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -0.630 -9.279 -0.360 1.00 0.00 H new ATOM 450 N SER A 32 -3.904 -8.935 -4.001 1.00 0.00 N ATOM 451 CA SER A 32 -4.645 -8.943 -5.255 1.00 0.00 C ATOM 452 C SER A 32 -5.001 -10.350 -5.726 1.00 0.00 C ATOM 453 O SER A 32 -6.009 -10.520 -6.409 1.00 0.00 O ATOM 454 CB SER A 32 -3.794 -8.234 -6.306 1.00 0.00 C ATOM 455 OG SER A 32 -3.176 -7.089 -5.749 1.00 0.00 O ATOM 0 H SER A 32 -2.990 -8.487 -4.063 1.00 0.00 H new ATOM 0 HA SER A 32 -5.593 -8.428 -5.100 1.00 0.00 H new ATOM 0 HB2 SER A 32 -3.034 -8.916 -6.688 1.00 0.00 H new ATOM 0 HB3 SER A 32 -4.417 -7.944 -7.152 1.00 0.00 H new ATOM 0 HG SER A 32 -2.511 -6.738 -6.377 1.00 0.00 H new ATOM 461 N LYS A 33 -4.226 -11.358 -5.319 1.00 0.00 N ATOM 462 CA LYS A 33 -4.461 -12.761 -5.649 1.00 0.00 C ATOM 463 C LYS A 33 -5.051 -13.533 -4.460 1.00 0.00 C ATOM 464 O LYS A 33 -5.138 -14.757 -4.522 1.00 0.00 O ATOM 465 CB LYS A 33 -3.194 -13.456 -6.179 1.00 0.00 C ATOM 466 CG LYS A 33 -2.440 -12.731 -7.309 1.00 0.00 C ATOM 467 CD LYS A 33 -1.377 -11.762 -6.773 1.00 0.00 C ATOM 468 CE LYS A 33 -0.576 -11.119 -7.915 1.00 0.00 C ATOM 469 NZ LYS A 33 0.538 -10.293 -7.389 1.00 0.00 N ATOM 0 H LYS A 33 -3.400 -11.216 -4.738 1.00 0.00 H new ATOM 0 HA LYS A 33 -5.197 -12.769 -6.453 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -2.507 -13.597 -5.345 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -3.471 -14.448 -6.535 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -1.963 -13.468 -7.956 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -3.153 -12.181 -7.924 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -1.858 -10.983 -6.181 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -0.699 -12.296 -6.107 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -0.179 -11.897 -8.567 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -1.236 -10.500 -8.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 0.776 -9.552 -8.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 0.250 -9.852 -6.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 1.370 -10.895 -7.227 1.00 0.00 H new ATOM 483 N MET A 34 -5.465 -12.847 -3.386 1.00 0.00 N ATOM 484 CA MET A 34 -6.097 -13.457 -2.212 1.00 0.00 C ATOM 485 C MET A 34 -7.490 -12.857 -2.013 1.00 0.00 C ATOM 486 O MET A 34 -8.458 -13.595 -1.853 1.00 0.00 O ATOM 487 CB MET A 34 -5.229 -13.275 -0.957 1.00 0.00 C ATOM 488 CG MET A 34 -3.835 -13.900 -1.103 1.00 0.00 C ATOM 489 SD MET A 34 -2.877 -14.010 0.438 1.00 0.00 S ATOM 490 CE MET A 34 -2.643 -12.256 0.838 1.00 0.00 C ATOM 0 H MET A 34 -5.368 -11.835 -3.309 1.00 0.00 H new ATOM 0 HA MET A 34 -6.196 -14.529 -2.381 1.00 0.00 H new ATOM 0 HB2 MET A 34 -5.125 -12.211 -0.744 1.00 0.00 H new ATOM 0 HB3 MET A 34 -5.736 -13.723 -0.102 1.00 0.00 H new ATOM 0 HG2 MET A 34 -3.944 -14.902 -1.517 1.00 0.00 H new ATOM 0 HG3 MET A 34 -3.266 -13.316 -1.826 1.00 0.00 H new ATOM 0 HE1 MET A 34 -2.055 -12.166 1.752 1.00 0.00 H new ATOM 0 HE2 MET A 34 -2.119 -11.763 0.019 1.00 0.00 H new ATOM 0 HE3 MET A 34 -3.614 -11.783 0.984 1.00 0.00 H new ATOM 500 N ILE A 35 -7.628 -11.534 -2.129 1.00 0.00 N ATOM 501 CA ILE A 35 -8.912 -10.852 -2.175 1.00 0.00 C ATOM 502 C ILE A 35 -9.700 -11.337 -3.403 1.00 0.00 C ATOM 503 O ILE A 35 -10.916 -11.478 -3.329 1.00 0.00 O ATOM 504 CB ILE A 35 -8.701 -9.312 -2.112 1.00 0.00 C ATOM 505 CG1 ILE A 35 -9.785 -8.626 -1.250 1.00 0.00 C ATOM 506 CG2 ILE A 35 -8.606 -8.636 -3.488 1.00 0.00 C ATOM 507 CD1 ILE A 35 -9.412 -8.698 0.237 1.00 0.00 C ATOM 0 H ILE A 35 -6.832 -10.900 -2.194 1.00 0.00 H new ATOM 0 HA ILE A 35 -9.519 -11.099 -1.304 1.00 0.00 H new ATOM 0 HB ILE A 35 -7.729 -9.179 -1.637 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -9.895 -7.585 -1.554 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -10.748 -9.109 -1.414 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -8.459 -7.564 -3.357 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -7.764 -9.053 -4.041 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -9.527 -8.811 -4.044 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -10.186 -8.210 0.830 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -9.326 -9.741 0.540 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -8.459 -8.193 0.398 1.00 0.00 H new ATOM 519 N ALA A 36 -9.016 -11.632 -4.522 1.00 0.00 N ATOM 520 CA ALA A 36 -9.639 -12.161 -5.733 1.00 0.00 C ATOM 521 C ALA A 36 -10.428 -13.456 -5.463 1.00 0.00 C ATOM 522 O ALA A 36 -11.649 -13.435 -5.629 1.00 0.00 O ATOM 523 CB ALA A 36 -8.607 -12.301 -6.868 1.00 0.00 C ATOM 0 H ALA A 36 -8.007 -11.507 -4.605 1.00 0.00 H new ATOM 0 HA ALA A 36 -10.381 -11.438 -6.072 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -9.096 -12.697 -7.758 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -8.179 -11.324 -7.093 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -7.814 -12.981 -6.557 1.00 0.00 H new ATOM 529 N PRO A 37 -9.799 -14.550 -4.992 1.00 0.00 N ATOM 530 CA PRO A 37 -10.522 -15.765 -4.640 1.00 0.00 C ATOM 531 C PRO A 37 -11.569 -15.505 -3.563 1.00 0.00 C ATOM 532 O PRO A 37 -12.673 -16.029 -3.664 1.00 0.00 O ATOM 533 CB PRO A 37 -9.483 -16.788 -4.168 1.00 0.00 C ATOM 534 CG PRO A 37 -8.163 -16.025 -4.080 1.00 0.00 C ATOM 535 CD PRO A 37 -8.367 -14.759 -4.905 1.00 0.00 C ATOM 0 HA PRO A 37 -11.067 -16.142 -5.505 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -9.758 -17.208 -3.200 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -9.408 -17.621 -4.867 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -7.918 -15.784 -3.046 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -7.339 -16.620 -4.473 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -7.879 -13.906 -4.434 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -7.930 -14.868 -5.898 1.00 0.00 H new ATOM 543 N VAL A 38 -11.255 -14.680 -2.560 1.00 0.00 N ATOM 544 CA VAL A 38 -12.183 -14.344 -1.489 1.00 0.00 C ATOM 545 C VAL A 38 -13.478 -13.769 -2.062 1.00 0.00 C ATOM 546 O VAL A 38 -14.556 -14.140 -1.598 1.00 0.00 O ATOM 547 CB VAL A 38 -11.470 -13.402 -0.496 1.00 0.00 C ATOM 548 CG1 VAL A 38 -12.401 -12.438 0.252 1.00 0.00 C ATOM 549 CG2 VAL A 38 -10.638 -14.253 0.474 1.00 0.00 C ATOM 0 H VAL A 38 -10.345 -14.227 -2.472 1.00 0.00 H new ATOM 0 HA VAL A 38 -12.480 -15.236 -0.938 1.00 0.00 H new ATOM 0 HB VAL A 38 -10.825 -12.745 -1.079 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -11.814 -11.815 0.927 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -12.921 -11.804 -0.466 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -13.130 -13.009 0.827 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -10.127 -13.602 1.183 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -11.294 -14.935 1.015 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -9.901 -14.828 -0.087 1.00 0.00 H new ATOM 559 N LEU A 39 -13.397 -12.900 -3.069 1.00 0.00 N ATOM 560 CA LEU A 39 -14.589 -12.295 -3.643 1.00 0.00 C ATOM 561 C LEU A 39 -15.381 -13.316 -4.443 1.00 0.00 C ATOM 562 O LEU A 39 -16.606 -13.322 -4.355 1.00 0.00 O ATOM 563 CB LEU A 39 -14.246 -11.097 -4.534 1.00 0.00 C ATOM 564 CG LEU A 39 -13.847 -9.844 -3.729 1.00 0.00 C ATOM 565 CD1 LEU A 39 -13.402 -8.738 -4.686 1.00 0.00 C ATOM 566 CD2 LEU A 39 -14.958 -9.304 -2.819 1.00 0.00 C ATOM 0 H LEU A 39 -12.521 -12.603 -3.499 1.00 0.00 H new ATOM 0 HA LEU A 39 -15.197 -11.939 -2.812 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -13.428 -11.369 -5.201 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -15.105 -10.861 -5.162 1.00 0.00 H new ATOM 0 HG LEU A 39 -13.032 -10.154 -3.075 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -13.121 -7.854 -4.114 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -12.546 -9.082 -5.267 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -14.221 -8.489 -5.360 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -14.597 -8.423 -2.288 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -15.824 -9.034 -3.423 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -15.243 -10.071 -2.098 1.00 0.00 H new ATOM 578 N GLU A 40 -14.730 -14.195 -5.203 1.00 0.00 N ATOM 579 CA GLU A 40 -15.451 -15.213 -5.951 1.00 0.00 C ATOM 580 C GLU A 40 -16.120 -16.199 -4.975 1.00 0.00 C ATOM 581 O GLU A 40 -17.239 -16.655 -5.218 1.00 0.00 O ATOM 582 CB GLU A 40 -14.527 -15.920 -6.949 1.00 0.00 C ATOM 583 CG GLU A 40 -13.933 -14.975 -8.005 1.00 0.00 C ATOM 584 CD GLU A 40 -13.070 -15.740 -9.024 1.00 0.00 C ATOM 585 OE1 GLU A 40 -13.610 -16.218 -10.048 1.00 0.00 O ATOM 586 OE2 GLU A 40 -11.839 -15.861 -8.826 1.00 0.00 O ATOM 0 H GLU A 40 -13.716 -14.220 -5.314 1.00 0.00 H new ATOM 0 HA GLU A 40 -16.237 -14.738 -6.539 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -13.715 -16.400 -6.404 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -15.084 -16.711 -7.452 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -14.738 -14.457 -8.525 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -13.328 -14.213 -7.514 1.00 0.00 H new ATOM 593 N GLU A 41 -15.477 -16.497 -3.841 1.00 0.00 N ATOM 594 CA GLU A 41 -16.012 -17.310 -2.755 1.00 0.00 C ATOM 595 C GLU A 41 -17.140 -16.605 -2.002 1.00 0.00 C ATOM 596 O GLU A 41 -17.978 -17.266 -1.390 1.00 0.00 O ATOM 597 CB GLU A 41 -14.888 -17.701 -1.780 1.00 0.00 C ATOM 598 CG GLU A 41 -13.938 -18.769 -2.351 1.00 0.00 C ATOM 599 CD GLU A 41 -14.598 -20.145 -2.575 1.00 0.00 C ATOM 600 OE1 GLU A 41 -15.424 -20.586 -1.745 1.00 0.00 O ATOM 601 OE2 GLU A 41 -14.256 -20.820 -3.572 1.00 0.00 O ATOM 0 H GLU A 41 -14.532 -16.163 -3.652 1.00 0.00 H new ATOM 0 HA GLU A 41 -16.435 -18.209 -3.204 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -14.313 -16.812 -1.523 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -15.330 -18.073 -0.856 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -13.536 -18.412 -3.299 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -13.094 -18.889 -1.672 1.00 0.00 H new ATOM 608 N LEU A 42 -17.169 -15.275 -2.017 1.00 0.00 N ATOM 609 CA LEU A 42 -18.219 -14.467 -1.417 1.00 0.00 C ATOM 610 C LEU A 42 -19.425 -14.431 -2.339 1.00 0.00 C ATOM 611 O LEU A 42 -20.552 -14.611 -1.881 1.00 0.00 O ATOM 612 CB LEU A 42 -17.651 -13.051 -1.194 1.00 0.00 C ATOM 613 CG LEU A 42 -18.624 -12.027 -0.600 1.00 0.00 C ATOM 614 CD1 LEU A 42 -18.935 -12.395 0.843 1.00 0.00 C ATOM 615 CD2 LEU A 42 -17.983 -10.636 -0.608 1.00 0.00 C ATOM 0 H LEU A 42 -16.440 -14.716 -2.461 1.00 0.00 H new ATOM 0 HA LEU A 42 -18.541 -14.888 -0.465 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -16.786 -13.127 -0.535 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -17.291 -12.670 -2.150 1.00 0.00 H new ATOM 0 HG LEU A 42 -19.536 -12.025 -1.197 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -19.627 -11.665 1.263 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -19.388 -13.386 0.876 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -18.013 -12.398 1.425 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -18.679 -9.912 -0.185 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -17.070 -10.653 -0.013 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -17.743 -10.352 -1.633 1.00 0.00 H new ATOM 627 N ASP A 43 -19.209 -14.234 -3.636 1.00 0.00 N ATOM 628 CA ASP A 43 -20.306 -14.043 -4.567 1.00 0.00 C ATOM 629 C ASP A 43 -21.075 -15.336 -4.766 1.00 0.00 C ATOM 630 O ASP A 43 -22.303 -15.335 -4.815 1.00 0.00 O ATOM 631 CB ASP A 43 -19.790 -13.562 -5.925 1.00 0.00 C ATOM 632 CG ASP A 43 -20.964 -13.348 -6.888 1.00 0.00 C ATOM 633 OD1 ASP A 43 -21.658 -12.314 -6.772 1.00 0.00 O ATOM 634 OD2 ASP A 43 -21.187 -14.207 -7.770 1.00 0.00 O ATOM 0 H ASP A 43 -18.283 -14.203 -4.062 1.00 0.00 H new ATOM 0 HA ASP A 43 -20.967 -13.288 -4.142 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -19.235 -12.632 -5.803 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -19.098 -14.294 -6.340 1.00 0.00 H new ATOM 639 N GLN A 44 -20.366 -16.462 -4.795 1.00 0.00 N ATOM 640 CA GLN A 44 -21.014 -17.755 -4.897 1.00 0.00 C ATOM 641 C GLN A 44 -21.799 -18.115 -3.626 1.00 0.00 C ATOM 642 O GLN A 44 -22.555 -19.088 -3.649 1.00 0.00 O ATOM 643 CB GLN A 44 -19.993 -18.819 -5.314 1.00 0.00 C ATOM 644 CG GLN A 44 -19.055 -19.274 -4.190 1.00 0.00 C ATOM 645 CD GLN A 44 -17.924 -20.139 -4.747 1.00 0.00 C ATOM 646 OE1 GLN A 44 -17.925 -21.361 -4.616 1.00 0.00 O ATOM 647 NE2 GLN A 44 -16.951 -19.522 -5.398 1.00 0.00 N ATOM 0 H GLN A 44 -19.348 -16.499 -4.749 1.00 0.00 H new ATOM 0 HA GLN A 44 -21.769 -17.709 -5.681 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -20.528 -19.688 -5.698 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -19.393 -18.427 -6.135 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -18.638 -18.404 -3.683 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -19.618 -19.837 -3.446 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -16.967 -18.507 -5.497 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -16.185 -20.062 -5.801 1.00 0.00 H new ATOM 656 N GLU A 45 -21.650 -17.355 -2.528 1.00 0.00 N ATOM 657 CA GLU A 45 -22.347 -17.580 -1.289 1.00 0.00 C ATOM 658 C GLU A 45 -23.516 -16.605 -1.128 1.00 0.00 C ATOM 659 O GLU A 45 -24.631 -17.035 -0.829 1.00 0.00 O ATOM 660 CB GLU A 45 -21.329 -17.597 -0.134 1.00 0.00 C ATOM 661 CG GLU A 45 -21.942 -17.120 1.185 1.00 0.00 C ATOM 662 CD GLU A 45 -21.180 -17.519 2.457 1.00 0.00 C ATOM 663 OE1 GLU A 45 -20.173 -18.257 2.388 1.00 0.00 O ATOM 664 OE2 GLU A 45 -21.599 -17.080 3.551 1.00 0.00 O ATOM 0 H GLU A 45 -21.022 -16.552 -2.496 1.00 0.00 H new ATOM 0 HA GLU A 45 -22.825 -18.560 -1.282 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -20.942 -18.608 -0.008 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -20.482 -16.961 -0.390 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -22.020 -16.033 1.156 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -22.957 -17.510 1.254 1.00 0.00 H new ATOM 671 N MET A 46 -23.284 -15.312 -1.353 1.00 0.00 N ATOM 672 CA MET A 46 -24.241 -14.255 -1.033 1.00 0.00 C ATOM 673 C MET A 46 -24.397 -13.250 -2.171 1.00 0.00 C ATOM 674 O MET A 46 -24.994 -12.185 -2.005 1.00 0.00 O ATOM 675 CB MET A 46 -23.858 -13.586 0.282 1.00 0.00 C ATOM 676 CG MET A 46 -22.415 -13.097 0.324 1.00 0.00 C ATOM 677 SD MET A 46 -22.127 -12.204 1.865 1.00 0.00 S ATOM 678 CE MET A 46 -22.978 -10.672 1.455 1.00 0.00 C ATOM 0 H MET A 46 -22.418 -14.966 -1.766 1.00 0.00 H new ATOM 0 HA MET A 46 -25.223 -14.712 -0.909 1.00 0.00 H new ATOM 0 HB2 MET A 46 -24.524 -12.741 0.457 1.00 0.00 H new ATOM 0 HB3 MET A 46 -24.017 -14.291 1.098 1.00 0.00 H new ATOM 0 HG2 MET A 46 -21.731 -13.942 0.248 1.00 0.00 H new ATOM 0 HG3 MET A 46 -22.215 -12.447 -0.528 1.00 0.00 H new ATOM 0 HE1 MET A 46 -22.588 -9.863 2.072 1.00 0.00 H new ATOM 0 HE2 MET A 46 -22.817 -10.437 0.403 1.00 0.00 H new ATOM 0 HE3 MET A 46 -24.046 -10.788 1.641 1.00 0.00 H new ATOM 688 N GLY A 47 -23.934 -13.601 -3.366 1.00 0.00 N ATOM 689 CA GLY A 47 -24.130 -12.786 -4.556 1.00 0.00 C ATOM 690 C GLY A 47 -25.575 -12.711 -5.020 1.00 0.00 C ATOM 691 O GLY A 47 -25.880 -11.998 -5.974 1.00 0.00 O ATOM 0 H GLY A 47 -23.412 -14.460 -3.535 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -23.770 -11.777 -4.356 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -23.520 -13.188 -5.364 1.00 0.00 H new ATOM 695 N ASP A 48 -26.466 -13.427 -4.342 1.00 0.00 N ATOM 696 CA ASP A 48 -27.904 -13.308 -4.506 1.00 0.00 C ATOM 697 C ASP A 48 -28.400 -11.960 -3.985 1.00 0.00 C ATOM 698 O ASP A 48 -29.422 -11.454 -4.454 1.00 0.00 O ATOM 699 CB ASP A 48 -28.612 -14.462 -3.789 1.00 0.00 C ATOM 700 CG ASP A 48 -30.142 -14.352 -3.908 1.00 0.00 C ATOM 701 OD1 ASP A 48 -30.684 -14.571 -5.014 1.00 0.00 O ATOM 702 OD2 ASP A 48 -30.812 -14.092 -2.883 1.00 0.00 O ATOM 0 H ASP A 48 -26.197 -14.123 -3.646 1.00 0.00 H new ATOM 0 HA ASP A 48 -28.139 -13.362 -5.569 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -28.281 -15.411 -4.212 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -28.328 -14.466 -2.737 1.00 0.00 H new ATOM 707 N LYS A 49 -27.655 -11.351 -3.052 1.00 0.00 N ATOM 708 CA LYS A 49 -28.018 -10.106 -2.406 1.00 0.00 C ATOM 709 C LYS A 49 -27.064 -8.972 -2.770 1.00 0.00 C ATOM 710 O LYS A 49 -27.442 -7.805 -2.674 1.00 0.00 O ATOM 711 CB LYS A 49 -28.007 -10.267 -0.875 1.00 0.00 C ATOM 712 CG LYS A 49 -28.514 -11.611 -0.321 1.00 0.00 C ATOM 713 CD LYS A 49 -27.361 -12.592 -0.054 1.00 0.00 C ATOM 714 CE LYS A 49 -27.613 -13.499 1.155 1.00 0.00 C ATOM 715 NZ LYS A 49 -28.715 -14.475 0.946 1.00 0.00 N ATOM 0 H LYS A 49 -26.765 -11.728 -2.726 1.00 0.00 H new ATOM 0 HA LYS A 49 -29.019 -9.856 -2.758 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -26.986 -10.117 -0.524 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -28.613 -9.470 -0.444 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -29.065 -11.438 0.603 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -29.212 -12.056 -1.030 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -27.205 -13.210 -0.938 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -26.442 -12.028 0.107 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -26.697 -14.042 1.389 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -27.846 -12.880 2.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -28.831 -15.055 1.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -29.599 -13.964 0.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -28.486 -15.090 0.139 1.00 0.00 H new ATOM 729 N LEU A 50 -25.841 -9.308 -3.185 1.00 0.00 N ATOM 730 CA LEU A 50 -24.741 -8.377 -3.344 1.00 0.00 C ATOM 731 C LEU A 50 -24.197 -8.392 -4.763 1.00 0.00 C ATOM 732 O LEU A 50 -24.150 -9.440 -5.409 1.00 0.00 O ATOM 733 CB LEU A 50 -23.649 -8.790 -2.339 1.00 0.00 C ATOM 734 CG LEU A 50 -22.375 -7.927 -2.347 1.00 0.00 C ATOM 735 CD1 LEU A 50 -22.678 -6.468 -1.992 1.00 0.00 C ATOM 736 CD2 LEU A 50 -21.356 -8.497 -1.360 1.00 0.00 C ATOM 0 H LEU A 50 -25.589 -10.267 -3.425 1.00 0.00 H new ATOM 0 HA LEU A 50 -25.082 -7.359 -3.154 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -24.076 -8.766 -1.336 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -23.367 -9.823 -2.541 1.00 0.00 H new ATOM 0 HG LEU A 50 -21.964 -7.949 -3.356 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -21.754 -5.890 -2.008 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -23.377 -6.054 -2.719 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -23.119 -6.420 -0.996 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -20.456 -7.882 -1.370 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -21.783 -8.499 -0.357 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -21.101 -9.517 -1.648 1.00 0.00 H new ATOM 748 N LYS A 51 -23.722 -7.234 -5.218 1.00 0.00 N ATOM 749 CA LYS A 51 -22.961 -7.084 -6.454 1.00 0.00 C ATOM 750 C LYS A 51 -21.519 -6.819 -6.052 1.00 0.00 C ATOM 751 O LYS A 51 -21.285 -6.109 -5.071 1.00 0.00 O ATOM 752 CB LYS A 51 -23.543 -5.915 -7.257 1.00 0.00 C ATOM 753 CG LYS A 51 -22.806 -5.667 -8.584 1.00 0.00 C ATOM 754 CD LYS A 51 -23.520 -4.557 -9.360 1.00 0.00 C ATOM 755 CE LYS A 51 -22.934 -4.417 -10.766 1.00 0.00 C ATOM 756 NZ LYS A 51 -23.623 -3.346 -11.516 1.00 0.00 N ATOM 0 H LYS A 51 -23.860 -6.353 -4.724 1.00 0.00 H new ATOM 0 HA LYS A 51 -23.012 -7.974 -7.081 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -24.595 -6.113 -7.464 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -23.502 -5.010 -6.651 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -21.771 -5.384 -8.391 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -22.781 -6.582 -9.176 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -24.585 -4.779 -9.425 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -23.424 -3.612 -8.825 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -21.869 -4.195 -10.701 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -23.030 -5.362 -11.301 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -23.345 -3.389 -12.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -24.652 -3.474 -11.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -23.358 -2.421 -11.122 1.00 0.00 H new ATOM 770 N ILE A 52 -20.561 -7.341 -6.810 1.00 0.00 N ATOM 771 CA ILE A 52 -19.147 -7.145 -6.562 1.00 0.00 C ATOM 772 C ILE A 52 -18.556 -6.655 -7.880 1.00 0.00 C ATOM 773 O ILE A 52 -18.912 -7.159 -8.946 1.00 0.00 O ATOM 774 CB ILE A 52 -18.523 -8.461 -6.047 1.00 0.00 C ATOM 775 CG1 ILE A 52 -18.988 -8.783 -4.605 1.00 0.00 C ATOM 776 CG2 ILE A 52 -16.991 -8.376 -6.062 1.00 0.00 C ATOM 777 CD1 ILE A 52 -19.092 -10.283 -4.332 1.00 0.00 C ATOM 0 H ILE A 52 -20.754 -7.921 -7.626 1.00 0.00 H new ATOM 0 HA ILE A 52 -18.943 -6.408 -5.785 1.00 0.00 H new ATOM 0 HB ILE A 52 -18.857 -9.255 -6.715 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -18.290 -8.338 -3.896 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -19.959 -8.319 -4.430 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -16.571 -9.313 -5.696 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -16.646 -8.198 -7.081 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -16.666 -7.557 -5.420 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -19.422 -10.444 -3.306 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -19.811 -10.729 -5.019 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -18.117 -10.748 -4.476 1.00 0.00 H new ATOM 789 N VAL A 53 -17.651 -5.687 -7.807 1.00 0.00 N ATOM 790 CA VAL A 53 -17.002 -5.045 -8.938 1.00 0.00 C ATOM 791 C VAL A 53 -15.522 -4.916 -8.579 1.00 0.00 C ATOM 792 O VAL A 53 -15.193 -4.623 -7.431 1.00 0.00 O ATOM 793 CB VAL A 53 -17.706 -3.698 -9.275 1.00 0.00 C ATOM 794 CG1 VAL A 53 -18.528 -3.061 -8.160 1.00 0.00 C ATOM 795 CG2 VAL A 53 -16.820 -2.643 -9.940 1.00 0.00 C ATOM 0 H VAL A 53 -17.336 -5.312 -6.912 1.00 0.00 H new ATOM 0 HA VAL A 53 -17.082 -5.629 -9.855 1.00 0.00 H new ATOM 0 HB VAL A 53 -18.420 -4.049 -10.020 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -18.967 -2.130 -8.518 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -19.322 -3.744 -7.858 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -17.883 -2.854 -7.306 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -17.406 -1.744 -10.132 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -15.987 -2.399 -9.280 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -16.434 -3.033 -10.882 1.00 0.00 H new ATOM 805 N LYS A 54 -14.624 -5.111 -9.545 1.00 0.00 N ATOM 806 CA LYS A 54 -13.195 -4.874 -9.369 1.00 0.00 C ATOM 807 C LYS A 54 -12.759 -3.704 -10.246 1.00 0.00 C ATOM 808 O LYS A 54 -13.409 -3.395 -11.245 1.00 0.00 O ATOM 809 CB LYS A 54 -12.389 -6.150 -9.663 1.00 0.00 C ATOM 810 CG LYS A 54 -12.628 -7.230 -8.592 1.00 0.00 C ATOM 811 CD LYS A 54 -11.791 -8.497 -8.833 1.00 0.00 C ATOM 812 CE LYS A 54 -10.318 -8.367 -8.401 1.00 0.00 C ATOM 813 NZ LYS A 54 -10.103 -8.718 -6.980 1.00 0.00 N ATOM 0 H LYS A 54 -14.872 -5.440 -10.478 1.00 0.00 H new ATOM 0 HA LYS A 54 -12.997 -4.610 -8.330 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -12.668 -6.540 -10.642 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -11.327 -5.908 -9.706 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -12.388 -6.822 -7.610 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -13.685 -7.495 -8.578 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -12.245 -9.328 -8.293 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -11.827 -8.748 -9.893 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -9.702 -9.013 -9.027 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -9.983 -7.344 -8.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -9.236 -9.286 -6.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -10.007 -7.848 -6.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -10.914 -9.268 -6.632 1.00 0.00 H new ATOM 827 N ILE A 55 -11.630 -3.091 -9.915 1.00 0.00 N ATOM 828 CA ILE A 55 -10.934 -2.094 -10.697 1.00 0.00 C ATOM 829 C ILE A 55 -9.516 -2.652 -10.771 1.00 0.00 C ATOM 830 O ILE A 55 -8.896 -2.884 -9.729 1.00 0.00 O ATOM 831 CB ILE A 55 -11.004 -0.716 -9.983 1.00 0.00 C ATOM 832 CG1 ILE A 55 -12.355 0.002 -10.183 1.00 0.00 C ATOM 833 CG2 ILE A 55 -9.833 0.180 -10.412 1.00 0.00 C ATOM 834 CD1 ILE A 55 -12.490 0.739 -11.520 1.00 0.00 C ATOM 0 H ILE A 55 -11.151 -3.294 -9.037 1.00 0.00 H new ATOM 0 HA ILE A 55 -11.353 -1.919 -11.688 1.00 0.00 H new ATOM 0 HB ILE A 55 -10.920 -0.915 -8.915 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -13.157 -0.732 -10.104 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -12.496 0.717 -9.372 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -9.902 1.140 -9.900 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -8.891 -0.303 -10.152 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -9.873 0.340 -11.489 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -13.469 1.214 -11.576 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -11.713 1.499 -11.597 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -12.384 0.028 -12.340 1.00 0.00 H new ATOM 846 N ASP A 56 -9.014 -2.890 -11.983 1.00 0.00 N ATOM 847 CA ASP A 56 -7.609 -3.219 -12.196 1.00 0.00 C ATOM 848 C ASP A 56 -6.802 -1.931 -12.043 1.00 0.00 C ATOM 849 O ASP A 56 -6.875 -1.055 -12.908 1.00 0.00 O ATOM 850 CB ASP A 56 -7.401 -3.842 -13.581 1.00 0.00 C ATOM 851 CG ASP A 56 -5.932 -4.249 -13.788 1.00 0.00 C ATOM 852 OD1 ASP A 56 -5.054 -3.359 -13.820 1.00 0.00 O ATOM 853 OD2 ASP A 56 -5.665 -5.460 -13.951 1.00 0.00 O ATOM 0 H ASP A 56 -9.568 -2.860 -12.839 1.00 0.00 H new ATOM 0 HA ASP A 56 -7.276 -3.956 -11.465 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -8.043 -4.716 -13.691 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -7.697 -3.130 -14.352 1.00 0.00 H new ATOM 858 N VAL A 57 -6.074 -1.770 -10.939 1.00 0.00 N ATOM 859 CA VAL A 57 -5.300 -0.573 -10.642 1.00 0.00 C ATOM 860 C VAL A 57 -3.957 -0.485 -11.389 1.00 0.00 C ATOM 861 O VAL A 57 -2.894 -0.231 -10.816 1.00 0.00 O ATOM 862 CB VAL A 57 -5.240 -0.241 -9.147 1.00 0.00 C ATOM 863 CG1 VAL A 57 -6.636 -0.008 -8.575 1.00 0.00 C ATOM 864 CG2 VAL A 57 -4.530 -1.256 -8.262 1.00 0.00 C ATOM 0 H VAL A 57 -6.007 -2.484 -10.214 1.00 0.00 H new ATOM 0 HA VAL A 57 -5.871 0.250 -11.072 1.00 0.00 H new ATOM 0 HB VAL A 57 -4.635 0.666 -9.123 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -6.560 0.225 -7.513 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -7.109 0.824 -9.096 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -7.238 -0.907 -8.707 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -4.551 -0.914 -7.227 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -5.035 -2.219 -8.336 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -3.495 -1.362 -8.588 1.00 0.00 H new ATOM 874 N ASP A 58 -4.025 -0.685 -12.698 1.00 0.00 N ATOM 875 CA ASP A 58 -2.961 -0.409 -13.651 1.00 0.00 C ATOM 876 C ASP A 58 -3.595 -0.187 -15.029 1.00 0.00 C ATOM 877 O ASP A 58 -3.279 0.795 -15.698 1.00 0.00 O ATOM 878 CB ASP A 58 -1.949 -1.556 -13.724 1.00 0.00 C ATOM 879 CG ASP A 58 -0.983 -1.356 -14.906 1.00 0.00 C ATOM 880 OD1 ASP A 58 -0.184 -0.393 -14.889 1.00 0.00 O ATOM 881 OD2 ASP A 58 -1.008 -2.171 -15.856 1.00 0.00 O ATOM 0 H ASP A 58 -4.862 -1.061 -13.144 1.00 0.00 H new ATOM 0 HA ASP A 58 -2.420 0.479 -13.325 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -1.385 -1.610 -12.793 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -2.474 -2.505 -13.834 1.00 0.00 H new ATOM 886 N GLU A 59 -4.546 -1.038 -15.434 1.00 0.00 N ATOM 887 CA GLU A 59 -5.266 -0.915 -16.695 1.00 0.00 C ATOM 888 C GLU A 59 -6.389 0.130 -16.585 1.00 0.00 C ATOM 889 O GLU A 59 -6.652 0.867 -17.536 1.00 0.00 O ATOM 890 CB GLU A 59 -5.764 -2.325 -17.097 1.00 0.00 C ATOM 891 CG GLU A 59 -7.141 -2.327 -17.757 1.00 0.00 C ATOM 892 CD GLU A 59 -7.648 -3.729 -18.127 1.00 0.00 C ATOM 893 OE1 GLU A 59 -7.041 -4.405 -18.989 1.00 0.00 O ATOM 894 OE2 GLU A 59 -8.693 -4.139 -17.575 1.00 0.00 O ATOM 0 H GLU A 59 -4.837 -1.844 -14.880 1.00 0.00 H new ATOM 0 HA GLU A 59 -4.614 -0.546 -17.487 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -5.043 -2.774 -17.780 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -5.796 -2.956 -16.209 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -7.858 -1.858 -17.083 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -7.103 -1.715 -18.658 1.00 0.00 H new ATOM 901 N ASN A 60 -7.047 0.198 -15.426 1.00 0.00 N ATOM 902 CA ASN A 60 -8.276 0.963 -15.188 1.00 0.00 C ATOM 903 C ASN A 60 -8.184 1.756 -13.887 1.00 0.00 C ATOM 904 O ASN A 60 -9.185 2.054 -13.235 1.00 0.00 O ATOM 905 CB ASN A 60 -9.505 0.026 -15.259 1.00 0.00 C ATOM 906 CG ASN A 60 -10.174 0.093 -16.626 1.00 0.00 C ATOM 907 OD1 ASN A 60 -10.599 1.161 -17.058 1.00 0.00 O ATOM 908 ND2 ASN A 60 -10.298 -1.019 -17.333 1.00 0.00 N ATOM 0 H ASN A 60 -6.727 -0.297 -14.594 1.00 0.00 H new ATOM 0 HA ASN A 60 -8.403 1.706 -15.976 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -9.196 -0.999 -15.053 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -10.222 0.304 -14.487 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -10.750 -0.995 -18.247 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -9.941 -1.900 -16.964 1.00 0.00 H new ATOM 915 N GLN A 61 -6.959 2.129 -13.513 1.00 0.00 N ATOM 916 CA GLN A 61 -6.658 2.734 -12.222 1.00 0.00 C ATOM 917 C GLN A 61 -7.175 4.174 -12.107 1.00 0.00 C ATOM 918 O GLN A 61 -7.054 4.788 -11.051 1.00 0.00 O ATOM 919 CB GLN A 61 -5.150 2.661 -11.940 1.00 0.00 C ATOM 920 CG GLN A 61 -4.263 3.697 -12.634 1.00 0.00 C ATOM 921 CD GLN A 61 -2.775 3.377 -12.423 1.00 0.00 C ATOM 922 OE1 GLN A 61 -2.037 3.147 -13.377 1.00 0.00 O ATOM 923 NE2 GLN A 61 -2.290 3.379 -11.188 1.00 0.00 N ATOM 0 H GLN A 61 -6.139 2.016 -14.109 1.00 0.00 H new ATOM 0 HA GLN A 61 -7.188 2.159 -11.463 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -5.002 2.754 -10.864 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -4.800 1.669 -12.225 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -4.487 3.717 -13.701 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -4.484 4.690 -12.244 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -2.906 3.571 -10.398 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -1.301 3.189 -11.028 1.00 0.00 H new ATOM 932 N GLU A 62 -7.699 4.727 -13.200 1.00 0.00 N ATOM 933 CA GLU A 62 -8.173 6.096 -13.322 1.00 0.00 C ATOM 934 C GLU A 62 -9.191 6.416 -12.225 1.00 0.00 C ATOM 935 O GLU A 62 -9.026 7.398 -11.503 1.00 0.00 O ATOM 936 CB GLU A 62 -8.768 6.248 -14.730 1.00 0.00 C ATOM 937 CG GLU A 62 -7.659 6.407 -15.782 1.00 0.00 C ATOM 938 CD GLU A 62 -8.226 6.563 -17.203 1.00 0.00 C ATOM 939 OE1 GLU A 62 -8.438 5.541 -17.893 1.00 0.00 O ATOM 940 OE2 GLU A 62 -8.424 7.711 -17.663 1.00 0.00 O ATOM 0 H GLU A 62 -7.808 4.201 -14.067 1.00 0.00 H new ATOM 0 HA GLU A 62 -7.357 6.807 -13.192 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -9.377 5.376 -14.967 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -9.428 7.115 -14.758 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -7.051 7.278 -15.538 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -7.001 5.539 -15.748 1.00 0.00 H new ATOM 947 N THR A 63 -10.192 5.555 -12.036 1.00 0.00 N ATOM 948 CA THR A 63 -11.179 5.691 -10.966 1.00 0.00 C ATOM 949 C THR A 63 -10.523 5.667 -9.587 1.00 0.00 C ATOM 950 O THR A 63 -10.980 6.361 -8.683 1.00 0.00 O ATOM 951 CB THR A 63 -12.222 4.577 -11.144 1.00 0.00 C ATOM 952 OG1 THR A 63 -12.981 4.944 -12.271 1.00 0.00 O ATOM 953 CG2 THR A 63 -13.166 4.336 -9.962 1.00 0.00 C ATOM 0 H THR A 63 -10.341 4.737 -12.627 1.00 0.00 H new ATOM 0 HA THR A 63 -11.674 6.660 -11.030 1.00 0.00 H new ATOM 0 HB THR A 63 -11.681 3.636 -11.243 1.00 0.00 H new ATOM 0 HG1 THR A 63 -13.366 4.142 -12.682 1.00 0.00 H new ATOM 0 HG21 THR A 63 -13.855 3.528 -10.206 1.00 0.00 H new ATOM 0 HG22 THR A 63 -12.584 4.064 -9.081 1.00 0.00 H new ATOM 0 HG23 THR A 63 -13.731 5.245 -9.756 1.00 0.00 H new ATOM 961 N ALA A 64 -9.454 4.891 -9.408 1.00 0.00 N ATOM 962 CA ALA A 64 -8.821 4.729 -8.114 1.00 0.00 C ATOM 963 C ALA A 64 -8.187 6.059 -7.700 1.00 0.00 C ATOM 964 O ALA A 64 -8.651 6.703 -6.760 1.00 0.00 O ATOM 965 CB ALA A 64 -7.822 3.572 -8.196 1.00 0.00 C ATOM 0 H ALA A 64 -9.009 4.362 -10.158 1.00 0.00 H new ATOM 0 HA ALA A 64 -9.543 4.471 -7.339 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -7.338 3.440 -7.228 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -8.347 2.656 -8.468 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -7.068 3.795 -8.951 1.00 0.00 H new ATOM 971 N GLY A 65 -7.194 6.509 -8.466 1.00 0.00 N ATOM 972 CA GLY A 65 -6.620 7.846 -8.349 1.00 0.00 C ATOM 973 C GLY A 65 -7.676 8.948 -8.188 1.00 0.00 C ATOM 974 O GLY A 65 -7.556 9.779 -7.286 1.00 0.00 O ATOM 0 H GLY A 65 -6.760 5.945 -9.196 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -5.946 7.871 -7.493 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -6.019 8.055 -9.234 1.00 0.00 H new ATOM 978 N LYS A 66 -8.743 8.924 -8.999 1.00 0.00 N ATOM 979 CA LYS A 66 -9.822 9.912 -8.961 1.00 0.00 C ATOM 980 C LYS A 66 -10.517 9.931 -7.599 1.00 0.00 C ATOM 981 O LYS A 66 -10.789 11.011 -7.076 1.00 0.00 O ATOM 982 CB LYS A 66 -10.805 9.593 -10.101 1.00 0.00 C ATOM 983 CG LYS A 66 -11.975 10.574 -10.271 1.00 0.00 C ATOM 984 CD LYS A 66 -12.982 10.089 -11.331 1.00 0.00 C ATOM 985 CE LYS A 66 -12.319 9.824 -12.694 1.00 0.00 C ATOM 986 NZ LYS A 66 -13.283 9.413 -13.739 1.00 0.00 N ATOM 0 H LYS A 66 -8.879 8.205 -9.710 1.00 0.00 H new ATOM 0 HA LYS A 66 -9.413 10.912 -9.103 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -10.247 9.557 -11.037 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -11.213 8.596 -9.935 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -12.485 10.699 -9.316 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -11.590 11.553 -10.557 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -13.462 9.176 -10.980 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -13.767 10.836 -11.451 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -11.801 10.726 -13.021 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -11.564 9.046 -12.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -12.777 9.249 -14.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -13.760 8.537 -13.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -13.990 10.164 -13.874 1.00 0.00 H new ATOM 1000 N TYR A 67 -10.796 8.760 -7.019 1.00 0.00 N ATOM 1001 CA TYR A 67 -11.493 8.636 -5.749 1.00 0.00 C ATOM 1002 C TYR A 67 -10.551 8.763 -4.542 1.00 0.00 C ATOM 1003 O TYR A 67 -11.030 8.799 -3.406 1.00 0.00 O ATOM 1004 CB TYR A 67 -12.340 7.349 -5.717 1.00 0.00 C ATOM 1005 CG TYR A 67 -13.731 7.548 -6.303 1.00 0.00 C ATOM 1006 CD1 TYR A 67 -13.918 7.659 -7.696 1.00 0.00 C ATOM 1007 CD2 TYR A 67 -14.839 7.689 -5.444 1.00 0.00 C ATOM 1008 CE1 TYR A 67 -15.195 7.909 -8.230 1.00 0.00 C ATOM 1009 CE2 TYR A 67 -16.119 7.940 -5.967 1.00 0.00 C ATOM 1010 CZ TYR A 67 -16.304 8.057 -7.364 1.00 0.00 C ATOM 1011 OH TYR A 67 -17.549 8.306 -7.858 1.00 0.00 O ATOM 0 H TYR A 67 -10.538 7.863 -7.430 1.00 0.00 H new ATOM 0 HA TYR A 67 -12.179 9.479 -5.664 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -11.825 6.566 -6.273 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -12.430 7.003 -4.687 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -13.073 7.551 -8.359 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -14.704 7.604 -4.376 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -15.329 7.988 -9.299 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -16.963 8.044 -5.301 1.00 0.00 H new ATOM 0 HH TYR A 67 -18.187 8.376 -7.117 1.00 0.00 H new ATOM 1021 N GLY A 68 -9.236 8.864 -4.756 1.00 0.00 N ATOM 1022 CA GLY A 68 -8.259 8.955 -3.681 1.00 0.00 C ATOM 1023 C GLY A 68 -7.973 7.554 -3.153 1.00 0.00 C ATOM 1024 O GLY A 68 -8.352 7.210 -2.032 1.00 0.00 O ATOM 0 H GLY A 68 -8.822 8.885 -5.688 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -7.340 9.415 -4.045 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -8.638 9.590 -2.880 1.00 0.00 H new ATOM 1028 N VAL A 69 -7.362 6.728 -4.000 1.00 0.00 N ATOM 1029 CA VAL A 69 -7.042 5.334 -3.776 1.00 0.00 C ATOM 1030 C VAL A 69 -5.712 5.221 -4.498 1.00 0.00 C ATOM 1031 O VAL A 69 -5.580 5.683 -5.635 1.00 0.00 O ATOM 1032 CB VAL A 69 -8.109 4.396 -4.391 1.00 0.00 C ATOM 1033 CG1 VAL A 69 -7.687 2.923 -4.306 1.00 0.00 C ATOM 1034 CG2 VAL A 69 -9.508 4.572 -3.786 1.00 0.00 C ATOM 0 H VAL A 69 -7.060 7.044 -4.922 1.00 0.00 H new ATOM 0 HA VAL A 69 -7.007 5.045 -2.726 1.00 0.00 H new ATOM 0 HB VAL A 69 -8.174 4.692 -5.438 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -8.462 2.296 -4.748 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -6.752 2.780 -4.848 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -7.547 2.644 -3.262 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -10.202 3.882 -4.266 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -9.471 4.363 -2.717 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -9.847 5.596 -3.944 1.00 0.00 H new ATOM 1044 N MET A 70 -4.719 4.642 -3.838 1.00 0.00 N ATOM 1045 CA MET A 70 -3.396 4.459 -4.413 1.00 0.00 C ATOM 1046 C MET A 70 -2.747 3.207 -3.823 1.00 0.00 C ATOM 1047 O MET A 70 -1.529 3.095 -3.829 1.00 0.00 O ATOM 1048 CB MET A 70 -2.565 5.740 -4.258 1.00 0.00 C ATOM 1049 CG MET A 70 -2.287 6.107 -2.807 1.00 0.00 C ATOM 1050 SD MET A 70 -1.098 7.441 -2.558 1.00 0.00 S ATOM 1051 CE MET A 70 0.385 6.595 -3.181 1.00 0.00 C ATOM 0 H MET A 70 -4.809 4.285 -2.887 1.00 0.00 H new ATOM 0 HA MET A 70 -3.464 4.287 -5.487 1.00 0.00 H new ATOM 0 HB2 MET A 70 -1.617 5.615 -4.782 1.00 0.00 H new ATOM 0 HB3 MET A 70 -3.089 6.565 -4.740 1.00 0.00 H new ATOM 0 HG2 MET A 70 -3.228 6.390 -2.335 1.00 0.00 H new ATOM 0 HG3 MET A 70 -1.925 5.219 -2.289 1.00 0.00 H new ATOM 0 HE1 MET A 70 1.217 6.770 -2.499 1.00 0.00 H new ATOM 0 HE2 MET A 70 0.191 5.525 -3.250 1.00 0.00 H new ATOM 0 HE3 MET A 70 0.637 6.982 -4.168 1.00 0.00 H new ATOM 1061 N SER A 71 -3.545 2.250 -3.345 1.00 0.00 N ATOM 1062 CA SER A 71 -3.120 1.117 -2.544 1.00 0.00 C ATOM 1063 C SER A 71 -3.843 -0.168 -2.914 1.00 0.00 C ATOM 1064 O SER A 71 -4.934 -0.109 -3.489 1.00 0.00 O ATOM 1065 CB SER A 71 -3.437 1.457 -1.086 1.00 0.00 C ATOM 1066 OG SER A 71 -4.606 2.264 -0.952 1.00 0.00 O ATOM 0 H SER A 71 -4.550 2.251 -3.518 1.00 0.00 H new ATOM 0 HA SER A 71 -2.057 0.945 -2.715 1.00 0.00 H new ATOM 0 HB2 SER A 71 -3.571 0.534 -0.522 1.00 0.00 H new ATOM 0 HB3 SER A 71 -2.587 1.979 -0.646 1.00 0.00 H new ATOM 0 HG SER A 71 -5.398 1.733 -1.180 1.00 0.00 H new ATOM 1072 N ILE A 72 -3.271 -1.316 -2.524 1.00 0.00 N ATOM 1073 CA ILE A 72 -3.861 -2.623 -2.784 1.00 0.00 C ATOM 1074 C ILE A 72 -3.926 -3.430 -1.473 1.00 0.00 C ATOM 1075 O ILE A 72 -2.925 -3.469 -0.755 1.00 0.00 O ATOM 1076 CB ILE A 72 -3.079 -3.463 -3.829 1.00 0.00 C ATOM 1077 CG1 ILE A 72 -1.922 -2.761 -4.564 1.00 0.00 C ATOM 1078 CG2 ILE A 72 -4.042 -4.151 -4.806 1.00 0.00 C ATOM 1079 CD1 ILE A 72 -2.319 -1.731 -5.620 1.00 0.00 C ATOM 0 H ILE A 72 -2.386 -1.357 -2.019 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.853 -2.430 -3.192 1.00 0.00 H new ATOM 0 HB ILE A 72 -2.561 -4.211 -3.228 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -1.295 -2.267 -3.822 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -1.308 -3.524 -5.043 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -3.472 -4.734 -5.529 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -4.710 -4.812 -4.254 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -4.629 -3.397 -5.330 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -1.421 -1.305 -6.068 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -2.916 -2.214 -6.393 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -2.903 -0.938 -5.153 1.00 0.00 H new ATOM 1091 N PRO A 73 -5.032 -4.123 -1.164 1.00 0.00 N ATOM 1092 CA PRO A 73 -6.311 -4.030 -1.841 1.00 0.00 C ATOM 1093 C PRO A 73 -7.076 -2.857 -1.218 1.00 0.00 C ATOM 1094 O PRO A 73 -6.997 -2.625 -0.005 1.00 0.00 O ATOM 1095 CB PRO A 73 -6.993 -5.368 -1.570 1.00 0.00 C ATOM 1096 CG PRO A 73 -6.500 -5.733 -0.172 1.00 0.00 C ATOM 1097 CD PRO A 73 -5.134 -5.046 -0.045 1.00 0.00 C ATOM 0 HA PRO A 73 -6.246 -3.851 -2.914 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -8.079 -5.281 -1.604 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -6.710 -6.121 -2.306 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -7.191 -5.383 0.595 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -6.412 -6.813 -0.053 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -5.053 -4.516 0.904 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -4.327 -5.778 -0.071 1.00 0.00 H new ATOM 1105 N THR A 74 -7.854 -2.149 -2.026 1.00 0.00 N ATOM 1106 CA THR A 74 -8.782 -1.143 -1.498 1.00 0.00 C ATOM 1107 C THR A 74 -10.213 -1.608 -1.765 1.00 0.00 C ATOM 1108 O THR A 74 -10.478 -2.226 -2.793 1.00 0.00 O ATOM 1109 CB THR A 74 -8.447 0.250 -2.059 1.00 0.00 C ATOM 1110 OG1 THR A 74 -7.133 0.614 -1.660 1.00 0.00 O ATOM 1111 CG2 THR A 74 -9.456 1.319 -1.609 1.00 0.00 C ATOM 0 H THR A 74 -7.866 -2.247 -3.041 1.00 0.00 H new ATOM 0 HA THR A 74 -8.679 -1.041 -0.418 1.00 0.00 H new ATOM 0 HB THR A 74 -8.506 0.196 -3.146 1.00 0.00 H new ATOM 0 HG1 THR A 74 -6.492 0.322 -2.341 1.00 0.00 H new ATOM 0 HG21 THR A 74 -9.176 2.284 -2.031 1.00 0.00 H new ATOM 0 HG22 THR A 74 -10.453 1.047 -1.955 1.00 0.00 H new ATOM 0 HG23 THR A 74 -9.455 1.385 -0.521 1.00 0.00 H new ATOM 1119 N LEU A 75 -11.133 -1.306 -0.845 1.00 0.00 N ATOM 1120 CA LEU A 75 -12.560 -1.551 -0.981 1.00 0.00 C ATOM 1121 C LEU A 75 -13.265 -0.215 -0.832 1.00 0.00 C ATOM 1122 O LEU A 75 -13.002 0.512 0.129 1.00 0.00 O ATOM 1123 CB LEU A 75 -13.098 -2.493 0.113 1.00 0.00 C ATOM 1124 CG LEU A 75 -12.558 -3.932 0.126 1.00 0.00 C ATOM 1125 CD1 LEU A 75 -13.285 -4.719 1.222 1.00 0.00 C ATOM 1126 CD2 LEU A 75 -12.744 -4.647 -1.208 1.00 0.00 C ATOM 0 H LEU A 75 -10.890 -0.869 0.044 1.00 0.00 H new ATOM 0 HA LEU A 75 -12.740 -2.020 -1.948 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -12.884 -2.043 1.082 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -14.183 -2.540 0.016 1.00 0.00 H new ATOM 0 HG LEU A 75 -11.486 -3.880 0.316 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -12.912 -5.743 1.243 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -13.106 -4.248 2.188 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -14.355 -4.727 1.015 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -12.344 -5.658 -1.138 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -13.806 -4.693 -1.451 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -12.216 -4.101 -1.990 1.00 0.00 H new ATOM 1138 N LEU A 76 -14.199 0.064 -1.740 1.00 0.00 N ATOM 1139 CA LEU A 76 -15.129 1.172 -1.656 1.00 0.00 C ATOM 1140 C LEU A 76 -16.484 0.496 -1.707 1.00 0.00 C ATOM 1141 O LEU A 76 -16.843 -0.098 -2.725 1.00 0.00 O ATOM 1142 CB LEU A 76 -14.991 2.202 -2.798 1.00 0.00 C ATOM 1143 CG LEU A 76 -13.571 2.699 -3.111 1.00 0.00 C ATOM 1144 CD1 LEU A 76 -13.628 3.709 -4.265 1.00 0.00 C ATOM 1145 CD2 LEU A 76 -12.896 3.364 -1.909 1.00 0.00 C ATOM 0 H LEU A 76 -14.327 -0.499 -2.581 1.00 0.00 H new ATOM 0 HA LEU A 76 -14.952 1.761 -0.756 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -15.405 1.762 -3.705 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -15.608 3.067 -2.553 1.00 0.00 H new ATOM 0 HG LEU A 76 -12.979 1.824 -3.381 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -12.622 4.063 -4.489 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -14.049 3.229 -5.148 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -14.254 4.554 -3.979 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -11.896 3.695 -2.190 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -13.486 4.223 -1.590 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -12.825 2.648 -1.090 1.00 0.00 H new ATOM 1157 N VAL A 77 -17.206 0.504 -0.596 1.00 0.00 N ATOM 1158 CA VAL A 77 -18.474 -0.193 -0.502 1.00 0.00 C ATOM 1159 C VAL A 77 -19.553 0.869 -0.641 1.00 0.00 C ATOM 1160 O VAL A 77 -19.561 1.849 0.107 1.00 0.00 O ATOM 1161 CB VAL A 77 -18.582 -1.009 0.799 1.00 0.00 C ATOM 1162 CG1 VAL A 77 -19.564 -2.146 0.537 1.00 0.00 C ATOM 1163 CG2 VAL A 77 -17.246 -1.585 1.309 1.00 0.00 C ATOM 0 H VAL A 77 -16.930 0.990 0.257 1.00 0.00 H new ATOM 0 HA VAL A 77 -18.582 -0.937 -1.291 1.00 0.00 H new ATOM 0 HB VAL A 77 -18.918 -0.333 1.586 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -19.669 -2.751 1.438 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -20.534 -1.733 0.262 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -19.191 -2.769 -0.276 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -17.418 -2.144 2.229 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -16.824 -2.249 0.554 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -16.549 -0.770 1.505 1.00 0.00 H new ATOM 1173 N LEU A 78 -20.425 0.707 -1.634 1.00 0.00 N ATOM 1174 CA LEU A 78 -21.402 1.692 -2.063 1.00 0.00 C ATOM 1175 C LEU A 78 -22.796 1.093 -1.906 1.00 0.00 C ATOM 1176 O LEU A 78 -22.970 -0.126 -1.986 1.00 0.00 O ATOM 1177 CB LEU A 78 -21.145 2.112 -3.530 1.00 0.00 C ATOM 1178 CG LEU A 78 -20.229 3.340 -3.706 1.00 0.00 C ATOM 1179 CD1 LEU A 78 -18.787 3.122 -3.236 1.00 0.00 C ATOM 1180 CD2 LEU A 78 -20.188 3.783 -5.171 1.00 0.00 C ATOM 0 H LEU A 78 -20.468 -0.153 -2.182 1.00 0.00 H new ATOM 0 HA LEU A 78 -21.318 2.588 -1.447 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -20.703 1.269 -4.061 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -22.103 2.321 -4.005 1.00 0.00 H new ATOM 0 HG LEU A 78 -20.671 4.108 -3.072 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -18.211 4.033 -3.395 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -18.784 2.871 -2.175 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -18.339 2.306 -3.803 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -19.536 4.651 -5.271 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -19.806 2.969 -5.787 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -21.193 4.045 -5.500 1.00 0.00 H new ATOM 1192 N LYS A 79 -23.807 1.942 -1.720 1.00 0.00 N ATOM 1193 CA LYS A 79 -25.201 1.544 -1.771 1.00 0.00 C ATOM 1194 C LYS A 79 -25.991 2.668 -2.407 1.00 0.00 C ATOM 1195 O LYS A 79 -25.856 3.823 -2.007 1.00 0.00 O ATOM 1196 CB LYS A 79 -25.757 1.145 -0.393 1.00 0.00 C ATOM 1197 CG LYS A 79 -25.824 2.241 0.687 1.00 0.00 C ATOM 1198 CD LYS A 79 -26.221 1.664 2.059 1.00 0.00 C ATOM 1199 CE LYS A 79 -27.633 1.059 2.050 1.00 0.00 C ATOM 1200 NZ LYS A 79 -28.008 0.426 3.341 1.00 0.00 N ATOM 0 H LYS A 79 -23.672 2.935 -1.528 1.00 0.00 H new ATOM 0 HA LYS A 79 -25.293 0.643 -2.378 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -26.763 0.751 -0.537 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -25.147 0.328 -0.007 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -24.855 2.734 0.766 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -26.546 3.002 0.389 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -25.502 0.899 2.351 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -26.170 2.452 2.811 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -28.355 1.841 1.813 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -27.697 0.315 1.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -29.035 0.266 3.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -27.514 -0.484 3.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -27.737 1.052 4.126 1.00 0.00 H new ATOM 1214 N ASP A 80 -26.805 2.305 -3.394 1.00 0.00 N ATOM 1215 CA ASP A 80 -27.826 3.117 -4.052 1.00 0.00 C ATOM 1216 C ASP A 80 -27.392 4.559 -4.382 1.00 0.00 C ATOM 1217 O ASP A 80 -28.211 5.480 -4.360 1.00 0.00 O ATOM 1218 CB ASP A 80 -29.125 3.035 -3.229 1.00 0.00 C ATOM 1219 CG ASP A 80 -30.350 3.574 -3.990 1.00 0.00 C ATOM 1220 OD1 ASP A 80 -30.604 3.125 -5.130 1.00 0.00 O ATOM 1221 OD2 ASP A 80 -31.112 4.389 -3.421 1.00 0.00 O ATOM 0 H ASP A 80 -26.766 1.364 -3.785 1.00 0.00 H new ATOM 0 HA ASP A 80 -28.002 2.698 -5.043 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -29.306 1.998 -2.947 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -29.000 3.599 -2.305 1.00 0.00 H new ATOM 1226 N GLY A 81 -26.096 4.777 -4.660 1.00 0.00 N ATOM 1227 CA GLY A 81 -25.563 6.078 -5.056 1.00 0.00 C ATOM 1228 C GLY A 81 -24.363 6.578 -4.261 1.00 0.00 C ATOM 1229 O GLY A 81 -23.660 7.460 -4.756 1.00 0.00 O ATOM 0 H GLY A 81 -25.388 4.044 -4.614 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -25.282 6.028 -6.108 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -26.361 6.816 -4.974 1.00 0.00 H new ATOM 1233 N GLU A 82 -24.109 6.049 -3.061 1.00 0.00 N ATOM 1234 CA GLU A 82 -23.137 6.624 -2.142 1.00 0.00 C ATOM 1235 C GLU A 82 -22.246 5.580 -1.478 1.00 0.00 C ATOM 1236 O GLU A 82 -22.678 4.455 -1.244 1.00 0.00 O ATOM 1237 CB GLU A 82 -23.898 7.457 -1.094 1.00 0.00 C ATOM 1238 CG GLU A 82 -24.530 6.628 0.040 1.00 0.00 C ATOM 1239 CD GLU A 82 -25.376 7.510 0.974 1.00 0.00 C ATOM 1240 OE1 GLU A 82 -24.833 8.066 1.957 1.00 0.00 O ATOM 1241 OE2 GLU A 82 -26.599 7.653 0.748 1.00 0.00 O ATOM 0 H GLU A 82 -24.572 5.213 -2.705 1.00 0.00 H new ATOM 0 HA GLU A 82 -22.458 7.258 -2.712 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -23.213 8.184 -0.658 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -24.684 8.021 -1.597 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -25.154 5.842 -0.386 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -23.745 6.135 0.614 1.00 0.00 H new ATOM 1248 N VAL A 83 -21.008 5.961 -1.155 1.00 0.00 N ATOM 1249 CA VAL A 83 -20.103 5.170 -0.329 1.00 0.00 C ATOM 1250 C VAL A 83 -20.669 5.125 1.094 1.00 0.00 C ATOM 1251 O VAL A 83 -21.174 6.119 1.621 1.00 0.00 O ATOM 1252 CB VAL A 83 -18.663 5.719 -0.458 1.00 0.00 C ATOM 1253 CG1 VAL A 83 -18.477 7.136 0.106 1.00 0.00 C ATOM 1254 CG2 VAL A 83 -17.628 4.774 0.164 1.00 0.00 C ATOM 0 H VAL A 83 -20.603 6.843 -1.467 1.00 0.00 H new ATOM 0 HA VAL A 83 -20.033 4.134 -0.662 1.00 0.00 H new ATOM 0 HB VAL A 83 -18.493 5.781 -1.533 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -17.440 7.446 -0.024 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -19.132 7.828 -0.424 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -18.727 7.141 1.167 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -16.631 5.200 0.050 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -17.847 4.641 1.224 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -17.669 3.808 -0.339 1.00 0.00 H new ATOM 1264 N VAL A 84 -20.584 3.948 1.702 1.00 0.00 N ATOM 1265 CA VAL A 84 -21.178 3.607 2.986 1.00 0.00 C ATOM 1266 C VAL A 84 -20.128 2.920 3.867 1.00 0.00 C ATOM 1267 O VAL A 84 -20.172 3.073 5.088 1.00 0.00 O ATOM 1268 CB VAL A 84 -22.471 2.792 2.742 1.00 0.00 C ATOM 1269 CG1 VAL A 84 -22.323 1.662 1.704 1.00 0.00 C ATOM 1270 CG2 VAL A 84 -23.073 2.246 4.042 1.00 0.00 C ATOM 0 H VAL A 84 -20.073 3.167 1.291 1.00 0.00 H new ATOM 0 HA VAL A 84 -21.486 4.492 3.542 1.00 0.00 H new ATOM 0 HB VAL A 84 -23.164 3.516 2.314 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -23.275 1.142 1.594 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -22.028 2.086 0.744 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -21.561 0.958 2.039 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -23.978 1.682 3.815 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -22.351 1.592 4.531 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -23.319 3.075 4.706 1.00 0.00 H new ATOM 1280 N GLU A 85 -19.129 2.263 3.270 1.00 0.00 N ATOM 1281 CA GLU A 85 -17.955 1.757 3.967 1.00 0.00 C ATOM 1282 C GLU A 85 -16.761 1.916 3.027 1.00 0.00 C ATOM 1283 O GLU A 85 -16.916 2.043 1.809 1.00 0.00 O ATOM 1284 CB GLU A 85 -18.128 0.293 4.428 1.00 0.00 C ATOM 1285 CG GLU A 85 -18.910 0.099 5.739 1.00 0.00 C ATOM 1286 CD GLU A 85 -18.216 0.637 7.009 1.00 0.00 C ATOM 1287 OE1 GLU A 85 -17.128 1.252 6.933 1.00 0.00 O ATOM 1288 OE2 GLU A 85 -18.764 0.417 8.115 1.00 0.00 O ATOM 0 H GLU A 85 -19.119 2.067 2.269 1.00 0.00 H new ATOM 0 HA GLU A 85 -17.798 2.328 4.882 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -18.635 -0.261 3.638 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -17.140 -0.152 4.546 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -19.879 0.588 5.640 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -19.102 -0.965 5.874 1.00 0.00 H new ATOM 1295 N THR A 86 -15.556 1.958 3.579 1.00 0.00 N ATOM 1296 CA THR A 86 -14.320 2.222 2.855 1.00 0.00 C ATOM 1297 C THR A 86 -13.223 1.556 3.689 1.00 0.00 C ATOM 1298 O THR A 86 -13.228 1.696 4.918 1.00 0.00 O ATOM 1299 CB THR A 86 -14.095 3.746 2.746 1.00 0.00 C ATOM 1300 OG1 THR A 86 -15.305 4.463 2.565 1.00 0.00 O ATOM 1301 CG2 THR A 86 -13.209 4.065 1.548 1.00 0.00 C ATOM 0 H THR A 86 -15.407 1.804 4.576 1.00 0.00 H new ATOM 0 HA THR A 86 -14.335 1.834 1.837 1.00 0.00 H new ATOM 0 HB THR A 86 -13.630 4.049 3.684 1.00 0.00 H new ATOM 0 HG1 THR A 86 -15.111 5.422 2.503 1.00 0.00 H new ATOM 0 HG21 THR A 86 -13.059 5.143 1.483 1.00 0.00 H new ATOM 0 HG22 THR A 86 -12.245 3.571 1.667 1.00 0.00 H new ATOM 0 HG23 THR A 86 -13.689 3.710 0.636 1.00 0.00 H new ATOM 1309 N SER A 87 -12.316 0.803 3.067 1.00 0.00 N ATOM 1310 CA SER A 87 -11.287 0.064 3.786 1.00 0.00 C ATOM 1311 C SER A 87 -10.099 -0.162 2.852 1.00 0.00 C ATOM 1312 O SER A 87 -10.268 -0.277 1.638 1.00 0.00 O ATOM 1313 CB SER A 87 -11.905 -1.236 4.315 1.00 0.00 C ATOM 1314 OG SER A 87 -10.992 -1.938 5.139 1.00 0.00 O ATOM 0 H SER A 87 -12.277 0.690 2.054 1.00 0.00 H new ATOM 0 HA SER A 87 -10.911 0.617 4.647 1.00 0.00 H new ATOM 0 HB2 SER A 87 -12.809 -1.009 4.880 1.00 0.00 H new ATOM 0 HB3 SER A 87 -12.203 -1.867 3.478 1.00 0.00 H new ATOM 0 HG SER A 87 -11.470 -2.632 5.639 1.00 0.00 H new ATOM 1320 N VAL A 88 -8.892 -0.214 3.414 1.00 0.00 N ATOM 1321 CA VAL A 88 -7.634 -0.196 2.677 1.00 0.00 C ATOM 1322 C VAL A 88 -6.697 -1.217 3.341 1.00 0.00 C ATOM 1323 O VAL A 88 -5.886 -0.876 4.205 1.00 0.00 O ATOM 1324 CB VAL A 88 -7.115 1.267 2.634 1.00 0.00 C ATOM 1325 CG1 VAL A 88 -5.734 1.376 1.987 1.00 0.00 C ATOM 1326 CG2 VAL A 88 -8.046 2.203 1.846 1.00 0.00 C ATOM 0 H VAL A 88 -8.761 -0.271 4.424 1.00 0.00 H new ATOM 0 HA VAL A 88 -7.727 -0.500 1.634 1.00 0.00 H new ATOM 0 HB VAL A 88 -7.073 1.569 3.680 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -5.416 2.419 1.981 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -5.018 0.782 2.555 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -5.782 1.006 0.963 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -7.634 3.212 1.849 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -8.133 1.849 0.819 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -9.032 2.212 2.311 1.00 0.00 H new ATOM 1336 N GLY A 89 -6.840 -2.496 2.987 1.00 0.00 N ATOM 1337 CA GLY A 89 -6.066 -3.602 3.551 1.00 0.00 C ATOM 1338 C GLY A 89 -6.748 -4.940 3.275 1.00 0.00 C ATOM 1339 O GLY A 89 -7.944 -4.968 2.973 1.00 0.00 O ATOM 0 H GLY A 89 -7.514 -2.798 2.283 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -5.063 -3.605 3.123 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -5.953 -3.461 4.626 1.00 0.00 H new ATOM 1343 N PHE A 90 -6.010 -6.049 3.349 1.00 0.00 N ATOM 1344 CA PHE A 90 -6.553 -7.384 3.102 1.00 0.00 C ATOM 1345 C PHE A 90 -7.568 -7.777 4.184 1.00 0.00 C ATOM 1346 O PHE A 90 -7.377 -7.457 5.360 1.00 0.00 O ATOM 1347 CB PHE A 90 -5.410 -8.412 3.030 1.00 0.00 C ATOM 1348 CG PHE A 90 -5.892 -9.846 2.885 1.00 0.00 C ATOM 1349 CD1 PHE A 90 -6.459 -10.285 1.672 1.00 0.00 C ATOM 1350 CD2 PHE A 90 -5.858 -10.718 3.992 1.00 0.00 C ATOM 1351 CE1 PHE A 90 -7.009 -11.576 1.578 1.00 0.00 C ATOM 1352 CE2 PHE A 90 -6.391 -12.015 3.890 1.00 0.00 C ATOM 1353 CZ PHE A 90 -6.969 -12.444 2.683 1.00 0.00 C ATOM 0 H PHE A 90 -5.017 -6.046 3.582 1.00 0.00 H new ATOM 0 HA PHE A 90 -7.076 -7.371 2.146 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -4.764 -8.167 2.187 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -4.802 -8.331 3.931 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -6.471 -9.630 0.814 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -5.421 -10.388 4.923 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -7.464 -11.902 0.654 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -6.356 -12.682 4.739 1.00 0.00 H new ATOM 0 HZ PHE A 90 -7.382 -13.439 2.605 1.00 0.00 H new ATOM 1363 N LYS A 91 -8.607 -8.529 3.796 1.00 0.00 N ATOM 1364 CA LYS A 91 -9.565 -9.162 4.706 1.00 0.00 C ATOM 1365 C LYS A 91 -9.806 -10.595 4.224 1.00 0.00 C ATOM 1366 O LYS A 91 -9.964 -10.782 3.014 1.00 0.00 O ATOM 1367 CB LYS A 91 -10.924 -8.431 4.688 1.00 0.00 C ATOM 1368 CG LYS A 91 -11.113 -7.323 5.739 1.00 0.00 C ATOM 1369 CD LYS A 91 -10.538 -5.958 5.350 1.00 0.00 C ATOM 1370 CE LYS A 91 -11.261 -5.366 4.133 1.00 0.00 C ATOM 1371 NZ LYS A 91 -10.523 -4.206 3.588 1.00 0.00 N ATOM 0 H LYS A 91 -8.808 -8.717 2.814 1.00 0.00 H new ATOM 0 HA LYS A 91 -9.156 -9.130 5.716 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -11.065 -7.993 3.700 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -11.713 -9.171 4.824 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -12.179 -7.209 5.937 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -10.648 -7.644 6.671 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -10.624 -5.273 6.193 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -9.476 -6.060 5.129 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -11.366 -6.129 3.362 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -12.268 -5.060 4.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -10.946 -3.920 2.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -10.575 -3.414 4.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -9.528 -4.467 3.438 1.00 0.00 H new ATOM 1385 N PRO A 92 -9.891 -11.591 5.125 1.00 0.00 N ATOM 1386 CA PRO A 92 -10.342 -12.930 4.763 1.00 0.00 C ATOM 1387 C PRO A 92 -11.839 -12.904 4.421 1.00 0.00 C ATOM 1388 O PRO A 92 -12.537 -11.926 4.701 1.00 0.00 O ATOM 1389 CB PRO A 92 -10.037 -13.804 5.985 1.00 0.00 C ATOM 1390 CG PRO A 92 -10.144 -12.821 7.148 1.00 0.00 C ATOM 1391 CD PRO A 92 -9.592 -11.528 6.549 1.00 0.00 C ATOM 0 HA PRO A 92 -9.840 -13.322 3.878 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -10.749 -14.623 6.083 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -9.044 -14.250 5.924 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -11.174 -12.703 7.485 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -9.562 -13.149 8.010 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -10.056 -10.655 7.008 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -8.519 -11.445 6.720 1.00 0.00 H new ATOM 1399 N LYS A 93 -12.345 -14.012 3.868 1.00 0.00 N ATOM 1400 CA LYS A 93 -13.729 -14.199 3.420 1.00 0.00 C ATOM 1401 C LYS A 93 -14.745 -13.705 4.447 1.00 0.00 C ATOM 1402 O LYS A 93 -15.656 -12.960 4.088 1.00 0.00 O ATOM 1403 CB LYS A 93 -13.895 -15.689 3.046 1.00 0.00 C ATOM 1404 CG LYS A 93 -15.326 -16.230 2.902 1.00 0.00 C ATOM 1405 CD LYS A 93 -16.160 -15.613 1.768 1.00 0.00 C ATOM 1406 CE LYS A 93 -17.595 -16.153 1.881 1.00 0.00 C ATOM 1407 NZ LYS A 93 -17.727 -17.554 1.409 1.00 0.00 N ATOM 0 H LYS A 93 -11.773 -14.842 3.713 1.00 0.00 H new ATOM 0 HA LYS A 93 -13.933 -13.587 2.542 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -13.375 -15.859 2.103 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -13.385 -16.285 3.803 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -15.274 -17.307 2.745 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -15.852 -16.070 3.843 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -16.156 -14.525 1.841 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -15.732 -15.869 0.799 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -17.919 -16.094 2.920 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -18.264 -15.516 1.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -18.600 -17.969 1.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -17.764 -17.568 0.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -16.909 -18.108 1.733 1.00 0.00 H new ATOM 1421 N GLU A 94 -14.593 -14.091 5.713 1.00 0.00 N ATOM 1422 CA GLU A 94 -15.581 -13.752 6.727 1.00 0.00 C ATOM 1423 C GLU A 94 -15.563 -12.256 7.035 1.00 0.00 C ATOM 1424 O GLU A 94 -16.622 -11.642 7.140 1.00 0.00 O ATOM 1425 CB GLU A 94 -15.341 -14.552 8.013 1.00 0.00 C ATOM 1426 CG GLU A 94 -15.554 -16.060 7.815 1.00 0.00 C ATOM 1427 CD GLU A 94 -15.366 -16.834 9.131 1.00 0.00 C ATOM 1428 OE1 GLU A 94 -14.229 -17.260 9.438 1.00 0.00 O ATOM 1429 OE2 GLU A 94 -16.357 -17.045 9.868 1.00 0.00 O ATOM 0 H GLU A 94 -13.801 -14.634 6.056 1.00 0.00 H new ATOM 0 HA GLU A 94 -16.562 -14.012 6.329 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -14.324 -14.375 8.363 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -16.013 -14.192 8.792 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -16.557 -16.239 7.427 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -14.852 -16.433 7.069 1.00 0.00 H new ATOM 1436 N ALA A 95 -14.377 -11.650 7.148 1.00 0.00 N ATOM 1437 CA ALA A 95 -14.257 -10.221 7.402 1.00 0.00 C ATOM 1438 C ALA A 95 -14.807 -9.416 6.225 1.00 0.00 C ATOM 1439 O ALA A 95 -15.436 -8.378 6.430 1.00 0.00 O ATOM 1440 CB ALA A 95 -12.795 -9.864 7.666 1.00 0.00 C ATOM 0 H ALA A 95 -13.484 -12.136 7.066 1.00 0.00 H new ATOM 0 HA ALA A 95 -14.845 -9.969 8.284 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -12.710 -8.794 7.855 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -12.437 -10.416 8.535 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -12.193 -10.127 6.796 1.00 0.00 H new ATOM 1446 N LEU A 96 -14.596 -9.907 5.002 1.00 0.00 N ATOM 1447 CA LEU A 96 -15.126 -9.300 3.790 1.00 0.00 C ATOM 1448 C LEU A 96 -16.648 -9.271 3.865 1.00 0.00 C ATOM 1449 O LEU A 96 -17.267 -8.210 3.740 1.00 0.00 O ATOM 1450 CB LEU A 96 -14.664 -10.097 2.551 1.00 0.00 C ATOM 1451 CG LEU A 96 -14.328 -9.244 1.317 1.00 0.00 C ATOM 1452 CD1 LEU A 96 -15.380 -8.180 0.978 1.00 0.00 C ATOM 1453 CD2 LEU A 96 -12.966 -8.571 1.511 1.00 0.00 C ATOM 0 H LEU A 96 -14.045 -10.748 4.829 1.00 0.00 H new ATOM 0 HA LEU A 96 -14.752 -8.280 3.701 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -13.784 -10.681 2.821 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -15.447 -10.806 2.281 1.00 0.00 H new ATOM 0 HG LEU A 96 -14.310 -9.933 0.473 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -15.064 -7.624 0.095 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -16.336 -8.664 0.779 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -15.488 -7.495 1.819 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -12.730 -7.967 0.635 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -12.998 -7.932 2.394 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -12.199 -9.334 1.643 1.00 0.00 H new ATOM 1465 N GLN A 97 -17.241 -10.445 4.098 1.00 0.00 N ATOM 1466 CA GLN A 97 -18.679 -10.589 4.090 1.00 0.00 C ATOM 1467 C GLN A 97 -19.282 -9.789 5.234 1.00 0.00 C ATOM 1468 O GLN A 97 -20.308 -9.152 5.033 1.00 0.00 O ATOM 1469 CB GLN A 97 -19.097 -12.064 4.026 1.00 0.00 C ATOM 1470 CG GLN A 97 -19.410 -12.809 5.313 1.00 0.00 C ATOM 1471 CD GLN A 97 -19.828 -14.254 5.014 1.00 0.00 C ATOM 1472 OE1 GLN A 97 -19.199 -15.197 5.488 1.00 0.00 O ATOM 1473 NE2 GLN A 97 -20.868 -14.473 4.214 1.00 0.00 N ATOM 0 H GLN A 97 -16.734 -11.308 4.295 1.00 0.00 H new ATOM 0 HA GLN A 97 -19.094 -10.161 3.177 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -19.980 -12.126 3.390 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -18.300 -12.608 3.519 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -18.535 -12.805 5.963 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -20.209 -12.298 5.850 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -21.386 -13.686 3.824 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -21.147 -15.428 3.991 1.00 0.00 H new ATOM 1482 N GLU A 98 -18.630 -9.747 6.399 1.00 0.00 N ATOM 1483 CA GLU A 98 -19.085 -8.949 7.528 1.00 0.00 C ATOM 1484 C GLU A 98 -19.110 -7.462 7.172 1.00 0.00 C ATOM 1485 O GLU A 98 -20.114 -6.792 7.420 1.00 0.00 O ATOM 1486 CB GLU A 98 -18.209 -9.241 8.756 1.00 0.00 C ATOM 1487 CG GLU A 98 -18.623 -8.414 9.981 1.00 0.00 C ATOM 1488 CD GLU A 98 -17.837 -8.832 11.235 1.00 0.00 C ATOM 1489 OE1 GLU A 98 -16.725 -8.308 11.468 1.00 0.00 O ATOM 1490 OE2 GLU A 98 -18.334 -9.676 12.018 1.00 0.00 O ATOM 0 H GLU A 98 -17.772 -10.268 6.581 1.00 0.00 H new ATOM 0 HA GLU A 98 -20.110 -9.226 7.775 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -18.271 -10.302 8.999 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -17.167 -9.030 8.514 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -18.455 -7.356 9.781 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -19.691 -8.538 10.161 1.00 0.00 H new ATOM 1497 N LEU A 99 -18.034 -6.952 6.563 1.00 0.00 N ATOM 1498 CA LEU A 99 -17.881 -5.533 6.256 1.00 0.00 C ATOM 1499 C LEU A 99 -19.027 -5.028 5.385 1.00 0.00 C ATOM 1500 O LEU A 99 -19.524 -3.927 5.611 1.00 0.00 O ATOM 1501 CB LEU A 99 -16.522 -5.285 5.581 1.00 0.00 C ATOM 1502 CG LEU A 99 -16.290 -3.823 5.143 1.00 0.00 C ATOM 1503 CD1 LEU A 99 -16.351 -2.835 6.314 1.00 0.00 C ATOM 1504 CD2 LEU A 99 -14.921 -3.723 4.471 1.00 0.00 C ATOM 0 H LEU A 99 -17.240 -7.521 6.268 1.00 0.00 H new ATOM 0 HA LEU A 99 -17.914 -4.973 7.190 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -15.729 -5.576 6.269 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -16.440 -5.932 4.707 1.00 0.00 H new ATOM 0 HG LEU A 99 -17.090 -3.554 4.454 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -16.181 -1.823 5.946 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -17.332 -2.889 6.785 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -15.583 -3.089 7.045 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -14.744 -2.694 4.156 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -14.147 -4.025 5.176 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -14.894 -4.378 3.600 1.00 0.00 H new ATOM 1516 N VAL A 100 -19.455 -5.833 4.414 1.00 0.00 N ATOM 1517 CA VAL A 100 -20.536 -5.447 3.517 1.00 0.00 C ATOM 1518 C VAL A 100 -21.902 -5.789 4.136 1.00 0.00 C ATOM 1519 O VAL A 100 -22.810 -4.960 4.117 1.00 0.00 O ATOM 1520 CB VAL A 100 -20.262 -6.017 2.116 1.00 0.00 C ATOM 1521 CG1 VAL A 100 -20.232 -7.549 2.038 1.00 0.00 C ATOM 1522 CG2 VAL A 100 -21.261 -5.477 1.090 1.00 0.00 C ATOM 0 H VAL A 100 -19.067 -6.758 4.230 1.00 0.00 H new ATOM 0 HA VAL A 100 -20.577 -4.366 3.383 1.00 0.00 H new ATOM 0 HB VAL A 100 -19.254 -5.676 1.880 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -20.032 -7.857 1.012 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -19.447 -7.931 2.691 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -21.195 -7.948 2.356 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -21.040 -5.899 0.110 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -22.272 -5.756 1.385 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -21.183 -4.391 1.043 1.00 0.00 H new ATOM 1532 N ASN A 101 -22.052 -6.958 4.774 1.00 0.00 N ATOM 1533 CA ASN A 101 -23.291 -7.402 5.430 1.00 0.00 C ATOM 1534 C ASN A 101 -23.777 -6.406 6.492 1.00 0.00 C ATOM 1535 O ASN A 101 -24.976 -6.311 6.745 1.00 0.00 O ATOM 1536 CB ASN A 101 -23.093 -8.784 6.063 1.00 0.00 C ATOM 1537 CG ASN A 101 -24.336 -9.231 6.821 1.00 0.00 C ATOM 1538 OD1 ASN A 101 -25.289 -9.737 6.235 1.00 0.00 O ATOM 1539 ND2 ASN A 101 -24.352 -9.046 8.129 1.00 0.00 N ATOM 0 H ASN A 101 -21.296 -7.639 4.850 1.00 0.00 H new ATOM 0 HA ASN A 101 -24.059 -7.460 4.658 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -22.858 -9.511 5.286 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -22.241 -8.756 6.742 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -25.168 -9.326 8.674 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -23.549 -8.624 8.594 1.00 0.00 H new ATOM 1546 N LYS A 102 -22.858 -5.639 7.091 1.00 0.00 N ATOM 1547 CA LYS A 102 -23.152 -4.560 8.035 1.00 0.00 C ATOM 1548 C LYS A 102 -24.210 -3.593 7.500 1.00 0.00 C ATOM 1549 O LYS A 102 -24.973 -3.052 8.302 1.00 0.00 O ATOM 1550 CB LYS A 102 -21.846 -3.806 8.345 1.00 0.00 C ATOM 1551 CG LYS A 102 -21.149 -4.303 9.624 1.00 0.00 C ATOM 1552 CD LYS A 102 -19.626 -4.102 9.647 1.00 0.00 C ATOM 1553 CE LYS A 102 -19.149 -2.762 9.074 1.00 0.00 C ATOM 1554 NZ LYS A 102 -19.484 -1.582 9.909 1.00 0.00 N ATOM 0 H LYS A 102 -21.859 -5.758 6.925 1.00 0.00 H new ATOM 0 HA LYS A 102 -23.562 -5.001 8.944 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -21.163 -3.913 7.502 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -22.063 -2.743 8.447 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -21.582 -3.787 10.481 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -21.363 -5.364 9.749 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -19.277 -4.187 10.676 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -19.158 -4.910 9.084 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -18.068 -2.802 8.941 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -19.587 -2.628 8.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -19.142 -0.718 9.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -20.515 -1.524 10.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -19.030 -1.676 10.840 1.00 0.00 H new ATOM 1568 N HIS A 103 -24.261 -3.367 6.183 1.00 0.00 N ATOM 1569 CA HIS A 103 -25.136 -2.360 5.581 1.00 0.00 C ATOM 1570 C HIS A 103 -25.877 -2.843 4.321 1.00 0.00 C ATOM 1571 O HIS A 103 -26.720 -2.111 3.794 1.00 0.00 O ATOM 1572 CB HIS A 103 -24.281 -1.123 5.302 1.00 0.00 C ATOM 1573 CG HIS A 103 -23.301 -1.342 4.185 1.00 0.00 C ATOM 1574 ND1 HIS A 103 -23.615 -1.380 2.847 1.00 0.00 N ATOM 1575 CD2 HIS A 103 -21.971 -1.651 4.304 1.00 0.00 C ATOM 1576 CE1 HIS A 103 -22.501 -1.700 2.178 1.00 0.00 C ATOM 1577 NE2 HIS A 103 -21.469 -1.856 3.021 1.00 0.00 N ATOM 0 H HIS A 103 -23.696 -3.878 5.505 1.00 0.00 H new ATOM 0 HA HIS A 103 -25.939 -2.131 6.282 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -24.931 -0.285 5.052 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -23.740 -0.847 6.207 1.00 0.00 H new ATOM 0 HD1 HIS A 103 -24.531 -1.197 2.438 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -21.413 -1.723 5.226 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -22.441 -1.817 1.106 1.00 0.00 H new ATOM 1585 N LEU A 104 -25.537 -4.026 3.805 1.00 0.00 N ATOM 1586 CA LEU A 104 -26.256 -4.754 2.765 1.00 0.00 C ATOM 1587 C LEU A 104 -27.565 -5.196 3.421 1.00 0.00 C ATOM 1588 O LEU A 104 -27.527 -5.847 4.486 1.00 0.00 O ATOM 1589 CB LEU A 104 -25.378 -5.942 2.351 1.00 0.00 C ATOM 1590 CG LEU A 104 -26.108 -7.106 1.680 1.00 0.00 C ATOM 1591 CD1 LEU A 104 -26.781 -6.690 0.373 1.00 0.00 C ATOM 1592 CD2 LEU A 104 -25.087 -8.209 1.414 1.00 0.00 C ATOM 1593 OXT LEU A 104 -28.638 -4.868 2.877 1.00 0.00 O ATOM 0 H LEU A 104 -24.706 -4.527 4.121 1.00 0.00 H new ATOM 0 HA LEU A 104 -26.471 -4.173 1.868 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -24.607 -5.580 1.670 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -24.869 -6.320 3.238 1.00 0.00 H new ATOM 0 HG LEU A 104 -26.900 -7.455 2.343 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -27.286 -7.550 -0.066 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -27.510 -5.904 0.573 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -26.028 -6.318 -0.322 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -25.581 -9.054 0.935 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -24.302 -7.829 0.760 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -24.647 -8.533 2.357 1.00 0.00 H new TER 1605 LEU A 104 ATOM 1606 N MET B 1 7.525 27.900 -9.225 1.00 0.00 N ATOM 1607 CA MET B 1 7.487 29.238 -8.601 1.00 0.00 C ATOM 1608 C MET B 1 6.869 29.133 -7.202 1.00 0.00 C ATOM 1609 O MET B 1 5.647 29.064 -7.066 1.00 0.00 O ATOM 1610 CB MET B 1 6.766 30.270 -9.494 1.00 0.00 C ATOM 1611 CG MET B 1 6.856 31.693 -8.921 1.00 0.00 C ATOM 1612 SD MET B 1 6.038 32.983 -9.908 1.00 0.00 S ATOM 1613 CE MET B 1 7.150 33.081 -11.340 1.00 0.00 C ATOM 0 H1 MET B 1 7.530 28.000 -10.260 1.00 0.00 H new ATOM 0 H2 MET B 1 8.385 27.400 -8.921 1.00 0.00 H new ATOM 0 H3 MET B 1 6.687 27.357 -8.933 1.00 0.00 H new ATOM 0 HA MET B 1 8.507 29.607 -8.494 1.00 0.00 H new ATOM 0 HB2 MET B 1 7.203 30.253 -10.492 1.00 0.00 H new ATOM 0 HB3 MET B 1 5.718 29.988 -9.600 1.00 0.00 H new ATOM 0 HG2 MET B 1 6.420 31.693 -7.922 1.00 0.00 H new ATOM 0 HG3 MET B 1 7.908 31.956 -8.810 1.00 0.00 H new ATOM 0 HE1 MET B 1 6.820 33.881 -12.003 1.00 0.00 H new ATOM 0 HE2 MET B 1 8.165 33.288 -10.999 1.00 0.00 H new ATOM 0 HE3 MET B 1 7.134 32.134 -11.879 1.00 0.00 H new ATOM 1625 N GLU B 2 7.710 29.150 -6.162 1.00 0.00 N ATOM 1626 CA GLU B 2 7.330 29.272 -4.751 1.00 0.00 C ATOM 1627 C GLU B 2 6.265 28.244 -4.320 1.00 0.00 C ATOM 1628 O GLU B 2 5.265 28.609 -3.701 1.00 0.00 O ATOM 1629 CB GLU B 2 6.963 30.737 -4.424 1.00 0.00 C ATOM 1630 CG GLU B 2 8.108 31.720 -4.716 1.00 0.00 C ATOM 1631 CD GLU B 2 7.754 33.151 -4.271 1.00 0.00 C ATOM 1632 OE1 GLU B 2 7.038 33.867 -5.007 1.00 0.00 O ATOM 1633 OE2 GLU B 2 8.207 33.589 -3.189 1.00 0.00 O ATOM 0 H GLU B 2 8.720 29.076 -6.287 1.00 0.00 H new ATOM 0 HA GLU B 2 8.196 29.016 -4.141 1.00 0.00 H new ATOM 0 HB2 GLU B 2 6.087 31.025 -5.005 1.00 0.00 H new ATOM 0 HB3 GLU B 2 6.687 30.811 -3.372 1.00 0.00 H new ATOM 0 HG2 GLU B 2 9.011 31.391 -4.201 1.00 0.00 H new ATOM 0 HG3 GLU B 2 8.330 31.715 -5.783 1.00 0.00 H new ATOM 1640 N ASN B 3 6.495 26.966 -4.672 1.00 0.00 N ATOM 1641 CA ASN B 3 5.824 25.719 -4.280 1.00 0.00 C ATOM 1642 C ASN B 3 5.606 24.855 -5.522 1.00 0.00 C ATOM 1643 O ASN B 3 5.037 25.284 -6.525 1.00 0.00 O ATOM 1644 CB ASN B 3 4.491 25.828 -3.515 1.00 0.00 C ATOM 1645 CG ASN B 3 4.561 26.225 -2.035 1.00 0.00 C ATOM 1646 OD1 ASN B 3 3.525 26.289 -1.380 1.00 0.00 O ATOM 1647 ND2 ASN B 3 5.724 26.457 -1.439 1.00 0.00 N ATOM 0 H ASN B 3 7.254 26.761 -5.322 1.00 0.00 H new ATOM 0 HA ASN B 3 6.509 25.279 -3.556 1.00 0.00 H new ATOM 0 HB2 ASN B 3 3.865 26.556 -4.030 1.00 0.00 H new ATOM 0 HB3 ASN B 3 3.983 24.866 -3.583 1.00 0.00 H new ATOM 0 HD21 ASN B 3 5.751 26.686 -0.445 1.00 0.00 H new ATOM 0 HD22 ASN B 3 6.591 26.406 -1.975 1.00 0.00 H new ATOM 1654 N LYS B 4 6.023 23.608 -5.361 1.00 0.00 N ATOM 1655 CA LYS B 4 5.874 22.385 -6.138 1.00 0.00 C ATOM 1656 C LYS B 4 5.919 21.277 -5.090 1.00 0.00 C ATOM 1657 O LYS B 4 6.451 21.512 -4.004 1.00 0.00 O ATOM 1658 CB LYS B 4 7.048 22.225 -7.116 1.00 0.00 C ATOM 1659 CG LYS B 4 6.861 23.109 -8.352 1.00 0.00 C ATOM 1660 CD LYS B 4 7.977 24.130 -8.593 1.00 0.00 C ATOM 1661 CE LYS B 4 9.362 23.488 -8.745 1.00 0.00 C ATOM 1662 NZ LYS B 4 10.322 24.410 -9.397 1.00 0.00 N ATOM 0 H LYS B 4 6.574 23.398 -4.529 1.00 0.00 H new ATOM 0 HA LYS B 4 4.961 22.376 -6.733 1.00 0.00 H new ATOM 0 HB2 LYS B 4 7.980 22.487 -6.616 1.00 0.00 H new ATOM 0 HB3 LYS B 4 7.132 21.182 -7.421 1.00 0.00 H new ATOM 0 HG2 LYS B 4 6.780 22.468 -9.230 1.00 0.00 H new ATOM 0 HG3 LYS B 4 5.915 23.643 -8.259 1.00 0.00 H new ATOM 0 HD2 LYS B 4 7.749 24.703 -9.492 1.00 0.00 H new ATOM 0 HD3 LYS B 4 8.000 24.836 -7.763 1.00 0.00 H new ATOM 0 HE2 LYS B 4 9.741 23.202 -7.764 1.00 0.00 H new ATOM 0 HE3 LYS B 4 9.278 22.574 -9.333 1.00 0.00 H new ATOM 0 HZ1 LYS B 4 11.294 24.095 -9.201 1.00 0.00 H new ATOM 0 HZ2 LYS B 4 10.159 24.412 -10.424 1.00 0.00 H new ATOM 0 HZ3 LYS B 4 10.188 25.371 -9.024 1.00 0.00 H new ATOM 1676 N ILE B 5 5.397 20.088 -5.368 1.00 0.00 N ATOM 1677 CA ILE B 5 5.216 19.077 -4.334 1.00 0.00 C ATOM 1678 C ILE B 5 5.964 17.811 -4.734 1.00 0.00 C ATOM 1679 O ILE B 5 5.968 17.420 -5.902 1.00 0.00 O ATOM 1680 CB ILE B 5 3.704 18.892 -4.076 1.00 0.00 C ATOM 1681 CG1 ILE B 5 3.108 20.239 -3.599 1.00 0.00 C ATOM 1682 CG2 ILE B 5 3.450 17.749 -3.085 1.00 0.00 C ATOM 1683 CD1 ILE B 5 1.798 20.147 -2.823 1.00 0.00 C ATOM 0 H ILE B 5 5.092 19.801 -6.298 1.00 0.00 H new ATOM 0 HA ILE B 5 5.647 19.381 -3.380 1.00 0.00 H new ATOM 0 HB ILE B 5 3.202 18.605 -5.000 1.00 0.00 H new ATOM 0 HG12 ILE B 5 3.846 20.739 -2.972 1.00 0.00 H new ATOM 0 HG13 ILE B 5 2.948 20.873 -4.471 1.00 0.00 H new ATOM 0 HG21 ILE B 5 2.378 17.641 -2.922 1.00 0.00 H new ATOM 0 HG22 ILE B 5 3.851 16.820 -3.490 1.00 0.00 H new ATOM 0 HG23 ILE B 5 3.941 17.973 -2.138 1.00 0.00 H new ATOM 0 HD11 ILE B 5 1.472 21.148 -2.539 1.00 0.00 H new ATOM 0 HD12 ILE B 5 1.036 19.682 -3.449 1.00 0.00 H new ATOM 0 HD13 ILE B 5 1.948 19.546 -1.926 1.00 0.00 H new ATOM 1695 N ILE B 6 6.559 17.153 -3.746 1.00 0.00 N ATOM 1696 CA ILE B 6 7.306 15.910 -3.891 1.00 0.00 C ATOM 1697 C ILE B 6 7.025 15.067 -2.644 1.00 0.00 C ATOM 1698 O ILE B 6 6.815 15.611 -1.553 1.00 0.00 O ATOM 1699 CB ILE B 6 8.808 16.217 -4.131 1.00 0.00 C ATOM 1700 CG1 ILE B 6 9.604 14.924 -4.427 1.00 0.00 C ATOM 1701 CG2 ILE B 6 9.438 17.033 -2.985 1.00 0.00 C ATOM 1702 CD1 ILE B 6 11.089 15.172 -4.707 1.00 0.00 C ATOM 0 H ILE B 6 6.533 17.485 -2.782 1.00 0.00 H new ATOM 0 HA ILE B 6 6.994 15.335 -4.763 1.00 0.00 H new ATOM 0 HB ILE B 6 8.864 16.849 -5.017 1.00 0.00 H new ATOM 0 HG12 ILE B 6 9.511 14.247 -3.578 1.00 0.00 H new ATOM 0 HG13 ILE B 6 9.159 14.422 -5.286 1.00 0.00 H new ATOM 0 HG21 ILE B 6 10.489 17.219 -3.206 1.00 0.00 H new ATOM 0 HG22 ILE B 6 8.915 17.984 -2.885 1.00 0.00 H new ATOM 0 HG23 ILE B 6 9.356 16.474 -2.053 1.00 0.00 H new ATOM 0 HD11 ILE B 6 11.585 14.222 -4.906 1.00 0.00 H new ATOM 0 HD12 ILE B 6 11.192 15.824 -5.574 1.00 0.00 H new ATOM 0 HD13 ILE B 6 11.548 15.647 -3.840 1.00 0.00 H new ATOM 1714 N TYR B 7 6.997 13.744 -2.807 1.00 0.00 N ATOM 1715 CA TYR B 7 6.539 12.828 -1.776 1.00 0.00 C ATOM 1716 C TYR B 7 7.478 11.638 -1.690 1.00 0.00 C ATOM 1717 O TYR B 7 7.830 11.064 -2.720 1.00 0.00 O ATOM 1718 CB TYR B 7 5.121 12.339 -2.127 1.00 0.00 C ATOM 1719 CG TYR B 7 4.115 12.614 -1.038 1.00 0.00 C ATOM 1720 CD1 TYR B 7 4.026 11.760 0.076 1.00 0.00 C ATOM 1721 CD2 TYR B 7 3.281 13.741 -1.129 1.00 0.00 C ATOM 1722 CE1 TYR B 7 3.078 12.015 1.081 1.00 0.00 C ATOM 1723 CE2 TYR B 7 2.337 13.998 -0.124 1.00 0.00 C ATOM 1724 CZ TYR B 7 2.219 13.129 0.983 1.00 0.00 C ATOM 1725 OH TYR B 7 1.329 13.374 1.985 1.00 0.00 O ATOM 0 H TYR B 7 7.294 13.280 -3.665 1.00 0.00 H new ATOM 0 HA TYR B 7 6.525 13.342 -0.815 1.00 0.00 H new ATOM 0 HB2 TYR B 7 4.793 12.823 -3.047 1.00 0.00 H new ATOM 0 HB3 TYR B 7 5.151 11.267 -2.324 1.00 0.00 H new ATOM 0 HD1 TYR B 7 4.686 10.909 0.159 1.00 0.00 H new ATOM 0 HD2 TYR B 7 3.367 14.409 -1.973 1.00 0.00 H new ATOM 0 HE1 TYR B 7 3.007 11.355 1.933 1.00 0.00 H new ATOM 0 HE2 TYR B 7 1.697 14.865 -0.197 1.00 0.00 H new ATOM 0 HH TYR B 7 0.982 14.287 1.899 1.00 0.00 H new ATOM 1735 N PHE B 8 7.856 11.251 -0.473 1.00 0.00 N ATOM 1736 CA PHE B 8 8.557 10.003 -0.219 1.00 0.00 C ATOM 1737 C PHE B 8 7.504 8.953 0.103 1.00 0.00 C ATOM 1738 O PHE B 8 6.526 9.255 0.792 1.00 0.00 O ATOM 1739 CB PHE B 8 9.520 10.155 0.963 1.00 0.00 C ATOM 1740 CG PHE B 8 10.548 11.245 0.764 1.00 0.00 C ATOM 1741 CD1 PHE B 8 11.391 11.219 -0.362 1.00 0.00 C ATOM 1742 CD2 PHE B 8 10.627 12.316 1.667 1.00 0.00 C ATOM 1743 CE1 PHE B 8 12.242 12.301 -0.639 1.00 0.00 C ATOM 1744 CE2 PHE B 8 11.508 13.374 1.410 1.00 0.00 C ATOM 1745 CZ PHE B 8 12.295 13.386 0.252 1.00 0.00 C ATOM 0 H PHE B 8 7.681 11.802 0.368 1.00 0.00 H new ATOM 0 HA PHE B 8 9.145 9.715 -1.090 1.00 0.00 H new ATOM 0 HB2 PHE B 8 8.946 10.368 1.865 1.00 0.00 H new ATOM 0 HB3 PHE B 8 10.033 9.208 1.128 1.00 0.00 H new ATOM 0 HD1 PHE B 8 11.384 10.361 -1.018 1.00 0.00 H new ATOM 0 HD2 PHE B 8 10.012 12.324 2.555 1.00 0.00 H new ATOM 0 HE1 PHE B 8 12.851 12.299 -1.531 1.00 0.00 H new ATOM 0 HE2 PHE B 8 11.581 14.190 2.113 1.00 0.00 H new ATOM 0 HZ PHE B 8 12.941 14.227 0.044 1.00 0.00 H new ATOM 1755 N LEU B 9 7.709 7.718 -0.342 1.00 0.00 N ATOM 1756 CA LEU B 9 6.794 6.619 -0.077 1.00 0.00 C ATOM 1757 C LEU B 9 7.668 5.464 0.388 1.00 0.00 C ATOM 1758 O LEU B 9 8.487 4.964 -0.389 1.00 0.00 O ATOM 1759 CB LEU B 9 5.963 6.361 -1.346 1.00 0.00 C ATOM 1760 CG LEU B 9 4.743 5.434 -1.178 1.00 0.00 C ATOM 1761 CD1 LEU B 9 3.821 5.830 -0.015 1.00 0.00 C ATOM 1762 CD2 LEU B 9 3.922 5.499 -2.472 1.00 0.00 C ATOM 0 H LEU B 9 8.520 7.452 -0.900 1.00 0.00 H new ATOM 0 HA LEU B 9 6.056 6.809 0.703 1.00 0.00 H new ATOM 0 HB2 LEU B 9 5.615 7.320 -1.730 1.00 0.00 H new ATOM 0 HB3 LEU B 9 6.618 5.933 -2.104 1.00 0.00 H new ATOM 0 HG LEU B 9 5.124 4.436 -0.962 1.00 0.00 H new ATOM 0 HD11 LEU B 9 2.985 5.132 0.041 1.00 0.00 H new ATOM 0 HD12 LEU B 9 4.381 5.801 0.920 1.00 0.00 H new ATOM 0 HD13 LEU B 9 3.441 6.838 -0.179 1.00 0.00 H new ATOM 0 HD21 LEU B 9 3.050 4.851 -2.383 1.00 0.00 H new ATOM 0 HD22 LEU B 9 3.596 6.525 -2.645 1.00 0.00 H new ATOM 0 HD23 LEU B 9 4.536 5.167 -3.309 1.00 0.00 H new ATOM 1774 N SER B 10 7.554 5.109 1.667 1.00 0.00 N ATOM 1775 CA SER B 10 8.453 4.186 2.342 1.00 0.00 C ATOM 1776 C SER B 10 7.631 3.287 3.259 1.00 0.00 C ATOM 1777 O SER B 10 6.715 3.779 3.913 1.00 0.00 O ATOM 1778 CB SER B 10 9.443 4.971 3.219 1.00 0.00 C ATOM 1779 OG SER B 10 10.114 6.016 2.535 1.00 0.00 O ATOM 0 H SER B 10 6.815 5.466 2.273 1.00 0.00 H new ATOM 0 HA SER B 10 8.993 3.602 1.597 1.00 0.00 H new ATOM 0 HB2 SER B 10 8.905 5.393 4.068 1.00 0.00 H new ATOM 0 HB3 SER B 10 10.183 4.280 3.622 1.00 0.00 H new ATOM 0 HG SER B 10 10.929 5.665 2.120 1.00 0.00 H new ATOM 1785 N THR B 11 8.016 2.014 3.366 1.00 0.00 N ATOM 1786 CA THR B 11 7.428 0.969 4.196 1.00 0.00 C ATOM 1787 C THR B 11 7.078 1.459 5.600 1.00 0.00 C ATOM 1788 O THR B 11 7.923 1.493 6.497 1.00 0.00 O ATOM 1789 CB THR B 11 8.396 -0.231 4.200 1.00 0.00 C ATOM 1790 OG1 THR B 11 9.011 -0.387 2.925 1.00 0.00 O ATOM 1791 CG2 THR B 11 7.678 -1.516 4.598 1.00 0.00 C ATOM 0 H THR B 11 8.810 1.663 2.831 1.00 0.00 H new ATOM 0 HA THR B 11 6.471 0.660 3.775 1.00 0.00 H new ATOM 0 HB THR B 11 9.171 -0.029 4.940 1.00 0.00 H new ATOM 0 HG1 THR B 11 8.651 -1.184 2.484 1.00 0.00 H new ATOM 0 HG21 THR B 11 8.386 -2.345 4.592 1.00 0.00 H new ATOM 0 HG22 THR B 11 7.259 -1.404 5.598 1.00 0.00 H new ATOM 0 HG23 THR B 11 6.875 -1.719 3.889 1.00 0.00 H new ATOM 1799 N GLY B 12 5.811 1.834 5.783 1.00 0.00 N ATOM 1800 CA GLY B 12 5.278 2.284 7.063 1.00 0.00 C ATOM 1801 C GLY B 12 6.027 3.511 7.571 1.00 0.00 C ATOM 1802 O GLY B 12 6.266 3.599 8.772 1.00 0.00 O ATOM 0 H GLY B 12 5.119 1.832 5.034 1.00 0.00 H new ATOM 0 HA2 GLY B 12 4.219 2.519 6.957 1.00 0.00 H new ATOM 0 HA3 GLY B 12 5.354 1.480 7.795 1.00 0.00 H new ATOM 1806 N ASN B 13 6.410 4.388 6.628 1.00 0.00 N ATOM 1807 CA ASN B 13 7.302 5.547 6.732 1.00 0.00 C ATOM 1808 C ASN B 13 7.820 5.798 8.147 1.00 0.00 C ATOM 1809 O ASN B 13 7.137 6.328 9.028 1.00 0.00 O ATOM 1810 CB ASN B 13 6.752 6.786 5.994 1.00 0.00 C ATOM 1811 CG ASN B 13 6.921 8.123 6.715 1.00 0.00 C ATOM 1812 OD1 ASN B 13 5.946 8.832 6.914 1.00 0.00 O ATOM 1813 ND2 ASN B 13 8.124 8.522 7.097 1.00 0.00 N ATOM 0 H ASN B 13 6.063 4.288 5.674 1.00 0.00 H new ATOM 0 HA ASN B 13 8.209 5.291 6.185 1.00 0.00 H new ATOM 0 HB2 ASN B 13 7.243 6.854 5.023 1.00 0.00 H new ATOM 0 HB3 ASN B 13 5.690 6.630 5.804 1.00 0.00 H new ATOM 0 HD21 ASN B 13 8.239 9.424 7.559 1.00 0.00 H new ATOM 0 HD22 ASN B 13 8.936 7.927 6.929 1.00 0.00 H new ATOM 1820 N SER B 14 9.079 5.402 8.295 1.00 0.00 N ATOM 1821 CA SER B 14 9.926 5.596 9.445 1.00 0.00 C ATOM 1822 C SER B 14 11.146 6.354 8.909 1.00 0.00 C ATOM 1823 O SER B 14 11.016 7.178 7.996 1.00 0.00 O ATOM 1824 CB SER B 14 10.191 4.216 10.079 1.00 0.00 C ATOM 1825 OG SER B 14 10.940 4.296 11.285 1.00 0.00 O ATOM 0 H SER B 14 9.563 4.899 7.551 1.00 0.00 H new ATOM 0 HA SER B 14 9.506 6.188 10.259 1.00 0.00 H new ATOM 0 HB2 SER B 14 9.239 3.725 10.280 1.00 0.00 H new ATOM 0 HB3 SER B 14 10.727 3.591 9.365 1.00 0.00 H new ATOM 0 HG SER B 14 11.078 3.395 11.645 1.00 0.00 H new ATOM 1831 N ALA B 15 12.317 6.072 9.474 1.00 0.00 N ATOM 1832 CA ALA B 15 13.553 6.811 9.299 1.00 0.00 C ATOM 1833 C ALA B 15 13.866 7.361 7.909 1.00 0.00 C ATOM 1834 O ALA B 15 14.185 8.548 7.823 1.00 0.00 O ATOM 1835 CB ALA B 15 14.720 5.977 9.840 1.00 0.00 C ATOM 0 H ALA B 15 12.429 5.275 10.101 1.00 0.00 H new ATOM 0 HA ALA B 15 13.403 7.725 9.874 1.00 0.00 H new ATOM 0 HB1 ALA B 15 15.652 6.528 9.711 1.00 0.00 H new ATOM 0 HB2 ALA B 15 14.562 5.774 10.899 1.00 0.00 H new ATOM 0 HB3 ALA B 15 14.777 5.035 9.295 1.00 0.00 H new ATOM 1841 N ARG B 16 13.800 6.550 6.840 1.00 0.00 N ATOM 1842 CA ARG B 16 14.245 7.000 5.513 1.00 0.00 C ATOM 1843 C ARG B 16 13.558 8.298 5.119 1.00 0.00 C ATOM 1844 O ARG B 16 14.225 9.256 4.739 1.00 0.00 O ATOM 1845 CB ARG B 16 13.987 5.946 4.422 1.00 0.00 C ATOM 1846 CG ARG B 16 15.025 4.819 4.440 1.00 0.00 C ATOM 1847 CD ARG B 16 14.963 3.919 3.200 1.00 0.00 C ATOM 1848 NE ARG B 16 15.268 4.665 1.967 1.00 0.00 N ATOM 1849 CZ ARG B 16 16.303 4.508 1.130 1.00 0.00 C ATOM 1850 NH1 ARG B 16 17.160 3.500 1.258 1.00 0.00 N ATOM 1851 NH2 ARG B 16 16.459 5.377 0.137 1.00 0.00 N ATOM 0 H ARG B 16 13.448 5.593 6.868 1.00 0.00 H new ATOM 0 HA ARG B 16 15.320 7.160 5.589 1.00 0.00 H new ATOM 0 HB2 ARG B 16 12.992 5.522 4.559 1.00 0.00 H new ATOM 0 HB3 ARG B 16 13.996 6.429 3.445 1.00 0.00 H new ATOM 0 HG2 ARG B 16 16.022 5.253 4.516 1.00 0.00 H new ATOM 0 HG3 ARG B 16 14.874 4.209 5.331 1.00 0.00 H new ATOM 0 HD2 ARG B 16 15.670 3.097 3.312 1.00 0.00 H new ATOM 0 HD3 ARG B 16 13.970 3.477 3.121 1.00 0.00 H new ATOM 0 HE ARG B 16 14.604 5.398 1.717 1.00 0.00 H new ATOM 0 HH11 ARG B 16 17.039 2.820 2.009 1.00 0.00 H new ATOM 0 HH12 ARG B 16 17.938 3.406 0.606 1.00 0.00 H new ATOM 0 HH21 ARG B 16 15.798 6.145 0.023 1.00 0.00 H new ATOM 0 HH22 ARG B 16 17.240 5.276 -0.511 1.00 0.00 H new ATOM 1865 N SER B 17 12.235 8.341 5.212 1.00 0.00 N ATOM 1866 CA SER B 17 11.480 9.459 4.682 1.00 0.00 C ATOM 1867 C SER B 17 11.740 10.713 5.517 1.00 0.00 C ATOM 1868 O SER B 17 11.990 11.764 4.940 1.00 0.00 O ATOM 1869 CB SER B 17 9.995 9.102 4.615 1.00 0.00 C ATOM 1870 OG SER B 17 9.750 7.712 4.804 1.00 0.00 O ATOM 0 H SER B 17 11.668 7.615 5.649 1.00 0.00 H new ATOM 0 HA SER B 17 11.808 9.675 3.665 1.00 0.00 H new ATOM 0 HB2 SER B 17 9.456 9.667 5.375 1.00 0.00 H new ATOM 0 HB3 SER B 17 9.596 9.408 3.648 1.00 0.00 H new ATOM 0 HG SER B 17 10.011 7.221 3.997 1.00 0.00 H new ATOM 1876 N GLN B 18 11.757 10.599 6.855 1.00 0.00 N ATOM 1877 CA GLN B 18 12.026 11.711 7.771 1.00 0.00 C ATOM 1878 C GLN B 18 13.355 12.370 7.424 1.00 0.00 C ATOM 1879 O GLN B 18 13.459 13.589 7.275 1.00 0.00 O ATOM 1880 CB GLN B 18 12.078 11.244 9.237 1.00 0.00 C ATOM 1881 CG GLN B 18 11.004 10.250 9.694 1.00 0.00 C ATOM 1882 CD GLN B 18 9.564 10.755 9.569 1.00 0.00 C ATOM 1883 OE1 GLN B 18 9.289 11.893 9.208 1.00 0.00 O ATOM 1884 NE2 GLN B 18 8.606 9.897 9.863 1.00 0.00 N ATOM 0 H GLN B 18 11.581 9.716 7.335 1.00 0.00 H new ATOM 0 HA GLN B 18 11.209 12.423 7.658 1.00 0.00 H new ATOM 0 HB2 GLN B 18 13.054 10.792 9.413 1.00 0.00 H new ATOM 0 HB3 GLN B 18 12.016 12.126 9.875 1.00 0.00 H new ATOM 0 HG2 GLN B 18 11.105 9.335 9.111 1.00 0.00 H new ATOM 0 HG3 GLN B 18 11.192 9.987 10.735 1.00 0.00 H new ATOM 0 HE21 GLN B 18 8.843 8.951 10.163 1.00 0.00 H new ATOM 0 HE22 GLN B 18 7.629 10.179 9.790 1.00 0.00 H new ATOM 1893 N MET B 19 14.368 11.522 7.284 1.00 0.00 N ATOM 1894 CA MET B 19 15.725 11.908 6.996 1.00 0.00 C ATOM 1895 C MET B 19 15.782 12.592 5.626 1.00 0.00 C ATOM 1896 O MET B 19 16.395 13.649 5.477 1.00 0.00 O ATOM 1897 CB MET B 19 16.525 10.601 7.054 1.00 0.00 C ATOM 1898 CG MET B 19 18.030 10.735 6.899 1.00 0.00 C ATOM 1899 SD MET B 19 18.783 9.203 6.312 1.00 0.00 S ATOM 1900 CE MET B 19 18.220 7.975 7.514 1.00 0.00 C ATOM 0 H MET B 19 14.252 10.513 7.373 1.00 0.00 H new ATOM 0 HA MET B 19 16.137 12.631 7.700 1.00 0.00 H new ATOM 0 HB2 MET B 19 16.320 10.114 8.007 1.00 0.00 H new ATOM 0 HB3 MET B 19 16.157 9.937 6.272 1.00 0.00 H new ATOM 0 HG2 MET B 19 18.253 11.541 6.200 1.00 0.00 H new ATOM 0 HG3 MET B 19 18.471 11.013 7.856 1.00 0.00 H new ATOM 0 HE1 MET B 19 18.875 7.105 7.479 1.00 0.00 H new ATOM 0 HE2 MET B 19 18.244 8.407 8.514 1.00 0.00 H new ATOM 0 HE3 MET B 19 17.201 7.672 7.274 1.00 0.00 H new ATOM 1910 N ALA B 20 15.099 12.025 4.629 1.00 0.00 N ATOM 1911 CA ALA B 20 14.997 12.599 3.305 1.00 0.00 C ATOM 1912 C ALA B 20 14.269 13.945 3.305 1.00 0.00 C ATOM 1913 O ALA B 20 14.604 14.777 2.465 1.00 0.00 O ATOM 1914 CB ALA B 20 14.350 11.601 2.350 1.00 0.00 C ATOM 0 H ALA B 20 14.598 11.142 4.730 1.00 0.00 H new ATOM 0 HA ALA B 20 16.007 12.808 2.953 1.00 0.00 H new ATOM 0 HB1 ALA B 20 14.278 12.043 1.356 1.00 0.00 H new ATOM 0 HB2 ALA B 20 14.957 10.697 2.302 1.00 0.00 H new ATOM 0 HB3 ALA B 20 13.352 11.349 2.708 1.00 0.00 H new ATOM 1920 N GLU B 21 13.330 14.214 4.223 1.00 0.00 N ATOM 1921 CA GLU B 21 12.693 15.523 4.293 1.00 0.00 C ATOM 1922 C GLU B 21 13.729 16.578 4.672 1.00 0.00 C ATOM 1923 O GLU B 21 13.838 17.614 4.012 1.00 0.00 O ATOM 1924 CB GLU B 21 11.509 15.565 5.273 1.00 0.00 C ATOM 1925 CG GLU B 21 10.431 14.494 5.074 1.00 0.00 C ATOM 1926 CD GLU B 21 9.019 14.942 5.485 1.00 0.00 C ATOM 1927 OE1 GLU B 21 8.887 15.881 6.300 1.00 0.00 O ATOM 1928 OE2 GLU B 21 8.039 14.324 5.014 1.00 0.00 O ATOM 0 H GLU B 21 13.001 13.544 4.919 1.00 0.00 H new ATOM 0 HA GLU B 21 12.285 15.735 3.305 1.00 0.00 H new ATOM 0 HB2 GLU B 21 11.899 15.475 6.287 1.00 0.00 H new ATOM 0 HB3 GLU B 21 11.037 16.545 5.199 1.00 0.00 H new ATOM 0 HG2 GLU B 21 10.416 14.199 4.025 1.00 0.00 H new ATOM 0 HG3 GLU B 21 10.702 13.609 5.650 1.00 0.00 H new ATOM 1935 N GLY B 22 14.527 16.282 5.701 1.00 0.00 N ATOM 1936 CA GLY B 22 15.602 17.160 6.139 1.00 0.00 C ATOM 1937 C GLY B 22 16.628 17.368 5.025 1.00 0.00 C ATOM 1938 O GLY B 22 16.988 18.506 4.714 1.00 0.00 O ATOM 0 H GLY B 22 14.442 15.427 6.250 1.00 0.00 H new ATOM 0 HA2 GLY B 22 15.190 18.122 6.443 1.00 0.00 H new ATOM 0 HA3 GLY B 22 16.092 16.733 7.014 1.00 0.00 H new ATOM 1942 N TRP B 23 17.067 16.281 4.383 1.00 0.00 N ATOM 1943 CA TRP B 23 18.040 16.348 3.299 1.00 0.00 C ATOM 1944 C TRP B 23 17.527 17.144 2.114 1.00 0.00 C ATOM 1945 O TRP B 23 18.279 17.945 1.560 1.00 0.00 O ATOM 1946 CB TRP B 23 18.439 14.946 2.843 1.00 0.00 C ATOM 1947 CG TRP B 23 19.663 14.465 3.532 1.00 0.00 C ATOM 1948 CD1 TRP B 23 19.699 13.542 4.509 1.00 0.00 C ATOM 1949 CD2 TRP B 23 21.041 14.900 3.336 1.00 0.00 C ATOM 1950 NE1 TRP B 23 20.992 13.385 4.946 1.00 0.00 N ATOM 1951 CE2 TRP B 23 21.870 14.161 4.227 1.00 0.00 C ATOM 1952 CE3 TRP B 23 21.680 15.804 2.458 1.00 0.00 C ATOM 1953 CZ2 TRP B 23 23.262 14.302 4.243 1.00 0.00 C ATOM 1954 CZ3 TRP B 23 23.083 15.925 2.443 1.00 0.00 C ATOM 1955 CH2 TRP B 23 23.875 15.185 3.340 1.00 0.00 C ATOM 0 H TRP B 23 16.756 15.335 4.603 1.00 0.00 H new ATOM 0 HA TRP B 23 18.915 16.864 3.694 1.00 0.00 H new ATOM 0 HB2 TRP B 23 17.619 14.255 3.036 1.00 0.00 H new ATOM 0 HB3 TRP B 23 18.607 14.949 1.766 1.00 0.00 H new ATOM 0 HD1 TRP B 23 18.843 13.006 4.892 1.00 0.00 H new ATOM 0 HE1 TRP B 23 21.267 12.768 5.710 1.00 0.00 H new ATOM 0 HE3 TRP B 23 21.085 16.410 1.790 1.00 0.00 H new ATOM 0 HZ2 TRP B 23 23.859 13.737 4.943 1.00 0.00 H new ATOM 0 HZ3 TRP B 23 23.555 16.592 1.737 1.00 0.00 H new ATOM 0 HH2 TRP B 23 24.949 15.296 3.334 1.00 0.00 H new ATOM 1966 N ALA B 24 16.263 16.948 1.730 1.00 0.00 N ATOM 1967 CA ALA B 24 15.692 17.694 0.631 1.00 0.00 C ATOM 1968 C ALA B 24 15.736 19.174 0.969 1.00 0.00 C ATOM 1969 O ALA B 24 16.178 19.979 0.155 1.00 0.00 O ATOM 1970 CB ALA B 24 14.235 17.295 0.381 1.00 0.00 C ATOM 0 H ALA B 24 15.627 16.281 2.167 1.00 0.00 H new ATOM 0 HA ALA B 24 16.270 17.477 -0.267 1.00 0.00 H new ATOM 0 HB1 ALA B 24 13.837 17.875 -0.452 1.00 0.00 H new ATOM 0 HB2 ALA B 24 14.185 16.233 0.141 1.00 0.00 H new ATOM 0 HB3 ALA B 24 13.645 17.493 1.276 1.00 0.00 H new ATOM 1976 N LYS B 25 15.297 19.554 2.171 1.00 0.00 N ATOM 1977 CA LYS B 25 15.120 20.961 2.488 1.00 0.00 C ATOM 1978 C LYS B 25 16.443 21.719 2.504 1.00 0.00 C ATOM 1979 O LYS B 25 16.435 22.909 2.189 1.00 0.00 O ATOM 1980 CB LYS B 25 14.314 21.125 3.792 1.00 0.00 C ATOM 1981 CG LYS B 25 12.799 21.082 3.514 1.00 0.00 C ATOM 1982 CD LYS B 25 12.304 22.416 2.922 1.00 0.00 C ATOM 1983 CE LYS B 25 10.893 22.298 2.320 1.00 0.00 C ATOM 1984 NZ LYS B 25 10.459 23.559 1.665 1.00 0.00 N ATOM 0 H LYS B 25 15.062 18.912 2.928 1.00 0.00 H new ATOM 0 HA LYS B 25 14.536 21.418 1.689 1.00 0.00 H new ATOM 0 HB2 LYS B 25 14.582 20.333 4.491 1.00 0.00 H new ATOM 0 HB3 LYS B 25 14.573 22.071 4.268 1.00 0.00 H new ATOM 0 HG2 LYS B 25 12.576 20.269 2.823 1.00 0.00 H new ATOM 0 HG3 LYS B 25 12.263 20.870 4.439 1.00 0.00 H new ATOM 0 HD2 LYS B 25 12.302 23.178 3.701 1.00 0.00 H new ATOM 0 HD3 LYS B 25 12.999 22.749 2.151 1.00 0.00 H new ATOM 0 HE2 LYS B 25 10.876 21.487 1.592 1.00 0.00 H new ATOM 0 HE3 LYS B 25 10.185 22.035 3.106 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 9.676 23.359 1.010 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 10.141 24.235 2.389 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 11.256 23.968 1.137 1.00 0.00 H new ATOM 1998 N GLN B 26 17.573 21.059 2.785 1.00 0.00 N ATOM 1999 CA GLN B 26 18.869 21.722 2.719 1.00 0.00 C ATOM 2000 C GLN B 26 19.332 22.010 1.281 1.00 0.00 C ATOM 2001 O GLN B 26 20.208 22.855 1.098 1.00 0.00 O ATOM 2002 CB GLN B 26 19.921 20.983 3.562 1.00 0.00 C ATOM 2003 CG GLN B 26 20.629 19.790 2.886 1.00 0.00 C ATOM 2004 CD GLN B 26 22.159 19.935 2.880 1.00 0.00 C ATOM 2005 OE1 GLN B 26 22.711 20.992 2.584 1.00 0.00 O ATOM 2006 NE2 GLN B 26 22.889 18.883 3.211 1.00 0.00 N ATOM 0 H GLN B 26 17.611 20.077 3.057 1.00 0.00 H new ATOM 0 HA GLN B 26 18.743 22.707 3.168 1.00 0.00 H new ATOM 0 HB2 GLN B 26 20.681 21.703 3.867 1.00 0.00 H new ATOM 0 HB3 GLN B 26 19.439 20.623 4.471 1.00 0.00 H new ATOM 0 HG2 GLN B 26 20.357 18.870 3.404 1.00 0.00 H new ATOM 0 HG3 GLN B 26 20.273 19.695 1.860 1.00 0.00 H new ATOM 0 HE21 GLN B 26 22.434 18.004 3.457 1.00 0.00 H new ATOM 0 HE22 GLN B 26 23.907 18.951 3.220 1.00 0.00 H new ATOM 2015 N TYR B 27 18.756 21.340 0.273 1.00 0.00 N ATOM 2016 CA TYR B 27 19.177 21.446 -1.125 1.00 0.00 C ATOM 2017 C TYR B 27 18.072 21.975 -2.047 1.00 0.00 C ATOM 2018 O TYR B 27 18.364 22.342 -3.186 1.00 0.00 O ATOM 2019 CB TYR B 27 19.739 20.095 -1.620 1.00 0.00 C ATOM 2020 CG TYR B 27 21.256 20.070 -1.633 1.00 0.00 C ATOM 2021 CD1 TYR B 27 21.945 20.810 -2.612 1.00 0.00 C ATOM 2022 CD2 TYR B 27 21.976 19.369 -0.647 1.00 0.00 C ATOM 2023 CE1 TYR B 27 23.348 20.908 -2.569 1.00 0.00 C ATOM 2024 CE2 TYR B 27 23.378 19.468 -0.594 1.00 0.00 C ATOM 2025 CZ TYR B 27 24.069 20.255 -1.544 1.00 0.00 C ATOM 2026 OH TYR B 27 25.429 20.338 -1.486 1.00 0.00 O ATOM 0 H TYR B 27 17.973 20.701 0.411 1.00 0.00 H new ATOM 0 HA TYR B 27 19.973 22.190 -1.166 1.00 0.00 H new ATOM 0 HB2 TYR B 27 19.371 19.294 -0.979 1.00 0.00 H new ATOM 0 HB3 TYR B 27 19.366 19.896 -2.625 1.00 0.00 H new ATOM 0 HD1 TYR B 27 21.395 21.304 -3.399 1.00 0.00 H new ATOM 0 HD2 TYR B 27 21.451 18.755 0.070 1.00 0.00 H new ATOM 0 HE1 TYR B 27 23.873 21.482 -3.318 1.00 0.00 H new ATOM 0 HE2 TYR B 27 23.927 18.942 0.173 1.00 0.00 H new ATOM 0 HH TYR B 27 25.740 20.009 -0.617 1.00 0.00 H new ATOM 2036 N LEU B 28 16.827 22.055 -1.571 1.00 0.00 N ATOM 2037 CA LEU B 28 15.685 22.581 -2.290 1.00 0.00 C ATOM 2038 C LEU B 28 15.438 23.983 -1.724 1.00 0.00 C ATOM 2039 O LEU B 28 16.354 24.809 -1.716 1.00 0.00 O ATOM 2040 CB LEU B 28 14.506 21.584 -2.194 1.00 0.00 C ATOM 2041 CG LEU B 28 14.748 20.219 -2.879 1.00 0.00 C ATOM 2042 CD1 LEU B 28 13.444 19.413 -2.895 1.00 0.00 C ATOM 2043 CD2 LEU B 28 15.273 20.335 -4.315 1.00 0.00 C ATOM 0 H LEU B 28 16.587 21.739 -0.632 1.00 0.00 H new ATOM 0 HA LEU B 28 15.841 22.688 -3.363 1.00 0.00 H new ATOM 0 HB2 LEU B 28 14.281 21.411 -1.142 1.00 0.00 H new ATOM 0 HB3 LEU B 28 13.623 22.045 -2.637 1.00 0.00 H new ATOM 0 HG LEU B 28 15.519 19.717 -2.294 1.00 0.00 H new ATOM 0 HD11 LEU B 28 13.617 18.451 -3.378 1.00 0.00 H new ATOM 0 HD12 LEU B 28 13.105 19.249 -1.872 1.00 0.00 H new ATOM 0 HD13 LEU B 28 12.682 19.964 -3.446 1.00 0.00 H new ATOM 0 HD21 LEU B 28 15.419 19.338 -4.731 1.00 0.00 H new ATOM 0 HD22 LEU B 28 14.551 20.880 -4.923 1.00 0.00 H new ATOM 0 HD23 LEU B 28 16.223 20.870 -4.313 1.00 0.00 H new ATOM 2055 N GLY B 29 14.227 24.270 -1.256 1.00 0.00 N ATOM 2056 CA GLY B 29 13.840 25.578 -0.741 1.00 0.00 C ATOM 2057 C GLY B 29 12.330 25.650 -0.573 1.00 0.00 C ATOM 2058 O GLY B 29 11.650 24.629 -0.692 1.00 0.00 O ATOM 0 H GLY B 29 13.472 23.585 -1.224 1.00 0.00 H new ATOM 0 HA2 GLY B 29 14.329 25.759 0.216 1.00 0.00 H new ATOM 0 HA3 GLY B 29 14.175 26.359 -1.423 1.00 0.00 H new ATOM 2062 N ASP B 30 11.791 26.847 -0.332 1.00 0.00 N ATOM 2063 CA ASP B 30 10.347 27.132 -0.353 1.00 0.00 C ATOM 2064 C ASP B 30 9.744 26.921 -1.750 1.00 0.00 C ATOM 2065 O ASP B 30 8.532 26.780 -1.922 1.00 0.00 O ATOM 2066 CB ASP B 30 10.095 28.567 0.124 1.00 0.00 C ATOM 2067 CG ASP B 30 8.594 28.905 0.153 1.00 0.00 C ATOM 2068 OD1 ASP B 30 7.856 28.324 0.981 1.00 0.00 O ATOM 2069 OD2 ASP B 30 8.162 29.801 -0.607 1.00 0.00 O ATOM 0 H ASP B 30 12.356 27.667 -0.111 1.00 0.00 H new ATOM 0 HA ASP B 30 9.856 26.432 0.323 1.00 0.00 H new ATOM 0 HB2 ASP B 30 10.516 28.698 1.121 1.00 0.00 H new ATOM 0 HB3 ASP B 30 10.612 29.265 -0.535 1.00 0.00 H new ATOM 2074 N GLU B 31 10.611 26.854 -2.762 1.00 0.00 N ATOM 2075 CA GLU B 31 10.290 26.443 -4.119 1.00 0.00 C ATOM 2076 C GLU B 31 9.599 25.071 -4.137 1.00 0.00 C ATOM 2077 O GLU B 31 8.798 24.815 -5.037 1.00 0.00 O ATOM 2078 CB GLU B 31 11.588 26.486 -4.932 1.00 0.00 C ATOM 2079 CG GLU B 31 11.358 26.214 -6.418 1.00 0.00 C ATOM 2080 CD GLU B 31 10.444 27.219 -7.133 1.00 0.00 C ATOM 2081 OE1 GLU B 31 10.354 28.401 -6.736 1.00 0.00 O ATOM 2082 OE2 GLU B 31 9.784 26.800 -8.110 1.00 0.00 O ATOM 0 H GLU B 31 11.595 27.096 -2.648 1.00 0.00 H new ATOM 0 HA GLU B 31 9.569 27.122 -4.575 1.00 0.00 H new ATOM 0 HB2 GLU B 31 12.055 27.464 -4.813 1.00 0.00 H new ATOM 0 HB3 GLU B 31 12.286 25.749 -4.535 1.00 0.00 H new ATOM 0 HG2 GLU B 31 12.324 26.203 -6.923 1.00 0.00 H new ATOM 0 HG3 GLU B 31 10.930 25.217 -6.527 1.00 0.00 H new ATOM 2089 N TRP B 32 9.831 24.229 -3.124 1.00 0.00 N ATOM 2090 CA TRP B 32 9.292 22.881 -3.027 1.00 0.00 C ATOM 2091 C TRP B 32 8.648 22.650 -1.659 1.00 0.00 C ATOM 2092 O TRP B 32 8.981 23.309 -0.671 1.00 0.00 O ATOM 2093 CB TRP B 32 10.422 21.874 -3.279 1.00 0.00 C ATOM 2094 CG TRP B 32 11.193 22.074 -4.551 1.00 0.00 C ATOM 2095 CD1 TRP B 32 12.247 22.907 -4.708 1.00 0.00 C ATOM 2096 CD2 TRP B 32 10.979 21.463 -5.859 1.00 0.00 C ATOM 2097 NE1 TRP B 32 12.722 22.828 -5.999 1.00 0.00 N ATOM 2098 CE2 TRP B 32 11.979 21.949 -6.753 1.00 0.00 C ATOM 2099 CE3 TRP B 32 10.039 20.551 -6.389 1.00 0.00 C ATOM 2100 CZ2 TRP B 32 12.060 21.540 -8.091 1.00 0.00 C ATOM 2101 CZ3 TRP B 32 10.089 20.158 -7.740 1.00 0.00 C ATOM 2102 CH2 TRP B 32 11.105 20.639 -8.588 1.00 0.00 C ATOM 0 H TRP B 32 10.418 24.481 -2.328 1.00 0.00 H new ATOM 0 HA TRP B 32 8.515 22.746 -3.779 1.00 0.00 H new ATOM 0 HB2 TRP B 32 11.118 21.918 -2.442 1.00 0.00 H new ATOM 0 HB3 TRP B 32 9.996 20.871 -3.287 1.00 0.00 H new ATOM 0 HD1 TRP B 32 12.656 23.541 -3.935 1.00 0.00 H new ATOM 0 HE1 TRP B 32 13.522 23.354 -6.351 1.00 0.00 H new ATOM 0 HE3 TRP B 32 9.269 20.149 -5.747 1.00 0.00 H new ATOM 0 HZ2 TRP B 32 12.846 21.913 -8.731 1.00 0.00 H new ATOM 0 HZ3 TRP B 32 9.342 19.482 -8.129 1.00 0.00 H new ATOM 0 HH2 TRP B 32 11.149 20.316 -9.618 1.00 0.00 H new ATOM 2113 N LYS B 33 7.758 21.666 -1.584 1.00 0.00 N ATOM 2114 CA LYS B 33 7.095 21.200 -0.373 1.00 0.00 C ATOM 2115 C LYS B 33 7.313 19.699 -0.348 1.00 0.00 C ATOM 2116 O LYS B 33 7.012 19.017 -1.330 1.00 0.00 O ATOM 2117 CB LYS B 33 5.611 21.564 -0.391 1.00 0.00 C ATOM 2118 CG LYS B 33 5.435 23.094 -0.370 1.00 0.00 C ATOM 2119 CD LYS B 33 4.427 23.539 0.688 1.00 0.00 C ATOM 2120 CE LYS B 33 2.994 23.134 0.313 1.00 0.00 C ATOM 2121 NZ LYS B 33 2.002 23.599 1.314 1.00 0.00 N ATOM 0 H LYS B 33 7.465 21.145 -2.411 1.00 0.00 H new ATOM 0 HA LYS B 33 7.499 21.668 0.524 1.00 0.00 H new ATOM 0 HB2 LYS B 33 5.139 21.149 -1.281 1.00 0.00 H new ATOM 0 HB3 LYS B 33 5.111 21.122 0.471 1.00 0.00 H new ATOM 0 HG2 LYS B 33 6.398 23.567 -0.176 1.00 0.00 H new ATOM 0 HG3 LYS B 33 5.105 23.435 -1.351 1.00 0.00 H new ATOM 0 HD2 LYS B 33 4.690 23.098 1.649 1.00 0.00 H new ATOM 0 HD3 LYS B 33 4.480 24.621 0.809 1.00 0.00 H new ATOM 0 HE2 LYS B 33 2.744 23.549 -0.664 1.00 0.00 H new ATOM 0 HE3 LYS B 33 2.936 22.049 0.223 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 1.049 23.304 1.021 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 2.223 23.183 2.241 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 2.038 24.636 1.382 1.00 0.00 H new ATOM 2135 N VAL B 34 7.861 19.203 0.754 1.00 0.00 N ATOM 2136 CA VAL B 34 8.347 17.840 0.867 1.00 0.00 C ATOM 2137 C VAL B 34 7.480 17.134 1.910 1.00 0.00 C ATOM 2138 O VAL B 34 7.202 17.698 2.973 1.00 0.00 O ATOM 2139 CB VAL B 34 9.854 17.887 1.213 1.00 0.00 C ATOM 2140 CG1 VAL B 34 10.426 16.478 1.356 1.00 0.00 C ATOM 2141 CG2 VAL B 34 10.677 18.656 0.161 1.00 0.00 C ATOM 0 H VAL B 34 7.981 19.749 1.607 1.00 0.00 H new ATOM 0 HA VAL B 34 8.266 17.272 -0.060 1.00 0.00 H new ATOM 0 HB VAL B 34 9.931 18.417 2.162 1.00 0.00 H new ATOM 0 HG11 VAL B 34 11.487 16.539 1.599 1.00 0.00 H new ATOM 0 HG12 VAL B 34 9.901 15.951 2.153 1.00 0.00 H new ATOM 0 HG13 VAL B 34 10.299 15.937 0.418 1.00 0.00 H new ATOM 0 HG21 VAL B 34 11.727 18.659 0.452 1.00 0.00 H new ATOM 0 HG22 VAL B 34 10.571 18.171 -0.810 1.00 0.00 H new ATOM 0 HG23 VAL B 34 10.316 19.682 0.096 1.00 0.00 H new ATOM 2151 N TYR B 35 7.043 15.914 1.593 1.00 0.00 N ATOM 2152 CA TYR B 35 6.110 15.125 2.389 1.00 0.00 C ATOM 2153 C TYR B 35 6.549 13.655 2.383 1.00 0.00 C ATOM 2154 O TYR B 35 7.384 13.256 1.564 1.00 0.00 O ATOM 2155 CB TYR B 35 4.711 15.238 1.785 1.00 0.00 C ATOM 2156 CG TYR B 35 4.077 16.614 1.814 1.00 0.00 C ATOM 2157 CD1 TYR B 35 3.313 17.013 2.927 1.00 0.00 C ATOM 2158 CD2 TYR B 35 4.210 17.476 0.708 1.00 0.00 C ATOM 2159 CE1 TYR B 35 2.678 18.268 2.939 1.00 0.00 C ATOM 2160 CE2 TYR B 35 3.572 18.727 0.710 1.00 0.00 C ATOM 2161 CZ TYR B 35 2.802 19.130 1.825 1.00 0.00 C ATOM 2162 OH TYR B 35 2.182 20.343 1.816 1.00 0.00 O ATOM 0 H TYR B 35 7.342 15.434 0.744 1.00 0.00 H new ATOM 0 HA TYR B 35 6.099 15.497 3.413 1.00 0.00 H new ATOM 0 HB2 TYR B 35 4.758 14.905 0.748 1.00 0.00 H new ATOM 0 HB3 TYR B 35 4.054 14.547 2.313 1.00 0.00 H new ATOM 0 HD1 TYR B 35 3.214 16.352 3.776 1.00 0.00 H new ATOM 0 HD2 TYR B 35 4.803 17.174 -0.143 1.00 0.00 H new ATOM 0 HE1 TYR B 35 2.097 18.573 3.797 1.00 0.00 H new ATOM 0 HE2 TYR B 35 3.670 19.383 -0.142 1.00 0.00 H new ATOM 0 HH TYR B 35 2.110 20.680 2.733 1.00 0.00 H new ATOM 2172 N SER B 36 5.947 12.827 3.239 1.00 0.00 N ATOM 2173 CA SER B 36 6.245 11.406 3.341 1.00 0.00 C ATOM 2174 C SER B 36 4.982 10.622 3.708 1.00 0.00 C ATOM 2175 O SER B 36 4.080 11.162 4.357 1.00 0.00 O ATOM 2176 CB SER B 36 7.366 11.182 4.365 1.00 0.00 C ATOM 2177 OG SER B 36 7.213 11.942 5.545 1.00 0.00 O ATOM 0 H SER B 36 5.226 13.136 3.891 1.00 0.00 H new ATOM 0 HA SER B 36 6.590 11.038 2.375 1.00 0.00 H new ATOM 0 HB2 SER B 36 7.402 10.124 4.626 1.00 0.00 H new ATOM 0 HB3 SER B 36 8.322 11.430 3.904 1.00 0.00 H new ATOM 0 HG SER B 36 7.778 12.741 5.495 1.00 0.00 H new ATOM 2183 N ALA B 37 4.912 9.361 3.269 1.00 0.00 N ATOM 2184 CA ALA B 37 3.782 8.465 3.471 1.00 0.00 C ATOM 2185 C ALA B 37 4.255 7.010 3.504 1.00 0.00 C ATOM 2186 O ALA B 37 5.372 6.699 3.083 1.00 0.00 O ATOM 2187 CB ALA B 37 2.782 8.648 2.324 1.00 0.00 C ATOM 0 H ALA B 37 5.671 8.926 2.745 1.00 0.00 H new ATOM 0 HA ALA B 37 3.306 8.703 4.423 1.00 0.00 H new ATOM 0 HB1 ALA B 37 1.934 7.979 2.471 1.00 0.00 H new ATOM 0 HB2 ALA B 37 2.432 9.680 2.308 1.00 0.00 H new ATOM 0 HB3 ALA B 37 3.268 8.415 1.377 1.00 0.00 H new ATOM 2193 N GLY B 38 3.372 6.120 3.959 1.00 0.00 N ATOM 2194 CA GLY B 38 3.554 4.678 3.946 1.00 0.00 C ATOM 2195 C GLY B 38 2.317 3.982 4.509 1.00 0.00 C ATOM 2196 O GLY B 38 1.349 4.657 4.874 1.00 0.00 O ATOM 0 H GLY B 38 2.478 6.400 4.361 1.00 0.00 H new ATOM 0 HA2 GLY B 38 3.739 4.337 2.927 1.00 0.00 H new ATOM 0 HA3 GLY B 38 4.430 4.410 4.536 1.00 0.00 H new ATOM 2200 N ILE B 39 2.358 2.648 4.587 1.00 0.00 N ATOM 2201 CA ILE B 39 1.231 1.801 5.001 1.00 0.00 C ATOM 2202 C ILE B 39 0.610 2.211 6.348 1.00 0.00 C ATOM 2203 O ILE B 39 -0.597 2.422 6.442 1.00 0.00 O ATOM 2204 CB ILE B 39 1.648 0.306 4.980 1.00 0.00 C ATOM 2205 CG1 ILE B 39 0.584 -0.562 5.678 1.00 0.00 C ATOM 2206 CG2 ILE B 39 3.018 -0.005 5.611 1.00 0.00 C ATOM 2207 CD1 ILE B 39 0.540 -1.996 5.161 1.00 0.00 C ATOM 0 H ILE B 39 3.196 2.113 4.359 1.00 0.00 H new ATOM 0 HA ILE B 39 0.436 1.952 4.271 1.00 0.00 H new ATOM 0 HB ILE B 39 1.732 0.067 3.920 1.00 0.00 H new ATOM 0 HG12 ILE B 39 0.782 -0.576 6.750 1.00 0.00 H new ATOM 0 HG13 ILE B 39 -0.395 -0.104 5.541 1.00 0.00 H new ATOM 0 HG21 ILE B 39 3.214 -1.075 5.545 1.00 0.00 H new ATOM 0 HG22 ILE B 39 3.797 0.540 5.077 1.00 0.00 H new ATOM 0 HG23 ILE B 39 3.014 0.300 6.658 1.00 0.00 H new ATOM 0 HD11 ILE B 39 -0.231 -2.552 5.695 1.00 0.00 H new ATOM 0 HD12 ILE B 39 0.312 -1.992 4.095 1.00 0.00 H new ATOM 0 HD13 ILE B 39 1.508 -2.471 5.323 1.00 0.00 H new ATOM 2219 N GLU B 40 1.443 2.305 7.384 1.00 0.00 N ATOM 2220 CA GLU B 40 1.070 2.461 8.795 1.00 0.00 C ATOM 2221 C GLU B 40 1.915 3.603 9.395 1.00 0.00 C ATOM 2222 O GLU B 40 2.282 3.610 10.571 1.00 0.00 O ATOM 2223 CB GLU B 40 1.293 1.096 9.488 1.00 0.00 C ATOM 2224 CG GLU B 40 0.130 0.108 9.319 1.00 0.00 C ATOM 2225 CD GLU B 40 -0.923 0.251 10.433 1.00 0.00 C ATOM 2226 OE1 GLU B 40 -1.759 1.181 10.375 1.00 0.00 O ATOM 2227 OE2 GLU B 40 -0.938 -0.577 11.372 1.00 0.00 O ATOM 0 H GLU B 40 2.455 2.273 7.257 1.00 0.00 H new ATOM 0 HA GLU B 40 0.024 2.735 8.932 1.00 0.00 H new ATOM 0 HB2 GLU B 40 2.201 0.643 9.090 1.00 0.00 H new ATOM 0 HB3 GLU B 40 1.461 1.264 10.552 1.00 0.00 H new ATOM 0 HG2 GLU B 40 -0.344 0.270 8.351 1.00 0.00 H new ATOM 0 HG3 GLU B 40 0.518 -0.910 9.317 1.00 0.00 H new ATOM 2234 N ALA B 41 2.303 4.533 8.523 1.00 0.00 N ATOM 2235 CA ALA B 41 3.239 5.605 8.778 1.00 0.00 C ATOM 2236 C ALA B 41 2.644 6.678 9.690 1.00 0.00 C ATOM 2237 O ALA B 41 1.489 7.060 9.505 1.00 0.00 O ATOM 2238 CB ALA B 41 3.562 6.209 7.422 1.00 0.00 C ATOM 0 H ALA B 41 1.947 4.551 7.567 1.00 0.00 H new ATOM 0 HA ALA B 41 4.124 5.221 9.285 1.00 0.00 H new ATOM 0 HB1 ALA B 41 4.269 7.029 7.548 1.00 0.00 H new ATOM 0 HB2 ALA B 41 4.002 5.446 6.779 1.00 0.00 H new ATOM 0 HB3 ALA B 41 2.647 6.585 6.964 1.00 0.00 H new ATOM 2244 N HIS B 42 3.479 7.190 10.600 1.00 0.00 N ATOM 2245 CA HIS B 42 3.246 8.261 11.581 1.00 0.00 C ATOM 2246 C HIS B 42 4.284 8.098 12.709 1.00 0.00 C ATOM 2247 O HIS B 42 3.934 7.874 13.871 1.00 0.00 O ATOM 2248 CB HIS B 42 1.788 8.375 12.094 1.00 0.00 C ATOM 2249 CG HIS B 42 1.144 7.099 12.598 1.00 0.00 C ATOM 2250 ND1 HIS B 42 1.579 6.321 13.647 1.00 0.00 N ATOM 2251 CD2 HIS B 42 -0.003 6.519 12.125 1.00 0.00 C ATOM 2252 CE1 HIS B 42 0.726 5.295 13.798 1.00 0.00 C ATOM 2253 NE2 HIS B 42 -0.266 5.373 12.890 1.00 0.00 N ATOM 0 H HIS B 42 4.430 6.830 10.677 1.00 0.00 H new ATOM 0 HA HIS B 42 3.384 9.220 11.082 1.00 0.00 H new ATOM 0 HB2 HIS B 42 1.767 9.109 12.900 1.00 0.00 H new ATOM 0 HB3 HIS B 42 1.173 8.771 11.286 1.00 0.00 H new ATOM 0 HD1 HIS B 42 2.409 6.495 14.214 1.00 0.00 H new ATOM 0 HD2 HIS B 42 -0.603 6.882 11.303 1.00 0.00 H new ATOM 0 HE1 HIS B 42 0.822 4.518 14.542 1.00 0.00 H new ATOM 2261 N GLY B 43 5.575 8.107 12.364 1.00 0.00 N ATOM 2262 CA GLY B 43 6.649 7.752 13.280 1.00 0.00 C ATOM 2263 C GLY B 43 7.922 8.518 12.965 1.00 0.00 C ATOM 2264 O GLY B 43 8.705 8.099 12.106 1.00 0.00 O ATOM 0 H GLY B 43 5.901 8.364 11.432 1.00 0.00 H new ATOM 0 HA2 GLY B 43 6.340 7.962 14.304 1.00 0.00 H new ATOM 0 HA3 GLY B 43 6.842 6.681 13.219 1.00 0.00 H new ATOM 2268 N LEU B 44 8.129 9.656 13.638 1.00 0.00 N ATOM 2269 CA LEU B 44 9.407 10.361 13.599 1.00 0.00 C ATOM 2270 C LEU B 44 10.401 9.542 14.424 1.00 0.00 C ATOM 2271 O LEU B 44 10.490 9.683 15.645 1.00 0.00 O ATOM 2272 CB LEU B 44 9.304 11.812 14.099 1.00 0.00 C ATOM 2273 CG LEU B 44 10.687 12.503 14.136 1.00 0.00 C ATOM 2274 CD1 LEU B 44 11.400 12.449 12.774 1.00 0.00 C ATOM 2275 CD2 LEU B 44 10.543 13.949 14.602 1.00 0.00 C ATOM 0 H LEU B 44 7.421 10.107 14.218 1.00 0.00 H new ATOM 0 HA LEU B 44 9.746 10.448 12.567 1.00 0.00 H new ATOM 0 HB2 LEU B 44 8.633 12.374 13.449 1.00 0.00 H new ATOM 0 HB3 LEU B 44 8.865 11.823 15.097 1.00 0.00 H new ATOM 0 HG LEU B 44 11.305 11.955 14.847 1.00 0.00 H new ATOM 0 HD11 LEU B 44 12.367 12.947 12.849 1.00 0.00 H new ATOM 0 HD12 LEU B 44 11.549 11.409 12.482 1.00 0.00 H new ATOM 0 HD13 LEU B 44 10.790 12.953 12.024 1.00 0.00 H new ATOM 0 HD21 LEU B 44 11.524 14.424 14.624 1.00 0.00 H new ATOM 0 HD22 LEU B 44 9.893 14.490 13.914 1.00 0.00 H new ATOM 0 HD23 LEU B 44 10.109 13.968 15.602 1.00 0.00 H new ATOM 2287 N ASN B 45 11.100 8.634 13.752 1.00 0.00 N ATOM 2288 CA ASN B 45 12.086 7.754 14.362 1.00 0.00 C ATOM 2289 C ASN B 45 13.281 8.583 14.870 1.00 0.00 C ATOM 2290 O ASN B 45 13.878 9.318 14.075 1.00 0.00 O ATOM 2291 CB ASN B 45 12.499 6.727 13.300 1.00 0.00 C ATOM 2292 CG ASN B 45 13.477 5.680 13.811 1.00 0.00 C ATOM 2293 OD1 ASN B 45 14.285 5.935 14.695 1.00 0.00 O ATOM 2294 ND2 ASN B 45 13.441 4.487 13.252 1.00 0.00 N ATOM 0 H ASN B 45 10.994 8.487 12.748 1.00 0.00 H new ATOM 0 HA ASN B 45 11.679 7.230 15.227 1.00 0.00 H new ATOM 0 HB2 ASN B 45 11.607 6.226 12.925 1.00 0.00 H new ATOM 0 HB3 ASN B 45 12.949 7.250 12.456 1.00 0.00 H new ATOM 0 HD21 ASN B 45 14.092 3.762 13.555 1.00 0.00 H new ATOM 0 HD22 ASN B 45 12.763 4.289 12.517 1.00 0.00 H new ATOM 2301 N PRO B 46 13.695 8.473 16.146 1.00 0.00 N ATOM 2302 CA PRO B 46 14.810 9.253 16.671 1.00 0.00 C ATOM 2303 C PRO B 46 16.148 8.930 15.993 1.00 0.00 C ATOM 2304 O PRO B 46 16.993 9.819 15.901 1.00 0.00 O ATOM 2305 CB PRO B 46 14.837 8.990 18.178 1.00 0.00 C ATOM 2306 CG PRO B 46 14.152 7.633 18.322 1.00 0.00 C ATOM 2307 CD PRO B 46 13.122 7.640 17.194 1.00 0.00 C ATOM 0 HA PRO B 46 14.665 10.312 16.459 1.00 0.00 H new ATOM 0 HB2 PRO B 46 15.857 8.966 18.562 1.00 0.00 H new ATOM 0 HB3 PRO B 46 14.307 9.767 18.729 1.00 0.00 H new ATOM 0 HG2 PRO B 46 14.860 6.811 18.215 1.00 0.00 H new ATOM 0 HG3 PRO B 46 13.679 7.522 19.298 1.00 0.00 H new ATOM 0 HD2 PRO B 46 12.931 6.630 16.831 1.00 0.00 H new ATOM 0 HD3 PRO B 46 12.168 8.042 17.536 1.00 0.00 H new ATOM 2315 N ASN B 47 16.352 7.722 15.446 1.00 0.00 N ATOM 2316 CA ASN B 47 17.560 7.428 14.666 1.00 0.00 C ATOM 2317 C ASN B 47 17.609 8.214 13.363 1.00 0.00 C ATOM 2318 O ASN B 47 18.684 8.382 12.798 1.00 0.00 O ATOM 2319 CB ASN B 47 17.785 5.919 14.436 1.00 0.00 C ATOM 2320 CG ASN B 47 17.104 5.193 13.268 1.00 0.00 C ATOM 2321 OD1 ASN B 47 16.349 4.248 13.472 1.00 0.00 O ATOM 2322 ND2 ASN B 47 17.428 5.495 12.019 1.00 0.00 N ATOM 0 H ASN B 47 15.702 6.941 15.529 1.00 0.00 H new ATOM 0 HA ASN B 47 18.395 7.767 15.279 1.00 0.00 H new ATOM 0 HB2 ASN B 47 18.859 5.768 14.325 1.00 0.00 H new ATOM 0 HB3 ASN B 47 17.485 5.407 15.350 1.00 0.00 H new ATOM 0 HD21 ASN B 47 17.051 4.945 11.247 1.00 0.00 H new ATOM 0 HD22 ASN B 47 18.054 6.277 11.830 1.00 0.00 H new ATOM 2329 N ALA B 48 16.471 8.711 12.885 1.00 0.00 N ATOM 2330 CA ALA B 48 16.403 9.575 11.718 1.00 0.00 C ATOM 2331 C ALA B 48 16.713 11.012 12.111 1.00 0.00 C ATOM 2332 O ALA B 48 17.414 11.713 11.391 1.00 0.00 O ATOM 2333 CB ALA B 48 15.005 9.451 11.135 1.00 0.00 C ATOM 0 H ALA B 48 15.561 8.521 13.305 1.00 0.00 H new ATOM 0 HA ALA B 48 17.140 9.279 10.972 1.00 0.00 H new ATOM 0 HB1 ALA B 48 14.920 10.089 10.255 1.00 0.00 H new ATOM 0 HB2 ALA B 48 14.820 8.415 10.852 1.00 0.00 H new ATOM 0 HB3 ALA B 48 14.272 9.760 11.880 1.00 0.00 H new ATOM 2339 N VAL B 49 16.241 11.437 13.282 1.00 0.00 N ATOM 2340 CA VAL B 49 16.618 12.733 13.847 1.00 0.00 C ATOM 2341 C VAL B 49 18.144 12.750 14.003 1.00 0.00 C ATOM 2342 O VAL B 49 18.806 13.640 13.468 1.00 0.00 O ATOM 2343 CB VAL B 49 15.861 13.017 15.167 1.00 0.00 C ATOM 2344 CG1 VAL B 49 16.130 14.446 15.663 1.00 0.00 C ATOM 2345 CG2 VAL B 49 14.339 12.858 15.017 1.00 0.00 C ATOM 0 H VAL B 49 15.594 10.901 13.860 1.00 0.00 H new ATOM 0 HA VAL B 49 16.327 13.544 13.180 1.00 0.00 H new ATOM 0 HB VAL B 49 16.232 12.283 15.883 1.00 0.00 H new ATOM 0 HG11 VAL B 49 15.586 14.617 16.592 1.00 0.00 H new ATOM 0 HG12 VAL B 49 17.198 14.575 15.839 1.00 0.00 H new ATOM 0 HG13 VAL B 49 15.798 15.161 14.910 1.00 0.00 H new ATOM 0 HG21 VAL B 49 13.855 13.068 15.971 1.00 0.00 H new ATOM 0 HG22 VAL B 49 13.973 13.555 14.263 1.00 0.00 H new ATOM 0 HG23 VAL B 49 14.108 11.838 14.710 1.00 0.00 H new ATOM 2355 N LYS B 50 18.727 11.727 14.640 1.00 0.00 N ATOM 2356 CA LYS B 50 20.172 11.602 14.818 1.00 0.00 C ATOM 2357 C LYS B 50 20.904 11.540 13.482 1.00 0.00 C ATOM 2358 O LYS B 50 21.935 12.196 13.348 1.00 0.00 O ATOM 2359 CB LYS B 50 20.469 10.406 15.740 1.00 0.00 C ATOM 2360 CG LYS B 50 21.883 10.492 16.337 1.00 0.00 C ATOM 2361 CD LYS B 50 22.060 9.631 17.599 1.00 0.00 C ATOM 2362 CE LYS B 50 21.956 8.120 17.344 1.00 0.00 C ATOM 2363 NZ LYS B 50 22.053 7.336 18.603 1.00 0.00 N ATOM 0 H LYS B 50 18.199 10.956 15.050 1.00 0.00 H new ATOM 0 HA LYS B 50 20.558 12.497 15.306 1.00 0.00 H new ATOM 0 HB2 LYS B 50 19.735 10.375 16.545 1.00 0.00 H new ATOM 0 HB3 LYS B 50 20.366 9.478 15.178 1.00 0.00 H new ATOM 0 HG2 LYS B 50 22.608 10.178 15.586 1.00 0.00 H new ATOM 0 HG3 LYS B 50 22.106 11.531 16.579 1.00 0.00 H new ATOM 0 HD2 LYS B 50 23.032 9.848 18.041 1.00 0.00 H new ATOM 0 HD3 LYS B 50 21.305 9.918 18.331 1.00 0.00 H new ATOM 0 HE2 LYS B 50 21.009 7.900 16.851 1.00 0.00 H new ATOM 0 HE3 LYS B 50 22.749 7.812 16.663 1.00 0.00 H new ATOM 0 HZ1 LYS B 50 21.978 6.321 18.387 1.00 0.00 H new ATOM 0 HZ2 LYS B 50 22.967 7.526 19.061 1.00 0.00 H new ATOM 0 HZ3 LYS B 50 21.281 7.611 19.244 1.00 0.00 H new ATOM 2377 N ALA B 51 20.349 10.857 12.477 1.00 0.00 N ATOM 2378 CA ALA B 51 20.884 10.873 11.121 1.00 0.00 C ATOM 2379 C ALA B 51 21.034 12.303 10.583 1.00 0.00 C ATOM 2380 O ALA B 51 22.025 12.596 9.919 1.00 0.00 O ATOM 2381 CB ALA B 51 20.002 10.015 10.208 1.00 0.00 C ATOM 0 H ALA B 51 19.516 10.278 12.585 1.00 0.00 H new ATOM 0 HA ALA B 51 21.886 10.445 11.140 1.00 0.00 H new ATOM 0 HB1 ALA B 51 20.405 10.029 9.195 1.00 0.00 H new ATOM 0 HB2 ALA B 51 19.985 8.990 10.577 1.00 0.00 H new ATOM 0 HB3 ALA B 51 18.988 10.415 10.201 1.00 0.00 H new ATOM 2387 N MET B 52 20.107 13.215 10.888 1.00 0.00 N ATOM 2388 CA MET B 52 20.205 14.599 10.446 1.00 0.00 C ATOM 2389 C MET B 52 21.216 15.371 11.279 1.00 0.00 C ATOM 2390 O MET B 52 21.950 16.191 10.727 1.00 0.00 O ATOM 2391 CB MET B 52 18.830 15.281 10.477 1.00 0.00 C ATOM 2392 CG MET B 52 17.788 14.563 9.616 1.00 0.00 C ATOM 2393 SD MET B 52 18.372 13.889 8.039 1.00 0.00 S ATOM 2394 CE MET B 52 18.911 15.404 7.234 1.00 0.00 C ATOM 0 H MET B 52 19.276 13.012 11.444 1.00 0.00 H new ATOM 0 HA MET B 52 20.558 14.597 9.415 1.00 0.00 H new ATOM 0 HB2 MET B 52 18.475 15.325 11.507 1.00 0.00 H new ATOM 0 HB3 MET B 52 18.933 16.310 10.131 1.00 0.00 H new ATOM 0 HG2 MET B 52 17.366 13.746 10.201 1.00 0.00 H new ATOM 0 HG3 MET B 52 16.976 15.260 9.410 1.00 0.00 H new ATOM 0 HE1 MET B 52 18.586 15.399 6.194 1.00 0.00 H new ATOM 0 HE2 MET B 52 18.476 16.263 7.746 1.00 0.00 H new ATOM 0 HE3 MET B 52 19.998 15.470 7.274 1.00 0.00 H new ATOM 2404 N LYS B 53 21.330 15.085 12.582 1.00 0.00 N ATOM 2405 CA LYS B 53 22.346 15.723 13.416 1.00 0.00 C ATOM 2406 C LYS B 53 23.758 15.380 12.936 1.00 0.00 C ATOM 2407 O LYS B 53 24.656 16.191 13.153 1.00 0.00 O ATOM 2408 CB LYS B 53 22.186 15.361 14.908 1.00 0.00 C ATOM 2409 CG LYS B 53 20.798 15.613 15.519 1.00 0.00 C ATOM 2410 CD LYS B 53 20.313 17.068 15.444 1.00 0.00 C ATOM 2411 CE LYS B 53 18.825 17.121 15.821 1.00 0.00 C ATOM 2412 NZ LYS B 53 18.316 18.510 15.924 1.00 0.00 N ATOM 0 H LYS B 53 20.734 14.420 13.075 1.00 0.00 H new ATOM 0 HA LYS B 53 22.197 16.798 13.317 1.00 0.00 H new ATOM 0 HB2 LYS B 53 22.430 14.306 15.033 1.00 0.00 H new ATOM 0 HB3 LYS B 53 22.921 15.928 15.480 1.00 0.00 H new ATOM 0 HG2 LYS B 53 20.073 14.977 15.011 1.00 0.00 H new ATOM 0 HG3 LYS B 53 20.816 15.305 16.564 1.00 0.00 H new ATOM 0 HD2 LYS B 53 20.895 17.694 16.121 1.00 0.00 H new ATOM 0 HD3 LYS B 53 20.461 17.462 14.439 1.00 0.00 H new ATOM 0 HE2 LYS B 53 18.245 16.579 15.074 1.00 0.00 H new ATOM 0 HE3 LYS B 53 18.676 16.611 16.773 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 17.348 18.554 15.546 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 18.312 18.805 16.921 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 18.930 19.146 15.377 1.00 0.00 H new ATOM 2426 N GLU B 54 23.969 14.253 12.237 1.00 0.00 N ATOM 2427 CA GLU B 54 25.281 13.916 11.676 1.00 0.00 C ATOM 2428 C GLU B 54 25.771 14.989 10.691 1.00 0.00 C ATOM 2429 O GLU B 54 26.979 15.172 10.535 1.00 0.00 O ATOM 2430 CB GLU B 54 25.282 12.558 10.956 1.00 0.00 C ATOM 2431 CG GLU B 54 24.949 11.346 11.837 1.00 0.00 C ATOM 2432 CD GLU B 54 25.371 10.039 11.142 1.00 0.00 C ATOM 2433 OE1 GLU B 54 25.045 9.848 9.948 1.00 0.00 O ATOM 2434 OE2 GLU B 54 26.070 9.212 11.769 1.00 0.00 O ATOM 0 H GLU B 54 23.244 13.561 12.048 1.00 0.00 H new ATOM 0 HA GLU B 54 25.957 13.864 12.530 1.00 0.00 H new ATOM 0 HB2 GLU B 54 24.563 12.599 10.137 1.00 0.00 H new ATOM 0 HB3 GLU B 54 26.264 12.403 10.510 1.00 0.00 H new ATOM 0 HG2 GLU B 54 25.459 11.435 12.796 1.00 0.00 H new ATOM 0 HG3 GLU B 54 23.879 11.324 12.046 1.00 0.00 H new ATOM 2441 N VAL B 55 24.846 15.716 10.056 1.00 0.00 N ATOM 2442 CA VAL B 55 25.125 16.768 9.080 1.00 0.00 C ATOM 2443 C VAL B 55 24.553 18.120 9.542 1.00 0.00 C ATOM 2444 O VAL B 55 24.476 19.065 8.755 1.00 0.00 O ATOM 2445 CB VAL B 55 24.643 16.315 7.683 1.00 0.00 C ATOM 2446 CG1 VAL B 55 25.502 15.139 7.185 1.00 0.00 C ATOM 2447 CG2 VAL B 55 23.157 15.913 7.652 1.00 0.00 C ATOM 0 H VAL B 55 23.848 15.581 10.215 1.00 0.00 H new ATOM 0 HA VAL B 55 26.200 16.933 9.001 1.00 0.00 H new ATOM 0 HB VAL B 55 24.755 17.176 7.024 1.00 0.00 H new ATOM 0 HG11 VAL B 55 25.155 14.827 6.200 1.00 0.00 H new ATOM 0 HG12 VAL B 55 26.544 15.451 7.120 1.00 0.00 H new ATOM 0 HG13 VAL B 55 25.416 14.305 7.881 1.00 0.00 H new ATOM 0 HG21 VAL B 55 22.884 15.606 6.642 1.00 0.00 H new ATOM 0 HG22 VAL B 55 22.990 15.085 8.341 1.00 0.00 H new ATOM 0 HG23 VAL B 55 22.544 16.763 7.951 1.00 0.00 H new ATOM 2457 N GLY B 56 24.187 18.235 10.825 1.00 0.00 N ATOM 2458 CA GLY B 56 23.707 19.470 11.425 1.00 0.00 C ATOM 2459 C GLY B 56 22.401 19.959 10.798 1.00 0.00 C ATOM 2460 O GLY B 56 22.266 21.159 10.548 1.00 0.00 O ATOM 0 H GLY B 56 24.220 17.454 11.480 1.00 0.00 H new ATOM 0 HA2 GLY B 56 23.558 19.316 12.494 1.00 0.00 H new ATOM 0 HA3 GLY B 56 24.469 20.242 11.317 1.00 0.00 H new ATOM 2464 N ILE B 57 21.449 19.055 10.535 1.00 0.00 N ATOM 2465 CA ILE B 57 20.100 19.411 10.092 1.00 0.00 C ATOM 2466 C ILE B 57 19.167 18.957 11.221 1.00 0.00 C ATOM 2467 O ILE B 57 19.507 18.057 11.995 1.00 0.00 O ATOM 2468 CB ILE B 57 19.795 18.795 8.696 1.00 0.00 C ATOM 2469 CG1 ILE B 57 20.774 19.335 7.627 1.00 0.00 C ATOM 2470 CG2 ILE B 57 18.340 19.058 8.237 1.00 0.00 C ATOM 2471 CD1 ILE B 57 20.698 18.609 6.276 1.00 0.00 C ATOM 0 H ILE B 57 21.597 18.050 10.625 1.00 0.00 H new ATOM 0 HA ILE B 57 19.966 20.481 9.930 1.00 0.00 H new ATOM 0 HB ILE B 57 19.926 17.718 8.802 1.00 0.00 H new ATOM 0 HG12 ILE B 57 20.572 20.394 7.469 1.00 0.00 H new ATOM 0 HG13 ILE B 57 21.791 19.258 8.011 1.00 0.00 H new ATOM 0 HG21 ILE B 57 18.180 18.607 7.258 1.00 0.00 H new ATOM 0 HG22 ILE B 57 17.647 18.620 8.955 1.00 0.00 H new ATOM 0 HG23 ILE B 57 18.167 20.132 8.174 1.00 0.00 H new ATOM 0 HD11 ILE B 57 21.416 19.050 5.585 1.00 0.00 H new ATOM 0 HD12 ILE B 57 20.931 17.553 6.417 1.00 0.00 H new ATOM 0 HD13 ILE B 57 19.693 18.708 5.866 1.00 0.00 H new ATOM 2483 N ASP B 58 17.989 19.572 11.328 1.00 0.00 N ATOM 2484 CA ASP B 58 16.987 19.234 12.329 1.00 0.00 C ATOM 2485 C ASP B 58 15.672 18.899 11.638 1.00 0.00 C ATOM 2486 O ASP B 58 15.285 19.559 10.672 1.00 0.00 O ATOM 2487 CB ASP B 58 16.775 20.393 13.311 1.00 0.00 C ATOM 2488 CG ASP B 58 15.655 20.042 14.299 1.00 0.00 C ATOM 2489 OD1 ASP B 58 15.734 18.941 14.896 1.00 0.00 O ATOM 2490 OD2 ASP B 58 14.691 20.821 14.443 1.00 0.00 O ATOM 0 H ASP B 58 17.703 20.331 10.709 1.00 0.00 H new ATOM 0 HA ASP B 58 17.340 18.370 12.893 1.00 0.00 H new ATOM 0 HB2 ASP B 58 17.699 20.596 13.852 1.00 0.00 H new ATOM 0 HB3 ASP B 58 16.519 21.301 12.765 1.00 0.00 H new ATOM 2495 N ILE B 59 14.990 17.888 12.171 1.00 0.00 N ATOM 2496 CA ILE B 59 13.664 17.443 11.755 1.00 0.00 C ATOM 2497 C ILE B 59 12.819 17.119 12.983 1.00 0.00 C ATOM 2498 O ILE B 59 11.859 16.363 12.882 1.00 0.00 O ATOM 2499 CB ILE B 59 13.737 16.235 10.794 1.00 0.00 C ATOM 2500 CG1 ILE B 59 14.530 15.060 11.415 1.00 0.00 C ATOM 2501 CG2 ILE B 59 14.333 16.668 9.452 1.00 0.00 C ATOM 2502 CD1 ILE B 59 14.425 13.778 10.592 1.00 0.00 C ATOM 0 H ILE B 59 15.365 17.332 12.940 1.00 0.00 H new ATOM 0 HA ILE B 59 13.190 18.255 11.203 1.00 0.00 H new ATOM 0 HB ILE B 59 12.724 15.873 10.620 1.00 0.00 H new ATOM 0 HG12 ILE B 59 15.579 15.343 11.507 1.00 0.00 H new ATOM 0 HG13 ILE B 59 14.161 14.871 12.423 1.00 0.00 H new ATOM 0 HG21 ILE B 59 14.381 15.810 8.781 1.00 0.00 H new ATOM 0 HG22 ILE B 59 13.706 17.441 9.008 1.00 0.00 H new ATOM 0 HG23 ILE B 59 15.337 17.061 9.610 1.00 0.00 H new ATOM 0 HD11 ILE B 59 15.000 12.988 11.074 1.00 0.00 H new ATOM 0 HD12 ILE B 59 13.380 13.475 10.522 1.00 0.00 H new ATOM 0 HD13 ILE B 59 14.819 13.955 9.591 1.00 0.00 H new ATOM 2514 N SER B 60 13.138 17.660 14.161 1.00 0.00 N ATOM 2515 CA SER B 60 12.316 17.414 15.342 1.00 0.00 C ATOM 2516 C SER B 60 10.863 17.922 15.151 1.00 0.00 C ATOM 2517 O SER B 60 9.955 17.532 15.885 1.00 0.00 O ATOM 2518 CB SER B 60 12.998 18.008 16.581 1.00 0.00 C ATOM 2519 OG SER B 60 14.357 17.604 16.666 1.00 0.00 O ATOM 0 H SER B 60 13.947 18.261 14.319 1.00 0.00 H new ATOM 0 HA SER B 60 12.230 16.338 15.494 1.00 0.00 H new ATOM 0 HB2 SER B 60 12.942 19.096 16.543 1.00 0.00 H new ATOM 0 HB3 SER B 60 12.466 17.692 17.478 1.00 0.00 H new ATOM 0 HG SER B 60 14.933 18.323 16.332 1.00 0.00 H new ATOM 2525 N ASN B 61 10.649 18.765 14.134 1.00 0.00 N ATOM 2526 CA ASN B 61 9.365 19.226 13.611 1.00 0.00 C ATOM 2527 C ASN B 61 8.487 18.109 13.023 1.00 0.00 C ATOM 2528 O ASN B 61 7.261 18.235 13.046 1.00 0.00 O ATOM 2529 CB ASN B 61 9.671 20.280 12.525 1.00 0.00 C ATOM 2530 CG ASN B 61 8.542 20.465 11.512 1.00 0.00 C ATOM 2531 OD1 ASN B 61 7.606 21.228 11.730 1.00 0.00 O ATOM 2532 ND2 ASN B 61 8.623 19.779 10.381 1.00 0.00 N ATOM 0 H ASN B 61 11.430 19.171 13.619 1.00 0.00 H new ATOM 0 HA ASN B 61 8.788 19.635 14.440 1.00 0.00 H new ATOM 0 HB2 ASN B 61 9.875 21.236 13.007 1.00 0.00 H new ATOM 0 HB3 ASN B 61 10.578 19.990 11.995 1.00 0.00 H new ATOM 0 HD21 ASN B 61 7.898 19.880 9.670 1.00 0.00 H new ATOM 0 HD22 ASN B 61 9.410 19.150 10.221 1.00 0.00 H new ATOM 2539 N GLN B 62 9.087 17.062 12.451 1.00 0.00 N ATOM 2540 CA GLN B 62 8.404 16.047 11.666 1.00 0.00 C ATOM 2541 C GLN B 62 7.374 15.286 12.518 1.00 0.00 C ATOM 2542 O GLN B 62 7.461 15.228 13.747 1.00 0.00 O ATOM 2543 CB GLN B 62 9.417 15.108 10.979 1.00 0.00 C ATOM 2544 CG GLN B 62 9.744 15.495 9.523 1.00 0.00 C ATOM 2545 CD GLN B 62 10.382 16.873 9.273 1.00 0.00 C ATOM 2546 OE1 GLN B 62 10.668 17.666 10.165 1.00 0.00 O ATOM 2547 NE2 GLN B 62 10.598 17.204 8.015 1.00 0.00 N ATOM 0 H GLN B 62 10.091 16.898 12.527 1.00 0.00 H new ATOM 0 HA GLN B 62 7.845 16.543 10.872 1.00 0.00 H new ATOM 0 HB2 GLN B 62 10.340 15.101 11.558 1.00 0.00 H new ATOM 0 HB3 GLN B 62 9.023 14.092 10.994 1.00 0.00 H new ATOM 0 HG2 GLN B 62 10.414 14.737 9.117 1.00 0.00 H new ATOM 0 HG3 GLN B 62 8.820 15.444 8.947 1.00 0.00 H new ATOM 0 HE21 GLN B 62 10.363 16.550 7.268 1.00 0.00 H new ATOM 0 HE22 GLN B 62 11.000 18.114 7.789 1.00 0.00 H new ATOM 2556 N THR B 63 6.403 14.679 11.838 1.00 0.00 N ATOM 2557 CA THR B 63 5.288 13.966 12.474 1.00 0.00 C ATOM 2558 C THR B 63 4.767 12.800 11.611 1.00 0.00 C ATOM 2559 O THR B 63 4.414 11.752 12.162 1.00 0.00 O ATOM 2560 CB THR B 63 4.204 15.001 12.869 1.00 0.00 C ATOM 2561 OG1 THR B 63 3.220 14.445 13.720 1.00 0.00 O ATOM 2562 CG2 THR B 63 3.496 15.654 11.673 1.00 0.00 C ATOM 0 H THR B 63 6.365 14.666 10.819 1.00 0.00 H new ATOM 0 HA THR B 63 5.631 13.476 13.385 1.00 0.00 H new ATOM 0 HB THR B 63 4.761 15.776 13.396 1.00 0.00 H new ATOM 0 HG1 THR B 63 2.557 15.131 13.946 1.00 0.00 H new ATOM 0 HG21 THR B 63 2.753 16.365 12.034 1.00 0.00 H new ATOM 0 HG22 THR B 63 4.228 16.176 11.057 1.00 0.00 H new ATOM 0 HG23 THR B 63 3.003 14.885 11.078 1.00 0.00 H new ATOM 2570 N SER B 64 4.850 12.898 10.274 1.00 0.00 N ATOM 2571 CA SER B 64 4.391 11.909 9.287 1.00 0.00 C ATOM 2572 C SER B 64 2.901 11.520 9.388 1.00 0.00 C ATOM 2573 O SER B 64 2.172 11.964 10.279 1.00 0.00 O ATOM 2574 CB SER B 64 5.347 10.701 9.218 1.00 0.00 C ATOM 2575 OG SER B 64 5.864 10.293 10.472 1.00 0.00 O ATOM 0 H SER B 64 5.263 13.717 9.828 1.00 0.00 H new ATOM 0 HA SER B 64 4.438 12.415 8.323 1.00 0.00 H new ATOM 0 HB2 SER B 64 4.820 9.861 8.765 1.00 0.00 H new ATOM 0 HB3 SER B 64 6.179 10.948 8.559 1.00 0.00 H new ATOM 0 HG SER B 64 5.187 10.434 11.167 1.00 0.00 H new ATOM 2581 N ASP B 65 2.435 10.723 8.421 1.00 0.00 N ATOM 2582 CA ASP B 65 1.059 10.256 8.243 1.00 0.00 C ATOM 2583 C ASP B 65 1.075 9.113 7.220 1.00 0.00 C ATOM 2584 O ASP B 65 2.073 8.945 6.514 1.00 0.00 O ATOM 2585 CB ASP B 65 0.180 11.398 7.703 1.00 0.00 C ATOM 2586 CG ASP B 65 -1.314 11.036 7.663 1.00 0.00 C ATOM 2587 OD1 ASP B 65 -1.767 10.202 8.479 1.00 0.00 O ATOM 2588 OD2 ASP B 65 -2.053 11.626 6.842 1.00 0.00 O ATOM 0 H ASP B 65 3.052 10.363 7.693 1.00 0.00 H new ATOM 0 HA ASP B 65 0.655 9.919 9.198 1.00 0.00 H new ATOM 0 HB2 ASP B 65 0.318 12.282 8.326 1.00 0.00 H new ATOM 0 HB3 ASP B 65 0.512 11.661 6.699 1.00 0.00 H new ATOM 2593 N ILE B 66 -0.010 8.343 7.104 1.00 0.00 N ATOM 2594 CA ILE B 66 -0.175 7.303 6.099 1.00 0.00 C ATOM 2595 C ILE B 66 -0.306 7.901 4.692 1.00 0.00 C ATOM 2596 O ILE B 66 -0.373 9.124 4.528 1.00 0.00 O ATOM 2597 CB ILE B 66 -1.393 6.429 6.461 1.00 0.00 C ATOM 2598 CG1 ILE B 66 -2.671 7.267 6.661 1.00 0.00 C ATOM 2599 CG2 ILE B 66 -1.060 5.584 7.698 1.00 0.00 C ATOM 2600 CD1 ILE B 66 -3.935 6.417 6.747 1.00 0.00 C ATOM 0 H ILE B 66 -0.815 8.432 7.724 1.00 0.00 H new ATOM 0 HA ILE B 66 0.716 6.675 6.089 1.00 0.00 H new ATOM 0 HB ILE B 66 -1.605 5.762 5.625 1.00 0.00 H new ATOM 0 HG12 ILE B 66 -2.573 7.856 7.573 1.00 0.00 H new ATOM 0 HG13 ILE B 66 -2.769 7.972 5.835 1.00 0.00 H new ATOM 0 HG21 ILE B 66 -1.919 4.965 7.957 1.00 0.00 H new ATOM 0 HG22 ILE B 66 -0.204 4.945 7.482 1.00 0.00 H new ATOM 0 HG23 ILE B 66 -0.821 6.241 8.534 1.00 0.00 H new ATOM 0 HD11 ILE B 66 -4.800 7.065 6.888 1.00 0.00 H new ATOM 0 HD12 ILE B 66 -4.054 5.848 5.825 1.00 0.00 H new ATOM 0 HD13 ILE B 66 -3.855 5.730 7.590 1.00 0.00 H new ATOM 2612 N ILE B 67 -0.353 7.029 3.677 1.00 0.00 N ATOM 2613 CA ILE B 67 -0.661 7.412 2.303 1.00 0.00 C ATOM 2614 C ILE B 67 -1.921 8.293 2.296 1.00 0.00 C ATOM 2615 O ILE B 67 -2.928 7.961 2.929 1.00 0.00 O ATOM 2616 CB ILE B 67 -0.701 6.194 1.330 1.00 0.00 C ATOM 2617 CG1 ILE B 67 -2.131 5.687 1.033 1.00 0.00 C ATOM 2618 CG2 ILE B 67 0.236 5.046 1.770 1.00 0.00 C ATOM 2619 CD1 ILE B 67 -2.223 4.479 0.092 1.00 0.00 C ATOM 0 H ILE B 67 -0.176 6.031 3.792 1.00 0.00 H new ATOM 0 HA ILE B 67 0.153 8.016 1.901 1.00 0.00 H new ATOM 0 HB ILE B 67 -0.314 6.576 0.385 1.00 0.00 H new ATOM 0 HG12 ILE B 67 -2.608 5.426 1.978 1.00 0.00 H new ATOM 0 HG13 ILE B 67 -2.705 6.506 0.601 1.00 0.00 H new ATOM 0 HG21 ILE B 67 0.167 4.226 1.056 1.00 0.00 H new ATOM 0 HG22 ILE B 67 1.263 5.409 1.807 1.00 0.00 H new ATOM 0 HG23 ILE B 67 -0.060 4.693 2.758 1.00 0.00 H new ATOM 0 HD11 ILE B 67 -3.269 4.206 -0.048 1.00 0.00 H new ATOM 0 HD12 ILE B 67 -1.782 4.734 -0.872 1.00 0.00 H new ATOM 0 HD13 ILE B 67 -1.684 3.637 0.527 1.00 0.00 H new ATOM 2631 N ASP B 68 -1.854 9.419 1.589 1.00 0.00 N ATOM 2632 CA ASP B 68 -2.967 10.351 1.450 1.00 0.00 C ATOM 2633 C ASP B 68 -2.898 10.999 0.075 1.00 0.00 C ATOM 2634 O ASP B 68 -2.149 11.953 -0.167 1.00 0.00 O ATOM 2635 CB ASP B 68 -3.000 11.403 2.567 1.00 0.00 C ATOM 2636 CG ASP B 68 -4.272 12.276 2.496 1.00 0.00 C ATOM 2637 OD1 ASP B 68 -5.045 12.189 1.515 1.00 0.00 O ATOM 2638 OD2 ASP B 68 -4.524 13.030 3.464 1.00 0.00 O ATOM 0 H ASP B 68 -1.014 9.712 1.091 1.00 0.00 H new ATOM 0 HA ASP B 68 -3.898 9.792 1.545 1.00 0.00 H new ATOM 0 HB2 ASP B 68 -2.954 10.906 3.536 1.00 0.00 H new ATOM 0 HB3 ASP B 68 -2.118 12.039 2.493 1.00 0.00 H new ATOM 2643 N SER B 69 -3.684 10.437 -0.838 1.00 0.00 N ATOM 2644 CA SER B 69 -3.836 10.902 -2.199 1.00 0.00 C ATOM 2645 C SER B 69 -4.145 12.397 -2.316 1.00 0.00 C ATOM 2646 O SER B 69 -3.793 12.983 -3.338 1.00 0.00 O ATOM 2647 CB SER B 69 -4.952 10.087 -2.854 1.00 0.00 C ATOM 2648 OG SER B 69 -4.781 8.694 -2.635 1.00 0.00 O ATOM 0 H SER B 69 -4.251 9.614 -0.635 1.00 0.00 H new ATOM 0 HA SER B 69 -2.880 10.761 -2.704 1.00 0.00 H new ATOM 0 HB2 SER B 69 -5.916 10.403 -2.455 1.00 0.00 H new ATOM 0 HB3 SER B 69 -4.969 10.288 -3.925 1.00 0.00 H new ATOM 0 HG SER B 69 -5.295 8.192 -3.302 1.00 0.00 H new ATOM 2654 N ASP B 70 -4.740 13.051 -1.312 1.00 0.00 N ATOM 2655 CA ASP B 70 -5.144 14.457 -1.420 1.00 0.00 C ATOM 2656 C ASP B 70 -3.948 15.384 -1.635 1.00 0.00 C ATOM 2657 O ASP B 70 -4.099 16.482 -2.169 1.00 0.00 O ATOM 2658 CB ASP B 70 -5.900 14.912 -0.172 1.00 0.00 C ATOM 2659 CG ASP B 70 -6.462 16.335 -0.332 1.00 0.00 C ATOM 2660 OD1 ASP B 70 -7.364 16.543 -1.173 1.00 0.00 O ATOM 2661 OD2 ASP B 70 -6.049 17.243 0.426 1.00 0.00 O ATOM 0 H ASP B 70 -4.953 12.625 -0.410 1.00 0.00 H new ATOM 0 HA ASP B 70 -5.798 14.520 -2.290 1.00 0.00 H new ATOM 0 HB2 ASP B 70 -6.717 14.219 0.031 1.00 0.00 H new ATOM 0 HB3 ASP B 70 -5.233 14.879 0.689 1.00 0.00 H new ATOM 2666 N ILE B 71 -2.749 14.931 -1.272 1.00 0.00 N ATOM 2667 CA ILE B 71 -1.510 15.679 -1.427 1.00 0.00 C ATOM 2668 C ILE B 71 -0.569 14.849 -2.298 1.00 0.00 C ATOM 2669 O ILE B 71 0.111 15.406 -3.154 1.00 0.00 O ATOM 2670 CB ILE B 71 -0.881 15.970 -0.049 1.00 0.00 C ATOM 2671 CG1 ILE B 71 -1.900 16.363 1.048 1.00 0.00 C ATOM 2672 CG2 ILE B 71 0.211 17.048 -0.076 1.00 0.00 C ATOM 2673 CD1 ILE B 71 -2.130 15.176 1.974 1.00 0.00 C ATOM 0 H ILE B 71 -2.613 14.011 -0.852 1.00 0.00 H new ATOM 0 HA ILE B 71 -1.701 16.641 -1.903 1.00 0.00 H new ATOM 0 HB ILE B 71 -0.437 15.008 0.205 1.00 0.00 H new ATOM 0 HG12 ILE B 71 -1.528 17.215 1.617 1.00 0.00 H new ATOM 0 HG13 ILE B 71 -2.841 16.670 0.592 1.00 0.00 H new ATOM 0 HG21 ILE B 71 0.603 17.194 0.931 1.00 0.00 H new ATOM 0 HG22 ILE B 71 1.018 16.732 -0.737 1.00 0.00 H new ATOM 0 HG23 ILE B 71 -0.211 17.984 -0.441 1.00 0.00 H new ATOM 0 HD11 ILE B 71 -2.847 15.451 2.747 1.00 0.00 H new ATOM 0 HD12 ILE B 71 -2.520 14.336 1.399 1.00 0.00 H new ATOM 0 HD13 ILE B 71 -1.187 14.890 2.440 1.00 0.00 H new ATOM 2685 N LEU B 72 -0.556 13.518 -2.141 1.00 0.00 N ATOM 2686 CA LEU B 72 0.352 12.668 -2.895 1.00 0.00 C ATOM 2687 C LEU B 72 -0.018 12.658 -4.376 1.00 0.00 C ATOM 2688 O LEU B 72 0.870 12.815 -5.206 1.00 0.00 O ATOM 2689 CB LEU B 72 0.408 11.272 -2.256 1.00 0.00 C ATOM 2690 CG LEU B 72 1.618 10.434 -2.721 1.00 0.00 C ATOM 2691 CD1 LEU B 72 1.964 9.410 -1.631 1.00 0.00 C ATOM 2692 CD2 LEU B 72 1.380 9.728 -4.065 1.00 0.00 C ATOM 0 H LEU B 72 -1.167 13.015 -1.497 1.00 0.00 H new ATOM 0 HA LEU B 72 1.364 13.071 -2.851 1.00 0.00 H new ATOM 0 HB2 LEU B 72 0.444 11.378 -1.172 1.00 0.00 H new ATOM 0 HB3 LEU B 72 -0.510 10.734 -2.494 1.00 0.00 H new ATOM 0 HG LEU B 72 2.453 11.117 -2.881 1.00 0.00 H new ATOM 0 HD11 LEU B 72 2.818 8.813 -1.951 1.00 0.00 H new ATOM 0 HD12 LEU B 72 2.212 9.932 -0.707 1.00 0.00 H new ATOM 0 HD13 LEU B 72 1.108 8.757 -1.461 1.00 0.00 H new ATOM 0 HD21 LEU B 72 2.267 9.155 -4.337 1.00 0.00 H new ATOM 0 HD22 LEU B 72 0.527 9.055 -3.977 1.00 0.00 H new ATOM 0 HD23 LEU B 72 1.177 10.472 -4.836 1.00 0.00 H new ATOM 2704 N ASN B 73 -1.308 12.586 -4.738 1.00 0.00 N ATOM 2705 CA ASN B 73 -1.712 12.709 -6.143 1.00 0.00 C ATOM 2706 C ASN B 73 -1.429 14.122 -6.687 1.00 0.00 C ATOM 2707 O ASN B 73 -1.307 14.298 -7.897 1.00 0.00 O ATOM 2708 CB ASN B 73 -3.178 12.289 -6.391 1.00 0.00 C ATOM 2709 CG ASN B 73 -4.109 13.459 -6.719 1.00 0.00 C ATOM 2710 OD1 ASN B 73 -4.473 13.677 -7.869 1.00 0.00 O ATOM 2711 ND2 ASN B 73 -4.494 14.243 -5.726 1.00 0.00 N ATOM 0 H ASN B 73 -2.079 12.445 -4.085 1.00 0.00 H new ATOM 0 HA ASN B 73 -1.097 12.003 -6.701 1.00 0.00 H new ATOM 0 HB2 ASN B 73 -3.207 11.573 -7.212 1.00 0.00 H new ATOM 0 HB3 ASN B 73 -3.554 11.775 -5.506 1.00 0.00 H new ATOM 0 HD21 ASN B 73 -5.102 15.041 -5.912 1.00 0.00 H new ATOM 0 HD22 ASN B 73 -4.183 14.050 -4.774 1.00 0.00 H new ATOM 2718 N ASN B 74 -1.342 15.129 -5.806 1.00 0.00 N ATOM 2719 CA ASN B 74 -0.983 16.498 -6.160 1.00 0.00 C ATOM 2720 C ASN B 74 0.534 16.696 -6.262 1.00 0.00 C ATOM 2721 O ASN B 74 0.962 17.724 -6.792 1.00 0.00 O ATOM 2722 CB ASN B 74 -1.595 17.513 -5.173 1.00 0.00 C ATOM 2723 CG ASN B 74 -3.024 17.888 -5.553 1.00 0.00 C ATOM 2724 OD1 ASN B 74 -3.274 18.389 -6.647 1.00 0.00 O ATOM 2725 ND2 ASN B 74 -3.991 17.662 -4.682 1.00 0.00 N ATOM 0 H ASN B 74 -1.524 15.006 -4.810 1.00 0.00 H new ATOM 0 HA ASN B 74 -1.403 16.681 -7.149 1.00 0.00 H new ATOM 0 HB2 ASN B 74 -1.586 17.092 -4.168 1.00 0.00 H new ATOM 0 HB3 ASN B 74 -0.979 18.412 -5.148 1.00 0.00 H new ATOM 0 HD21 ASN B 74 -4.954 17.904 -4.915 1.00 0.00 H new ATOM 0 HD22 ASN B 74 -3.775 17.246 -3.776 1.00 0.00 H new ATOM 2732 N ALA B 75 1.356 15.755 -5.774 1.00 0.00 N ATOM 2733 CA ALA B 75 2.788 15.760 -6.013 1.00 0.00 C ATOM 2734 C ALA B 75 3.105 15.738 -7.507 1.00 0.00 C ATOM 2735 O ALA B 75 2.279 15.378 -8.347 1.00 0.00 O ATOM 2736 CB ALA B 75 3.478 14.605 -5.273 1.00 0.00 C ATOM 0 H ALA B 75 1.036 14.973 -5.203 1.00 0.00 H new ATOM 0 HA ALA B 75 3.187 16.692 -5.612 1.00 0.00 H new ATOM 0 HB1 ALA B 75 4.549 14.635 -5.471 1.00 0.00 H new ATOM 0 HB2 ALA B 75 3.304 14.704 -4.202 1.00 0.00 H new ATOM 0 HB3 ALA B 75 3.071 13.655 -5.621 1.00 0.00 H new ATOM 2742 N ASP B 76 4.343 16.110 -7.814 1.00 0.00 N ATOM 2743 CA ASP B 76 4.931 15.963 -9.146 1.00 0.00 C ATOM 2744 C ASP B 76 5.620 14.604 -9.284 1.00 0.00 C ATOM 2745 O ASP B 76 5.572 13.993 -10.352 1.00 0.00 O ATOM 2746 CB ASP B 76 5.964 17.067 -9.397 1.00 0.00 C ATOM 2747 CG ASP B 76 6.584 16.926 -10.797 1.00 0.00 C ATOM 2748 OD1 ASP B 76 5.898 17.234 -11.797 1.00 0.00 O ATOM 2749 OD2 ASP B 76 7.772 16.547 -10.899 1.00 0.00 O ATOM 0 H ASP B 76 4.979 16.529 -7.135 1.00 0.00 H new ATOM 0 HA ASP B 76 4.126 16.038 -9.877 1.00 0.00 H new ATOM 0 HB2 ASP B 76 5.490 18.044 -9.301 1.00 0.00 H new ATOM 0 HB3 ASP B 76 6.747 17.017 -8.641 1.00 0.00 H new ATOM 2754 N LEU B 77 6.218 14.108 -8.193 1.00 0.00 N ATOM 2755 CA LEU B 77 7.068 12.929 -8.169 1.00 0.00 C ATOM 2756 C LEU B 77 6.859 12.185 -6.851 1.00 0.00 C ATOM 2757 O LEU B 77 6.924 12.788 -5.777 1.00 0.00 O ATOM 2758 CB LEU B 77 8.545 13.350 -8.352 1.00 0.00 C ATOM 2759 CG LEU B 77 9.604 12.279 -7.999 1.00 0.00 C ATOM 2760 CD1 LEU B 77 9.552 11.003 -8.843 1.00 0.00 C ATOM 2761 CD2 LEU B 77 11.009 12.879 -8.119 1.00 0.00 C ATOM 0 H LEU B 77 6.114 14.538 -7.274 1.00 0.00 H new ATOM 0 HA LEU B 77 6.806 12.259 -8.987 1.00 0.00 H new ATOM 0 HB2 LEU B 77 8.691 13.649 -9.390 1.00 0.00 H new ATOM 0 HB3 LEU B 77 8.730 14.231 -7.738 1.00 0.00 H new ATOM 0 HG LEU B 77 9.368 11.981 -6.977 1.00 0.00 H new ATOM 0 HD11 LEU B 77 10.334 10.318 -8.516 1.00 0.00 H new ATOM 0 HD12 LEU B 77 8.579 10.526 -8.723 1.00 0.00 H new ATOM 0 HD13 LEU B 77 9.705 11.254 -9.892 1.00 0.00 H new ATOM 0 HD21 LEU B 77 11.751 12.121 -7.869 1.00 0.00 H new ATOM 0 HD22 LEU B 77 11.172 13.223 -9.140 1.00 0.00 H new ATOM 0 HD23 LEU B 77 11.105 13.720 -7.433 1.00 0.00 H new ATOM 2773 N VAL B 78 6.665 10.872 -6.955 1.00 0.00 N ATOM 2774 CA VAL B 78 6.658 9.935 -5.847 1.00 0.00 C ATOM 2775 C VAL B 78 8.028 9.268 -5.856 1.00 0.00 C ATOM 2776 O VAL B 78 8.339 8.441 -6.712 1.00 0.00 O ATOM 2777 CB VAL B 78 5.484 8.942 -5.943 1.00 0.00 C ATOM 2778 CG1 VAL B 78 5.336 8.189 -4.613 1.00 0.00 C ATOM 2779 CG2 VAL B 78 4.162 9.646 -6.274 1.00 0.00 C ATOM 0 H VAL B 78 6.502 10.419 -7.854 1.00 0.00 H new ATOM 0 HA VAL B 78 6.495 10.436 -4.893 1.00 0.00 H new ATOM 0 HB VAL B 78 5.707 8.246 -6.752 1.00 0.00 H new ATOM 0 HG11 VAL B 78 4.505 7.487 -4.683 1.00 0.00 H new ATOM 0 HG12 VAL B 78 6.255 7.643 -4.400 1.00 0.00 H new ATOM 0 HG13 VAL B 78 5.143 8.901 -3.811 1.00 0.00 H new ATOM 0 HG21 VAL B 78 3.362 8.908 -6.332 1.00 0.00 H new ATOM 0 HG22 VAL B 78 3.931 10.372 -5.494 1.00 0.00 H new ATOM 0 HG23 VAL B 78 4.253 10.159 -7.231 1.00 0.00 H new ATOM 2789 N VAL B 79 8.877 9.682 -4.928 1.00 0.00 N ATOM 2790 CA VAL B 79 10.165 9.077 -4.680 1.00 0.00 C ATOM 2791 C VAL B 79 9.856 7.825 -3.854 1.00 0.00 C ATOM 2792 O VAL B 79 9.601 7.924 -2.650 1.00 0.00 O ATOM 2793 CB VAL B 79 11.048 10.095 -3.923 1.00 0.00 C ATOM 2794 CG1 VAL B 79 12.464 9.572 -3.651 1.00 0.00 C ATOM 2795 CG2 VAL B 79 11.189 11.430 -4.670 1.00 0.00 C ATOM 0 H VAL B 79 8.678 10.471 -4.312 1.00 0.00 H new ATOM 0 HA VAL B 79 10.714 8.804 -5.581 1.00 0.00 H new ATOM 0 HB VAL B 79 10.524 10.249 -2.980 1.00 0.00 H new ATOM 0 HG11 VAL B 79 13.036 10.331 -3.117 1.00 0.00 H new ATOM 0 HG12 VAL B 79 12.408 8.667 -3.045 1.00 0.00 H new ATOM 0 HG13 VAL B 79 12.956 9.345 -4.597 1.00 0.00 H new ATOM 0 HG21 VAL B 79 11.819 12.106 -4.092 1.00 0.00 H new ATOM 0 HG22 VAL B 79 11.644 11.255 -5.645 1.00 0.00 H new ATOM 0 HG23 VAL B 79 10.204 11.878 -4.804 1.00 0.00 H new ATOM 2805 N THR B 80 9.810 6.649 -4.482 1.00 0.00 N ATOM 2806 CA THR B 80 9.753 5.413 -3.707 1.00 0.00 C ATOM 2807 C THR B 80 11.098 5.359 -2.972 1.00 0.00 C ATOM 2808 O THR B 80 12.158 5.394 -3.605 1.00 0.00 O ATOM 2809 CB THR B 80 9.450 4.221 -4.616 1.00 0.00 C ATOM 2810 OG1 THR B 80 8.239 4.467 -5.307 1.00 0.00 O ATOM 2811 CG2 THR B 80 9.272 2.932 -3.817 1.00 0.00 C ATOM 0 H THR B 80 9.811 6.528 -5.495 1.00 0.00 H new ATOM 0 HA THR B 80 8.943 5.377 -2.978 1.00 0.00 H new ATOM 0 HB THR B 80 10.291 4.103 -5.300 1.00 0.00 H new ATOM 0 HG1 THR B 80 7.489 4.423 -4.678 1.00 0.00 H new ATOM 0 HG21 THR B 80 9.058 2.108 -4.498 1.00 0.00 H new ATOM 0 HG22 THR B 80 10.186 2.717 -3.264 1.00 0.00 H new ATOM 0 HG23 THR B 80 8.444 3.049 -3.118 1.00 0.00 H new ATOM 2819 N LEU B 81 11.062 5.306 -1.640 1.00 0.00 N ATOM 2820 CA LEU B 81 12.225 5.517 -0.788 1.00 0.00 C ATOM 2821 C LEU B 81 12.289 4.470 0.329 1.00 0.00 C ATOM 2822 O LEU B 81 12.345 4.816 1.509 1.00 0.00 O ATOM 2823 CB LEU B 81 12.121 6.967 -0.267 1.00 0.00 C ATOM 2824 CG LEU B 81 13.416 7.478 0.386 1.00 0.00 C ATOM 2825 CD1 LEU B 81 14.316 8.196 -0.625 1.00 0.00 C ATOM 2826 CD2 LEU B 81 13.104 8.400 1.557 1.00 0.00 C ATOM 0 H LEU B 81 10.208 5.112 -1.117 1.00 0.00 H new ATOM 0 HA LEU B 81 13.160 5.391 -1.334 1.00 0.00 H new ATOM 0 HB2 LEU B 81 11.857 7.624 -1.095 1.00 0.00 H new ATOM 0 HB3 LEU B 81 11.310 7.027 0.458 1.00 0.00 H new ATOM 0 HG LEU B 81 13.956 6.607 0.757 1.00 0.00 H new ATOM 0 HD11 LEU B 81 15.221 8.542 -0.125 1.00 0.00 H new ATOM 0 HD12 LEU B 81 14.585 7.507 -1.426 1.00 0.00 H new ATOM 0 HD13 LEU B 81 13.784 9.050 -1.044 1.00 0.00 H new ATOM 0 HD21 LEU B 81 14.035 8.749 2.003 1.00 0.00 H new ATOM 0 HD22 LEU B 81 12.528 9.255 1.203 1.00 0.00 H new ATOM 0 HD23 LEU B 81 12.525 7.857 2.304 1.00 0.00 H new ATOM 2838 N SER B 82 12.254 3.192 -0.037 1.00 0.00 N ATOM 2839 CA SER B 82 12.466 2.029 0.821 1.00 0.00 C ATOM 2840 C SER B 82 12.678 0.838 -0.131 1.00 0.00 C ATOM 2841 O SER B 82 12.839 1.039 -1.339 1.00 0.00 O ATOM 2842 CB SER B 82 11.246 1.824 1.735 1.00 0.00 C ATOM 2843 OG SER B 82 11.469 0.806 2.694 1.00 0.00 O ATOM 0 H SER B 82 12.065 2.923 -1.003 1.00 0.00 H new ATOM 0 HA SER B 82 13.327 2.148 1.479 1.00 0.00 H new ATOM 0 HB2 SER B 82 11.014 2.759 2.245 1.00 0.00 H new ATOM 0 HB3 SER B 82 10.377 1.567 1.129 1.00 0.00 H new ATOM 0 HG SER B 82 10.619 0.367 2.909 1.00 0.00 H new ATOM 2849 N GLY B 83 12.666 -0.392 0.384 1.00 0.00 N ATOM 2850 CA GLY B 83 12.828 -1.603 -0.405 1.00 0.00 C ATOM 2851 C GLY B 83 12.240 -2.814 0.309 1.00 0.00 C ATOM 2852 O GLY B 83 12.848 -3.885 0.287 1.00 0.00 O ATOM 0 H GLY B 83 12.541 -0.572 1.380 1.00 0.00 H new ATOM 0 HA2 GLY B 83 12.341 -1.477 -1.372 1.00 0.00 H new ATOM 0 HA3 GLY B 83 13.887 -1.773 -0.601 1.00 0.00 H new ATOM 2856 N ASP B 84 11.082 -2.656 0.960 1.00 0.00 N ATOM 2857 CA ASP B 84 10.368 -3.754 1.608 1.00 0.00 C ATOM 2858 C ASP B 84 8.888 -3.673 1.231 1.00 0.00 C ATOM 2859 O ASP B 84 8.264 -2.612 1.341 1.00 0.00 O ATOM 2860 CB ASP B 84 10.577 -3.728 3.125 1.00 0.00 C ATOM 2861 CG ASP B 84 9.871 -4.919 3.797 1.00 0.00 C ATOM 2862 OD1 ASP B 84 8.623 -4.950 3.837 1.00 0.00 O ATOM 2863 OD2 ASP B 84 10.573 -5.837 4.279 1.00 0.00 O ATOM 0 H ASP B 84 10.613 -1.755 1.051 1.00 0.00 H new ATOM 0 HA ASP B 84 10.766 -4.707 1.259 1.00 0.00 H new ATOM 0 HB2 ASP B 84 11.643 -3.758 3.350 1.00 0.00 H new ATOM 0 HB3 ASP B 84 10.191 -2.794 3.533 1.00 0.00 H new ATOM 2868 N ALA B 85 8.349 -4.794 0.742 1.00 0.00 N ATOM 2869 CA ALA B 85 7.032 -4.887 0.125 1.00 0.00 C ATOM 2870 C ALA B 85 5.851 -4.714 1.092 1.00 0.00 C ATOM 2871 O ALA B 85 4.713 -4.678 0.619 1.00 0.00 O ATOM 2872 CB ALA B 85 6.923 -6.231 -0.608 1.00 0.00 C ATOM 0 H ALA B 85 8.838 -5.689 0.768 1.00 0.00 H new ATOM 0 HA ALA B 85 6.955 -4.047 -0.566 1.00 0.00 H new ATOM 0 HB1 ALA B 85 5.941 -6.313 -1.074 1.00 0.00 H new ATOM 0 HB2 ALA B 85 7.695 -6.291 -1.375 1.00 0.00 H new ATOM 0 HB3 ALA B 85 7.055 -7.046 0.104 1.00 0.00 H new ATOM 2878 N ALA B 86 6.064 -4.604 2.412 1.00 0.00 N ATOM 2879 CA ALA B 86 4.964 -4.409 3.358 1.00 0.00 C ATOM 2880 C ALA B 86 4.202 -3.100 3.119 1.00 0.00 C ATOM 2881 O ALA B 86 3.132 -2.937 3.691 1.00 0.00 O ATOM 2882 CB ALA B 86 5.445 -4.476 4.819 1.00 0.00 C ATOM 0 H ALA B 86 6.987 -4.647 2.844 1.00 0.00 H new ATOM 0 HA ALA B 86 4.274 -5.233 3.179 1.00 0.00 H new ATOM 0 HB1 ALA B 86 4.598 -4.326 5.488 1.00 0.00 H new ATOM 0 HB2 ALA B 86 5.891 -5.452 5.011 1.00 0.00 H new ATOM 0 HB3 ALA B 86 6.187 -3.697 4.994 1.00 0.00 H new ATOM 2888 N ASP B 87 4.704 -2.165 2.302 1.00 0.00 N ATOM 2889 CA ASP B 87 4.163 -0.805 2.176 1.00 0.00 C ATOM 2890 C ASP B 87 2.778 -0.690 1.506 1.00 0.00 C ATOM 2891 O ASP B 87 2.396 0.396 1.080 1.00 0.00 O ATOM 2892 CB ASP B 87 5.173 0.115 1.474 1.00 0.00 C ATOM 2893 CG ASP B 87 4.919 1.591 1.847 1.00 0.00 C ATOM 2894 OD1 ASP B 87 4.554 1.851 3.023 1.00 0.00 O ATOM 2895 OD2 ASP B 87 5.165 2.465 0.987 1.00 0.00 O ATOM 0 H ASP B 87 5.510 -2.335 1.700 1.00 0.00 H new ATOM 0 HA ASP B 87 3.999 -0.483 3.204 1.00 0.00 H new ATOM 0 HB2 ASP B 87 6.187 -0.167 1.757 1.00 0.00 H new ATOM 0 HB3 ASP B 87 5.097 -0.010 0.394 1.00 0.00 H new ATOM 2900 N LYS B 88 2.016 -1.787 1.380 1.00 0.00 N ATOM 2901 CA LYS B 88 0.691 -1.859 0.736 1.00 0.00 C ATOM 2902 C LYS B 88 0.787 -1.803 -0.801 1.00 0.00 C ATOM 2903 O LYS B 88 -0.185 -1.434 -1.464 1.00 0.00 O ATOM 2904 CB LYS B 88 -0.260 -0.798 1.343 1.00 0.00 C ATOM 2905 CG LYS B 88 -1.727 -1.241 1.364 1.00 0.00 C ATOM 2906 CD LYS B 88 -2.648 -0.204 2.023 1.00 0.00 C ATOM 2907 CE LYS B 88 -2.443 0.004 3.535 1.00 0.00 C ATOM 2908 NZ LYS B 88 -3.053 -1.065 4.371 1.00 0.00 N ATOM 0 H LYS B 88 2.319 -2.692 1.741 1.00 0.00 H new ATOM 0 HA LYS B 88 0.252 -2.834 0.950 1.00 0.00 H new ATOM 0 HB2 LYS B 88 0.059 -0.574 2.361 1.00 0.00 H new ATOM 0 HB3 LYS B 88 -0.175 0.126 0.771 1.00 0.00 H new ATOM 0 HG2 LYS B 88 -2.062 -1.422 0.343 1.00 0.00 H new ATOM 0 HG3 LYS B 88 -1.809 -2.187 1.899 1.00 0.00 H new ATOM 0 HD2 LYS B 88 -2.506 0.753 1.520 1.00 0.00 H new ATOM 0 HD3 LYS B 88 -3.682 -0.503 1.853 1.00 0.00 H new ATOM 0 HE2 LYS B 88 -1.375 0.053 3.745 1.00 0.00 H new ATOM 0 HE3 LYS B 88 -2.869 0.966 3.822 1.00 0.00 H new ATOM 0 HZ1 LYS B 88 -2.764 -0.938 5.362 1.00 0.00 H new ATOM 0 HZ2 LYS B 88 -4.089 -1.010 4.303 1.00 0.00 H new ATOM 0 HZ3 LYS B 88 -2.732 -1.995 4.034 1.00 0.00 H new ATOM 2922 N CYS B 89 1.964 -2.161 -1.344 1.00 0.00 N ATOM 2923 CA CYS B 89 2.375 -2.083 -2.753 1.00 0.00 C ATOM 2924 C CYS B 89 1.675 -0.942 -3.519 1.00 0.00 C ATOM 2925 O CYS B 89 0.968 -1.222 -4.489 1.00 0.00 O ATOM 2926 CB CYS B 89 2.174 -3.442 -3.450 1.00 0.00 C ATOM 2927 SG CYS B 89 2.596 -4.930 -2.504 1.00 0.00 S ATOM 0 H CYS B 89 2.709 -2.542 -0.761 1.00 0.00 H new ATOM 0 HA CYS B 89 3.438 -1.843 -2.765 1.00 0.00 H new ATOM 0 HB2 CYS B 89 1.128 -3.517 -3.749 1.00 0.00 H new ATOM 0 HB3 CYS B 89 2.767 -3.444 -4.364 1.00 0.00 H new ATOM 2932 N PRO B 90 1.791 0.325 -3.071 1.00 0.00 N ATOM 2933 CA PRO B 90 0.987 1.420 -3.596 1.00 0.00 C ATOM 2934 C PRO B 90 1.075 1.513 -5.115 1.00 0.00 C ATOM 2935 O PRO B 90 2.183 1.463 -5.657 1.00 0.00 O ATOM 2936 CB PRO B 90 1.515 2.690 -2.926 1.00 0.00 C ATOM 2937 CG PRO B 90 2.166 2.175 -1.645 1.00 0.00 C ATOM 2938 CD PRO B 90 2.748 0.842 -2.106 1.00 0.00 C ATOM 0 HA PRO B 90 -0.070 1.266 -3.377 1.00 0.00 H new ATOM 0 HB2 PRO B 90 2.234 3.209 -3.560 1.00 0.00 H new ATOM 0 HB3 PRO B 90 0.711 3.395 -2.712 1.00 0.00 H new ATOM 0 HG2 PRO B 90 2.937 2.852 -1.277 1.00 0.00 H new ATOM 0 HG3 PRO B 90 1.442 2.049 -0.840 1.00 0.00 H new ATOM 0 HD2 PRO B 90 3.731 0.976 -2.558 1.00 0.00 H new ATOM 0 HD3 PRO B 90 2.873 0.156 -1.269 1.00 0.00 H new ATOM 2946 N MET B 91 -0.059 1.661 -5.809 1.00 0.00 N ATOM 2947 CA MET B 91 -0.041 1.638 -7.279 1.00 0.00 C ATOM 2948 C MET B 91 0.347 2.966 -7.950 1.00 0.00 C ATOM 2949 O MET B 91 0.497 2.963 -9.169 1.00 0.00 O ATOM 2950 CB MET B 91 -1.325 1.042 -7.853 1.00 0.00 C ATOM 2951 CG MET B 91 -2.580 1.636 -7.264 1.00 0.00 C ATOM 2952 SD MET B 91 -3.050 3.220 -7.972 1.00 0.00 S ATOM 2953 CE MET B 91 -4.691 3.079 -7.280 1.00 0.00 C ATOM 0 H MET B 91 -0.980 1.795 -5.391 1.00 0.00 H new ATOM 0 HA MET B 91 0.780 0.969 -7.536 1.00 0.00 H new ATOM 0 HB2 MET B 91 -1.334 1.191 -8.933 1.00 0.00 H new ATOM 0 HB3 MET B 91 -1.326 -0.034 -7.680 1.00 0.00 H new ATOM 0 HG2 MET B 91 -3.401 0.932 -7.401 1.00 0.00 H new ATOM 0 HG3 MET B 91 -2.441 1.758 -6.190 1.00 0.00 H new ATOM 0 HE1 MET B 91 -5.179 4.053 -7.300 1.00 0.00 H new ATOM 0 HE2 MET B 91 -5.274 2.369 -7.867 1.00 0.00 H new ATOM 0 HE3 MET B 91 -4.623 2.728 -6.250 1.00 0.00 H new ATOM 2963 N THR B 92 0.541 4.046 -7.174 1.00 0.00 N ATOM 2964 CA THR B 92 0.827 5.429 -7.601 1.00 0.00 C ATOM 2965 C THR B 92 -0.052 5.915 -8.776 1.00 0.00 C ATOM 2966 O THR B 92 0.201 5.552 -9.928 1.00 0.00 O ATOM 2967 CB THR B 92 2.330 5.658 -7.866 1.00 0.00 C ATOM 2968 OG1 THR B 92 2.895 4.649 -8.685 1.00 0.00 O ATOM 2969 CG2 THR B 92 3.123 5.712 -6.554 1.00 0.00 C ATOM 0 H THR B 92 0.499 3.971 -6.158 1.00 0.00 H new ATOM 0 HA THR B 92 0.548 6.055 -6.753 1.00 0.00 H new ATOM 0 HB THR B 92 2.397 6.614 -8.386 1.00 0.00 H new ATOM 0 HG1 THR B 92 2.242 4.374 -9.362 1.00 0.00 H new ATOM 0 HG21 THR B 92 4.178 5.874 -6.773 1.00 0.00 H new ATOM 0 HG22 THR B 92 2.751 6.530 -5.937 1.00 0.00 H new ATOM 0 HG23 THR B 92 3.004 4.770 -6.018 1.00 0.00 H new ATOM 2977 N PRO B 93 -1.081 6.749 -8.530 1.00 0.00 N ATOM 2978 CA PRO B 93 -2.032 7.112 -9.573 1.00 0.00 C ATOM 2979 C PRO B 93 -1.303 7.887 -10.694 1.00 0.00 C ATOM 2980 O PRO B 93 -0.387 8.663 -10.399 1.00 0.00 O ATOM 2981 CB PRO B 93 -3.129 7.908 -8.852 1.00 0.00 C ATOM 2982 CG PRO B 93 -2.412 8.534 -7.657 1.00 0.00 C ATOM 2983 CD PRO B 93 -1.381 7.464 -7.295 1.00 0.00 C ATOM 0 HA PRO B 93 -2.485 6.260 -10.081 1.00 0.00 H new ATOM 0 HB2 PRO B 93 -3.561 8.670 -9.501 1.00 0.00 H new ATOM 0 HB3 PRO B 93 -3.946 7.261 -8.532 1.00 0.00 H new ATOM 0 HG2 PRO B 93 -1.940 9.481 -7.917 1.00 0.00 H new ATOM 0 HG3 PRO B 93 -3.096 8.735 -6.832 1.00 0.00 H new ATOM 0 HD2 PRO B 93 -0.481 7.917 -6.879 1.00 0.00 H new ATOM 0 HD3 PRO B 93 -1.775 6.785 -6.539 1.00 0.00 H new ATOM 2991 N PRO B 94 -1.695 7.719 -11.974 1.00 0.00 N ATOM 2992 CA PRO B 94 -0.956 8.229 -13.135 1.00 0.00 C ATOM 2993 C PRO B 94 -0.873 9.761 -13.215 1.00 0.00 C ATOM 2994 O PRO B 94 -0.184 10.296 -14.085 1.00 0.00 O ATOM 2995 CB PRO B 94 -1.643 7.624 -14.368 1.00 0.00 C ATOM 2996 CG PRO B 94 -3.047 7.285 -13.875 1.00 0.00 C ATOM 2997 CD PRO B 94 -2.785 6.873 -12.431 1.00 0.00 C ATOM 0 HA PRO B 94 0.090 7.931 -13.060 1.00 0.00 H new ATOM 0 HB2 PRO B 94 -1.670 8.331 -15.197 1.00 0.00 H new ATOM 0 HB3 PRO B 94 -1.119 6.737 -14.723 1.00 0.00 H new ATOM 0 HG2 PRO B 94 -3.720 8.140 -13.940 1.00 0.00 H new ATOM 0 HG3 PRO B 94 -3.499 6.479 -14.454 1.00 0.00 H new ATOM 0 HD2 PRO B 94 -3.674 7.013 -11.816 1.00 0.00 H new ATOM 0 HD3 PRO B 94 -2.516 5.819 -12.367 1.00 0.00 H new ATOM 3005 N HIS B 95 -1.540 10.472 -12.303 1.00 0.00 N ATOM 3006 CA HIS B 95 -1.405 11.907 -12.102 1.00 0.00 C ATOM 3007 C HIS B 95 0.028 12.311 -11.698 1.00 0.00 C ATOM 3008 O HIS B 95 0.340 13.503 -11.726 1.00 0.00 O ATOM 3009 CB HIS B 95 -2.417 12.358 -11.029 1.00 0.00 C ATOM 3010 CG HIS B 95 -3.819 11.810 -11.207 1.00 0.00 C ATOM 3011 ND1 HIS B 95 -4.539 11.737 -12.381 1.00 0.00 N ATOM 3012 CD2 HIS B 95 -4.597 11.243 -10.231 1.00 0.00 C ATOM 3013 CE1 HIS B 95 -5.710 11.133 -12.117 1.00 0.00 C ATOM 3014 NE2 HIS B 95 -5.793 10.808 -10.813 1.00 0.00 N ATOM 0 H HIS B 95 -2.211 10.045 -11.665 1.00 0.00 H new ATOM 0 HA HIS B 95 -1.613 12.406 -13.049 1.00 0.00 H new ATOM 0 HB2 HIS B 95 -2.046 12.056 -10.050 1.00 0.00 H new ATOM 0 HB3 HIS B 95 -2.465 13.447 -11.030 1.00 0.00 H new ATOM 0 HD2 HIS B 95 -4.332 11.148 -9.188 1.00 0.00 H new ATOM 0 HE1 HIS B 95 -6.479 10.936 -12.850 1.00 0.00 H new ATOM 0 HE2 HIS B 95 -6.569 10.340 -10.345 1.00 0.00 H new ATOM 3022 N VAL B 96 0.899 11.360 -11.325 1.00 0.00 N ATOM 3023 CA VAL B 96 2.212 11.631 -10.738 1.00 0.00 C ATOM 3024 C VAL B 96 3.290 10.774 -11.413 1.00 0.00 C ATOM 3025 O VAL B 96 3.030 9.639 -11.825 1.00 0.00 O ATOM 3026 CB VAL B 96 2.184 11.354 -9.215 1.00 0.00 C ATOM 3027 CG1 VAL B 96 3.287 12.161 -8.521 1.00 0.00 C ATOM 3028 CG2 VAL B 96 0.859 11.704 -8.523 1.00 0.00 C ATOM 0 H VAL B 96 0.703 10.364 -11.427 1.00 0.00 H new ATOM 0 HA VAL B 96 2.454 12.681 -10.900 1.00 0.00 H new ATOM 0 HB VAL B 96 2.329 10.278 -9.123 1.00 0.00 H new ATOM 0 HG11 VAL B 96 3.263 11.963 -7.449 1.00 0.00 H new ATOM 0 HG12 VAL B 96 4.258 11.870 -8.922 1.00 0.00 H new ATOM 0 HG13 VAL B 96 3.125 13.224 -8.697 1.00 0.00 H new ATOM 0 HG21 VAL B 96 0.933 11.477 -7.460 1.00 0.00 H new ATOM 0 HG22 VAL B 96 0.650 12.766 -8.653 1.00 0.00 H new ATOM 0 HG23 VAL B 96 0.052 11.118 -8.964 1.00 0.00 H new ATOM 3038 N LYS B 97 4.508 11.317 -11.514 1.00 0.00 N ATOM 3039 CA LYS B 97 5.706 10.582 -11.923 1.00 0.00 C ATOM 3040 C LYS B 97 6.181 9.744 -10.731 1.00 0.00 C ATOM 3041 O LYS B 97 5.899 10.097 -9.586 1.00 0.00 O ATOM 3042 CB LYS B 97 6.735 11.627 -12.392 1.00 0.00 C ATOM 3043 CG LYS B 97 7.928 11.040 -13.165 1.00 0.00 C ATOM 3044 CD LYS B 97 9.224 11.050 -12.359 1.00 0.00 C ATOM 3045 CE LYS B 97 9.774 12.461 -12.053 1.00 0.00 C ATOM 3046 NZ LYS B 97 10.158 13.220 -13.269 1.00 0.00 N ATOM 0 H LYS B 97 4.690 12.299 -11.309 1.00 0.00 H new ATOM 0 HA LYS B 97 5.531 9.889 -12.746 1.00 0.00 H new ATOM 0 HB2 LYS B 97 6.231 12.357 -13.025 1.00 0.00 H new ATOM 0 HB3 LYS B 97 7.111 12.165 -11.522 1.00 0.00 H new ATOM 0 HG2 LYS B 97 7.696 10.016 -13.457 1.00 0.00 H new ATOM 0 HG3 LYS B 97 8.074 11.608 -14.084 1.00 0.00 H new ATOM 0 HD2 LYS B 97 9.056 10.527 -11.418 1.00 0.00 H new ATOM 0 HD3 LYS B 97 9.982 10.488 -12.905 1.00 0.00 H new ATOM 0 HE2 LYS B 97 9.020 13.026 -11.504 1.00 0.00 H new ATOM 0 HE3 LYS B 97 10.642 12.371 -11.401 1.00 0.00 H new ATOM 0 HZ1 LYS B 97 10.627 14.106 -12.992 1.00 0.00 H new ATOM 0 HZ2 LYS B 97 10.810 12.648 -13.844 1.00 0.00 H new ATOM 0 HZ3 LYS B 97 9.307 13.438 -13.825 1.00 0.00 H new ATOM 3060 N ARG B 98 6.952 8.679 -10.945 1.00 0.00 N ATOM 3061 CA ARG B 98 7.575 7.925 -9.854 1.00 0.00 C ATOM 3062 C ARG B 98 8.937 7.427 -10.308 1.00 0.00 C ATOM 3063 O ARG B 98 9.113 7.086 -11.478 1.00 0.00 O ATOM 3064 CB ARG B 98 6.684 6.730 -9.437 1.00 0.00 C ATOM 3065 CG ARG B 98 7.203 5.947 -8.203 1.00 0.00 C ATOM 3066 CD ARG B 98 7.071 4.427 -8.359 1.00 0.00 C ATOM 3067 NE ARG B 98 5.706 3.946 -8.107 1.00 0.00 N ATOM 3068 CZ ARG B 98 5.328 3.067 -7.170 1.00 0.00 C ATOM 3069 NH1 ARG B 98 6.133 2.703 -6.175 1.00 0.00 N ATOM 3070 NH2 ARG B 98 4.107 2.568 -7.260 1.00 0.00 N ATOM 0 H ARG B 98 7.163 8.314 -11.874 1.00 0.00 H new ATOM 0 HA ARG B 98 7.692 8.579 -8.990 1.00 0.00 H new ATOM 0 HB2 ARG B 98 5.680 7.097 -9.224 1.00 0.00 H new ATOM 0 HB3 ARG B 98 6.600 6.043 -10.279 1.00 0.00 H new ATOM 0 HG2 ARG B 98 8.250 6.200 -8.033 1.00 0.00 H new ATOM 0 HG3 ARG B 98 6.651 6.265 -7.319 1.00 0.00 H new ATOM 0 HD2 ARG B 98 7.371 4.142 -9.367 1.00 0.00 H new ATOM 0 HD3 ARG B 98 7.758 3.935 -7.671 1.00 0.00 H new ATOM 0 HE ARG B 98 4.971 4.320 -8.707 1.00 0.00 H new ATOM 0 HH11 ARG B 98 7.072 3.096 -6.109 1.00 0.00 H new ATOM 0 HH12 ARG B 98 5.811 2.031 -5.479 1.00 0.00 H new ATOM 0 HH21 ARG B 98 3.493 2.856 -8.022 1.00 0.00 H new ATOM 0 HH22 ARG B 98 3.779 1.895 -6.567 1.00 0.00 H new ATOM 3084 N GLU B 99 9.881 7.371 -9.376 1.00 0.00 N ATOM 3085 CA GLU B 99 11.160 6.707 -9.534 1.00 0.00 C ATOM 3086 C GLU B 99 11.540 6.199 -8.138 1.00 0.00 C ATOM 3087 O GLU B 99 11.114 6.764 -7.125 1.00 0.00 O ATOM 3088 CB GLU B 99 12.204 7.648 -10.163 1.00 0.00 C ATOM 3089 CG GLU B 99 13.554 6.966 -10.457 1.00 0.00 C ATOM 3090 CD GLU B 99 13.420 5.697 -11.319 1.00 0.00 C ATOM 3091 OE1 GLU B 99 13.150 4.614 -10.746 1.00 0.00 O ATOM 3092 OE2 GLU B 99 13.585 5.773 -12.558 1.00 0.00 O ATOM 0 H GLU B 99 9.769 7.803 -8.459 1.00 0.00 H new ATOM 0 HA GLU B 99 11.110 5.868 -10.228 1.00 0.00 H new ATOM 0 HB2 GLU B 99 11.802 8.054 -11.091 1.00 0.00 H new ATOM 0 HB3 GLU B 99 12.371 8.491 -9.493 1.00 0.00 H new ATOM 0 HG2 GLU B 99 14.208 7.675 -10.965 1.00 0.00 H new ATOM 0 HG3 GLU B 99 14.036 6.707 -9.514 1.00 0.00 H new ATOM 3099 N HIS B 100 12.302 5.111 -8.086 1.00 0.00 N ATOM 3100 CA HIS B 100 12.678 4.417 -6.866 1.00 0.00 C ATOM 3101 C HIS B 100 14.159 4.636 -6.556 1.00 0.00 C ATOM 3102 O HIS B 100 15.007 4.637 -7.452 1.00 0.00 O ATOM 3103 CB HIS B 100 12.309 2.926 -6.965 1.00 0.00 C ATOM 3104 CG HIS B 100 13.176 2.075 -7.870 1.00 0.00 C ATOM 3105 ND1 HIS B 100 13.520 2.315 -9.187 1.00 0.00 N ATOM 3106 CD2 HIS B 100 13.762 0.886 -7.521 1.00 0.00 C ATOM 3107 CE1 HIS B 100 14.295 1.303 -9.609 1.00 0.00 C ATOM 3108 NE2 HIS B 100 14.470 0.397 -8.628 1.00 0.00 N ATOM 0 H HIS B 100 12.687 4.675 -8.924 1.00 0.00 H new ATOM 0 HA HIS B 100 12.117 4.832 -6.029 1.00 0.00 H new ATOM 0 HB2 HIS B 100 12.340 2.499 -5.962 1.00 0.00 H new ATOM 0 HB3 HIS B 100 11.278 2.852 -7.311 1.00 0.00 H new ATOM 0 HD1 HIS B 100 13.234 3.122 -9.742 1.00 0.00 H new ATOM 0 HD2 HIS B 100 13.690 0.407 -6.556 1.00 0.00 H new ATOM 0 HE1 HIS B 100 14.720 1.226 -10.599 1.00 0.00 H new ATOM 3116 N TRP B 101 14.454 4.817 -5.266 1.00 0.00 N ATOM 3117 CA TRP B 101 15.758 5.244 -4.762 1.00 0.00 C ATOM 3118 C TRP B 101 16.083 4.561 -3.426 1.00 0.00 C ATOM 3119 O TRP B 101 16.875 5.081 -2.635 1.00 0.00 O ATOM 3120 CB TRP B 101 15.755 6.777 -4.644 1.00 0.00 C ATOM 3121 CG TRP B 101 15.531 7.514 -5.931 1.00 0.00 C ATOM 3122 CD1 TRP B 101 14.347 7.992 -6.377 1.00 0.00 C ATOM 3123 CD2 TRP B 101 16.494 7.803 -6.990 1.00 0.00 C ATOM 3124 NE1 TRP B 101 14.526 8.637 -7.582 1.00 0.00 N ATOM 3125 CE2 TRP B 101 15.824 8.520 -8.022 1.00 0.00 C ATOM 3126 CE3 TRP B 101 17.857 7.503 -7.204 1.00 0.00 C ATOM 3127 CZ2 TRP B 101 16.470 8.934 -9.192 1.00 0.00 C ATOM 3128 CZ3 TRP B 101 18.520 7.915 -8.379 1.00 0.00 C ATOM 3129 CH2 TRP B 101 17.831 8.634 -9.371 1.00 0.00 C ATOM 0 H TRP B 101 13.771 4.666 -4.524 1.00 0.00 H new ATOM 0 HA TRP B 101 16.544 4.945 -5.455 1.00 0.00 H new ATOM 0 HB2 TRP B 101 14.980 7.070 -3.936 1.00 0.00 H new ATOM 0 HB3 TRP B 101 16.708 7.095 -4.222 1.00 0.00 H new ATOM 0 HD1 TRP B 101 13.402 7.884 -5.865 1.00 0.00 H new ATOM 0 HE1 TRP B 101 13.791 9.136 -8.083 1.00 0.00 H new ATOM 0 HE3 TRP B 101 18.402 6.948 -6.455 1.00 0.00 H new ATOM 0 HZ2 TRP B 101 15.928 9.479 -9.950 1.00 0.00 H new ATOM 0 HZ3 TRP B 101 19.564 7.676 -8.517 1.00 0.00 H new ATOM 0 HH2 TRP B 101 18.345 8.954 -10.266 1.00 0.00 H new ATOM 3140 N GLY B 102 15.461 3.413 -3.142 1.00 0.00 N ATOM 3141 CA GLY B 102 15.700 2.631 -1.941 1.00 0.00 C ATOM 3142 C GLY B 102 15.766 1.142 -2.264 1.00 0.00 C ATOM 3143 O GLY B 102 15.390 0.709 -3.357 1.00 0.00 O ATOM 0 H GLY B 102 14.763 2.998 -3.759 1.00 0.00 H new ATOM 0 HA2 GLY B 102 16.634 2.948 -1.476 1.00 0.00 H new ATOM 0 HA3 GLY B 102 14.905 2.815 -1.218 1.00 0.00 H new ATOM 3147 N PHE B 103 16.288 0.386 -1.296 1.00 0.00 N ATOM 3148 CA PHE B 103 16.624 -1.037 -1.402 1.00 0.00 C ATOM 3149 C PHE B 103 16.591 -1.703 -0.020 1.00 0.00 C ATOM 3150 O PHE B 103 16.266 -2.883 0.105 1.00 0.00 O ATOM 3151 CB PHE B 103 18.034 -1.215 -1.999 1.00 0.00 C ATOM 3152 CG PHE B 103 18.252 -0.603 -3.373 1.00 0.00 C ATOM 3153 CD1 PHE B 103 17.801 -1.274 -4.527 1.00 0.00 C ATOM 3154 CD2 PHE B 103 18.896 0.646 -3.499 1.00 0.00 C ATOM 3155 CE1 PHE B 103 17.985 -0.696 -5.797 1.00 0.00 C ATOM 3156 CE2 PHE B 103 19.077 1.223 -4.769 1.00 0.00 C ATOM 3157 CZ PHE B 103 18.620 0.553 -5.919 1.00 0.00 C ATOM 0 H PHE B 103 16.498 0.766 -0.373 1.00 0.00 H new ATOM 0 HA PHE B 103 15.886 -1.505 -2.053 1.00 0.00 H new ATOM 0 HB2 PHE B 103 18.758 -0.780 -1.309 1.00 0.00 H new ATOM 0 HB3 PHE B 103 18.251 -2.282 -2.058 1.00 0.00 H new ATOM 0 HD1 PHE B 103 17.313 -2.233 -4.437 1.00 0.00 H new ATOM 0 HD2 PHE B 103 19.251 1.160 -2.618 1.00 0.00 H new ATOM 0 HE1 PHE B 103 17.638 -1.213 -6.680 1.00 0.00 H new ATOM 0 HE2 PHE B 103 19.567 2.181 -4.862 1.00 0.00 H new ATOM 0 HZ PHE B 103 18.757 0.997 -6.894 1.00 0.00 H new ATOM 3167 N ASP B 104 16.903 -0.923 1.013 1.00 0.00 N ATOM 3168 CA ASP B 104 16.895 -1.267 2.431 1.00 0.00 C ATOM 3169 C ASP B 104 16.656 0.024 3.212 1.00 0.00 C ATOM 3170 O ASP B 104 16.764 1.118 2.651 1.00 0.00 O ATOM 3171 CB ASP B 104 18.220 -1.916 2.861 1.00 0.00 C ATOM 3172 CG ASP B 104 19.406 -0.939 2.848 1.00 0.00 C ATOM 3173 OD1 ASP B 104 19.930 -0.634 1.755 1.00 0.00 O ATOM 3174 OD2 ASP B 104 19.875 -0.523 3.929 1.00 0.00 O ATOM 0 H ASP B 104 17.191 0.044 0.866 1.00 0.00 H new ATOM 0 HA ASP B 104 16.109 -1.995 2.631 1.00 0.00 H new ATOM 0 HB2 ASP B 104 18.107 -2.326 3.864 1.00 0.00 H new ATOM 0 HB3 ASP B 104 18.439 -2.752 2.197 1.00 0.00 H new ATOM 3179 N ASP B 105 16.308 -0.096 4.491 1.00 0.00 N ATOM 3180 CA ASP B 105 15.863 0.999 5.352 1.00 0.00 C ATOM 3181 C ASP B 105 16.485 0.802 6.746 1.00 0.00 C ATOM 3182 O ASP B 105 16.586 -0.336 7.211 1.00 0.00 O ATOM 3183 CB ASP B 105 14.321 1.012 5.350 1.00 0.00 C ATOM 3184 CG ASP B 105 13.682 1.898 6.423 1.00 0.00 C ATOM 3185 OD1 ASP B 105 13.938 1.669 7.622 1.00 0.00 O ATOM 3186 OD2 ASP B 105 12.809 2.730 6.101 1.00 0.00 O ATOM 0 H ASP B 105 16.329 -0.993 4.976 1.00 0.00 H new ATOM 0 HA ASP B 105 16.191 1.976 4.997 1.00 0.00 H new ATOM 0 HB2 ASP B 105 13.976 1.346 4.371 1.00 0.00 H new ATOM 0 HB3 ASP B 105 13.963 -0.009 5.483 1.00 0.00 H new ATOM 3191 N PRO B 106 16.955 1.871 7.416 1.00 0.00 N ATOM 3192 CA PRO B 106 17.744 1.743 8.628 1.00 0.00 C ATOM 3193 C PRO B 106 16.909 1.497 9.883 1.00 0.00 C ATOM 3194 O PRO B 106 17.441 0.976 10.861 1.00 0.00 O ATOM 3195 CB PRO B 106 18.549 3.034 8.707 1.00 0.00 C ATOM 3196 CG PRO B 106 17.624 4.070 8.082 1.00 0.00 C ATOM 3197 CD PRO B 106 16.861 3.269 7.027 1.00 0.00 C ATOM 0 HA PRO B 106 18.383 0.861 8.584 1.00 0.00 H new ATOM 0 HB2 PRO B 106 18.799 3.289 9.737 1.00 0.00 H new ATOM 0 HB3 PRO B 106 19.489 2.955 8.161 1.00 0.00 H new ATOM 0 HG2 PRO B 106 16.951 4.506 8.820 1.00 0.00 H new ATOM 0 HG3 PRO B 106 18.184 4.892 7.636 1.00 0.00 H new ATOM 0 HD2 PRO B 106 15.820 3.588 6.977 1.00 0.00 H new ATOM 0 HD3 PRO B 106 17.290 3.425 6.037 1.00 0.00 H new ATOM 3205 N ALA B 107 15.601 1.772 9.865 1.00 0.00 N ATOM 3206 CA ALA B 107 14.702 1.361 10.928 1.00 0.00 C ATOM 3207 C ALA B 107 14.526 -0.171 10.930 1.00 0.00 C ATOM 3208 O ALA B 107 13.800 -0.700 11.772 1.00 0.00 O ATOM 3209 CB ALA B 107 13.355 2.081 10.796 1.00 0.00 C ATOM 0 H ALA B 107 15.144 2.285 9.111 1.00 0.00 H new ATOM 0 HA ALA B 107 15.140 1.643 11.886 1.00 0.00 H new ATOM 0 HB1 ALA B 107 12.692 1.762 11.600 1.00 0.00 H new ATOM 0 HB2 ALA B 107 13.510 3.158 10.859 1.00 0.00 H new ATOM 0 HB3 ALA B 107 12.904 1.835 9.835 1.00 0.00 H new ATOM 3215 N ARG B 108 15.181 -0.888 10.003 1.00 0.00 N ATOM 3216 CA ARG B 108 15.146 -2.352 9.894 1.00 0.00 C ATOM 3217 C ARG B 108 16.530 -2.954 10.149 1.00 0.00 C ATOM 3218 O ARG B 108 16.752 -4.128 9.844 1.00 0.00 O ATOM 3219 CB ARG B 108 14.671 -2.820 8.509 1.00 0.00 C ATOM 3220 CG ARG B 108 13.651 -1.952 7.752 1.00 0.00 C ATOM 3221 CD ARG B 108 12.328 -1.605 8.458 1.00 0.00 C ATOM 3222 NE ARG B 108 11.939 -0.226 8.104 1.00 0.00 N ATOM 3223 CZ ARG B 108 10.725 0.242 7.801 1.00 0.00 C ATOM 3224 NH1 ARG B 108 9.631 -0.490 7.985 1.00 0.00 N ATOM 3225 NH2 ARG B 108 10.605 1.464 7.297 1.00 0.00 N ATOM 0 H ARG B 108 15.765 -0.452 9.290 1.00 0.00 H new ATOM 0 HA ARG B 108 14.438 -2.694 10.649 1.00 0.00 H new ATOM 0 HB2 ARG B 108 15.551 -2.927 7.875 1.00 0.00 H new ATOM 0 HB3 ARG B 108 14.239 -3.814 8.625 1.00 0.00 H new ATOM 0 HG2 ARG B 108 14.142 -1.016 7.486 1.00 0.00 H new ATOM 0 HG3 ARG B 108 13.408 -2.461 6.819 1.00 0.00 H new ATOM 0 HD2 ARG B 108 11.547 -2.304 8.159 1.00 0.00 H new ATOM 0 HD3 ARG B 108 12.442 -1.698 9.538 1.00 0.00 H new ATOM 0 HE ARG B 108 12.695 0.458 8.089 1.00 0.00 H new ATOM 0 HH11 ARG B 108 9.707 -1.433 8.366 1.00 0.00 H new ATOM 0 HH12 ARG B 108 8.716 -0.109 7.745 1.00 0.00 H new ATOM 0 HH21 ARG B 108 11.435 2.036 7.144 1.00 0.00 H new ATOM 0 HH22 ARG B 108 9.683 1.831 7.062 1.00 0.00 H new ATOM 3239 N ALA B 109 17.472 -2.143 10.643 1.00 0.00 N ATOM 3240 CA ALA B 109 18.801 -2.579 11.022 1.00 0.00 C ATOM 3241 C ALA B 109 18.730 -3.806 11.917 1.00 0.00 C ATOM 3242 O ALA B 109 17.716 -4.056 12.577 1.00 0.00 O ATOM 3243 CB ALA B 109 19.519 -1.461 11.769 1.00 0.00 C ATOM 0 H ALA B 109 17.318 -1.145 10.790 1.00 0.00 H new ATOM 0 HA ALA B 109 19.349 -2.832 10.114 1.00 0.00 H new ATOM 0 HB1 ALA B 109 20.517 -1.795 12.051 1.00 0.00 H new ATOM 0 HB2 ALA B 109 19.598 -0.585 11.125 1.00 0.00 H new ATOM 0 HB3 ALA B 109 18.956 -1.202 12.666 1.00 0.00 H new ATOM 3249 N GLN B 110 19.849 -4.526 11.979 1.00 0.00 N ATOM 3250 CA GLN B 110 19.901 -5.831 12.620 1.00 0.00 C ATOM 3251 C GLN B 110 19.431 -5.738 14.070 1.00 0.00 C ATOM 3252 O GLN B 110 18.801 -6.672 14.571 1.00 0.00 O ATOM 3253 CB GLN B 110 21.325 -6.411 12.541 1.00 0.00 C ATOM 3254 CG GLN B 110 21.373 -7.890 12.969 1.00 0.00 C ATOM 3255 CD GLN B 110 21.987 -8.109 14.354 1.00 0.00 C ATOM 3256 OE1 GLN B 110 23.183 -8.353 14.491 1.00 0.00 O ATOM 3257 NE2 GLN B 110 21.188 -8.043 15.408 1.00 0.00 N ATOM 0 H GLN B 110 20.739 -4.219 11.587 1.00 0.00 H new ATOM 0 HA GLN B 110 19.227 -6.504 12.090 1.00 0.00 H new ATOM 0 HB2 GLN B 110 21.698 -6.317 11.521 1.00 0.00 H new ATOM 0 HB3 GLN B 110 21.989 -5.828 13.179 1.00 0.00 H new ATOM 0 HG2 GLN B 110 20.361 -8.294 12.962 1.00 0.00 H new ATOM 0 HG3 GLN B 110 21.947 -8.454 12.233 1.00 0.00 H new ATOM 0 HE21 GLN B 110 20.196 -7.840 15.284 1.00 0.00 H new ATOM 0 HE22 GLN B 110 21.564 -8.195 16.344 1.00 0.00 H new ATOM 3266 N GLY B 111 19.758 -4.627 14.736 1.00 0.00 N ATOM 3267 CA GLY B 111 19.187 -4.290 16.026 1.00 0.00 C ATOM 3268 C GLY B 111 20.177 -3.893 17.099 1.00 0.00 C ATOM 3269 O GLY B 111 19.781 -3.326 18.120 1.00 0.00 O ATOM 0 H GLY B 111 20.428 -3.941 14.388 1.00 0.00 H new ATOM 0 HA2 GLY B 111 18.482 -3.471 15.887 1.00 0.00 H new ATOM 0 HA3 GLY B 111 18.615 -5.146 16.384 1.00 0.00 H new ATOM 3273 N THR B 112 21.448 -4.197 16.880 1.00 0.00 N ATOM 3274 CA THR B 112 22.510 -3.789 17.781 1.00 0.00 C ATOM 3275 C THR B 112 22.684 -2.280 17.668 1.00 0.00 C ATOM 3276 O THR B 112 22.226 -1.650 16.708 1.00 0.00 O ATOM 3277 CB THR B 112 23.812 -4.533 17.463 1.00 0.00 C ATOM 3278 OG1 THR B 112 24.270 -4.174 16.187 1.00 0.00 O ATOM 3279 CG2 THR B 112 23.598 -6.036 17.441 1.00 0.00 C ATOM 0 H THR B 112 21.769 -4.733 16.074 1.00 0.00 H new ATOM 0 HA THR B 112 22.246 -4.044 18.807 1.00 0.00 H new ATOM 0 HB THR B 112 24.530 -4.264 18.238 1.00 0.00 H new ATOM 0 HG1 THR B 112 24.893 -4.856 15.859 1.00 0.00 H new ATOM 0 HG21 THR B 112 24.540 -6.534 17.213 1.00 0.00 H new ATOM 0 HG22 THR B 112 23.239 -6.367 18.416 1.00 0.00 H new ATOM 0 HG23 THR B 112 22.861 -6.287 16.679 1.00 0.00 H new ATOM 3287 N GLU B 113 23.390 -1.701 18.632 1.00 0.00 N ATOM 3288 CA GLU B 113 23.641 -0.274 18.637 1.00 0.00 C ATOM 3289 C GLU B 113 24.462 0.122 17.410 1.00 0.00 C ATOM 3290 O GLU B 113 24.181 1.120 16.743 1.00 0.00 O ATOM 3291 CB GLU B 113 24.422 0.090 19.906 1.00 0.00 C ATOM 3292 CG GLU B 113 23.628 -0.239 21.175 1.00 0.00 C ATOM 3293 CD GLU B 113 24.358 0.237 22.444 1.00 0.00 C ATOM 3294 OE1 GLU B 113 25.160 -0.534 23.018 1.00 0.00 O ATOM 3295 OE2 GLU B 113 24.125 1.382 22.895 1.00 0.00 O ATOM 0 H GLU B 113 23.798 -2.204 19.420 1.00 0.00 H new ATOM 0 HA GLU B 113 22.690 0.258 18.614 1.00 0.00 H new ATOM 0 HB2 GLU B 113 25.368 -0.451 19.918 1.00 0.00 H new ATOM 0 HB3 GLU B 113 24.663 1.153 19.893 1.00 0.00 H new ATOM 0 HG2 GLU B 113 22.646 0.232 21.122 1.00 0.00 H new ATOM 0 HG3 GLU B 113 23.463 -1.315 21.232 1.00 0.00 H new ATOM 3302 N GLU B 114 25.469 -0.699 17.111 1.00 0.00 N ATOM 3303 CA GLU B 114 26.349 -0.533 15.986 1.00 0.00 C ATOM 3304 C GLU B 114 25.570 -0.740 14.703 1.00 0.00 C ATOM 3305 O GLU B 114 25.750 0.074 13.811 1.00 0.00 O ATOM 3306 CB GLU B 114 27.570 -1.465 16.070 1.00 0.00 C ATOM 3307 CG GLU B 114 27.259 -2.905 16.486 1.00 0.00 C ATOM 3308 CD GLU B 114 28.544 -3.731 16.675 1.00 0.00 C ATOM 3309 OE1 GLU B 114 29.096 -4.257 15.680 1.00 0.00 O ATOM 3310 OE2 GLU B 114 29.017 -3.874 17.826 1.00 0.00 O ATOM 0 H GLU B 114 25.690 -1.521 17.673 1.00 0.00 H new ATOM 0 HA GLU B 114 26.743 0.483 15.998 1.00 0.00 H new ATOM 0 HB2 GLU B 114 28.062 -1.482 15.098 1.00 0.00 H new ATOM 0 HB3 GLU B 114 28.281 -1.043 16.780 1.00 0.00 H new ATOM 0 HG2 GLU B 114 26.689 -2.901 17.415 1.00 0.00 H new ATOM 0 HG3 GLU B 114 26.632 -3.375 15.729 1.00 0.00 H new ATOM 3317 N GLU B 115 24.691 -1.744 14.578 1.00 0.00 N ATOM 3318 CA GLU B 115 24.065 -2.008 13.292 1.00 0.00 C ATOM 3319 C GLU B 115 23.001 -0.950 13.019 1.00 0.00 C ATOM 3320 O GLU B 115 22.875 -0.497 11.886 1.00 0.00 O ATOM 3321 CB GLU B 115 23.526 -3.439 13.224 1.00 0.00 C ATOM 3322 CG GLU B 115 24.686 -4.453 13.154 1.00 0.00 C ATOM 3323 CD GLU B 115 25.216 -4.636 11.720 1.00 0.00 C ATOM 3324 OE1 GLU B 115 26.096 -3.861 11.285 1.00 0.00 O ATOM 3325 OE2 GLU B 115 24.776 -5.579 11.023 1.00 0.00 O ATOM 0 H GLU B 115 24.408 -2.367 15.334 1.00 0.00 H new ATOM 0 HA GLU B 115 24.809 -1.936 12.498 1.00 0.00 H new ATOM 0 HB2 GLU B 115 22.910 -3.643 14.099 1.00 0.00 H new ATOM 0 HB3 GLU B 115 22.885 -3.551 12.350 1.00 0.00 H new ATOM 0 HG2 GLU B 115 25.498 -4.118 13.799 1.00 0.00 H new ATOM 0 HG3 GLU B 115 24.349 -5.415 13.540 1.00 0.00 H new ATOM 3332 N LYS B 116 22.285 -0.481 14.045 1.00 0.00 N ATOM 3333 CA LYS B 116 21.376 0.654 13.919 1.00 0.00 C ATOM 3334 C LYS B 116 22.112 1.873 13.408 1.00 0.00 C ATOM 3335 O LYS B 116 21.695 2.456 12.404 1.00 0.00 O ATOM 3336 CB LYS B 116 20.701 0.965 15.268 1.00 0.00 C ATOM 3337 CG LYS B 116 19.564 0.013 15.641 1.00 0.00 C ATOM 3338 CD LYS B 116 18.248 0.497 15.006 1.00 0.00 C ATOM 3339 CE LYS B 116 17.100 -0.488 15.235 1.00 0.00 C ATOM 3340 NZ LYS B 116 16.644 -0.540 16.649 1.00 0.00 N ATOM 0 H LYS B 116 22.321 -0.879 14.983 1.00 0.00 H new ATOM 0 HA LYS B 116 20.602 0.389 13.199 1.00 0.00 H new ATOM 0 HB2 LYS B 116 21.456 0.935 16.054 1.00 0.00 H new ATOM 0 HB3 LYS B 116 20.312 1.983 15.239 1.00 0.00 H new ATOM 0 HG2 LYS B 116 19.795 -0.995 15.298 1.00 0.00 H new ATOM 0 HG3 LYS B 116 19.459 -0.036 16.725 1.00 0.00 H new ATOM 0 HD2 LYS B 116 17.980 1.468 15.423 1.00 0.00 H new ATOM 0 HD3 LYS B 116 18.394 0.640 13.935 1.00 0.00 H new ATOM 0 HE2 LYS B 116 16.259 -0.210 14.599 1.00 0.00 H new ATOM 0 HE3 LYS B 116 17.418 -1.484 14.926 1.00 0.00 H new ATOM 0 HZ1 LYS B 116 15.866 -1.224 16.738 1.00 0.00 H new ATOM 0 HZ2 LYS B 116 17.434 -0.833 17.258 1.00 0.00 H new ATOM 0 HZ3 LYS B 116 16.312 0.401 16.942 1.00 0.00 H new ATOM 3354 N TRP B 117 23.197 2.252 14.080 1.00 0.00 N ATOM 3355 CA TRP B 117 23.936 3.430 13.671 1.00 0.00 C ATOM 3356 C TRP B 117 24.502 3.221 12.271 1.00 0.00 C ATOM 3357 O TRP B 117 24.371 4.080 11.407 1.00 0.00 O ATOM 3358 CB TRP B 117 25.017 3.802 14.690 1.00 0.00 C ATOM 3359 CG TRP B 117 25.643 5.148 14.491 1.00 0.00 C ATOM 3360 CD1 TRP B 117 25.282 6.065 13.563 1.00 0.00 C ATOM 3361 CD2 TRP B 117 26.724 5.763 15.256 1.00 0.00 C ATOM 3362 NE1 TRP B 117 26.066 7.188 13.690 1.00 0.00 N ATOM 3363 CE2 TRP B 117 26.955 7.068 14.730 1.00 0.00 C ATOM 3364 CE3 TRP B 117 27.524 5.363 16.348 1.00 0.00 C ATOM 3365 CZ2 TRP B 117 27.916 7.932 15.262 1.00 0.00 C ATOM 3366 CZ3 TRP B 117 28.501 6.223 16.889 1.00 0.00 C ATOM 3367 CH2 TRP B 117 28.698 7.508 16.350 1.00 0.00 C ATOM 0 H TRP B 117 23.574 1.767 14.894 1.00 0.00 H new ATOM 0 HA TRP B 117 23.254 4.280 13.636 1.00 0.00 H new ATOM 0 HB2 TRP B 117 24.581 3.766 15.688 1.00 0.00 H new ATOM 0 HB3 TRP B 117 25.801 3.046 14.657 1.00 0.00 H new ATOM 0 HD1 TRP B 117 24.497 5.935 12.833 1.00 0.00 H new ATOM 0 HE1 TRP B 117 25.996 8.008 13.087 1.00 0.00 H new ATOM 0 HE3 TRP B 117 27.385 4.381 16.776 1.00 0.00 H new ATOM 0 HZ2 TRP B 117 28.056 8.917 14.841 1.00 0.00 H new ATOM 0 HZ3 TRP B 117 29.103 5.893 17.723 1.00 0.00 H new ATOM 0 HH2 TRP B 117 29.446 8.164 16.770 1.00 0.00 H new ATOM 3378 N ALA B 118 25.084 2.057 12.023 1.00 0.00 N ATOM 3379 CA ALA B 118 25.734 1.729 10.773 1.00 0.00 C ATOM 3380 C ALA B 118 24.764 1.779 9.599 1.00 0.00 C ATOM 3381 O ALA B 118 25.109 2.342 8.556 1.00 0.00 O ATOM 3382 CB ALA B 118 26.364 0.337 10.922 1.00 0.00 C ATOM 0 H ALA B 118 25.115 1.299 12.705 1.00 0.00 H new ATOM 0 HA ALA B 118 26.505 2.468 10.555 1.00 0.00 H new ATOM 0 HB1 ALA B 118 26.863 0.062 9.993 1.00 0.00 H new ATOM 0 HB2 ALA B 118 27.092 0.352 11.734 1.00 0.00 H new ATOM 0 HB3 ALA B 118 25.586 -0.393 11.146 1.00 0.00 H new ATOM 3388 N PHE B 119 23.551 1.245 9.766 1.00 0.00 N ATOM 3389 CA PHE B 119 22.552 1.310 8.719 1.00 0.00 C ATOM 3390 C PHE B 119 22.178 2.773 8.502 1.00 0.00 C ATOM 3391 O PHE B 119 22.181 3.222 7.355 1.00 0.00 O ATOM 3392 CB PHE B 119 21.310 0.463 9.045 1.00 0.00 C ATOM 3393 CG PHE B 119 21.362 -1.010 8.655 1.00 0.00 C ATOM 3394 CD1 PHE B 119 22.419 -1.846 9.072 1.00 0.00 C ATOM 3395 CD2 PHE B 119 20.321 -1.559 7.876 1.00 0.00 C ATOM 3396 CE1 PHE B 119 22.421 -3.212 8.738 1.00 0.00 C ATOM 3397 CE2 PHE B 119 20.328 -2.924 7.536 1.00 0.00 C ATOM 3398 CZ PHE B 119 21.375 -3.753 7.973 1.00 0.00 C ATOM 0 H PHE B 119 23.247 0.767 10.614 1.00 0.00 H new ATOM 0 HA PHE B 119 22.971 0.890 7.804 1.00 0.00 H new ATOM 0 HB2 PHE B 119 21.129 0.524 10.118 1.00 0.00 H new ATOM 0 HB3 PHE B 119 20.451 0.915 8.550 1.00 0.00 H new ATOM 0 HD1 PHE B 119 23.232 -1.434 9.652 1.00 0.00 H new ATOM 0 HD2 PHE B 119 19.513 -0.927 7.538 1.00 0.00 H new ATOM 0 HE1 PHE B 119 23.229 -3.847 9.071 1.00 0.00 H new ATOM 0 HE2 PHE B 119 19.528 -3.335 6.938 1.00 0.00 H new ATOM 0 HZ PHE B 119 21.375 -4.803 7.721 1.00 0.00 H new ATOM 3408 N PHE B 120 21.879 3.531 9.569 1.00 0.00 N ATOM 3409 CA PHE B 120 21.407 4.897 9.377 1.00 0.00 C ATOM 3410 C PHE B 120 22.489 5.777 8.770 1.00 0.00 C ATOM 3411 O PHE B 120 22.172 6.551 7.874 1.00 0.00 O ATOM 3412 CB PHE B 120 20.697 5.483 10.612 1.00 0.00 C ATOM 3413 CG PHE B 120 21.463 6.191 11.715 1.00 0.00 C ATOM 3414 CD1 PHE B 120 22.137 7.405 11.473 1.00 0.00 C ATOM 3415 CD2 PHE B 120 21.330 5.731 13.039 1.00 0.00 C ATOM 3416 CE1 PHE B 120 22.704 8.119 12.541 1.00 0.00 C ATOM 3417 CE2 PHE B 120 21.895 6.449 14.106 1.00 0.00 C ATOM 3418 CZ PHE B 120 22.588 7.643 13.854 1.00 0.00 C ATOM 0 H PHE B 120 21.954 3.228 10.540 1.00 0.00 H new ATOM 0 HA PHE B 120 20.609 4.866 8.635 1.00 0.00 H new ATOM 0 HB2 PHE B 120 19.953 6.188 10.242 1.00 0.00 H new ATOM 0 HB3 PHE B 120 20.154 4.663 11.082 1.00 0.00 H new ATOM 0 HD1 PHE B 120 22.217 7.786 10.466 1.00 0.00 H new ATOM 0 HD2 PHE B 120 20.789 4.818 13.236 1.00 0.00 H new ATOM 0 HE1 PHE B 120 23.233 9.041 12.349 1.00 0.00 H new ATOM 0 HE2 PHE B 120 21.796 6.083 15.117 1.00 0.00 H new ATOM 0 HZ PHE B 120 23.031 8.194 14.670 1.00 0.00 H new ATOM 3428 N GLN B 121 23.754 5.625 9.165 1.00 0.00 N ATOM 3429 CA GLN B 121 24.848 6.405 8.624 1.00 0.00 C ATOM 3430 C GLN B 121 25.002 6.151 7.124 1.00 0.00 C ATOM 3431 O GLN B 121 25.081 7.099 6.340 1.00 0.00 O ATOM 3432 CB GLN B 121 26.117 6.070 9.411 1.00 0.00 C ATOM 3433 CG GLN B 121 27.311 6.890 8.916 1.00 0.00 C ATOM 3434 CD GLN B 121 28.438 6.886 9.947 1.00 0.00 C ATOM 3435 OE1 GLN B 121 29.483 6.267 9.756 1.00 0.00 O ATOM 3436 NE2 GLN B 121 28.245 7.568 11.065 1.00 0.00 N ATOM 0 H GLN B 121 24.041 4.951 9.874 1.00 0.00 H new ATOM 0 HA GLN B 121 24.646 7.471 8.732 1.00 0.00 H new ATOM 0 HB2 GLN B 121 25.953 6.266 10.471 1.00 0.00 H new ATOM 0 HB3 GLN B 121 26.338 5.007 9.314 1.00 0.00 H new ATOM 0 HG2 GLN B 121 27.673 6.480 7.973 1.00 0.00 H new ATOM 0 HG3 GLN B 121 26.997 7.915 8.718 1.00 0.00 H new ATOM 0 HE21 GLN B 121 27.372 8.076 11.208 1.00 0.00 H new ATOM 0 HE22 GLN B 121 28.969 7.585 11.783 1.00 0.00 H new ATOM 3445 N ARG B 122 25.020 4.876 6.712 1.00 0.00 N ATOM 3446 CA ARG B 122 25.176 4.524 5.308 1.00 0.00 C ATOM 3447 C ARG B 122 23.994 5.057 4.502 1.00 0.00 C ATOM 3448 O ARG B 122 24.192 5.727 3.485 1.00 0.00 O ATOM 3449 CB ARG B 122 25.310 2.993 5.176 1.00 0.00 C ATOM 3450 CG ARG B 122 25.188 2.501 3.724 1.00 0.00 C ATOM 3451 CD ARG B 122 25.344 0.979 3.637 1.00 0.00 C ATOM 3452 NE ARG B 122 24.558 0.422 2.518 1.00 0.00 N ATOM 3453 CZ ARG B 122 23.247 0.138 2.545 1.00 0.00 C ATOM 3454 NH1 ARG B 122 22.538 0.255 3.665 1.00 0.00 N ATOM 3455 NH2 ARG B 122 22.632 -0.260 1.440 1.00 0.00 N ATOM 0 H ARG B 122 24.928 4.076 7.338 1.00 0.00 H new ATOM 0 HA ARG B 122 26.081 4.982 4.908 1.00 0.00 H new ATOM 0 HB2 ARG B 122 26.274 2.682 5.579 1.00 0.00 H new ATOM 0 HB3 ARG B 122 24.541 2.513 5.782 1.00 0.00 H new ATOM 0 HG2 ARG B 122 24.219 2.793 3.319 1.00 0.00 H new ATOM 0 HG3 ARG B 122 25.949 2.982 3.109 1.00 0.00 H new ATOM 0 HD2 ARG B 122 26.396 0.726 3.506 1.00 0.00 H new ATOM 0 HD3 ARG B 122 25.021 0.524 4.573 1.00 0.00 H new ATOM 0 HE ARG B 122 25.056 0.237 1.647 1.00 0.00 H new ATOM 0 HH11 ARG B 122 22.990 0.566 4.525 1.00 0.00 H new ATOM 0 HH12 ARG B 122 21.542 0.034 3.664 1.00 0.00 H new ATOM 0 HH21 ARG B 122 23.156 -0.350 0.569 1.00 0.00 H new ATOM 0 HH22 ARG B 122 21.635 -0.476 1.461 1.00 0.00 H new ATOM 3469 N VAL B 123 22.768 4.750 4.935 1.00 0.00 N ATOM 3470 CA VAL B 123 21.582 5.141 4.189 1.00 0.00 C ATOM 3471 C VAL B 123 21.505 6.672 4.129 1.00 0.00 C ATOM 3472 O VAL B 123 21.132 7.198 3.088 1.00 0.00 O ATOM 3473 CB VAL B 123 20.319 4.462 4.765 1.00 0.00 C ATOM 3474 CG1 VAL B 123 19.054 4.934 4.036 1.00 0.00 C ATOM 3475 CG2 VAL B 123 20.383 2.931 4.616 1.00 0.00 C ATOM 0 H VAL B 123 22.577 4.235 5.794 1.00 0.00 H new ATOM 0 HA VAL B 123 21.645 4.789 3.160 1.00 0.00 H new ATOM 0 HB VAL B 123 20.281 4.738 5.819 1.00 0.00 H new ATOM 0 HG11 VAL B 123 18.182 4.439 4.463 1.00 0.00 H new ATOM 0 HG12 VAL B 123 18.950 6.013 4.149 1.00 0.00 H new ATOM 0 HG13 VAL B 123 19.130 4.685 2.977 1.00 0.00 H new ATOM 0 HG21 VAL B 123 19.479 2.487 5.032 1.00 0.00 H new ATOM 0 HG22 VAL B 123 20.463 2.671 3.560 1.00 0.00 H new ATOM 0 HG23 VAL B 123 21.253 2.550 5.150 1.00 0.00 H new ATOM 3485 N ARG B 124 21.914 7.399 5.174 1.00 0.00 N ATOM 3486 CA ARG B 124 21.913 8.860 5.200 1.00 0.00 C ATOM 3487 C ARG B 124 22.818 9.457 4.139 1.00 0.00 C ATOM 3488 O ARG B 124 22.401 10.403 3.470 1.00 0.00 O ATOM 3489 CB ARG B 124 22.242 9.304 6.637 1.00 0.00 C ATOM 3490 CG ARG B 124 22.266 10.805 6.940 1.00 0.00 C ATOM 3491 CD ARG B 124 23.579 11.524 6.608 1.00 0.00 C ATOM 3492 NE ARG B 124 24.701 11.002 7.403 1.00 0.00 N ATOM 3493 CZ ARG B 124 25.999 11.033 7.094 1.00 0.00 C ATOM 3494 NH1 ARG B 124 26.439 11.565 5.956 1.00 0.00 N ATOM 3495 NH2 ARG B 124 26.848 10.518 7.971 1.00 0.00 N ATOM 0 H ARG B 124 22.260 6.980 6.037 1.00 0.00 H new ATOM 0 HA ARG B 124 20.928 9.246 4.937 1.00 0.00 H new ATOM 0 HB2 ARG B 124 21.515 8.841 7.304 1.00 0.00 H new ATOM 0 HB3 ARG B 124 23.219 8.896 6.897 1.00 0.00 H new ATOM 0 HG2 ARG B 124 21.459 11.283 6.384 1.00 0.00 H new ATOM 0 HG3 ARG B 124 22.051 10.948 7.999 1.00 0.00 H new ATOM 0 HD2 ARG B 124 23.800 11.407 5.547 1.00 0.00 H new ATOM 0 HD3 ARG B 124 23.466 12.592 6.795 1.00 0.00 H new ATOM 0 HE ARG B 124 24.459 10.566 8.293 1.00 0.00 H new ATOM 0 HH11 ARG B 124 25.777 11.965 5.290 1.00 0.00 H new ATOM 0 HH12 ARG B 124 27.438 11.573 5.749 1.00 0.00 H new ATOM 0 HH21 ARG B 124 26.501 10.118 8.843 1.00 0.00 H new ATOM 0 HH22 ARG B 124 27.849 10.521 7.774 1.00 0.00 H new ATOM 3509 N ASP B 125 24.024 8.919 3.966 1.00 0.00 N ATOM 3510 CA ASP B 125 24.928 9.360 2.907 1.00 0.00 C ATOM 3511 C ASP B 125 24.256 9.239 1.535 1.00 0.00 C ATOM 3512 O ASP B 125 24.282 10.188 0.749 1.00 0.00 O ATOM 3513 CB ASP B 125 26.229 8.551 2.937 1.00 0.00 C ATOM 3514 CG ASP B 125 27.158 8.994 1.795 1.00 0.00 C ATOM 3515 OD1 ASP B 125 27.760 10.086 1.893 1.00 0.00 O ATOM 3516 OD2 ASP B 125 27.315 8.241 0.808 1.00 0.00 O ATOM 0 H ASP B 125 24.399 8.172 4.550 1.00 0.00 H new ATOM 0 HA ASP B 125 25.168 10.409 3.081 1.00 0.00 H new ATOM 0 HB2 ASP B 125 26.729 8.688 3.896 1.00 0.00 H new ATOM 0 HB3 ASP B 125 26.007 7.488 2.843 1.00 0.00 H new ATOM 3521 N GLU B 126 23.605 8.103 1.263 1.00 0.00 N ATOM 3522 CA GLU B 126 22.949 7.878 -0.022 1.00 0.00 C ATOM 3523 C GLU B 126 21.682 8.737 -0.168 1.00 0.00 C ATOM 3524 O GLU B 126 21.451 9.312 -1.228 1.00 0.00 O ATOM 3525 CB GLU B 126 22.664 6.377 -0.198 1.00 0.00 C ATOM 3526 CG GLU B 126 21.912 5.991 -1.485 1.00 0.00 C ATOM 3527 CD GLU B 126 22.667 6.231 -2.809 1.00 0.00 C ATOM 3528 OE1 GLU B 126 23.397 7.236 -2.965 1.00 0.00 O ATOM 3529 OE2 GLU B 126 22.457 5.439 -3.758 1.00 0.00 O ATOM 0 H GLU B 126 23.520 7.326 1.919 1.00 0.00 H new ATOM 0 HA GLU B 126 23.618 8.192 -0.823 1.00 0.00 H new ATOM 0 HB2 GLU B 126 23.612 5.840 -0.177 1.00 0.00 H new ATOM 0 HB3 GLU B 126 22.084 6.032 0.658 1.00 0.00 H new ATOM 0 HG2 GLU B 126 21.650 4.935 -1.426 1.00 0.00 H new ATOM 0 HG3 GLU B 126 20.977 6.550 -1.517 1.00 0.00 H new ATOM 3536 N ILE B 127 20.871 8.867 0.885 1.00 0.00 N ATOM 3537 CA ILE B 127 19.644 9.660 0.881 1.00 0.00 C ATOM 3538 C ILE B 127 19.971 11.112 0.524 1.00 0.00 C ATOM 3539 O ILE B 127 19.320 11.682 -0.353 1.00 0.00 O ATOM 3540 CB ILE B 127 18.884 9.456 2.223 1.00 0.00 C ATOM 3541 CG1 ILE B 127 17.924 8.257 2.033 1.00 0.00 C ATOM 3542 CG2 ILE B 127 18.148 10.703 2.733 1.00 0.00 C ATOM 3543 CD1 ILE B 127 16.987 7.949 3.205 1.00 0.00 C ATOM 0 H ILE B 127 21.054 8.414 1.780 1.00 0.00 H new ATOM 0 HA ILE B 127 18.953 9.324 0.108 1.00 0.00 H new ATOM 0 HB ILE B 127 19.616 9.254 3.005 1.00 0.00 H new ATOM 0 HG12 ILE B 127 17.316 8.442 1.148 1.00 0.00 H new ATOM 0 HG13 ILE B 127 18.522 7.368 1.829 1.00 0.00 H new ATOM 0 HG21 ILE B 127 17.646 10.471 3.672 1.00 0.00 H new ATOM 0 HG22 ILE B 127 18.865 11.508 2.894 1.00 0.00 H new ATOM 0 HG23 ILE B 127 17.410 11.017 1.995 1.00 0.00 H new ATOM 0 HD11 ILE B 127 16.363 7.090 2.956 1.00 0.00 H new ATOM 0 HD12 ILE B 127 17.577 7.724 4.093 1.00 0.00 H new ATOM 0 HD13 ILE B 127 16.353 8.814 3.401 1.00 0.00 H new ATOM 3555 N GLY B 128 21.006 11.694 1.136 1.00 0.00 N ATOM 3556 CA GLY B 128 21.413 13.047 0.809 1.00 0.00 C ATOM 3557 C GLY B 128 21.893 13.146 -0.629 1.00 0.00 C ATOM 3558 O GLY B 128 21.507 14.076 -1.330 1.00 0.00 O ATOM 0 H GLY B 128 21.570 11.244 1.857 1.00 0.00 H new ATOM 0 HA2 GLY B 128 20.576 13.728 0.963 1.00 0.00 H new ATOM 0 HA3 GLY B 128 22.209 13.363 1.483 1.00 0.00 H new ATOM 3562 N ASN B 129 22.673 12.173 -1.103 1.00 0.00 N ATOM 3563 CA ASN B 129 23.141 12.144 -2.482 1.00 0.00 C ATOM 3564 C ASN B 129 21.988 12.095 -3.486 1.00 0.00 C ATOM 3565 O ASN B 129 21.988 12.848 -4.457 1.00 0.00 O ATOM 3566 CB ASN B 129 24.102 10.958 -2.667 1.00 0.00 C ATOM 3567 CG ASN B 129 24.412 10.664 -4.131 1.00 0.00 C ATOM 3568 OD1 ASN B 129 24.858 11.534 -4.873 1.00 0.00 O ATOM 3569 ND2 ASN B 129 24.202 9.434 -4.571 1.00 0.00 N ATOM 0 H ASN B 129 22.995 11.386 -0.540 1.00 0.00 H new ATOM 0 HA ASN B 129 23.675 13.073 -2.684 1.00 0.00 H new ATOM 0 HB2 ASN B 129 25.033 11.166 -2.139 1.00 0.00 H new ATOM 0 HB3 ASN B 129 23.667 10.070 -2.208 1.00 0.00 H new ATOM 0 HD21 ASN B 129 24.411 9.197 -5.541 1.00 0.00 H new ATOM 0 HD22 ASN B 129 23.831 8.723 -3.941 1.00 0.00 H new ATOM 3576 N ARG B 130 20.972 11.265 -3.261 1.00 0.00 N ATOM 3577 CA ARG B 130 19.859 11.185 -4.208 1.00 0.00 C ATOM 3578 C ARG B 130 18.977 12.424 -4.138 1.00 0.00 C ATOM 3579 O ARG B 130 18.508 12.872 -5.185 1.00 0.00 O ATOM 3580 CB ARG B 130 19.064 9.881 -4.046 1.00 0.00 C ATOM 3581 CG ARG B 130 19.914 8.612 -4.253 1.00 0.00 C ATOM 3582 CD ARG B 130 20.816 8.659 -5.497 1.00 0.00 C ATOM 3583 NE ARG B 130 21.626 7.445 -5.607 1.00 0.00 N ATOM 3584 CZ ARG B 130 22.589 7.208 -6.496 1.00 0.00 C ATOM 3585 NH1 ARG B 130 22.853 8.056 -7.487 1.00 0.00 N ATOM 3586 NH2 ARG B 130 23.296 6.098 -6.340 1.00 0.00 N ATOM 0 H ARG B 130 20.894 10.650 -2.451 1.00 0.00 H new ATOM 0 HA ARG B 130 20.282 11.161 -5.212 1.00 0.00 H new ATOM 0 HB2 ARG B 130 18.624 9.855 -3.049 1.00 0.00 H new ATOM 0 HB3 ARG B 130 18.240 9.877 -4.759 1.00 0.00 H new ATOM 0 HG2 ARG B 130 20.536 8.456 -3.372 1.00 0.00 H new ATOM 0 HG3 ARG B 130 19.250 7.751 -4.331 1.00 0.00 H new ATOM 0 HD2 ARG B 130 20.202 8.773 -6.391 1.00 0.00 H new ATOM 0 HD3 ARG B 130 21.468 9.531 -5.445 1.00 0.00 H new ATOM 0 HE ARG B 130 21.433 6.704 -4.933 1.00 0.00 H new ATOM 0 HH11 ARG B 130 22.311 8.915 -7.581 1.00 0.00 H new ATOM 0 HH12 ARG B 130 23.597 7.847 -8.153 1.00 0.00 H new ATOM 0 HH21 ARG B 130 23.092 5.468 -5.564 1.00 0.00 H new ATOM 0 HH22 ARG B 130 24.044 5.873 -6.996 1.00 0.00 H new ATOM 3600 N LEU B 131 18.780 13.031 -2.963 1.00 0.00 N ATOM 3601 CA LEU B 131 18.008 14.270 -2.896 1.00 0.00 C ATOM 3602 C LEU B 131 18.787 15.443 -3.478 1.00 0.00 C ATOM 3603 O LEU B 131 18.184 16.292 -4.138 1.00 0.00 O ATOM 3604 CB LEU B 131 17.518 14.583 -1.469 1.00 0.00 C ATOM 3605 CG LEU B 131 16.088 14.084 -1.180 1.00 0.00 C ATOM 3606 CD1 LEU B 131 15.054 14.721 -2.128 1.00 0.00 C ATOM 3607 CD2 LEU B 131 15.999 12.555 -1.244 1.00 0.00 C ATOM 0 H LEU B 131 19.135 12.694 -2.068 1.00 0.00 H new ATOM 0 HA LEU B 131 17.120 14.116 -3.509 1.00 0.00 H new ATOM 0 HB2 LEU B 131 18.203 14.130 -0.752 1.00 0.00 H new ATOM 0 HB3 LEU B 131 17.556 15.661 -1.310 1.00 0.00 H new ATOM 0 HG LEU B 131 15.849 14.397 -0.164 1.00 0.00 H new ATOM 0 HD11 LEU B 131 14.060 14.342 -1.890 1.00 0.00 H new ATOM 0 HD12 LEU B 131 15.068 15.804 -2.007 1.00 0.00 H new ATOM 0 HD13 LEU B 131 15.301 14.468 -3.159 1.00 0.00 H new ATOM 0 HD21 LEU B 131 14.976 12.241 -1.035 1.00 0.00 H new ATOM 0 HD22 LEU B 131 16.287 12.215 -2.239 1.00 0.00 H new ATOM 0 HD23 LEU B 131 16.671 12.120 -0.504 1.00 0.00 H new ATOM 3619 N LYS B 132 20.111 15.502 -3.294 1.00 0.00 N ATOM 3620 CA LYS B 132 20.897 16.554 -3.923 1.00 0.00 C ATOM 3621 C LYS B 132 20.892 16.361 -5.432 1.00 0.00 C ATOM 3622 O LYS B 132 20.759 17.339 -6.157 1.00 0.00 O ATOM 3623 CB LYS B 132 22.287 16.701 -3.291 1.00 0.00 C ATOM 3624 CG LYS B 132 23.450 15.960 -3.966 1.00 0.00 C ATOM 3625 CD LYS B 132 24.699 15.951 -3.078 1.00 0.00 C ATOM 3626 CE LYS B 132 25.182 17.372 -2.764 1.00 0.00 C ATOM 3627 NZ LYS B 132 26.425 17.394 -1.955 1.00 0.00 N ATOM 0 H LYS B 132 20.646 14.845 -2.726 1.00 0.00 H new ATOM 0 HA LYS B 132 20.431 17.521 -3.733 1.00 0.00 H new ATOM 0 HB2 LYS B 132 22.534 17.762 -3.263 1.00 0.00 H new ATOM 0 HB3 LYS B 132 22.225 16.361 -2.257 1.00 0.00 H new ATOM 0 HG2 LYS B 132 23.151 14.935 -4.186 1.00 0.00 H new ATOM 0 HG3 LYS B 132 23.683 16.436 -4.919 1.00 0.00 H new ATOM 0 HD2 LYS B 132 24.480 15.427 -2.148 1.00 0.00 H new ATOM 0 HD3 LYS B 132 25.495 15.398 -3.576 1.00 0.00 H new ATOM 0 HE2 LYS B 132 25.353 17.907 -3.698 1.00 0.00 H new ATOM 0 HE3 LYS B 132 24.397 17.907 -2.229 1.00 0.00 H new ATOM 0 HZ1 LYS B 132 26.539 18.331 -1.519 1.00 0.00 H new ATOM 0 HZ2 LYS B 132 26.367 16.671 -1.210 1.00 0.00 H new ATOM 0 HZ3 LYS B 132 27.242 17.195 -2.568 1.00 0.00 H new ATOM 3641 N GLU B 133 20.938 15.120 -5.923 1.00 0.00 N ATOM 3642 CA GLU B 133 20.741 14.878 -7.344 1.00 0.00 C ATOM 3643 C GLU B 133 19.373 15.346 -7.785 1.00 0.00 C ATOM 3644 O GLU B 133 19.306 15.973 -8.828 1.00 0.00 O ATOM 3645 CB GLU B 133 20.889 13.404 -7.756 1.00 0.00 C ATOM 3646 CG GLU B 133 22.324 13.068 -8.150 1.00 0.00 C ATOM 3647 CD GLU B 133 22.501 11.584 -8.528 1.00 0.00 C ATOM 3648 OE1 GLU B 133 22.051 10.685 -7.780 1.00 0.00 O ATOM 3649 OE2 GLU B 133 23.116 11.305 -9.583 1.00 0.00 O ATOM 0 H GLU B 133 21.107 14.284 -5.364 1.00 0.00 H new ATOM 0 HA GLU B 133 21.532 15.445 -7.834 1.00 0.00 H new ATOM 0 HB2 GLU B 133 20.579 12.763 -6.931 1.00 0.00 H new ATOM 0 HB3 GLU B 133 20.223 13.192 -8.592 1.00 0.00 H new ATOM 0 HG2 GLU B 133 22.621 13.692 -8.993 1.00 0.00 H new ATOM 0 HG3 GLU B 133 22.991 13.311 -7.323 1.00 0.00 H new ATOM 3656 N PHE B 134 18.285 15.105 -7.056 1.00 0.00 N ATOM 3657 CA PHE B 134 16.984 15.604 -7.489 1.00 0.00 C ATOM 3658 C PHE B 134 17.020 17.129 -7.655 1.00 0.00 C ATOM 3659 O PHE B 134 16.520 17.651 -8.653 1.00 0.00 O ATOM 3660 CB PHE B 134 15.900 15.159 -6.500 1.00 0.00 C ATOM 3661 CG PHE B 134 14.572 15.843 -6.745 1.00 0.00 C ATOM 3662 CD1 PHE B 134 13.739 15.391 -7.779 1.00 0.00 C ATOM 3663 CD2 PHE B 134 14.226 16.998 -6.021 1.00 0.00 C ATOM 3664 CE1 PHE B 134 12.593 16.121 -8.137 1.00 0.00 C ATOM 3665 CE2 PHE B 134 13.082 17.735 -6.379 1.00 0.00 C ATOM 3666 CZ PHE B 134 12.274 17.302 -7.445 1.00 0.00 C ATOM 0 H PHE B 134 18.277 14.579 -6.182 1.00 0.00 H new ATOM 0 HA PHE B 134 16.741 15.181 -8.464 1.00 0.00 H new ATOM 0 HB2 PHE B 134 15.767 14.080 -6.573 1.00 0.00 H new ATOM 0 HB3 PHE B 134 16.232 15.371 -5.484 1.00 0.00 H new ATOM 0 HD1 PHE B 134 13.980 14.478 -8.303 1.00 0.00 H new ATOM 0 HD2 PHE B 134 14.838 17.319 -5.191 1.00 0.00 H new ATOM 0 HE1 PHE B 134 11.960 15.776 -8.941 1.00 0.00 H new ATOM 0 HE2 PHE B 134 12.825 18.632 -5.836 1.00 0.00 H new ATOM 0 HZ PHE B 134 11.407 17.878 -7.733 1.00 0.00 H new ATOM 3676 N ALA B 135 17.676 17.830 -6.728 1.00 0.00 N ATOM 3677 CA ALA B 135 17.867 19.271 -6.787 1.00 0.00 C ATOM 3678 C ALA B 135 18.678 19.710 -8.017 1.00 0.00 C ATOM 3679 O ALA B 135 18.452 20.798 -8.550 1.00 0.00 O ATOM 3680 CB ALA B 135 18.556 19.742 -5.503 1.00 0.00 C ATOM 0 H ALA B 135 18.095 17.400 -5.903 1.00 0.00 H new ATOM 0 HA ALA B 135 16.884 19.733 -6.879 1.00 0.00 H new ATOM 0 HB1 ALA B 135 18.701 20.822 -5.543 1.00 0.00 H new ATOM 0 HB2 ALA B 135 17.934 19.491 -4.643 1.00 0.00 H new ATOM 0 HB3 ALA B 135 19.523 19.249 -5.407 1.00 0.00 H new ATOM 3686 N GLU B 136 19.627 18.884 -8.460 1.00 0.00 N ATOM 3687 CA GLU B 136 20.564 19.174 -9.534 1.00 0.00 C ATOM 3688 C GLU B 136 19.968 18.823 -10.895 1.00 0.00 C ATOM 3689 O GLU B 136 20.127 19.558 -11.871 1.00 0.00 O ATOM 3690 CB GLU B 136 21.850 18.348 -9.340 1.00 0.00 C ATOM 3691 CG GLU B 136 22.721 18.787 -8.156 1.00 0.00 C ATOM 3692 CD GLU B 136 23.692 19.919 -8.537 1.00 0.00 C ATOM 3693 OE1 GLU B 136 23.276 21.098 -8.590 1.00 0.00 O ATOM 3694 OE2 GLU B 136 24.891 19.643 -8.778 1.00 0.00 O ATOM 0 H GLU B 136 19.765 17.956 -8.060 1.00 0.00 H new ATOM 0 HA GLU B 136 20.785 20.241 -9.504 1.00 0.00 H new ATOM 0 HB2 GLU B 136 21.577 17.302 -9.204 1.00 0.00 H new ATOM 0 HB3 GLU B 136 22.444 18.406 -10.252 1.00 0.00 H new ATOM 0 HG2 GLU B 136 22.080 19.120 -7.339 1.00 0.00 H new ATOM 0 HG3 GLU B 136 23.289 17.932 -7.788 1.00 0.00 H new ATOM 3701 N THR B 137 19.288 17.683 -10.949 1.00 0.00 N ATOM 3702 CA THR B 137 18.821 17.045 -12.168 1.00 0.00 C ATOM 3703 C THR B 137 17.415 17.540 -12.527 1.00 0.00 C ATOM 3704 O THR B 137 17.049 17.511 -13.704 1.00 0.00 O ATOM 3705 CB THR B 137 18.908 15.510 -11.990 1.00 0.00 C ATOM 3706 OG1 THR B 137 18.069 15.054 -10.948 1.00 0.00 O ATOM 3707 CG2 THR B 137 20.349 15.042 -11.729 1.00 0.00 C ATOM 0 H THR B 137 19.039 17.160 -10.110 1.00 0.00 H new ATOM 0 HA THR B 137 19.454 17.315 -13.013 1.00 0.00 H new ATOM 0 HB THR B 137 18.567 15.077 -12.930 1.00 0.00 H new ATOM 0 HG1 THR B 137 18.558 15.079 -10.099 1.00 0.00 H new ATOM 0 HG21 THR B 137 20.364 13.959 -11.610 1.00 0.00 H new ATOM 0 HG22 THR B 137 20.981 15.323 -12.571 1.00 0.00 H new ATOM 0 HG23 THR B 137 20.725 15.512 -10.820 1.00 0.00 H new ATOM 3715 N GLY B 138 16.648 18.032 -11.539 1.00 0.00 N ATOM 3716 CA GLY B 138 15.230 18.337 -11.691 1.00 0.00 C ATOM 3717 C GLY B 138 14.528 17.125 -12.280 1.00 0.00 C ATOM 3718 O GLY B 138 13.927 17.221 -13.353 1.00 0.00 O ATOM 0 H GLY B 138 17.007 18.228 -10.605 1.00 0.00 H new ATOM 0 HA2 GLY B 138 14.794 18.593 -10.726 1.00 0.00 H new ATOM 0 HA3 GLY B 138 15.098 19.202 -12.341 1.00 0.00 H new ATOM 3722 N LYS B 139 14.721 15.991 -11.595 1.00 0.00 N ATOM 3723 CA LYS B 139 14.356 14.656 -12.046 1.00 0.00 C ATOM 3724 C LYS B 139 13.079 14.595 -12.871 1.00 0.00 C ATOM 3725 O LYS B 139 12.018 15.075 -12.417 1.00 0.00 O ATOM 3726 CB LYS B 139 14.296 13.700 -10.855 1.00 0.00 C ATOM 3727 CG LYS B 139 14.151 12.226 -11.240 1.00 0.00 C ATOM 3728 CD LYS B 139 15.441 11.510 -11.675 1.00 0.00 C ATOM 3729 CE LYS B 139 16.158 12.055 -12.921 1.00 0.00 C ATOM 3730 NZ LYS B 139 15.295 12.088 -14.134 1.00 0.00 N ATOM 3731 OXT LYS B 139 13.134 13.936 -13.930 1.00 0.00 O ATOM 0 H LYS B 139 15.155 15.986 -10.672 1.00 0.00 H new ATOM 0 HA LYS B 139 15.143 14.341 -12.731 1.00 0.00 H new ATOM 0 HB2 LYS B 139 15.201 13.821 -10.260 1.00 0.00 H new ATOM 0 HB3 LYS B 139 13.457 13.982 -10.219 1.00 0.00 H new ATOM 0 HG2 LYS B 139 13.731 11.689 -10.390 1.00 0.00 H new ATOM 0 HG3 LYS B 139 13.428 12.153 -12.052 1.00 0.00 H new ATOM 0 HD2 LYS B 139 16.142 11.540 -10.841 1.00 0.00 H new ATOM 0 HD3 LYS B 139 15.202 10.462 -11.853 1.00 0.00 H new ATOM 0 HE2 LYS B 139 16.517 13.063 -12.712 1.00 0.00 H new ATOM 0 HE3 LYS B 139 17.035 11.440 -13.125 1.00 0.00 H new ATOM 0 HZ1 LYS B 139 15.857 12.401 -14.951 1.00 0.00 H new ATOM 0 HZ2 LYS B 139 14.917 11.137 -14.317 1.00 0.00 H new ATOM 0 HZ3 LYS B 139 14.507 12.750 -13.982 1.00 0.00 H new TER 3745 LYS B 139