USER MOD reduce.3.24.130724 H: found=0, std=0, add=1290, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1290 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 50 ASN :FLIP amide:sc= 0 F(o=-2.4,f=-0.43) USER MOD Set 1.2: A 51 LYS NZ :NH3+ 176:sc= -0.433 (180deg=-0.484) USER MOD Set 2.1: A 49 GLN : amide:sc= -0.275 K(o=-0.79,f=-1.9!) USER MOD Set 2.2: B 49 GLN : amide:sc= -0.517 X(o=-0.79,f=-0.56) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ -140:sc= -1.1 (180deg=-2.9!) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 87:sc= -1.19 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 HIS : no HD1:sc= -0.258 X(o=-0.26,f=-0.1) USER MOD Single : A 23 THR OG1 : rot -86:sc= -0.79 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 63:sc= 0.879 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= -0.124 K(o=-0.12,f=-1.1) USER MOD Single : A 35 MET CE :methyl -162:sc= -1.75 (180deg=-2.98!) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0.102 USER MOD Single : A 45 MET CE :methyl 173:sc= 0 (180deg=-0.065) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 LYS NZ :NH3+ 159:sc=-0.00947 (180deg=-0.753) USER MOD Single : A 61 LYS NZ :NH3+ -137:sc= -0.353 (180deg=-0.852) USER MOD Single : A 66 SER OG : rot -64:sc= 0.971 USER MOD Single : A 67 LYS NZ :NH3+ -134:sc= -0.951 (180deg=-3.48!) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET CE :methyl -144:sc= -1.13 (180deg=-2.44!) USER MOD Single : B 1 MET N :NH3+ -173:sc= -1.88 (180deg=-2.09) USER MOD Single : B 4 SER OG : rot 180:sc= -0.0127 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 LYS NZ :NH3+ 153:sc= -0.313 (180deg=-1.56!) USER MOD Single : B 10 LYS NZ :NH3+ -122:sc= -2.57! (180deg=-6.4!) USER MOD Single : B 11 LYS NZ :NH3+ -171:sc= -0.0565 (180deg=-0.131) USER MOD Single : B 12 THR OG1 : rot -118:sc= 0.237 USER MOD Single : B 13 THR OG1 : rot 180:sc= 0 USER MOD Single : B 21 TYR OH : rot 180:sc= 0 USER MOD Single : B 22 HIS : no HD1:sc= 0 X(o=0,f=-0.0013) USER MOD Single : B 23 THR OG1 : rot -76:sc= -0.476 USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 SER OG : rot 78:sc= 0.98 USER MOD Single : B 30 TYR OH : rot 180:sc= 0 USER MOD Single : B 32 ASN : amide:sc= -0.218 K(o=-0.22,f=-1.2!) USER MOD Single : B 35 MET CE :methyl 147:sc= -0.805 (180deg=-2.26!) USER MOD Single : B 36 THR OG1 : rot 180:sc= 0.0644 USER MOD Single : B 45 MET CE :methyl 141:sc= -0.17 (180deg=-0.738) USER MOD Single : B 50 ASN : amide:sc= -1.92 K(o=-1.9,f=-5!) USER MOD Single : B 51 LYS NZ :NH3+ 161:sc= -0.244 (180deg=-0.776) USER MOD Single : B 53 LYS NZ :NH3+ -130:sc= -1.06 (180deg=-1.75!) USER MOD Single : B 56 ASN : amide:sc=-0.00212 X(o=-0.0021,f=0) USER MOD Single : B 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 61 LYS NZ :NH3+ -110:sc= -0.464 (180deg=-1.24) USER MOD Single : B 66 SER OG : rot -100:sc= -1.44 USER MOD Single : B 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.386 14.125 -21.614 1.00 0.00 N ATOM 2 CA MET A 1 -2.629 14.112 -20.147 1.00 0.00 C ATOM 3 C MET A 1 -3.052 15.490 -19.647 1.00 0.00 C ATOM 4 O MET A 1 -4.074 15.631 -18.976 1.00 0.00 O ATOM 5 CB MET A 1 -1.346 13.663 -19.445 1.00 0.00 C ATOM 6 CG MET A 1 -1.574 12.601 -18.382 1.00 0.00 C ATOM 7 SD MET A 1 -1.030 10.963 -18.906 1.00 0.00 S ATOM 8 CE MET A 1 -2.550 10.030 -18.738 1.00 0.00 C ATOM 0 H1 MET A 1 -2.100 13.175 -21.927 1.00 0.00 H new ATOM 0 H2 MET A 1 -3.258 14.404 -22.108 1.00 0.00 H new ATOM 0 H3 MET A 1 -1.630 14.805 -21.835 1.00 0.00 H new ATOM 0 HA MET A 1 -3.441 13.420 -19.923 1.00 0.00 H new ATOM 0 HB2 MET A 1 -0.650 13.276 -20.190 1.00 0.00 H new ATOM 0 HB3 MET A 1 -0.871 14.530 -18.985 1.00 0.00 H new ATOM 0 HG2 MET A 1 -1.042 12.882 -17.473 1.00 0.00 H new ATOM 0 HG3 MET A 1 -2.634 12.565 -18.132 1.00 0.00 H new ATOM 0 HE1 MET A 1 -2.375 8.994 -19.027 1.00 0.00 H new ATOM 0 HE2 MET A 1 -2.887 10.066 -17.702 1.00 0.00 H new ATOM 0 HE3 MET A 1 -3.315 10.462 -19.383 1.00 0.00 H new ATOM 20 N VAL A 2 -2.257 16.503 -19.978 1.00 0.00 N ATOM 21 CA VAL A 2 -2.548 17.869 -19.563 1.00 0.00 C ATOM 22 C VAL A 2 -2.510 18.000 -18.043 1.00 0.00 C ATOM 23 O VAL A 2 -3.362 18.655 -17.443 1.00 0.00 O ATOM 24 CB VAL A 2 -3.928 18.330 -20.074 1.00 0.00 C ATOM 25 CG1 VAL A 2 -4.116 19.822 -19.838 1.00 0.00 C ATOM 26 CG2 VAL A 2 -4.092 17.992 -21.548 1.00 0.00 C ATOM 0 H VAL A 2 -1.407 16.403 -20.532 1.00 0.00 H new ATOM 0 HA VAL A 2 -1.777 18.504 -20.000 1.00 0.00 H new ATOM 0 HB VAL A 2 -4.697 17.798 -19.514 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -5.096 20.128 -20.205 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -4.046 20.033 -18.771 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -3.341 20.375 -20.369 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -5.072 18.325 -21.891 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -3.316 18.494 -22.125 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -4.006 16.914 -21.686 1.00 0.00 H new ATOM 36 N GLU A 3 -1.515 17.370 -17.426 1.00 0.00 N ATOM 37 CA GLU A 3 -1.364 17.415 -15.977 1.00 0.00 C ATOM 38 C GLU A 3 -0.048 18.078 -15.586 1.00 0.00 C ATOM 39 O GLU A 3 -0.037 19.163 -15.004 1.00 0.00 O ATOM 40 CB GLU A 3 -1.431 16.003 -15.392 1.00 0.00 C ATOM 41 CG GLU A 3 -1.572 15.978 -13.879 1.00 0.00 C ATOM 42 CD GLU A 3 -2.807 15.228 -13.419 1.00 0.00 C ATOM 43 OE1 GLU A 3 -3.295 14.365 -14.177 1.00 0.00 O ATOM 44 OE2 GLU A 3 -3.285 15.503 -12.298 1.00 0.00 O ATOM 0 H GLU A 3 -0.802 16.823 -17.908 1.00 0.00 H new ATOM 0 HA GLU A 3 -2.183 18.009 -15.571 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -2.274 15.474 -15.836 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -0.530 15.459 -15.674 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -0.687 15.514 -13.443 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -1.613 17.001 -13.505 1.00 0.00 H new ATOM 51 N SER A 4 1.062 17.420 -15.909 1.00 0.00 N ATOM 52 CA SER A 4 2.382 17.948 -15.589 1.00 0.00 C ATOM 53 C SER A 4 3.356 17.723 -16.741 1.00 0.00 C ATOM 54 O SER A 4 3.936 16.646 -16.875 1.00 0.00 O ATOM 55 CB SER A 4 2.920 17.294 -14.313 1.00 0.00 C ATOM 56 OG SER A 4 3.356 18.271 -13.384 1.00 0.00 O ATOM 0 H SER A 4 1.072 16.521 -16.392 1.00 0.00 H new ATOM 0 HA SER A 4 2.286 19.022 -15.427 1.00 0.00 H new ATOM 0 HB2 SER A 4 2.142 16.679 -13.860 1.00 0.00 H new ATOM 0 HB3 SER A 4 3.747 16.630 -14.562 1.00 0.00 H new ATOM 0 HG SER A 4 3.693 17.828 -12.577 1.00 0.00 H new ATOM 62 N LYS A 5 3.529 18.749 -17.570 1.00 0.00 N ATOM 63 CA LYS A 5 4.434 18.670 -18.714 1.00 0.00 C ATOM 64 C LYS A 5 3.900 17.712 -19.773 1.00 0.00 C ATOM 65 O LYS A 5 3.530 18.128 -20.871 1.00 0.00 O ATOM 66 CB LYS A 5 5.830 18.228 -18.264 1.00 0.00 C ATOM 67 CG LYS A 5 6.934 18.626 -19.229 1.00 0.00 C ATOM 68 CD LYS A 5 7.189 20.124 -19.198 1.00 0.00 C ATOM 69 CE LYS A 5 8.004 20.576 -20.400 1.00 0.00 C ATOM 70 NZ LYS A 5 7.544 21.893 -20.919 1.00 0.00 N ATOM 0 H LYS A 5 3.054 19.646 -17.471 1.00 0.00 H new ATOM 0 HA LYS A 5 4.501 19.665 -19.155 1.00 0.00 H new ATOM 0 HB2 LYS A 5 6.041 18.660 -17.286 1.00 0.00 H new ATOM 0 HB3 LYS A 5 5.838 17.145 -18.143 1.00 0.00 H new ATOM 0 HG2 LYS A 5 7.851 18.095 -18.973 1.00 0.00 H new ATOM 0 HG3 LYS A 5 6.661 18.323 -20.240 1.00 0.00 H new ATOM 0 HD2 LYS A 5 6.238 20.656 -19.181 1.00 0.00 H new ATOM 0 HD3 LYS A 5 7.716 20.385 -18.281 1.00 0.00 H new ATOM 0 HE2 LYS A 5 9.056 20.643 -20.121 1.00 0.00 H new ATOM 0 HE3 LYS A 5 7.931 19.829 -21.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 8.125 22.166 -21.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 6.548 21.823 -21.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 7.638 22.612 -20.173 1.00 0.00 H new ATOM 84 N LYS A 6 3.861 16.426 -19.438 1.00 0.00 N ATOM 85 CA LYS A 6 3.372 15.411 -20.363 1.00 0.00 C ATOM 86 C LYS A 6 2.852 14.190 -19.610 1.00 0.00 C ATOM 87 O LYS A 6 1.654 13.914 -19.609 1.00 0.00 O ATOM 88 CB LYS A 6 4.484 14.994 -21.328 1.00 0.00 C ATOM 89 CG LYS A 6 3.997 14.734 -22.744 1.00 0.00 C ATOM 90 CD LYS A 6 3.038 13.554 -22.795 1.00 0.00 C ATOM 91 CE LYS A 6 1.591 14.013 -22.874 1.00 0.00 C ATOM 92 NZ LYS A 6 1.050 13.911 -24.258 1.00 0.00 N ATOM 0 H LYS A 6 4.162 16.063 -18.534 1.00 0.00 H new ATOM 0 HA LYS A 6 2.548 15.841 -20.932 1.00 0.00 H new ATOM 0 HB2 LYS A 6 5.244 15.775 -21.352 1.00 0.00 H new ATOM 0 HB3 LYS A 6 4.965 14.093 -20.947 1.00 0.00 H new ATOM 0 HG2 LYS A 6 3.500 15.625 -23.129 1.00 0.00 H new ATOM 0 HG3 LYS A 6 4.850 14.539 -23.394 1.00 0.00 H new ATOM 0 HD2 LYS A 6 3.271 12.932 -23.659 1.00 0.00 H new ATOM 0 HD3 LYS A 6 3.176 12.934 -21.909 1.00 0.00 H new ATOM 0 HE2 LYS A 6 0.982 13.410 -22.201 1.00 0.00 H new ATOM 0 HE3 LYS A 6 1.518 15.045 -22.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 0.061 14.233 -24.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 1.615 14.506 -24.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 1.095 12.922 -24.576 1.00 0.00 H new ATOM 106 N ILE A 7 3.764 13.463 -18.971 1.00 0.00 N ATOM 107 CA ILE A 7 3.398 12.271 -18.215 1.00 0.00 C ATOM 108 C ILE A 7 3.765 12.419 -16.743 1.00 0.00 C ATOM 109 O ILE A 7 4.940 12.523 -16.393 1.00 0.00 O ATOM 110 CB ILE A 7 4.085 11.014 -18.780 1.00 0.00 C ATOM 111 CG1 ILE A 7 3.915 10.952 -20.300 1.00 0.00 C ATOM 112 CG2 ILE A 7 3.521 9.762 -18.125 1.00 0.00 C ATOM 113 CD1 ILE A 7 4.586 9.753 -20.935 1.00 0.00 C ATOM 0 H ILE A 7 4.761 13.679 -18.962 1.00 0.00 H new ATOM 0 HA ILE A 7 2.318 12.158 -18.308 1.00 0.00 H new ATOM 0 HB ILE A 7 5.150 11.068 -18.556 1.00 0.00 H new ATOM 0 HG12 ILE A 7 2.851 10.931 -20.538 1.00 0.00 H new ATOM 0 HG13 ILE A 7 4.323 11.862 -20.740 1.00 0.00 H new ATOM 0 HG21 ILE A 7 4.017 8.882 -18.535 1.00 0.00 H new ATOM 0 HG22 ILE A 7 3.691 9.806 -17.049 1.00 0.00 H new ATOM 0 HG23 ILE A 7 2.451 9.700 -18.321 1.00 0.00 H new ATOM 0 HD11 ILE A 7 4.424 9.774 -22.013 1.00 0.00 H new ATOM 0 HD12 ILE A 7 5.656 9.783 -20.728 1.00 0.00 H new ATOM 0 HD13 ILE A 7 4.162 8.838 -20.522 1.00 0.00 H new ATOM 125 N ALA A 8 2.750 12.427 -15.885 1.00 0.00 N ATOM 126 CA ALA A 8 2.963 12.564 -14.447 1.00 0.00 C ATOM 127 C ALA A 8 2.547 11.313 -13.693 1.00 0.00 C ATOM 128 O ALA A 8 2.729 11.204 -12.481 1.00 0.00 O ATOM 129 CB ALA A 8 2.196 13.758 -13.924 1.00 0.00 C ATOM 0 H ALA A 8 1.772 12.340 -16.160 1.00 0.00 H new ATOM 0 HA ALA A 8 4.030 12.711 -14.283 1.00 0.00 H new ATOM 0 HB1 ALA A 8 2.360 13.854 -12.851 1.00 0.00 H new ATOM 0 HB2 ALA A 8 2.542 14.661 -14.426 1.00 0.00 H new ATOM 0 HB3 ALA A 8 1.132 13.620 -14.118 1.00 0.00 H new ATOM 135 N LYS A 9 1.986 10.384 -14.428 1.00 0.00 N ATOM 136 CA LYS A 9 1.522 9.122 -13.863 1.00 0.00 C ATOM 137 C LYS A 9 1.290 8.081 -14.954 1.00 0.00 C ATOM 138 O LYS A 9 0.671 8.371 -15.978 1.00 0.00 O ATOM 139 CB LYS A 9 0.238 9.345 -13.074 1.00 0.00 C ATOM 140 CG LYS A 9 -0.908 9.750 -13.956 1.00 0.00 C ATOM 141 CD LYS A 9 -1.885 10.664 -13.235 1.00 0.00 C ATOM 142 CE LYS A 9 -1.340 12.078 -13.116 1.00 0.00 C ATOM 143 NZ LYS A 9 -0.505 12.252 -11.895 1.00 0.00 N ATOM 0 H LYS A 9 1.834 10.472 -15.433 1.00 0.00 H new ATOM 0 HA LYS A 9 2.296 8.745 -13.194 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -0.022 8.431 -12.541 1.00 0.00 H new ATOM 0 HB3 LYS A 9 0.405 10.116 -12.322 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -0.523 10.257 -14.841 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -1.432 8.859 -14.301 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -2.833 10.682 -13.773 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -2.090 10.267 -12.241 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -0.745 12.313 -13.999 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -2.169 12.785 -13.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -0.702 13.180 -11.469 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -0.731 11.502 -11.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 0.501 12.195 -12.152 1.00 0.00 H new ATOM 157 N LYS A 10 1.782 6.866 -14.727 1.00 0.00 N ATOM 158 CA LYS A 10 1.616 5.785 -15.691 1.00 0.00 C ATOM 159 C LYS A 10 0.954 4.587 -15.019 1.00 0.00 C ATOM 160 O LYS A 10 1.264 4.261 -13.879 1.00 0.00 O ATOM 161 CB LYS A 10 2.973 5.385 -16.276 1.00 0.00 C ATOM 162 CG LYS A 10 3.729 6.543 -16.906 1.00 0.00 C ATOM 163 CD LYS A 10 5.182 6.571 -16.452 1.00 0.00 C ATOM 164 CE LYS A 10 6.097 7.097 -17.546 1.00 0.00 C ATOM 165 NZ LYS A 10 6.497 6.025 -18.501 1.00 0.00 N ATOM 0 H LYS A 10 2.297 6.607 -13.886 1.00 0.00 H new ATOM 0 HA LYS A 10 0.977 6.130 -16.504 1.00 0.00 H new ATOM 0 HB2 LYS A 10 3.585 4.949 -15.487 1.00 0.00 H new ATOM 0 HB3 LYS A 10 2.821 4.610 -17.027 1.00 0.00 H new ATOM 0 HG2 LYS A 10 3.687 6.459 -17.992 1.00 0.00 H new ATOM 0 HG3 LYS A 10 3.245 7.483 -16.640 1.00 0.00 H new ATOM 0 HD2 LYS A 10 5.275 7.198 -15.565 1.00 0.00 H new ATOM 0 HD3 LYS A 10 5.495 5.567 -16.166 1.00 0.00 H new ATOM 0 HE2 LYS A 10 5.592 7.896 -18.088 1.00 0.00 H new ATOM 0 HE3 LYS A 10 6.989 7.532 -17.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 7.120 6.425 -19.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 7.002 5.274 -17.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 5.648 5.627 -18.951 1.00 0.00 H new ATOM 179 N LYS A 11 0.035 3.928 -15.714 1.00 0.00 N ATOM 180 CA LYS A 11 -0.642 2.778 -15.129 1.00 0.00 C ATOM 181 C LYS A 11 0.361 1.671 -14.832 1.00 0.00 C ATOM 182 O LYS A 11 0.875 1.023 -15.742 1.00 0.00 O ATOM 183 CB LYS A 11 -1.740 2.257 -16.057 1.00 0.00 C ATOM 184 CG LYS A 11 -2.738 3.324 -16.477 1.00 0.00 C ATOM 185 CD LYS A 11 -4.001 3.270 -15.632 1.00 0.00 C ATOM 186 CE LYS A 11 -4.800 4.558 -15.742 1.00 0.00 C ATOM 187 NZ LYS A 11 -5.900 4.447 -16.740 1.00 0.00 N ATOM 0 H LYS A 11 -0.254 4.163 -16.663 1.00 0.00 H new ATOM 0 HA LYS A 11 -1.107 3.097 -14.196 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -1.279 1.831 -16.948 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -2.274 1.449 -15.557 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -2.280 4.309 -16.385 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -2.996 3.189 -17.527 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -4.618 2.430 -15.951 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -3.735 3.093 -14.590 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -5.218 4.810 -14.767 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -4.135 5.374 -16.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -6.420 5.346 -16.785 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -5.500 4.232 -17.675 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -6.549 3.685 -16.458 1.00 0.00 H new ATOM 201 N THR A 12 0.642 1.472 -13.550 1.00 0.00 N ATOM 202 CA THR A 12 1.594 0.456 -13.129 1.00 0.00 C ATOM 203 C THR A 12 0.891 -0.720 -12.458 1.00 0.00 C ATOM 204 O THR A 12 -0.137 -0.546 -11.809 1.00 0.00 O ATOM 205 CB THR A 12 2.629 1.057 -12.179 1.00 0.00 C ATOM 206 OG1 THR A 12 3.075 2.312 -12.655 1.00 0.00 O ATOM 207 CG2 THR A 12 3.848 0.180 -11.990 1.00 0.00 C ATOM 0 H THR A 12 0.223 2.002 -12.785 1.00 0.00 H new ATOM 0 HA THR A 12 2.100 0.085 -14.021 1.00 0.00 H new ATOM 0 HB THR A 12 2.119 1.155 -11.221 1.00 0.00 H new ATOM 0 HG1 THR A 12 2.475 3.016 -12.332 1.00 0.00 H new ATOM 0 HG21 THR A 12 4.543 0.665 -11.304 1.00 0.00 H new ATOM 0 HG22 THR A 12 3.544 -0.782 -11.578 1.00 0.00 H new ATOM 0 HG23 THR A 12 4.337 0.024 -12.952 1.00 0.00 H new ATOM 215 N THR A 13 1.449 -1.921 -12.619 1.00 0.00 N ATOM 216 CA THR A 13 0.858 -3.116 -12.024 1.00 0.00 C ATOM 217 C THR A 13 1.790 -3.778 -11.016 1.00 0.00 C ATOM 218 O THR A 13 3.010 -3.790 -11.181 1.00 0.00 O ATOM 219 CB THR A 13 0.492 -4.141 -13.095 1.00 0.00 C ATOM 220 OG1 THR A 13 0.302 -3.517 -14.353 1.00 0.00 O ATOM 221 CG2 THR A 13 -0.763 -4.915 -12.764 1.00 0.00 C ATOM 0 H THR A 13 2.302 -2.089 -13.152 1.00 0.00 H new ATOM 0 HA THR A 13 -0.041 -2.784 -11.506 1.00 0.00 H new ATOM 0 HB THR A 13 1.331 -4.835 -13.133 1.00 0.00 H new ATOM 0 HG1 THR A 13 0.070 -4.194 -15.022 1.00 0.00 H new ATOM 0 HG21 THR A 13 -0.972 -5.628 -13.562 1.00 0.00 H new ATOM 0 HG22 THR A 13 -0.623 -5.452 -11.826 1.00 0.00 H new ATOM 0 HG23 THR A 13 -1.601 -4.225 -12.666 1.00 0.00 H new ATOM 229 N LEU A 14 1.182 -4.355 -9.988 1.00 0.00 N ATOM 230 CA LEU A 14 1.906 -5.065 -8.944 1.00 0.00 C ATOM 231 C LEU A 14 1.080 -6.263 -8.507 1.00 0.00 C ATOM 232 O LEU A 14 -0.124 -6.135 -8.302 1.00 0.00 O ATOM 233 CB LEU A 14 2.165 -4.161 -7.735 1.00 0.00 C ATOM 234 CG LEU A 14 2.405 -2.684 -8.047 1.00 0.00 C ATOM 235 CD1 LEU A 14 1.738 -1.816 -6.995 1.00 0.00 C ATOM 236 CD2 LEU A 14 3.897 -2.382 -8.122 1.00 0.00 C ATOM 0 H LEU A 14 0.171 -4.343 -9.855 1.00 0.00 H new ATOM 0 HA LEU A 14 2.869 -5.385 -9.341 1.00 0.00 H new ATOM 0 HB2 LEU A 14 1.313 -4.236 -7.060 1.00 0.00 H new ATOM 0 HB3 LEU A 14 3.032 -4.545 -7.198 1.00 0.00 H new ATOM 0 HG LEU A 14 1.966 -2.459 -9.019 1.00 0.00 H new ATOM 0 HD11 LEU A 14 1.914 -0.765 -7.225 1.00 0.00 H new ATOM 0 HD12 LEU A 14 0.666 -2.011 -6.989 1.00 0.00 H new ATOM 0 HD13 LEU A 14 2.155 -2.047 -6.015 1.00 0.00 H new ATOM 0 HD21 LEU A 14 4.044 -1.325 -8.345 1.00 0.00 H new ATOM 0 HD22 LEU A 14 4.365 -2.619 -7.167 1.00 0.00 H new ATOM 0 HD23 LEU A 14 4.351 -2.985 -8.908 1.00 0.00 H new ATOM 248 N ALA A 15 1.701 -7.427 -8.372 1.00 0.00 N ATOM 249 CA ALA A 15 0.946 -8.603 -7.971 1.00 0.00 C ATOM 250 C ALA A 15 0.860 -8.714 -6.461 1.00 0.00 C ATOM 251 O ALA A 15 1.726 -9.298 -5.812 1.00 0.00 O ATOM 252 CB ALA A 15 1.561 -9.859 -8.568 1.00 0.00 C ATOM 0 H ALA A 15 2.697 -7.580 -8.529 1.00 0.00 H new ATOM 0 HA ALA A 15 -0.069 -8.497 -8.354 1.00 0.00 H new ATOM 0 HB1 ALA A 15 0.983 -10.730 -8.258 1.00 0.00 H new ATOM 0 HB2 ALA A 15 1.553 -9.787 -9.656 1.00 0.00 H new ATOM 0 HB3 ALA A 15 2.589 -9.962 -8.219 1.00 0.00 H new ATOM 258 N PHE A 16 -0.226 -8.167 -5.927 1.00 0.00 N ATOM 259 CA PHE A 16 -0.507 -8.200 -4.505 1.00 0.00 C ATOM 260 C PHE A 16 -1.963 -7.907 -4.251 1.00 0.00 C ATOM 261 O PHE A 16 -2.707 -7.548 -5.157 1.00 0.00 O ATOM 262 CB PHE A 16 0.343 -7.205 -3.732 1.00 0.00 C ATOM 263 CG PHE A 16 1.816 -7.354 -3.972 1.00 0.00 C ATOM 264 CD1 PHE A 16 2.442 -6.648 -4.987 1.00 0.00 C ATOM 265 CD2 PHE A 16 2.576 -8.199 -3.181 1.00 0.00 C ATOM 266 CE1 PHE A 16 3.799 -6.785 -5.210 1.00 0.00 C ATOM 267 CE2 PHE A 16 3.933 -8.339 -3.397 1.00 0.00 C ATOM 268 CZ PHE A 16 4.545 -7.632 -4.413 1.00 0.00 C ATOM 0 H PHE A 16 -0.938 -7.686 -6.476 1.00 0.00 H new ATOM 0 HA PHE A 16 -0.262 -9.203 -4.156 1.00 0.00 H new ATOM 0 HB2 PHE A 16 0.040 -6.194 -4.004 1.00 0.00 H new ATOM 0 HB3 PHE A 16 0.144 -7.322 -2.667 1.00 0.00 H new ATOM 0 HD1 PHE A 16 1.863 -5.983 -5.611 1.00 0.00 H new ATOM 0 HD2 PHE A 16 2.102 -8.755 -2.386 1.00 0.00 H new ATOM 0 HE1 PHE A 16 4.275 -6.231 -6.006 1.00 0.00 H new ATOM 0 HE2 PHE A 16 4.515 -9.001 -2.772 1.00 0.00 H new ATOM 0 HZ PHE A 16 5.606 -7.741 -4.585 1.00 0.00 H new ATOM 278 N ASP A 17 -2.348 -8.035 -3.003 1.00 0.00 N ATOM 279 CA ASP A 17 -3.704 -7.760 -2.576 1.00 0.00 C ATOM 280 C ASP A 17 -3.986 -8.510 -1.315 1.00 0.00 C ATOM 281 O ASP A 17 -4.622 -7.999 -0.399 1.00 0.00 O ATOM 282 CB ASP A 17 -4.735 -8.141 -3.630 1.00 0.00 C ATOM 283 CG ASP A 17 -5.230 -6.943 -4.418 1.00 0.00 C ATOM 284 OD1 ASP A 17 -6.278 -7.065 -5.087 1.00 0.00 O ATOM 285 OD2 ASP A 17 -4.571 -5.883 -4.366 1.00 0.00 O ATOM 0 H ASP A 17 -1.728 -8.334 -2.250 1.00 0.00 H new ATOM 0 HA ASP A 17 -3.785 -6.685 -2.413 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -4.298 -8.867 -4.315 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -5.581 -8.629 -3.146 1.00 0.00 H new ATOM 290 N GLU A 18 -3.499 -9.728 -1.253 1.00 0.00 N ATOM 291 CA GLU A 18 -3.715 -10.518 -0.068 1.00 0.00 C ATOM 292 C GLU A 18 -3.390 -9.678 1.166 1.00 0.00 C ATOM 293 O GLU A 18 -4.261 -9.388 1.991 1.00 0.00 O ATOM 294 CB GLU A 18 -2.864 -11.787 -0.091 1.00 0.00 C ATOM 295 CG GLU A 18 -3.051 -12.667 1.134 1.00 0.00 C ATOM 296 CD GLU A 18 -1.743 -13.235 1.649 1.00 0.00 C ATOM 297 OE1 GLU A 18 -1.700 -13.652 2.826 1.00 0.00 O ATOM 298 OE2 GLU A 18 -0.762 -13.261 0.876 1.00 0.00 O ATOM 0 H GLU A 18 -2.963 -10.183 -1.992 1.00 0.00 H new ATOM 0 HA GLU A 18 -4.761 -10.823 -0.034 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -3.110 -12.363 -0.983 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -1.813 -11.508 -0.171 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -3.527 -12.087 1.924 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -3.727 -13.486 0.889 1.00 0.00 H new ATOM 305 N ASP A 19 -2.134 -9.254 1.262 1.00 0.00 N ATOM 306 CA ASP A 19 -1.696 -8.428 2.381 1.00 0.00 C ATOM 307 C ASP A 19 -1.961 -6.952 2.128 1.00 0.00 C ATOM 308 O ASP A 19 -2.513 -6.263 2.985 1.00 0.00 O ATOM 309 CB ASP A 19 -0.210 -8.654 2.661 1.00 0.00 C ATOM 310 CG ASP A 19 0.025 -9.731 3.703 1.00 0.00 C ATOM 311 OD1 ASP A 19 0.845 -10.638 3.446 1.00 0.00 O ATOM 312 OD2 ASP A 19 -0.611 -9.667 4.776 1.00 0.00 O ATOM 0 H ASP A 19 -1.405 -9.468 0.582 1.00 0.00 H new ATOM 0 HA ASP A 19 -2.275 -8.726 3.255 1.00 0.00 H new ATOM 0 HB2 ASP A 19 0.293 -8.932 1.735 1.00 0.00 H new ATOM 0 HB3 ASP A 19 0.239 -7.720 3.000 1.00 0.00 H new ATOM 317 N VAL A 20 -1.564 -6.460 0.961 1.00 0.00 N ATOM 318 CA VAL A 20 -1.771 -5.057 0.640 1.00 0.00 C ATOM 319 C VAL A 20 -3.257 -4.707 0.649 1.00 0.00 C ATOM 320 O VAL A 20 -3.648 -3.686 1.205 1.00 0.00 O ATOM 321 CB VAL A 20 -1.137 -4.663 -0.714 1.00 0.00 C ATOM 322 CG1 VAL A 20 0.304 -5.141 -0.785 1.00 0.00 C ATOM 323 CG2 VAL A 20 -1.938 -5.217 -1.876 1.00 0.00 C ATOM 0 H VAL A 20 -1.103 -7.004 0.231 1.00 0.00 H new ATOM 0 HA VAL A 20 -1.267 -4.482 1.417 1.00 0.00 H new ATOM 0 HB VAL A 20 -1.148 -3.575 -0.787 1.00 0.00 H new ATOM 0 HG11 VAL A 20 0.735 -4.855 -1.744 1.00 0.00 H new ATOM 0 HG12 VAL A 20 0.879 -4.685 0.021 1.00 0.00 H new ATOM 0 HG13 VAL A 20 0.333 -6.226 -0.683 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -1.468 -4.924 -2.815 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -1.970 -6.305 -1.810 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -2.953 -4.822 -1.839 1.00 0.00 H new ATOM 333 N TYR A 21 -4.092 -5.561 0.051 1.00 0.00 N ATOM 334 CA TYR A 21 -5.530 -5.303 0.031 1.00 0.00 C ATOM 335 C TYR A 21 -6.099 -5.380 1.442 1.00 0.00 C ATOM 336 O TYR A 21 -6.868 -4.508 1.846 1.00 0.00 O ATOM 337 CB TYR A 21 -6.280 -6.270 -0.897 1.00 0.00 C ATOM 338 CG TYR A 21 -7.546 -5.683 -1.479 1.00 0.00 C ATOM 339 CD1 TYR A 21 -8.724 -6.420 -1.514 1.00 0.00 C ATOM 340 CD2 TYR A 21 -7.564 -4.394 -1.996 1.00 0.00 C ATOM 341 CE1 TYR A 21 -9.883 -5.888 -2.046 1.00 0.00 C ATOM 342 CE2 TYR A 21 -8.720 -3.855 -2.528 1.00 0.00 C ATOM 343 CZ TYR A 21 -9.876 -4.605 -2.551 1.00 0.00 C ATOM 344 OH TYR A 21 -11.028 -4.072 -3.082 1.00 0.00 O ATOM 0 H TYR A 21 -3.803 -6.420 -0.417 1.00 0.00 H new ATOM 0 HA TYR A 21 -5.674 -4.297 -0.363 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -5.619 -6.567 -1.711 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -6.529 -7.174 -0.342 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -8.734 -7.425 -1.119 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -6.660 -3.803 -1.982 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -10.790 -6.474 -2.066 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -8.718 -2.850 -2.924 1.00 0.00 H new ATOM 0 HH TYR A 21 -10.853 -3.159 -3.393 1.00 0.00 H new ATOM 354 N HIS A 22 -5.715 -6.407 2.208 1.00 0.00 N ATOM 355 CA HIS A 22 -6.210 -6.524 3.572 1.00 0.00 C ATOM 356 C HIS A 22 -5.682 -5.371 4.415 1.00 0.00 C ATOM 357 O HIS A 22 -6.430 -4.752 5.171 1.00 0.00 O ATOM 358 CB HIS A 22 -5.810 -7.865 4.188 1.00 0.00 C ATOM 359 CG HIS A 22 -6.825 -8.411 5.143 1.00 0.00 C ATOM 360 ND1 HIS A 22 -6.698 -9.641 5.754 1.00 0.00 N ATOM 361 CD2 HIS A 22 -7.992 -7.890 5.592 1.00 0.00 C ATOM 362 CE1 HIS A 22 -7.742 -9.853 6.534 1.00 0.00 C ATOM 363 NE2 HIS A 22 -8.542 -8.806 6.454 1.00 0.00 N ATOM 0 H HIS A 22 -5.080 -7.148 1.912 1.00 0.00 H new ATOM 0 HA HIS A 22 -7.299 -6.479 3.550 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -5.648 -8.589 3.389 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -4.860 -7.747 4.709 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -8.412 -6.932 5.322 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -7.913 -10.734 7.135 1.00 0.00 H new ATOM 0 HE2 HIS A 22 -9.425 -8.696 6.952 1.00 0.00 H new ATOM 372 N THR A 23 -4.395 -5.067 4.270 1.00 0.00 N ATOM 373 CA THR A 23 -3.801 -3.963 5.012 1.00 0.00 C ATOM 374 C THR A 23 -4.438 -2.649 4.578 1.00 0.00 C ATOM 375 O THR A 23 -4.800 -1.812 5.407 1.00 0.00 O ATOM 376 CB THR A 23 -2.295 -3.897 4.800 1.00 0.00 C ATOM 377 OG1 THR A 23 -1.979 -3.874 3.421 1.00 0.00 O ATOM 378 CG2 THR A 23 -1.546 -5.052 5.428 1.00 0.00 C ATOM 0 H THR A 23 -3.752 -5.563 3.653 1.00 0.00 H new ATOM 0 HA THR A 23 -3.987 -4.131 6.073 1.00 0.00 H new ATOM 0 HB THR A 23 -1.979 -2.976 5.290 1.00 0.00 H new ATOM 0 HG1 THR A 23 -1.925 -4.792 3.082 1.00 0.00 H new ATOM 0 HG21 THR A 23 -0.479 -4.940 5.237 1.00 0.00 H new ATOM 0 HG22 THR A 23 -1.724 -5.059 6.503 1.00 0.00 H new ATOM 0 HG23 THR A 23 -1.895 -5.990 4.996 1.00 0.00 H new ATOM 386 N LEU A 24 -4.602 -2.486 3.267 1.00 0.00 N ATOM 387 CA LEU A 24 -5.229 -1.286 2.726 1.00 0.00 C ATOM 388 C LEU A 24 -6.608 -1.097 3.351 1.00 0.00 C ATOM 389 O LEU A 24 -7.172 -0.007 3.311 1.00 0.00 O ATOM 390 CB LEU A 24 -5.357 -1.375 1.201 1.00 0.00 C ATOM 391 CG LEU A 24 -4.324 -0.567 0.406 1.00 0.00 C ATOM 392 CD1 LEU A 24 -4.224 0.853 0.939 1.00 0.00 C ATOM 393 CD2 LEU A 24 -2.963 -1.243 0.443 1.00 0.00 C ATOM 0 H LEU A 24 -4.311 -3.166 2.565 1.00 0.00 H new ATOM 0 HA LEU A 24 -4.599 -0.430 2.968 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.279 -2.422 0.907 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -6.354 -1.038 0.917 1.00 0.00 H new ATOM 0 HG LEU A 24 -4.658 -0.524 -0.631 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -3.485 1.408 0.360 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -5.194 1.343 0.854 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -3.921 0.828 1.986 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -2.247 -0.651 -0.128 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -2.625 -1.324 1.476 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -3.040 -2.239 0.007 1.00 0.00 H new ATOM 405 N LYS A 25 -7.147 -2.173 3.923 1.00 0.00 N ATOM 406 CA LYS A 25 -8.458 -2.126 4.544 1.00 0.00 C ATOM 407 C LYS A 25 -8.474 -1.242 5.785 1.00 0.00 C ATOM 408 O LYS A 25 -9.368 -0.413 5.941 1.00 0.00 O ATOM 409 CB LYS A 25 -8.937 -3.535 4.898 1.00 0.00 C ATOM 410 CG LYS A 25 -10.408 -3.603 5.278 1.00 0.00 C ATOM 411 CD LYS A 25 -11.299 -3.037 4.182 1.00 0.00 C ATOM 412 CE LYS A 25 -12.020 -1.779 4.641 1.00 0.00 C ATOM 413 NZ LYS A 25 -13.173 -2.093 5.530 1.00 0.00 N ATOM 0 H LYS A 25 -6.692 -3.085 3.966 1.00 0.00 H new ATOM 0 HA LYS A 25 -9.140 -1.687 3.816 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.760 -4.194 4.048 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.339 -3.915 5.726 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -10.686 -4.639 5.474 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.571 -3.049 6.202 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.696 -2.811 3.302 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -12.030 -3.788 3.883 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -11.320 -1.132 5.169 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -12.373 -1.225 3.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -13.638 -1.209 5.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -13.854 -2.690 5.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.834 -2.599 6.373 1.00 0.00 H new ATOM 427 N LEU A 26 -7.490 -1.402 6.671 1.00 0.00 N ATOM 428 CA LEU A 26 -7.452 -0.577 7.876 1.00 0.00 C ATOM 429 C LEU A 26 -7.083 0.845 7.507 1.00 0.00 C ATOM 430 O LEU A 26 -7.703 1.800 7.965 1.00 0.00 O ATOM 431 CB LEU A 26 -6.477 -1.111 8.929 1.00 0.00 C ATOM 432 CG LEU A 26 -6.166 -2.598 8.844 1.00 0.00 C ATOM 433 CD1 LEU A 26 -5.027 -2.820 7.874 1.00 0.00 C ATOM 434 CD2 LEU A 26 -5.824 -3.153 10.220 1.00 0.00 C ATOM 0 H LEU A 26 -6.729 -2.076 6.581 1.00 0.00 H new ATOM 0 HA LEU A 26 -8.447 -0.606 8.320 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -5.542 -0.557 8.846 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -6.886 -0.900 9.917 1.00 0.00 H new ATOM 0 HG LEU A 26 -7.046 -3.129 8.482 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -4.804 -3.885 7.813 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -5.311 -2.452 6.888 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -4.144 -2.284 8.221 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -5.605 -4.218 10.139 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -4.952 -2.632 10.616 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -6.670 -3.007 10.892 1.00 0.00 H new ATOM 446 N VAL A 27 -6.075 0.972 6.657 1.00 0.00 N ATOM 447 CA VAL A 27 -5.623 2.280 6.202 1.00 0.00 C ATOM 448 C VAL A 27 -6.708 2.981 5.410 1.00 0.00 C ATOM 449 O VAL A 27 -6.935 4.174 5.579 1.00 0.00 O ATOM 450 CB VAL A 27 -4.364 2.193 5.324 1.00 0.00 C ATOM 451 CG1 VAL A 27 -3.123 2.569 6.110 1.00 0.00 C ATOM 452 CG2 VAL A 27 -4.219 0.825 4.741 1.00 0.00 C ATOM 0 H VAL A 27 -5.554 0.186 6.268 1.00 0.00 H new ATOM 0 HA VAL A 27 -5.384 2.846 7.102 1.00 0.00 H new ATOM 0 HB VAL A 27 -4.477 2.906 4.508 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.248 2.499 5.464 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.221 3.590 6.478 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -3.007 1.889 6.954 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -3.322 0.786 4.123 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -4.138 0.094 5.545 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -5.091 0.596 4.129 1.00 0.00 H new ATOM 462 N SER A 28 -7.372 2.249 4.530 1.00 0.00 N ATOM 463 CA SER A 28 -8.413 2.852 3.722 1.00 0.00 C ATOM 464 C SER A 28 -9.571 3.329 4.588 1.00 0.00 C ATOM 465 O SER A 28 -10.180 4.362 4.307 1.00 0.00 O ATOM 466 CB SER A 28 -8.916 1.879 2.653 1.00 0.00 C ATOM 467 OG SER A 28 -10.024 2.419 1.954 1.00 0.00 O ATOM 0 H SER A 28 -7.212 1.256 4.360 1.00 0.00 H new ATOM 0 HA SER A 28 -7.979 3.717 3.221 1.00 0.00 H new ATOM 0 HB2 SER A 28 -8.112 1.657 1.951 1.00 0.00 H new ATOM 0 HB3 SER A 28 -9.201 0.936 3.120 1.00 0.00 H new ATOM 0 HG SER A 28 -9.746 3.227 1.474 1.00 0.00 H new ATOM 473 N VAL A 29 -9.860 2.582 5.647 1.00 0.00 N ATOM 474 CA VAL A 29 -10.934 2.935 6.558 1.00 0.00 C ATOM 475 C VAL A 29 -10.463 4.011 7.529 1.00 0.00 C ATOM 476 O VAL A 29 -11.143 5.013 7.749 1.00 0.00 O ATOM 477 CB VAL A 29 -11.418 1.683 7.329 1.00 0.00 C ATOM 478 CG1 VAL A 29 -11.157 1.792 8.824 1.00 0.00 C ATOM 479 CG2 VAL A 29 -12.892 1.421 7.054 1.00 0.00 C ATOM 0 H VAL A 29 -9.362 1.727 5.894 1.00 0.00 H new ATOM 0 HA VAL A 29 -11.771 3.328 5.981 1.00 0.00 H new ATOM 0 HB VAL A 29 -10.838 0.835 6.965 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -11.514 0.890 9.322 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -10.087 1.905 8.999 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -11.683 2.659 9.223 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -13.213 0.537 7.605 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -13.480 2.281 7.373 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -13.039 1.257 5.987 1.00 0.00 H new ATOM 489 N TYR A 30 -9.291 3.782 8.104 1.00 0.00 N ATOM 490 CA TYR A 30 -8.709 4.719 9.056 1.00 0.00 C ATOM 491 C TYR A 30 -8.244 5.993 8.364 1.00 0.00 C ATOM 492 O TYR A 30 -8.186 7.055 8.985 1.00 0.00 O ATOM 493 CB TYR A 30 -7.535 4.074 9.796 1.00 0.00 C ATOM 494 CG TYR A 30 -7.956 3.203 10.957 1.00 0.00 C ATOM 495 CD1 TYR A 30 -7.710 1.836 10.952 1.00 0.00 C ATOM 496 CD2 TYR A 30 -8.598 3.749 12.062 1.00 0.00 C ATOM 497 CE1 TYR A 30 -8.093 1.038 12.013 1.00 0.00 C ATOM 498 CE2 TYR A 30 -8.984 2.958 13.127 1.00 0.00 C ATOM 499 CZ TYR A 30 -8.729 1.604 13.097 1.00 0.00 C ATOM 500 OH TYR A 30 -9.113 0.813 14.155 1.00 0.00 O ATOM 0 H TYR A 30 -8.723 2.953 7.928 1.00 0.00 H new ATOM 0 HA TYR A 30 -9.485 4.982 9.775 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -6.959 3.473 9.092 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -6.873 4.858 10.163 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -7.211 1.389 10.105 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -8.799 4.810 12.089 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -7.895 -0.024 11.993 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -9.483 3.398 13.978 1.00 0.00 H new ATOM 0 HH TYR A 30 -9.547 1.367 14.837 1.00 0.00 H new ATOM 510 N LEU A 31 -7.910 5.897 7.077 1.00 0.00 N ATOM 511 CA LEU A 31 -7.454 7.062 6.334 1.00 0.00 C ATOM 512 C LEU A 31 -8.519 7.517 5.339 1.00 0.00 C ATOM 513 O LEU A 31 -8.330 8.506 4.630 1.00 0.00 O ATOM 514 CB LEU A 31 -6.144 6.763 5.585 1.00 0.00 C ATOM 515 CG LEU A 31 -5.047 5.992 6.353 1.00 0.00 C ATOM 516 CD1 LEU A 31 -3.682 6.606 6.082 1.00 0.00 C ATOM 517 CD2 LEU A 31 -5.314 5.957 7.853 1.00 0.00 C ATOM 0 H LEU A 31 -7.947 5.033 6.536 1.00 0.00 H new ATOM 0 HA LEU A 31 -7.271 7.860 7.053 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -6.391 6.194 4.688 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -5.721 7.712 5.254 1.00 0.00 H new ATOM 0 HG LEU A 31 -5.061 4.964 5.992 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -2.919 6.053 6.629 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -3.468 6.560 5.014 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -3.680 7.646 6.408 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -4.517 5.405 8.352 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -5.347 6.975 8.240 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -6.269 5.466 8.041 1.00 0.00 H new ATOM 529 N ASN A 32 -9.635 6.786 5.277 1.00 0.00 N ATOM 530 CA ASN A 32 -10.714 7.118 4.352 1.00 0.00 C ATOM 531 C ASN A 32 -10.148 7.344 2.957 1.00 0.00 C ATOM 532 O ASN A 32 -10.619 8.200 2.209 1.00 0.00 O ATOM 533 CB ASN A 32 -11.459 8.369 4.824 1.00 0.00 C ATOM 534 CG ASN A 32 -12.890 8.413 4.323 1.00 0.00 C ATOM 535 OD1 ASN A 32 -13.560 7.385 4.232 1.00 0.00 O ATOM 536 ND2 ASN A 32 -13.365 9.609 3.993 1.00 0.00 N ATOM 0 H ASN A 32 -9.812 5.964 5.855 1.00 0.00 H new ATOM 0 HA ASN A 32 -11.418 6.286 4.323 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -11.457 8.400 5.914 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -10.929 9.256 4.479 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -14.321 9.701 3.648 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -12.774 10.435 4.084 1.00 0.00 H new ATOM 543 N ARG A 33 -9.115 6.575 2.629 1.00 0.00 N ATOM 544 CA ARG A 33 -8.454 6.694 1.336 1.00 0.00 C ATOM 545 C ARG A 33 -8.462 5.375 0.575 1.00 0.00 C ATOM 546 O ARG A 33 -8.240 4.312 1.153 1.00 0.00 O ATOM 547 CB ARG A 33 -7.010 7.158 1.536 1.00 0.00 C ATOM 548 CG ARG A 33 -6.899 8.587 2.047 1.00 0.00 C ATOM 549 CD ARG A 33 -5.790 9.350 1.340 1.00 0.00 C ATOM 550 NE ARG A 33 -6.108 10.769 1.199 1.00 0.00 N ATOM 551 CZ ARG A 33 -6.892 11.263 0.243 1.00 0.00 C ATOM 552 NH1 ARG A 33 -7.448 10.457 -0.654 1.00 0.00 N ATOM 553 NH2 ARG A 33 -7.125 12.568 0.185 1.00 0.00 N ATOM 0 H ARG A 33 -8.718 5.863 3.242 1.00 0.00 H new ATOM 0 HA ARG A 33 -9.005 7.427 0.747 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -6.516 6.489 2.240 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -6.476 7.076 0.590 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -7.848 9.102 1.898 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -6.707 8.576 3.120 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -4.861 9.240 1.899 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -5.622 8.916 0.354 1.00 0.00 H new ATOM 0 HE ARG A 33 -5.705 11.420 1.873 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -7.276 9.453 -0.613 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -8.048 10.842 -1.384 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -6.704 13.192 0.873 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -7.726 12.947 -0.547 1.00 0.00 H new ATOM 567 N ASP A 34 -8.695 5.452 -0.731 1.00 0.00 N ATOM 568 CA ASP A 34 -8.704 4.263 -1.573 1.00 0.00 C ATOM 569 C ASP A 34 -7.359 3.556 -1.475 1.00 0.00 C ATOM 570 O ASP A 34 -6.379 4.143 -1.016 1.00 0.00 O ATOM 571 CB ASP A 34 -8.998 4.633 -3.028 1.00 0.00 C ATOM 572 CG ASP A 34 -9.237 3.413 -3.896 1.00 0.00 C ATOM 573 OD1 ASP A 34 -9.765 2.407 -3.375 1.00 0.00 O ATOM 574 OD2 ASP A 34 -8.896 3.462 -5.096 1.00 0.00 O ATOM 0 H ASP A 34 -8.880 6.324 -1.228 1.00 0.00 H new ATOM 0 HA ASP A 34 -9.490 3.593 -1.225 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -9.874 5.280 -3.066 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -8.162 5.205 -3.431 1.00 0.00 H new ATOM 579 N MET A 35 -7.305 2.300 -1.898 1.00 0.00 N ATOM 580 CA MET A 35 -6.070 1.546 -1.841 1.00 0.00 C ATOM 581 C MET A 35 -4.980 2.255 -2.643 1.00 0.00 C ATOM 582 O MET A 35 -3.882 2.495 -2.141 1.00 0.00 O ATOM 583 CB MET A 35 -6.300 0.126 -2.365 1.00 0.00 C ATOM 584 CG MET A 35 -5.178 -0.380 -3.241 1.00 0.00 C ATOM 585 SD MET A 35 -5.257 -2.157 -3.533 1.00 0.00 S ATOM 586 CE MET A 35 -3.573 -2.637 -3.161 1.00 0.00 C ATOM 0 H MET A 35 -8.100 1.788 -2.281 1.00 0.00 H new ATOM 0 HA MET A 35 -5.739 1.481 -0.805 1.00 0.00 H new ATOM 0 HB2 MET A 35 -6.423 -0.550 -1.519 1.00 0.00 H new ATOM 0 HB3 MET A 35 -7.232 0.102 -2.931 1.00 0.00 H new ATOM 0 HG2 MET A 35 -5.208 0.141 -4.198 1.00 0.00 H new ATOM 0 HG3 MET A 35 -4.223 -0.136 -2.775 1.00 0.00 H new ATOM 0 HE1 MET A 35 -3.371 -3.619 -3.590 1.00 0.00 H new ATOM 0 HE2 MET A 35 -2.884 -1.907 -3.586 1.00 0.00 H new ATOM 0 HE3 MET A 35 -3.437 -2.678 -2.080 1.00 0.00 H new ATOM 596 N THR A 36 -5.293 2.594 -3.891 1.00 0.00 N ATOM 597 CA THR A 36 -4.340 3.282 -4.756 1.00 0.00 C ATOM 598 C THR A 36 -3.951 4.624 -4.148 1.00 0.00 C ATOM 599 O THR A 36 -2.818 5.078 -4.294 1.00 0.00 O ATOM 600 CB THR A 36 -4.933 3.485 -6.158 1.00 0.00 C ATOM 601 OG1 THR A 36 -6.108 2.712 -6.325 1.00 0.00 O ATOM 602 CG2 THR A 36 -3.983 3.121 -7.280 1.00 0.00 C ATOM 0 H THR A 36 -6.197 2.404 -4.324 1.00 0.00 H new ATOM 0 HA THR A 36 -3.446 2.665 -4.846 1.00 0.00 H new ATOM 0 HB THR A 36 -5.147 4.552 -6.221 1.00 0.00 H new ATOM 0 HG1 THR A 36 -6.470 2.857 -7.224 1.00 0.00 H new ATOM 0 HG21 THR A 36 -4.471 3.290 -8.240 1.00 0.00 H new ATOM 0 HG22 THR A 36 -3.088 3.740 -7.214 1.00 0.00 H new ATOM 0 HG23 THR A 36 -3.705 2.071 -7.195 1.00 0.00 H new ATOM 610 N GLU A 37 -4.899 5.251 -3.457 1.00 0.00 N ATOM 611 CA GLU A 37 -4.650 6.538 -2.818 1.00 0.00 C ATOM 612 C GLU A 37 -3.722 6.367 -1.620 1.00 0.00 C ATOM 613 O GLU A 37 -2.835 7.187 -1.387 1.00 0.00 O ATOM 614 CB GLU A 37 -5.969 7.177 -2.377 1.00 0.00 C ATOM 615 CG GLU A 37 -6.364 8.388 -3.206 1.00 0.00 C ATOM 616 CD GLU A 37 -7.046 8.007 -4.506 1.00 0.00 C ATOM 617 OE1 GLU A 37 -8.271 8.224 -4.620 1.00 0.00 O ATOM 618 OE2 GLU A 37 -6.355 7.491 -5.410 1.00 0.00 O ATOM 0 H GLU A 37 -5.844 4.889 -3.326 1.00 0.00 H new ATOM 0 HA GLU A 37 -4.167 7.195 -3.541 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -6.762 6.432 -2.437 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -5.888 7.473 -1.331 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -7.031 9.022 -2.622 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -5.475 8.979 -3.426 1.00 0.00 H new ATOM 625 N ILE A 38 -3.931 5.290 -0.867 1.00 0.00 N ATOM 626 CA ILE A 38 -3.112 5.001 0.304 1.00 0.00 C ATOM 627 C ILE A 38 -1.749 4.458 -0.109 1.00 0.00 C ATOM 628 O ILE A 38 -0.721 4.895 0.402 1.00 0.00 O ATOM 629 CB ILE A 38 -3.802 3.977 1.235 1.00 0.00 C ATOM 630 CG1 ILE A 38 -4.804 4.655 2.178 1.00 0.00 C ATOM 631 CG2 ILE A 38 -2.781 3.210 2.058 1.00 0.00 C ATOM 632 CD1 ILE A 38 -4.255 5.892 2.856 1.00 0.00 C ATOM 0 H ILE A 38 -4.662 4.603 -1.049 1.00 0.00 H new ATOM 0 HA ILE A 38 -2.982 5.939 0.844 1.00 0.00 H new ATOM 0 HB ILE A 38 -4.341 3.282 0.592 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -5.696 4.926 1.613 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -5.114 3.940 2.940 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -3.295 2.497 2.703 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -2.105 2.674 1.392 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -2.210 3.907 2.671 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -5.018 6.319 3.507 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -3.380 5.624 3.449 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -3.971 6.625 2.101 1.00 0.00 H new ATOM 644 N ILE A 39 -1.741 3.503 -1.036 1.00 0.00 N ATOM 645 CA ILE A 39 -0.489 2.922 -1.495 1.00 0.00 C ATOM 646 C ILE A 39 0.361 3.987 -2.169 1.00 0.00 C ATOM 647 O ILE A 39 1.586 3.987 -2.057 1.00 0.00 O ATOM 648 CB ILE A 39 -0.719 1.752 -2.475 1.00 0.00 C ATOM 649 CG1 ILE A 39 -1.195 2.275 -3.830 1.00 0.00 C ATOM 650 CG2 ILE A 39 -1.720 0.762 -1.899 1.00 0.00 C ATOM 651 CD1 ILE A 39 -0.070 2.480 -4.820 1.00 0.00 C ATOM 0 H ILE A 39 -2.578 3.121 -1.477 1.00 0.00 H new ATOM 0 HA ILE A 39 0.028 2.529 -0.619 1.00 0.00 H new ATOM 0 HB ILE A 39 0.228 1.233 -2.622 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -1.916 1.573 -4.250 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -1.718 3.220 -3.684 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -1.870 -0.056 -2.604 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -1.339 0.365 -0.958 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -2.670 1.266 -1.722 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -0.476 2.852 -5.761 1.00 0.00 H new ATOM 0 HD12 ILE A 39 0.640 3.204 -4.420 1.00 0.00 H new ATOM 0 HD13 ILE A 39 0.439 1.532 -4.994 1.00 0.00 H new ATOM 663 N GLU A 40 -0.309 4.906 -2.857 1.00 0.00 N ATOM 664 CA GLU A 40 0.377 5.991 -3.536 1.00 0.00 C ATOM 665 C GLU A 40 0.687 7.107 -2.548 1.00 0.00 C ATOM 666 O GLU A 40 1.621 7.884 -2.750 1.00 0.00 O ATOM 667 CB GLU A 40 -0.466 6.533 -4.691 1.00 0.00 C ATOM 668 CG GLU A 40 -0.603 5.565 -5.854 1.00 0.00 C ATOM 669 CD GLU A 40 0.725 5.261 -6.520 1.00 0.00 C ATOM 670 OE1 GLU A 40 0.983 4.075 -6.816 1.00 0.00 O ATOM 671 OE2 GLU A 40 1.507 6.208 -6.744 1.00 0.00 O ATOM 0 H GLU A 40 -1.324 4.918 -2.957 1.00 0.00 H new ATOM 0 HA GLU A 40 1.310 5.604 -3.947 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -1.460 6.782 -4.318 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -0.019 7.460 -5.052 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -1.048 4.636 -5.498 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -1.288 5.984 -6.592 1.00 0.00 H new ATOM 678 N GLU A 41 -0.086 7.171 -1.465 1.00 0.00 N ATOM 679 CA GLU A 41 0.143 8.184 -0.445 1.00 0.00 C ATOM 680 C GLU A 41 1.212 7.699 0.526 1.00 0.00 C ATOM 681 O GLU A 41 1.977 8.492 1.077 1.00 0.00 O ATOM 682 CB GLU A 41 -1.159 8.493 0.303 1.00 0.00 C ATOM 683 CG GLU A 41 -0.968 9.332 1.558 1.00 0.00 C ATOM 684 CD GLU A 41 -2.186 9.311 2.462 1.00 0.00 C ATOM 685 OE1 GLU A 41 -2.929 8.308 2.434 1.00 0.00 O ATOM 686 OE2 GLU A 41 -2.395 10.298 3.198 1.00 0.00 O ATOM 0 H GLU A 41 -0.865 6.541 -1.275 1.00 0.00 H new ATOM 0 HA GLU A 41 0.487 9.101 -0.924 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -1.838 9.015 -0.371 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -1.641 7.554 0.576 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -0.104 8.963 2.110 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -0.749 10.361 1.273 1.00 0.00 H new ATOM 693 N ALA A 42 1.261 6.385 0.723 1.00 0.00 N ATOM 694 CA ALA A 42 2.234 5.785 1.620 1.00 0.00 C ATOM 695 C ALA A 42 3.607 5.737 0.967 1.00 0.00 C ATOM 696 O ALA A 42 4.621 6.010 1.608 1.00 0.00 O ATOM 697 CB ALA A 42 1.790 4.386 2.022 1.00 0.00 C ATOM 0 H ALA A 42 0.636 5.717 0.271 1.00 0.00 H new ATOM 0 HA ALA A 42 2.301 6.401 2.516 1.00 0.00 H new ATOM 0 HB1 ALA A 42 2.529 3.949 2.694 1.00 0.00 H new ATOM 0 HB2 ALA A 42 0.826 4.442 2.529 1.00 0.00 H new ATOM 0 HB3 ALA A 42 1.696 3.764 1.132 1.00 0.00 H new ATOM 703 N VAL A 43 3.631 5.396 -0.318 1.00 0.00 N ATOM 704 CA VAL A 43 4.882 5.321 -1.064 1.00 0.00 C ATOM 705 C VAL A 43 5.676 6.600 -0.913 1.00 0.00 C ATOM 706 O VAL A 43 6.784 6.606 -0.380 1.00 0.00 O ATOM 707 CB VAL A 43 4.635 5.071 -2.572 1.00 0.00 C ATOM 708 CG1 VAL A 43 3.534 5.956 -3.113 1.00 0.00 C ATOM 709 CG2 VAL A 43 5.901 5.291 -3.377 1.00 0.00 C ATOM 0 H VAL A 43 2.800 5.168 -0.863 1.00 0.00 H new ATOM 0 HA VAL A 43 5.443 4.483 -0.651 1.00 0.00 H new ATOM 0 HB VAL A 43 4.324 4.031 -2.672 1.00 0.00 H new ATOM 0 HG11 VAL A 43 3.391 5.751 -4.174 1.00 0.00 H new ATOM 0 HG12 VAL A 43 2.607 5.754 -2.576 1.00 0.00 H new ATOM 0 HG13 VAL A 43 3.810 7.002 -2.980 1.00 0.00 H new ATOM 0 HG21 VAL A 43 5.698 5.108 -4.432 1.00 0.00 H new ATOM 0 HG22 VAL A 43 6.242 6.318 -3.246 1.00 0.00 H new ATOM 0 HG23 VAL A 43 6.675 4.605 -3.033 1.00 0.00 H new ATOM 719 N VAL A 44 5.089 7.678 -1.388 1.00 0.00 N ATOM 720 CA VAL A 44 5.711 8.983 -1.321 1.00 0.00 C ATOM 721 C VAL A 44 6.080 9.315 0.115 1.00 0.00 C ATOM 722 O VAL A 44 7.239 9.567 0.428 1.00 0.00 O ATOM 723 CB VAL A 44 4.767 10.059 -1.893 1.00 0.00 C ATOM 724 CG1 VAL A 44 4.796 11.344 -1.069 1.00 0.00 C ATOM 725 CG2 VAL A 44 5.099 10.346 -3.348 1.00 0.00 C ATOM 0 H VAL A 44 4.170 7.675 -1.830 1.00 0.00 H new ATOM 0 HA VAL A 44 6.621 8.966 -1.921 1.00 0.00 H new ATOM 0 HB VAL A 44 3.753 9.662 -1.837 1.00 0.00 H new ATOM 0 HG11 VAL A 44 4.116 12.074 -1.509 1.00 0.00 H new ATOM 0 HG12 VAL A 44 4.485 11.128 -0.047 1.00 0.00 H new ATOM 0 HG13 VAL A 44 5.808 11.749 -1.062 1.00 0.00 H new ATOM 0 HG21 VAL A 44 4.421 11.108 -3.732 1.00 0.00 H new ATOM 0 HG22 VAL A 44 6.126 10.703 -3.423 1.00 0.00 H new ATOM 0 HG23 VAL A 44 4.988 9.433 -3.933 1.00 0.00 H new ATOM 735 N MET A 45 5.084 9.301 0.986 1.00 0.00 N ATOM 736 CA MET A 45 5.314 9.594 2.390 1.00 0.00 C ATOM 737 C MET A 45 6.414 8.705 2.953 1.00 0.00 C ATOM 738 O MET A 45 7.135 9.106 3.867 1.00 0.00 O ATOM 739 CB MET A 45 4.029 9.418 3.199 1.00 0.00 C ATOM 740 CG MET A 45 3.964 10.316 4.421 1.00 0.00 C ATOM 741 SD MET A 45 4.075 12.069 4.001 1.00 0.00 S ATOM 742 CE MET A 45 5.211 12.646 5.261 1.00 0.00 C ATOM 0 H MET A 45 4.115 9.091 0.747 1.00 0.00 H new ATOM 0 HA MET A 45 5.633 10.633 2.468 1.00 0.00 H new ATOM 0 HB2 MET A 45 3.172 9.625 2.558 1.00 0.00 H new ATOM 0 HB3 MET A 45 3.946 8.378 3.515 1.00 0.00 H new ATOM 0 HG2 MET A 45 3.031 10.132 4.953 1.00 0.00 H new ATOM 0 HG3 MET A 45 4.775 10.057 5.101 1.00 0.00 H new ATOM 0 HE1 MET A 45 5.478 13.684 5.062 1.00 0.00 H new ATOM 0 HE2 MET A 45 4.736 12.575 6.239 1.00 0.00 H new ATOM 0 HE3 MET A 45 6.111 12.031 5.249 1.00 0.00 H new ATOM 752 N TRP A 46 6.560 7.502 2.397 1.00 0.00 N ATOM 753 CA TRP A 46 7.599 6.596 2.859 1.00 0.00 C ATOM 754 C TRP A 46 8.957 7.104 2.413 1.00 0.00 C ATOM 755 O TRP A 46 9.843 7.327 3.234 1.00 0.00 O ATOM 756 CB TRP A 46 7.359 5.177 2.336 1.00 0.00 C ATOM 757 CG TRP A 46 8.408 4.199 2.771 1.00 0.00 C ATOM 758 CD1 TRP A 46 9.339 3.590 1.979 1.00 0.00 C ATOM 759 CD2 TRP A 46 8.633 3.716 4.099 1.00 0.00 C ATOM 760 NE1 TRP A 46 10.129 2.757 2.735 1.00 0.00 N ATOM 761 CE2 TRP A 46 9.715 2.818 4.040 1.00 0.00 C ATOM 762 CE3 TRP A 46 8.025 3.956 5.336 1.00 0.00 C ATOM 763 CZ2 TRP A 46 10.200 2.160 5.167 1.00 0.00 C ATOM 764 CZ3 TRP A 46 8.508 3.303 6.453 1.00 0.00 C ATOM 765 CH2 TRP A 46 9.587 2.415 6.363 1.00 0.00 C ATOM 0 H TRP A 46 5.980 7.141 1.639 1.00 0.00 H new ATOM 0 HA TRP A 46 7.572 6.560 3.948 1.00 0.00 H new ATOM 0 HB2 TRP A 46 6.384 4.831 2.680 1.00 0.00 H new ATOM 0 HB3 TRP A 46 7.323 5.200 1.247 1.00 0.00 H new ATOM 0 HD1 TRP A 46 9.440 3.741 0.914 1.00 0.00 H new ATOM 0 HE1 TRP A 46 10.898 2.187 2.382 1.00 0.00 H new ATOM 0 HE3 TRP A 46 7.193 4.640 5.416 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 11.030 1.473 5.099 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 8.045 3.480 7.413 1.00 0.00 H new ATOM 0 HH2 TRP A 46 9.942 1.922 7.256 1.00 0.00 H new ATOM 776 N LEU A 47 9.112 7.312 1.113 1.00 0.00 N ATOM 777 CA LEU A 47 10.365 7.828 0.582 1.00 0.00 C ATOM 778 C LEU A 47 10.662 9.184 1.186 1.00 0.00 C ATOM 779 O LEU A 47 11.789 9.484 1.574 1.00 0.00 O ATOM 780 CB LEU A 47 10.316 7.998 -0.937 1.00 0.00 C ATOM 781 CG LEU A 47 8.968 8.411 -1.524 1.00 0.00 C ATOM 782 CD1 LEU A 47 8.914 9.921 -1.677 1.00 0.00 C ATOM 783 CD2 LEU A 47 8.737 7.728 -2.864 1.00 0.00 C ATOM 0 H LEU A 47 8.393 7.133 0.412 1.00 0.00 H new ATOM 0 HA LEU A 47 11.139 7.104 0.837 1.00 0.00 H new ATOM 0 HB2 LEU A 47 11.058 8.744 -1.223 1.00 0.00 H new ATOM 0 HB3 LEU A 47 10.617 7.057 -1.397 1.00 0.00 H new ATOM 0 HG LEU A 47 8.176 8.098 -0.844 1.00 0.00 H new ATOM 0 HD11 LEU A 47 7.950 10.210 -2.096 1.00 0.00 H new ATOM 0 HD12 LEU A 47 9.041 10.390 -0.701 1.00 0.00 H new ATOM 0 HD13 LEU A 47 9.712 10.248 -2.343 1.00 0.00 H new ATOM 0 HD21 LEU A 47 7.772 8.034 -3.267 1.00 0.00 H new ATOM 0 HD22 LEU A 47 9.527 8.013 -3.559 1.00 0.00 H new ATOM 0 HD23 LEU A 47 8.747 6.647 -2.728 1.00 0.00 H new ATOM 795 N ILE A 48 9.635 10.009 1.232 1.00 0.00 N ATOM 796 CA ILE A 48 9.760 11.344 1.753 1.00 0.00 C ATOM 797 C ILE A 48 10.295 11.337 3.176 1.00 0.00 C ATOM 798 O ILE A 48 11.190 12.112 3.513 1.00 0.00 O ATOM 799 CB ILE A 48 8.402 12.070 1.676 1.00 0.00 C ATOM 800 CG1 ILE A 48 8.493 13.210 0.676 1.00 0.00 C ATOM 801 CG2 ILE A 48 7.958 12.577 3.038 1.00 0.00 C ATOM 802 CD1 ILE A 48 8.493 12.759 -0.767 1.00 0.00 C ATOM 0 H ILE A 48 8.697 9.769 0.910 1.00 0.00 H new ATOM 0 HA ILE A 48 10.481 11.885 1.140 1.00 0.00 H new ATOM 0 HB ILE A 48 7.648 11.357 1.341 1.00 0.00 H new ATOM 0 HG12 ILE A 48 7.654 13.888 0.835 1.00 0.00 H new ATOM 0 HG13 ILE A 48 9.403 13.778 0.869 1.00 0.00 H new ATOM 0 HG21 ILE A 48 6.997 13.083 2.942 1.00 0.00 H new ATOM 0 HG22 ILE A 48 7.859 11.736 3.725 1.00 0.00 H new ATOM 0 HG23 ILE A 48 8.699 13.276 3.425 1.00 0.00 H new ATOM 0 HD11 ILE A 48 8.560 13.629 -1.420 1.00 0.00 H new ATOM 0 HD12 ILE A 48 9.347 12.106 -0.944 1.00 0.00 H new ATOM 0 HD13 ILE A 48 7.571 12.217 -0.979 1.00 0.00 H new ATOM 814 N GLN A 49 9.745 10.469 4.013 1.00 0.00 N ATOM 815 CA GLN A 49 10.187 10.397 5.392 1.00 0.00 C ATOM 816 C GLN A 49 11.426 9.513 5.543 1.00 0.00 C ATOM 817 O GLN A 49 12.249 9.735 6.431 1.00 0.00 O ATOM 818 CB GLN A 49 9.055 9.892 6.296 1.00 0.00 C ATOM 819 CG GLN A 49 8.796 8.393 6.198 1.00 0.00 C ATOM 820 CD GLN A 49 8.903 7.694 7.540 1.00 0.00 C ATOM 821 OE1 GLN A 49 8.729 8.312 8.591 1.00 0.00 O ATOM 822 NE2 GLN A 49 9.190 6.398 7.510 1.00 0.00 N ATOM 0 H GLN A 49 9.003 9.815 3.764 1.00 0.00 H new ATOM 0 HA GLN A 49 10.461 11.406 5.702 1.00 0.00 H new ATOM 0 HB2 GLN A 49 9.293 10.141 7.330 1.00 0.00 H new ATOM 0 HB3 GLN A 49 8.138 10.425 6.043 1.00 0.00 H new ATOM 0 HG2 GLN A 49 7.802 8.226 5.784 1.00 0.00 H new ATOM 0 HG3 GLN A 49 9.509 7.949 5.503 1.00 0.00 H new ATOM 0 HE21 GLN A 49 9.326 5.926 6.616 1.00 0.00 H new ATOM 0 HE22 GLN A 49 9.274 5.874 8.381 1.00 0.00 H new ATOM 831 N ASN A 50 11.538 8.492 4.693 1.00 0.00 N ATOM 832 CA ASN A 50 12.666 7.562 4.768 1.00 0.00 C ATOM 833 C ASN A 50 13.771 7.880 3.764 1.00 0.00 C ATOM 834 O ASN A 50 14.915 8.134 4.143 1.00 0.00 O ATOM 835 CB ASN A 50 12.176 6.126 4.561 1.00 0.00 C ATOM 836 CG ASN A 50 12.677 5.185 5.639 1.00 0.00 C ATOM 837 OD1 ASN A 50 13.491 4.213 5.244 1.00 0.00 O flip ATOM 838 ND2 ASN A 50 12.339 5.329 6.814 1.00 0.00 N flip ATOM 0 H ASN A 50 10.868 8.289 3.951 1.00 0.00 H new ATOM 0 HA ASN A 50 13.098 7.673 5.763 1.00 0.00 H new ATOM 0 HB2 ASN A 50 11.086 6.115 4.550 1.00 0.00 H new ATOM 0 HB3 ASN A 50 12.508 5.768 3.587 1.00 0.00 H new ATOM 0 HD21 ASN A 50 11.711 6.090 7.075 1.00 0.00 H new ATOM 0 HD22 ASN A 50 12.687 4.688 7.527 1.00 0.00 H new ATOM 845 N LYS A 51 13.428 7.832 2.485 1.00 0.00 N ATOM 846 CA LYS A 51 14.392 8.079 1.415 1.00 0.00 C ATOM 847 C LYS A 51 15.024 9.464 1.525 1.00 0.00 C ATOM 848 O LYS A 51 16.247 9.592 1.583 1.00 0.00 O ATOM 849 CB LYS A 51 13.728 7.916 0.047 1.00 0.00 C ATOM 850 CG LYS A 51 13.811 6.502 -0.509 1.00 0.00 C ATOM 851 CD LYS A 51 13.182 5.481 0.429 1.00 0.00 C ATOM 852 CE LYS A 51 14.201 4.458 0.908 1.00 0.00 C ATOM 853 NZ LYS A 51 13.641 3.569 1.963 1.00 0.00 N ATOM 0 H LYS A 51 12.484 7.623 2.159 1.00 0.00 H new ATOM 0 HA LYS A 51 15.187 7.340 1.520 1.00 0.00 H new ATOM 0 HB2 LYS A 51 12.680 8.205 0.125 1.00 0.00 H new ATOM 0 HB3 LYS A 51 14.196 8.602 -0.658 1.00 0.00 H new ATOM 0 HG2 LYS A 51 13.309 6.463 -1.476 1.00 0.00 H new ATOM 0 HG3 LYS A 51 14.855 6.241 -0.681 1.00 0.00 H new ATOM 0 HD2 LYS A 51 12.749 5.994 1.288 1.00 0.00 H new ATOM 0 HD3 LYS A 51 12.366 4.971 -0.082 1.00 0.00 H new ATOM 0 HE2 LYS A 51 14.534 3.854 0.064 1.00 0.00 H new ATOM 0 HE3 LYS A 51 15.079 4.974 1.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 14.343 2.844 2.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 13.409 4.133 2.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 12.779 3.108 1.607 1.00 0.00 H new ATOM 867 N GLU A 52 14.189 10.501 1.547 1.00 0.00 N ATOM 868 CA GLU A 52 14.677 11.876 1.644 1.00 0.00 C ATOM 869 C GLU A 52 15.755 12.004 2.718 1.00 0.00 C ATOM 870 O GLU A 52 16.647 12.846 2.623 1.00 0.00 O ATOM 871 CB GLU A 52 13.519 12.830 1.949 1.00 0.00 C ATOM 872 CG GLU A 52 13.556 14.111 1.131 1.00 0.00 C ATOM 873 CD GLU A 52 12.432 15.063 1.490 1.00 0.00 C ATOM 874 OE1 GLU A 52 11.368 14.996 0.841 1.00 0.00 O ATOM 875 OE2 GLU A 52 12.617 15.876 2.420 1.00 0.00 O ATOM 0 H GLU A 52 13.174 10.416 1.499 1.00 0.00 H new ATOM 0 HA GLU A 52 15.118 12.144 0.684 1.00 0.00 H new ATOM 0 HB2 GLU A 52 12.576 12.316 1.762 1.00 0.00 H new ATOM 0 HB3 GLU A 52 13.538 13.084 3.009 1.00 0.00 H new ATOM 0 HG2 GLU A 52 14.513 14.609 1.286 1.00 0.00 H new ATOM 0 HG3 GLU A 52 13.493 13.863 0.071 1.00 0.00 H new ATOM 882 N LYS A 53 15.663 11.157 3.737 1.00 0.00 N ATOM 883 CA LYS A 53 16.623 11.160 4.833 1.00 0.00 C ATOM 884 C LYS A 53 17.230 9.773 5.024 1.00 0.00 C ATOM 885 O LYS A 53 17.595 9.397 6.136 1.00 0.00 O ATOM 886 CB LYS A 53 15.955 11.624 6.128 1.00 0.00 C ATOM 887 CG LYS A 53 14.759 10.778 6.533 1.00 0.00 C ATOM 888 CD LYS A 53 14.704 10.573 8.038 1.00 0.00 C ATOM 889 CE LYS A 53 15.277 9.223 8.436 1.00 0.00 C ATOM 890 NZ LYS A 53 15.258 9.024 9.912 1.00 0.00 N ATOM 0 H LYS A 53 14.928 10.455 3.826 1.00 0.00 H new ATOM 0 HA LYS A 53 17.423 11.856 4.581 1.00 0.00 H new ATOM 0 HB2 LYS A 53 16.690 11.607 6.932 1.00 0.00 H new ATOM 0 HB3 LYS A 53 15.634 12.659 6.011 1.00 0.00 H new ATOM 0 HG2 LYS A 53 13.841 11.260 6.197 1.00 0.00 H new ATOM 0 HG3 LYS A 53 14.812 9.810 6.035 1.00 0.00 H new ATOM 0 HD2 LYS A 53 15.261 11.367 8.535 1.00 0.00 H new ATOM 0 HD3 LYS A 53 13.671 10.646 8.379 1.00 0.00 H new ATOM 0 HE2 LYS A 53 14.704 8.430 7.956 1.00 0.00 H new ATOM 0 HE3 LYS A 53 16.301 9.142 8.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 15.657 8.092 10.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 15.825 9.766 10.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 14.278 9.076 10.257 1.00 0.00 H new ATOM 904 N LEU A 54 17.320 9.012 3.932 1.00 0.00 N ATOM 905 CA LEU A 54 17.864 7.655 3.978 1.00 0.00 C ATOM 906 C LEU A 54 19.246 7.633 4.629 1.00 0.00 C ATOM 907 O LEU A 54 20.246 7.969 3.995 1.00 0.00 O ATOM 908 CB LEU A 54 17.959 7.077 2.565 1.00 0.00 C ATOM 909 CG LEU A 54 18.304 5.588 2.496 1.00 0.00 C ATOM 910 CD1 LEU A 54 17.140 4.748 2.998 1.00 0.00 C ATOM 911 CD2 LEU A 54 18.677 5.193 1.076 1.00 0.00 C ATOM 0 H LEU A 54 17.023 9.313 3.004 1.00 0.00 H new ATOM 0 HA LEU A 54 17.188 7.047 4.579 1.00 0.00 H new ATOM 0 HB2 LEU A 54 17.007 7.238 2.058 1.00 0.00 H new ATOM 0 HB3 LEU A 54 18.713 7.635 2.011 1.00 0.00 H new ATOM 0 HG LEU A 54 19.164 5.402 3.140 1.00 0.00 H new ATOM 0 HD11 LEU A 54 17.403 3.692 2.942 1.00 0.00 H new ATOM 0 HD12 LEU A 54 16.920 5.013 4.032 1.00 0.00 H new ATOM 0 HD13 LEU A 54 16.262 4.937 2.380 1.00 0.00 H new ATOM 0 HD21 LEU A 54 18.919 4.131 1.046 1.00 0.00 H new ATOM 0 HD22 LEU A 54 17.837 5.393 0.410 1.00 0.00 H new ATOM 0 HD23 LEU A 54 19.542 5.772 0.753 1.00 0.00 H new ATOM 923 N PRO A 55 19.316 7.233 5.913 1.00 0.00 N ATOM 924 CA PRO A 55 20.571 7.162 6.661 1.00 0.00 C ATOM 925 C PRO A 55 21.374 5.911 6.328 1.00 0.00 C ATOM 926 O PRO A 55 20.835 4.932 5.811 1.00 0.00 O ATOM 927 CB PRO A 55 20.123 7.122 8.134 1.00 0.00 C ATOM 928 CG PRO A 55 18.628 7.215 8.121 1.00 0.00 C ATOM 929 CD PRO A 55 18.185 6.814 6.744 1.00 0.00 C ATOM 0 HA PRO A 55 21.224 8.001 6.423 1.00 0.00 H new ATOM 0 HB2 PRO A 55 20.451 6.201 8.615 1.00 0.00 H new ATOM 0 HB3 PRO A 55 20.559 7.948 8.696 1.00 0.00 H new ATOM 0 HG2 PRO A 55 18.192 6.559 8.874 1.00 0.00 H new ATOM 0 HG3 PRO A 55 18.301 8.228 8.353 1.00 0.00 H new ATOM 0 HD2 PRO A 55 18.004 5.742 6.672 1.00 0.00 H new ATOM 0 HD3 PRO A 55 17.261 7.314 6.453 1.00 0.00 H new ATOM 937 N ASN A 56 22.665 5.943 6.642 1.00 0.00 N ATOM 938 CA ASN A 56 23.539 4.804 6.392 1.00 0.00 C ATOM 939 C ASN A 56 23.284 3.701 7.416 1.00 0.00 C ATOM 940 O ASN A 56 23.504 2.522 7.142 1.00 0.00 O ATOM 941 CB ASN A 56 25.006 5.238 6.439 1.00 0.00 C ATOM 942 CG ASN A 56 25.605 5.403 5.056 1.00 0.00 C ATOM 943 OD1 ASN A 56 25.053 6.103 4.207 1.00 0.00 O ATOM 944 ND2 ASN A 56 26.740 4.755 4.821 1.00 0.00 N ATOM 0 H ASN A 56 23.128 6.745 7.070 1.00 0.00 H new ATOM 0 HA ASN A 56 23.321 4.414 5.398 1.00 0.00 H new ATOM 0 HB2 ASN A 56 25.086 6.180 6.981 1.00 0.00 H new ATOM 0 HB3 ASN A 56 25.583 4.500 6.996 1.00 0.00 H new ATOM 0 HD21 ASN A 56 27.189 4.827 3.908 1.00 0.00 H new ATOM 0 HD22 ASN A 56 27.163 4.186 5.554 1.00 0.00 H new ATOM 951 N GLU A 57 22.817 4.098 8.598 1.00 0.00 N ATOM 952 CA GLU A 57 22.529 3.149 9.668 1.00 0.00 C ATOM 953 C GLU A 57 21.199 2.439 9.429 1.00 0.00 C ATOM 954 O GLU A 57 20.965 1.351 9.955 1.00 0.00 O ATOM 955 CB GLU A 57 22.500 3.868 11.018 1.00 0.00 C ATOM 956 CG GLU A 57 21.389 4.898 11.135 1.00 0.00 C ATOM 957 CD GLU A 57 21.170 5.360 12.562 1.00 0.00 C ATOM 958 OE1 GLU A 57 20.065 5.860 12.861 1.00 0.00 O ATOM 959 OE2 GLU A 57 22.103 5.222 13.381 1.00 0.00 O ATOM 0 H GLU A 57 22.630 5.072 8.838 1.00 0.00 H new ATOM 0 HA GLU A 57 23.321 2.400 9.677 1.00 0.00 H new ATOM 0 HB2 GLU A 57 22.384 3.129 11.811 1.00 0.00 H new ATOM 0 HB3 GLU A 57 23.459 4.361 11.179 1.00 0.00 H new ATOM 0 HG2 GLU A 57 21.630 5.759 10.511 1.00 0.00 H new ATOM 0 HG3 GLU A 57 20.463 4.473 10.748 1.00 0.00 H new ATOM 966 N LEU A 58 20.331 3.058 8.634 1.00 0.00 N ATOM 967 CA LEU A 58 19.028 2.476 8.327 1.00 0.00 C ATOM 968 C LEU A 58 19.153 1.403 7.252 1.00 0.00 C ATOM 969 O LEU A 58 18.298 0.527 7.143 1.00 0.00 O ATOM 970 CB LEU A 58 18.053 3.559 7.861 1.00 0.00 C ATOM 971 CG LEU A 58 16.741 3.636 8.646 1.00 0.00 C ATOM 972 CD1 LEU A 58 16.847 4.663 9.762 1.00 0.00 C ATOM 973 CD2 LEU A 58 15.583 3.974 7.717 1.00 0.00 C ATOM 0 H LEU A 58 20.506 3.960 8.192 1.00 0.00 H new ATOM 0 HA LEU A 58 18.644 2.017 9.238 1.00 0.00 H new ATOM 0 HB2 LEU A 58 18.552 4.526 7.923 1.00 0.00 H new ATOM 0 HB3 LEU A 58 17.820 3.388 6.810 1.00 0.00 H new ATOM 0 HG LEU A 58 16.550 2.661 9.094 1.00 0.00 H new ATOM 0 HD11 LEU A 58 15.905 4.704 10.309 1.00 0.00 H new ATOM 0 HD12 LEU A 58 17.650 4.379 10.442 1.00 0.00 H new ATOM 0 HD13 LEU A 58 17.062 5.643 9.336 1.00 0.00 H new ATOM 0 HD21 LEU A 58 14.658 4.025 8.292 1.00 0.00 H new ATOM 0 HD22 LEU A 58 15.768 4.937 7.241 1.00 0.00 H new ATOM 0 HD23 LEU A 58 15.493 3.203 6.952 1.00 0.00 H new ATOM 985 N LYS A 59 20.225 1.482 6.460 1.00 0.00 N ATOM 986 CA LYS A 59 20.473 0.521 5.385 1.00 0.00 C ATOM 987 C LYS A 59 20.049 -0.893 5.785 1.00 0.00 C ATOM 988 O LYS A 59 19.279 -1.535 5.075 1.00 0.00 O ATOM 989 CB LYS A 59 21.951 0.537 4.989 1.00 0.00 C ATOM 990 CG LYS A 59 22.293 -0.434 3.869 1.00 0.00 C ATOM 991 CD LYS A 59 22.775 -1.768 4.416 1.00 0.00 C ATOM 992 CE LYS A 59 24.268 -1.749 4.703 1.00 0.00 C ATOM 993 NZ LYS A 59 24.555 -1.822 6.162 1.00 0.00 N ATOM 0 H LYS A 59 20.938 2.206 6.545 1.00 0.00 H new ATOM 0 HA LYS A 59 19.870 0.820 4.528 1.00 0.00 H new ATOM 0 HB2 LYS A 59 22.225 1.546 4.680 1.00 0.00 H new ATOM 0 HB3 LYS A 59 22.555 0.297 5.864 1.00 0.00 H new ATOM 0 HG2 LYS A 59 21.415 -0.592 3.243 1.00 0.00 H new ATOM 0 HG3 LYS A 59 23.065 -0.000 3.233 1.00 0.00 H new ATOM 0 HD2 LYS A 59 22.231 -2.005 5.330 1.00 0.00 H new ATOM 0 HD3 LYS A 59 22.552 -2.558 3.699 1.00 0.00 H new ATOM 0 HE2 LYS A 59 24.745 -2.588 4.197 1.00 0.00 H new ATOM 0 HE3 LYS A 59 24.705 -0.839 4.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 25.528 -2.159 6.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 24.449 -0.878 6.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 23.889 -2.480 6.614 1.00 0.00 H new ATOM 1007 N PRO A 60 20.541 -1.403 6.929 1.00 0.00 N ATOM 1008 CA PRO A 60 20.188 -2.746 7.395 1.00 0.00 C ATOM 1009 C PRO A 60 18.716 -2.860 7.768 1.00 0.00 C ATOM 1010 O PRO A 60 18.111 -3.923 7.628 1.00 0.00 O ATOM 1011 CB PRO A 60 21.073 -2.948 8.629 1.00 0.00 C ATOM 1012 CG PRO A 60 21.396 -1.571 9.094 1.00 0.00 C ATOM 1013 CD PRO A 60 21.471 -0.725 7.854 1.00 0.00 C ATOM 0 HA PRO A 60 20.344 -3.497 6.621 1.00 0.00 H new ATOM 0 HB2 PRO A 60 20.552 -3.514 9.401 1.00 0.00 H new ATOM 0 HB3 PRO A 60 21.977 -3.504 8.381 1.00 0.00 H new ATOM 0 HG2 PRO A 60 20.631 -1.199 9.775 1.00 0.00 H new ATOM 0 HG3 PRO A 60 22.341 -1.554 9.637 1.00 0.00 H new ATOM 0 HD2 PRO A 60 21.167 0.304 8.049 1.00 0.00 H new ATOM 0 HD3 PRO A 60 22.484 -0.688 7.452 1.00 0.00 H new ATOM 1021 N LYS A 61 18.139 -1.760 8.239 1.00 0.00 N ATOM 1022 CA LYS A 61 16.732 -1.751 8.620 1.00 0.00 C ATOM 1023 C LYS A 61 15.845 -1.974 7.403 1.00 0.00 C ATOM 1024 O LYS A 61 14.732 -2.484 7.522 1.00 0.00 O ATOM 1025 CB LYS A 61 16.357 -0.437 9.307 1.00 0.00 C ATOM 1026 CG LYS A 61 15.052 -0.518 10.086 1.00 0.00 C ATOM 1027 CD LYS A 61 13.866 -0.110 9.230 1.00 0.00 C ATOM 1028 CE LYS A 61 13.473 1.339 9.475 1.00 0.00 C ATOM 1029 NZ LYS A 61 12.185 1.447 10.214 1.00 0.00 N ATOM 0 H LYS A 61 18.620 -0.869 8.365 1.00 0.00 H new ATOM 0 HA LYS A 61 16.573 -2.566 9.326 1.00 0.00 H new ATOM 0 HB2 LYS A 61 17.160 -0.147 9.985 1.00 0.00 H new ATOM 0 HB3 LYS A 61 16.276 0.348 8.555 1.00 0.00 H new ATOM 0 HG2 LYS A 61 14.907 -1.535 10.449 1.00 0.00 H new ATOM 0 HG3 LYS A 61 15.109 0.128 10.962 1.00 0.00 H new ATOM 0 HD2 LYS A 61 14.111 -0.248 8.177 1.00 0.00 H new ATOM 0 HD3 LYS A 61 13.018 -0.760 9.448 1.00 0.00 H new ATOM 0 HE2 LYS A 61 14.260 1.838 10.041 1.00 0.00 H new ATOM 0 HE3 LYS A 61 13.389 1.859 8.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 11.602 2.195 9.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 11.678 0.541 10.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 12.374 1.681 11.210 1.00 0.00 H new ATOM 1043 N ILE A 62 16.345 -1.608 6.223 1.00 0.00 N ATOM 1044 CA ILE A 62 15.588 -1.798 4.992 1.00 0.00 C ATOM 1045 C ILE A 62 15.149 -3.255 4.884 1.00 0.00 C ATOM 1046 O ILE A 62 14.095 -3.562 4.323 1.00 0.00 O ATOM 1047 CB ILE A 62 16.410 -1.375 3.751 1.00 0.00 C ATOM 1048 CG1 ILE A 62 16.252 0.126 3.505 1.00 0.00 C ATOM 1049 CG2 ILE A 62 15.994 -2.162 2.512 1.00 0.00 C ATOM 1050 CD1 ILE A 62 16.441 0.963 4.751 1.00 0.00 C ATOM 0 H ILE A 62 17.263 -1.182 6.096 1.00 0.00 H new ATOM 0 HA ILE A 62 14.705 -1.160 5.025 1.00 0.00 H new ATOM 0 HB ILE A 62 17.459 -1.597 3.949 1.00 0.00 H new ATOM 0 HG12 ILE A 62 16.974 0.441 2.752 1.00 0.00 H new ATOM 0 HG13 ILE A 62 15.260 0.317 3.095 1.00 0.00 H new ATOM 0 HG21 ILE A 62 16.591 -1.840 1.659 1.00 0.00 H new ATOM 0 HG22 ILE A 62 16.154 -3.226 2.686 1.00 0.00 H new ATOM 0 HG23 ILE A 62 14.939 -1.983 2.305 1.00 0.00 H new ATOM 0 HD11 ILE A 62 16.315 2.017 4.504 1.00 0.00 H new ATOM 0 HD12 ILE A 62 15.702 0.675 5.498 1.00 0.00 H new ATOM 0 HD13 ILE A 62 17.442 0.801 5.150 1.00 0.00 H new ATOM 1062 N ASP A 63 15.947 -4.146 5.469 1.00 0.00 N ATOM 1063 CA ASP A 63 15.623 -5.555 5.485 1.00 0.00 C ATOM 1064 C ASP A 63 14.476 -5.761 6.457 1.00 0.00 C ATOM 1065 O ASP A 63 13.537 -6.507 6.187 1.00 0.00 O ATOM 1066 CB ASP A 63 16.840 -6.385 5.902 1.00 0.00 C ATOM 1067 CG ASP A 63 17.147 -7.497 4.918 1.00 0.00 C ATOM 1068 OD1 ASP A 63 16.461 -8.539 4.968 1.00 0.00 O ATOM 1069 OD2 ASP A 63 18.072 -7.325 4.097 1.00 0.00 O ATOM 0 H ASP A 63 16.822 -3.908 5.936 1.00 0.00 H new ATOM 0 HA ASP A 63 15.332 -5.883 4.487 1.00 0.00 H new ATOM 0 HB2 ASP A 63 17.708 -5.732 5.991 1.00 0.00 H new ATOM 0 HB3 ASP A 63 16.663 -6.815 6.888 1.00 0.00 H new ATOM 1074 N GLU A 64 14.552 -5.048 7.582 1.00 0.00 N ATOM 1075 CA GLU A 64 13.513 -5.103 8.598 1.00 0.00 C ATOM 1076 C GLU A 64 12.176 -4.731 7.975 1.00 0.00 C ATOM 1077 O GLU A 64 11.164 -5.380 8.214 1.00 0.00 O ATOM 1078 CB GLU A 64 13.842 -4.158 9.758 1.00 0.00 C ATOM 1079 CG GLU A 64 14.337 -4.875 11.004 1.00 0.00 C ATOM 1080 CD GLU A 64 15.313 -4.039 11.809 1.00 0.00 C ATOM 1081 OE1 GLU A 64 16.536 -4.197 11.607 1.00 0.00 O ATOM 1082 OE2 GLU A 64 14.856 -3.228 12.640 1.00 0.00 O ATOM 0 H GLU A 64 15.327 -4.425 7.808 1.00 0.00 H new ATOM 0 HA GLU A 64 13.456 -6.117 8.994 1.00 0.00 H new ATOM 0 HB2 GLU A 64 14.601 -3.447 9.432 1.00 0.00 H new ATOM 0 HB3 GLU A 64 12.952 -3.581 10.010 1.00 0.00 H new ATOM 0 HG2 GLU A 64 13.485 -5.136 11.631 1.00 0.00 H new ATOM 0 HG3 GLU A 64 14.818 -5.809 10.714 1.00 0.00 H new ATOM 1089 N ILE A 65 12.194 -3.691 7.148 1.00 0.00 N ATOM 1090 CA ILE A 65 10.995 -3.234 6.456 1.00 0.00 C ATOM 1091 C ILE A 65 10.399 -4.363 5.628 1.00 0.00 C ATOM 1092 O ILE A 65 9.199 -4.618 5.683 1.00 0.00 O ATOM 1093 CB ILE A 65 11.312 -2.043 5.527 1.00 0.00 C ATOM 1094 CG1 ILE A 65 12.058 -0.953 6.299 1.00 0.00 C ATOM 1095 CG2 ILE A 65 10.033 -1.487 4.919 1.00 0.00 C ATOM 1096 CD1 ILE A 65 11.383 -0.579 7.600 1.00 0.00 C ATOM 0 H ILE A 65 13.031 -3.146 6.940 1.00 0.00 H new ATOM 0 HA ILE A 65 10.278 -2.914 7.212 1.00 0.00 H new ATOM 0 HB ILE A 65 11.952 -2.394 4.717 1.00 0.00 H new ATOM 0 HG12 ILE A 65 13.072 -1.293 6.508 1.00 0.00 H new ATOM 0 HG13 ILE A 65 12.142 -0.065 5.672 1.00 0.00 H new ATOM 0 HG21 ILE A 65 10.275 -0.648 4.267 1.00 0.00 H new ATOM 0 HG22 ILE A 65 9.537 -2.266 4.340 1.00 0.00 H new ATOM 0 HG23 ILE A 65 9.369 -1.148 5.715 1.00 0.00 H new ATOM 0 HD11 ILE A 65 11.961 0.198 8.099 1.00 0.00 H new ATOM 0 HD12 ILE A 65 10.378 -0.209 7.395 1.00 0.00 H new ATOM 0 HD13 ILE A 65 11.323 -1.456 8.244 1.00 0.00 H new ATOM 1108 N SER A 66 11.253 -5.037 4.863 1.00 0.00 N ATOM 1109 CA SER A 66 10.819 -6.143 4.017 1.00 0.00 C ATOM 1110 C SER A 66 10.356 -7.337 4.850 1.00 0.00 C ATOM 1111 O SER A 66 9.288 -7.895 4.606 1.00 0.00 O ATOM 1112 CB SER A 66 11.953 -6.569 3.084 1.00 0.00 C ATOM 1113 OG SER A 66 12.934 -7.318 3.781 1.00 0.00 O ATOM 0 H SER A 66 12.252 -4.836 4.812 1.00 0.00 H new ATOM 0 HA SER A 66 9.972 -5.796 3.425 1.00 0.00 H new ATOM 0 HB2 SER A 66 11.550 -7.165 2.265 1.00 0.00 H new ATOM 0 HB3 SER A 66 12.413 -5.687 2.639 1.00 0.00 H new ATOM 0 HG SER A 66 13.355 -6.752 4.462 1.00 0.00 H new ATOM 1119 N LYS A 67 11.167 -7.731 5.829 1.00 0.00 N ATOM 1120 CA LYS A 67 10.826 -8.867 6.680 1.00 0.00 C ATOM 1121 C LYS A 67 9.682 -8.524 7.633 1.00 0.00 C ATOM 1122 O LYS A 67 8.977 -9.413 8.111 1.00 0.00 O ATOM 1123 CB LYS A 67 12.050 -9.343 7.468 1.00 0.00 C ATOM 1124 CG LYS A 67 12.833 -8.218 8.125 1.00 0.00 C ATOM 1125 CD LYS A 67 13.059 -8.485 9.606 1.00 0.00 C ATOM 1126 CE LYS A 67 14.470 -8.984 9.873 1.00 0.00 C ATOM 1127 NZ LYS A 67 15.497 -7.964 9.523 1.00 0.00 N ATOM 0 H LYS A 67 12.057 -7.285 6.051 1.00 0.00 H new ATOM 0 HA LYS A 67 10.494 -9.677 6.030 1.00 0.00 H new ATOM 0 HB2 LYS A 67 11.725 -10.044 8.237 1.00 0.00 H new ATOM 0 HB3 LYS A 67 12.712 -9.890 6.797 1.00 0.00 H new ATOM 0 HG2 LYS A 67 13.794 -8.102 7.625 1.00 0.00 H new ATOM 0 HG3 LYS A 67 12.294 -7.278 8.002 1.00 0.00 H new ATOM 0 HD2 LYS A 67 12.882 -7.571 10.173 1.00 0.00 H new ATOM 0 HD3 LYS A 67 12.338 -9.223 9.958 1.00 0.00 H new ATOM 0 HE2 LYS A 67 14.567 -9.250 10.925 1.00 0.00 H new ATOM 0 HE3 LYS A 67 14.649 -9.892 9.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 16.261 -8.413 8.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 15.060 -7.214 8.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 15.888 -7.552 10.394 1.00 0.00 H new ATOM 1141 N ARG A 68 9.492 -7.233 7.901 1.00 0.00 N ATOM 1142 CA ARG A 68 8.421 -6.792 8.790 1.00 0.00 C ATOM 1143 C ARG A 68 7.135 -6.566 8.005 1.00 0.00 C ATOM 1144 O ARG A 68 6.039 -6.776 8.522 1.00 0.00 O ATOM 1145 CB ARG A 68 8.813 -5.510 9.526 1.00 0.00 C ATOM 1146 CG ARG A 68 9.892 -5.721 10.575 1.00 0.00 C ATOM 1147 CD ARG A 68 10.629 -4.425 10.883 1.00 0.00 C ATOM 1148 NE ARG A 68 10.047 -3.722 12.024 1.00 0.00 N ATOM 1149 CZ ARG A 68 10.289 -2.444 12.309 1.00 0.00 C ATOM 1150 NH1 ARG A 68 11.100 -1.728 11.540 1.00 0.00 N ATOM 1151 NH2 ARG A 68 9.717 -1.881 13.364 1.00 0.00 N ATOM 0 H ARG A 68 10.062 -6.479 7.518 1.00 0.00 H new ATOM 0 HA ARG A 68 8.254 -7.577 9.527 1.00 0.00 H new ATOM 0 HB2 ARG A 68 9.161 -4.775 8.800 1.00 0.00 H new ATOM 0 HB3 ARG A 68 7.928 -5.090 10.005 1.00 0.00 H new ATOM 0 HG2 ARG A 68 9.442 -6.111 11.488 1.00 0.00 H new ATOM 0 HG3 ARG A 68 10.602 -6.470 10.224 1.00 0.00 H new ATOM 0 HD2 ARG A 68 11.677 -4.644 11.088 1.00 0.00 H new ATOM 0 HD3 ARG A 68 10.604 -3.777 10.007 1.00 0.00 H new ATOM 0 HE ARG A 68 9.419 -4.240 12.638 1.00 0.00 H new ATOM 0 HH11 ARG A 68 11.541 -2.156 10.726 1.00 0.00 H new ATOM 0 HH12 ARG A 68 11.282 -0.749 11.763 1.00 0.00 H new ATOM 0 HH21 ARG A 68 9.092 -2.427 13.957 1.00 0.00 H new ATOM 0 HH22 ARG A 68 9.902 -0.902 13.583 1.00 0.00 H new ATOM 1165 N PHE A 69 7.276 -6.145 6.751 1.00 0.00 N ATOM 1166 CA PHE A 69 6.118 -5.906 5.897 1.00 0.00 C ATOM 1167 C PHE A 69 5.322 -7.201 5.735 1.00 0.00 C ATOM 1168 O PHE A 69 4.102 -7.183 5.581 1.00 0.00 O ATOM 1169 CB PHE A 69 6.567 -5.339 4.535 1.00 0.00 C ATOM 1170 CG PHE A 69 6.235 -6.205 3.347 1.00 0.00 C ATOM 1171 CD1 PHE A 69 4.926 -6.336 2.910 1.00 0.00 C ATOM 1172 CD2 PHE A 69 7.235 -6.884 2.669 1.00 0.00 C ATOM 1173 CE1 PHE A 69 4.622 -7.129 1.819 1.00 0.00 C ATOM 1174 CE2 PHE A 69 6.935 -7.678 1.578 1.00 0.00 C ATOM 1175 CZ PHE A 69 5.628 -7.802 1.153 1.00 0.00 C ATOM 0 H PHE A 69 8.176 -5.963 6.306 1.00 0.00 H new ATOM 0 HA PHE A 69 5.468 -5.165 6.362 1.00 0.00 H new ATOM 0 HB2 PHE A 69 6.105 -4.362 4.394 1.00 0.00 H new ATOM 0 HB3 PHE A 69 7.645 -5.181 4.561 1.00 0.00 H new ATOM 0 HD1 PHE A 69 4.135 -5.813 3.427 1.00 0.00 H new ATOM 0 HD2 PHE A 69 8.260 -6.792 2.997 1.00 0.00 H new ATOM 0 HE1 PHE A 69 3.598 -7.222 1.488 1.00 0.00 H new ATOM 0 HE2 PHE A 69 7.724 -8.201 1.058 1.00 0.00 H new ATOM 0 HZ PHE A 69 5.392 -8.424 0.302 1.00 0.00 H new ATOM 1185 N PHE A 70 6.031 -8.325 5.797 1.00 0.00 N ATOM 1186 CA PHE A 70 5.408 -9.637 5.686 1.00 0.00 C ATOM 1187 C PHE A 70 5.579 -10.398 6.998 1.00 0.00 C ATOM 1188 O PHE A 70 6.387 -11.321 7.092 1.00 0.00 O ATOM 1189 CB PHE A 70 6.027 -10.428 4.532 1.00 0.00 C ATOM 1190 CG PHE A 70 5.119 -11.489 3.978 1.00 0.00 C ATOM 1191 CD1 PHE A 70 4.682 -12.531 4.779 1.00 0.00 C ATOM 1192 CD2 PHE A 70 4.706 -11.445 2.657 1.00 0.00 C ATOM 1193 CE1 PHE A 70 3.848 -13.509 4.273 1.00 0.00 C ATOM 1194 CE2 PHE A 70 3.872 -12.420 2.145 1.00 0.00 C ATOM 1195 CZ PHE A 70 3.442 -13.454 2.954 1.00 0.00 C ATOM 0 H PHE A 70 7.043 -8.351 5.924 1.00 0.00 H new ATOM 0 HA PHE A 70 4.345 -9.508 5.482 1.00 0.00 H new ATOM 0 HB2 PHE A 70 6.297 -9.738 3.732 1.00 0.00 H new ATOM 0 HB3 PHE A 70 6.950 -10.894 4.876 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.997 -12.579 5.811 1.00 0.00 H new ATOM 0 HD2 PHE A 70 5.040 -10.639 2.020 1.00 0.00 H new ATOM 0 HE1 PHE A 70 3.514 -14.316 4.908 1.00 0.00 H new ATOM 0 HE2 PHE A 70 3.556 -12.374 1.113 1.00 0.00 H new ATOM 0 HZ PHE A 70 2.790 -14.217 2.556 1.00 0.00 H new ATOM 1205 N PRO A 71 4.821 -10.005 8.038 1.00 0.00 N ATOM 1206 CA PRO A 71 4.898 -10.640 9.356 1.00 0.00 C ATOM 1207 C PRO A 71 4.228 -12.009 9.385 1.00 0.00 C ATOM 1208 O PRO A 71 3.895 -12.571 8.341 1.00 0.00 O ATOM 1209 CB PRO A 71 4.150 -9.659 10.259 1.00 0.00 C ATOM 1210 CG PRO A 71 3.170 -8.994 9.357 1.00 0.00 C ATOM 1211 CD PRO A 71 3.837 -8.905 8.011 1.00 0.00 C ATOM 0 HA PRO A 71 5.928 -10.826 9.660 1.00 0.00 H new ATOM 0 HB2 PRO A 71 3.649 -10.176 11.077 1.00 0.00 H new ATOM 0 HB3 PRO A 71 4.830 -8.935 10.708 1.00 0.00 H new ATOM 0 HG2 PRO A 71 2.245 -9.567 9.296 1.00 0.00 H new ATOM 0 HG3 PRO A 71 2.908 -8.003 9.729 1.00 0.00 H new ATOM 0 HD2 PRO A 71 3.120 -9.028 7.199 1.00 0.00 H new ATOM 0 HD3 PRO A 71 4.320 -7.939 7.866 1.00 0.00 H new ATOM 1219 N ALA A 72 4.033 -12.541 10.588 1.00 0.00 N ATOM 1220 CA ALA A 72 3.402 -13.844 10.754 1.00 0.00 C ATOM 1221 C ALA A 72 1.906 -13.698 11.014 1.00 0.00 C ATOM 1222 O ALA A 72 1.114 -14.564 10.641 1.00 0.00 O ATOM 1223 CB ALA A 72 4.065 -14.609 11.889 1.00 0.00 C ATOM 0 H ALA A 72 4.303 -12.089 11.462 1.00 0.00 H new ATOM 0 HA ALA A 72 3.531 -14.405 9.829 1.00 0.00 H new ATOM 0 HB1 ALA A 72 3.584 -15.581 12.003 1.00 0.00 H new ATOM 0 HB2 ALA A 72 5.122 -14.751 11.663 1.00 0.00 H new ATOM 0 HB3 ALA A 72 3.965 -14.044 12.816 1.00 0.00 H new ATOM 1229 N LYS A 73 1.526 -12.597 11.653 1.00 0.00 N ATOM 1230 CA LYS A 73 0.124 -12.336 11.963 1.00 0.00 C ATOM 1231 C LYS A 73 -0.347 -11.046 11.300 1.00 0.00 C ATOM 1232 O LYS A 73 -0.009 -9.960 11.814 1.00 0.00 O ATOM 1233 CB LYS A 73 -0.078 -12.250 13.476 1.00 0.00 C ATOM 1234 CG LYS A 73 -1.512 -12.498 13.914 1.00 0.00 C ATOM 1235 CD LYS A 73 -1.570 -13.226 15.247 1.00 0.00 C ATOM 1236 CE LYS A 73 -2.938 -13.091 15.897 1.00 0.00 C ATOM 1237 NZ LYS A 73 -2.907 -13.457 17.339 1.00 0.00 N ATOM 1238 OXT LYS A 73 -1.053 -11.133 10.273 1.00 0.00 O ATOM 0 H LYS A 73 2.169 -11.870 11.967 1.00 0.00 H new ATOM 0 HA LYS A 73 -0.470 -13.162 11.572 1.00 0.00 H new ATOM 0 HB2 LYS A 73 0.572 -12.977 13.963 1.00 0.00 H new ATOM 0 HB3 LYS A 73 0.233 -11.263 13.820 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -2.038 -11.547 13.995 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -2.029 -13.085 13.155 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -1.340 -14.281 15.097 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -0.808 -12.825 15.915 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -3.291 -12.065 15.791 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -3.652 -13.729 15.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -3.859 -13.351 17.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -2.595 -14.444 17.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -2.245 -12.832 17.842 1.00 0.00 H new TER 1252 LYS A 73 ATOM 1253 N MET B 1 -8.313 -17.603 -7.098 1.00 0.00 N ATOM 1254 CA MET B 1 -7.257 -18.649 -7.130 1.00 0.00 C ATOM 1255 C MET B 1 -6.337 -18.466 -8.333 1.00 0.00 C ATOM 1256 O MET B 1 -6.480 -19.151 -9.346 1.00 0.00 O ATOM 1257 CB MET B 1 -7.933 -20.021 -7.185 1.00 0.00 C ATOM 1258 CG MET B 1 -7.104 -21.132 -6.563 1.00 0.00 C ATOM 1259 SD MET B 1 -7.565 -22.766 -7.173 1.00 0.00 S ATOM 1260 CE MET B 1 -7.463 -23.730 -5.667 1.00 0.00 C ATOM 0 H1 MET B 1 -8.850 -17.679 -6.211 1.00 0.00 H new ATOM 0 H2 MET B 1 -7.872 -16.663 -7.157 1.00 0.00 H new ATOM 0 H3 MET B 1 -8.957 -17.735 -7.904 1.00 0.00 H new ATOM 0 HA MET B 1 -6.644 -18.568 -6.233 1.00 0.00 H new ATOM 0 HB2 MET B 1 -8.893 -19.965 -6.672 1.00 0.00 H new ATOM 0 HB3 MET B 1 -8.141 -20.273 -8.225 1.00 0.00 H new ATOM 0 HG2 MET B 1 -6.049 -20.954 -6.773 1.00 0.00 H new ATOM 0 HG3 MET B 1 -7.222 -21.106 -5.480 1.00 0.00 H new ATOM 0 HE1 MET B 1 -7.087 -24.727 -5.898 1.00 0.00 H new ATOM 0 HE2 MET B 1 -6.786 -23.240 -4.967 1.00 0.00 H new ATOM 0 HE3 MET B 1 -8.453 -23.810 -5.219 1.00 0.00 H new ATOM 1272 N VAL B 2 -5.392 -17.539 -8.213 1.00 0.00 N ATOM 1273 CA VAL B 2 -4.448 -17.267 -9.289 1.00 0.00 C ATOM 1274 C VAL B 2 -3.038 -17.060 -8.746 1.00 0.00 C ATOM 1275 O VAL B 2 -2.546 -15.933 -8.676 1.00 0.00 O ATOM 1276 CB VAL B 2 -4.863 -16.025 -10.100 1.00 0.00 C ATOM 1277 CG1 VAL B 2 -3.989 -15.875 -11.336 1.00 0.00 C ATOM 1278 CG2 VAL B 2 -6.333 -16.103 -10.483 1.00 0.00 C ATOM 0 H VAL B 2 -5.260 -16.964 -7.381 1.00 0.00 H new ATOM 0 HA VAL B 2 -4.456 -18.138 -9.944 1.00 0.00 H new ATOM 0 HB VAL B 2 -4.721 -15.143 -9.475 1.00 0.00 H new ATOM 0 HG11 VAL B 2 -4.298 -14.992 -11.895 1.00 0.00 H new ATOM 0 HG12 VAL B 2 -2.947 -15.767 -11.034 1.00 0.00 H new ATOM 0 HG13 VAL B 2 -4.094 -16.759 -11.966 1.00 0.00 H new ATOM 0 HG21 VAL B 2 -6.607 -15.217 -11.055 1.00 0.00 H new ATOM 0 HG22 VAL B 2 -6.505 -16.993 -11.088 1.00 0.00 H new ATOM 0 HG23 VAL B 2 -6.942 -16.155 -9.580 1.00 0.00 H new ATOM 1288 N GLU B 3 -2.392 -18.155 -8.360 1.00 0.00 N ATOM 1289 CA GLU B 3 -1.038 -18.095 -7.823 1.00 0.00 C ATOM 1290 C GLU B 3 -0.499 -19.493 -7.542 1.00 0.00 C ATOM 1291 O GLU B 3 0.450 -19.944 -8.185 1.00 0.00 O ATOM 1292 CB GLU B 3 -1.011 -17.259 -6.540 1.00 0.00 C ATOM 1293 CG GLU B 3 0.379 -16.784 -6.153 1.00 0.00 C ATOM 1294 CD GLU B 3 0.383 -15.361 -5.626 1.00 0.00 C ATOM 1295 OE1 GLU B 3 -0.001 -14.447 -6.386 1.00 0.00 O ATOM 1296 OE2 GLU B 3 0.769 -15.163 -4.456 1.00 0.00 O ATOM 0 H GLU B 3 -2.785 -19.095 -8.409 1.00 0.00 H new ATOM 0 HA GLU B 3 -0.400 -17.623 -8.571 1.00 0.00 H new ATOM 0 HB2 GLU B 3 -1.660 -16.392 -6.667 1.00 0.00 H new ATOM 0 HB3 GLU B 3 -1.425 -17.850 -5.723 1.00 0.00 H new ATOM 0 HG2 GLU B 3 0.788 -17.450 -5.393 1.00 0.00 H new ATOM 0 HG3 GLU B 3 1.036 -16.848 -7.021 1.00 0.00 H new ATOM 1303 N SER B 4 -1.110 -20.176 -6.579 1.00 0.00 N ATOM 1304 CA SER B 4 -0.691 -21.525 -6.215 1.00 0.00 C ATOM 1305 C SER B 4 -1.709 -22.182 -5.288 1.00 0.00 C ATOM 1306 O SER B 4 -1.475 -22.318 -4.086 1.00 0.00 O ATOM 1307 CB SER B 4 0.683 -21.490 -5.542 1.00 0.00 C ATOM 1308 OG SER B 4 1.041 -22.769 -5.046 1.00 0.00 O ATOM 0 H SER B 4 -1.896 -19.818 -6.037 1.00 0.00 H new ATOM 0 HA SER B 4 -0.626 -22.117 -7.128 1.00 0.00 H new ATOM 0 HB2 SER B 4 1.433 -21.151 -6.257 1.00 0.00 H new ATOM 0 HB3 SER B 4 0.673 -20.769 -4.724 1.00 0.00 H new ATOM 0 HG SER B 4 1.923 -22.720 -4.622 1.00 0.00 H new ATOM 1314 N LYS B 5 -2.842 -22.586 -5.853 1.00 0.00 N ATOM 1315 CA LYS B 5 -3.897 -23.230 -5.079 1.00 0.00 C ATOM 1316 C LYS B 5 -4.380 -22.324 -3.949 1.00 0.00 C ATOM 1317 O LYS B 5 -4.875 -22.801 -2.928 1.00 0.00 O ATOM 1318 CB LYS B 5 -3.398 -24.558 -4.505 1.00 0.00 C ATOM 1319 CG LYS B 5 -3.684 -25.753 -5.400 1.00 0.00 C ATOM 1320 CD LYS B 5 -5.001 -26.421 -5.036 1.00 0.00 C ATOM 1321 CE LYS B 5 -4.829 -27.917 -4.819 1.00 0.00 C ATOM 1322 NZ LYS B 5 -4.822 -28.272 -3.373 1.00 0.00 N ATOM 0 H LYS B 5 -3.053 -22.479 -6.845 1.00 0.00 H new ATOM 0 HA LYS B 5 -4.736 -23.421 -5.748 1.00 0.00 H new ATOM 0 HB2 LYS B 5 -2.323 -24.490 -4.336 1.00 0.00 H new ATOM 0 HB3 LYS B 5 -3.864 -24.722 -3.533 1.00 0.00 H new ATOM 0 HG2 LYS B 5 -3.714 -25.430 -6.441 1.00 0.00 H new ATOM 0 HG3 LYS B 5 -2.873 -26.476 -5.314 1.00 0.00 H new ATOM 0 HD2 LYS B 5 -5.403 -25.965 -4.131 1.00 0.00 H new ATOM 0 HD3 LYS B 5 -5.728 -26.249 -5.829 1.00 0.00 H new ATOM 0 HE2 LYS B 5 -5.636 -28.451 -5.320 1.00 0.00 H new ATOM 0 HE3 LYS B 5 -3.896 -28.245 -5.278 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 -4.703 -29.300 -3.268 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 -4.036 -27.782 -2.899 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 -5.722 -27.982 -2.940 1.00 0.00 H new ATOM 1336 N LYS B 6 -4.232 -21.015 -4.139 1.00 0.00 N ATOM 1337 CA LYS B 6 -4.655 -20.043 -3.136 1.00 0.00 C ATOM 1338 C LYS B 6 -4.380 -18.620 -3.610 1.00 0.00 C ATOM 1339 O LYS B 6 -3.428 -18.375 -4.350 1.00 0.00 O ATOM 1340 CB LYS B 6 -3.932 -20.298 -1.811 1.00 0.00 C ATOM 1341 CG LYS B 6 -4.771 -19.969 -0.586 1.00 0.00 C ATOM 1342 CD LYS B 6 -6.054 -20.787 -0.550 1.00 0.00 C ATOM 1343 CE LYS B 6 -7.280 -19.915 -0.777 1.00 0.00 C ATOM 1344 NZ LYS B 6 -8.012 -19.646 0.492 1.00 0.00 N ATOM 0 H LYS B 6 -3.823 -20.604 -4.978 1.00 0.00 H new ATOM 0 HA LYS B 6 -5.728 -20.158 -2.985 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -3.633 -21.345 -1.766 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -3.018 -19.704 -1.785 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -4.190 -20.162 0.316 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -5.016 -18.907 -0.586 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -6.013 -21.564 -1.314 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -6.138 -21.291 0.413 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -6.975 -18.970 -1.228 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -7.948 -20.405 -1.485 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -8.840 -19.049 0.295 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -8.325 -20.546 0.910 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -7.382 -19.155 1.159 1.00 0.00 H new ATOM 1358 N ILE B 7 -5.219 -17.685 -3.177 1.00 0.00 N ATOM 1359 CA ILE B 7 -5.064 -16.286 -3.556 1.00 0.00 C ATOM 1360 C ILE B 7 -4.191 -15.542 -2.554 1.00 0.00 C ATOM 1361 O ILE B 7 -4.693 -14.853 -1.667 1.00 0.00 O ATOM 1362 CB ILE B 7 -6.428 -15.575 -3.657 1.00 0.00 C ATOM 1363 CG1 ILE B 7 -7.412 -16.412 -4.479 1.00 0.00 C ATOM 1364 CG2 ILE B 7 -6.257 -14.191 -4.270 1.00 0.00 C ATOM 1365 CD1 ILE B 7 -8.746 -16.616 -3.796 1.00 0.00 C ATOM 0 H ILE B 7 -6.013 -17.871 -2.564 1.00 0.00 H new ATOM 0 HA ILE B 7 -4.584 -16.275 -4.535 1.00 0.00 H new ATOM 0 HB ILE B 7 -6.836 -15.461 -2.653 1.00 0.00 H new ATOM 0 HG12 ILE B 7 -7.576 -15.926 -5.441 1.00 0.00 H new ATOM 0 HG13 ILE B 7 -6.966 -17.385 -4.685 1.00 0.00 H new ATOM 0 HG21 ILE B 7 -7.228 -13.700 -4.336 1.00 0.00 H new ATOM 0 HG22 ILE B 7 -5.591 -13.596 -3.645 1.00 0.00 H new ATOM 0 HG23 ILE B 7 -5.830 -14.286 -5.268 1.00 0.00 H new ATOM 0 HD11 ILE B 7 -9.393 -17.217 -4.434 1.00 0.00 H new ATOM 0 HD12 ILE B 7 -8.594 -17.130 -2.847 1.00 0.00 H new ATOM 0 HD13 ILE B 7 -9.213 -15.648 -3.614 1.00 0.00 H new ATOM 1377 N ALA B 8 -2.877 -15.688 -2.698 1.00 0.00 N ATOM 1378 CA ALA B 8 -1.933 -15.030 -1.801 1.00 0.00 C ATOM 1379 C ALA B 8 -1.542 -13.653 -2.302 1.00 0.00 C ATOM 1380 O ALA B 8 -0.877 -12.883 -1.610 1.00 0.00 O ATOM 1381 CB ALA B 8 -0.697 -15.890 -1.623 1.00 0.00 C ATOM 0 H ALA B 8 -2.443 -16.255 -3.426 1.00 0.00 H new ATOM 0 HA ALA B 8 -2.428 -14.902 -0.839 1.00 0.00 H new ATOM 0 HB1 ALA B 8 0.001 -15.390 -0.952 1.00 0.00 H new ATOM 0 HB2 ALA B 8 -0.982 -16.853 -1.198 1.00 0.00 H new ATOM 0 HB3 ALA B 8 -0.220 -16.047 -2.591 1.00 0.00 H new ATOM 1387 N LYS B 9 -1.964 -13.361 -3.507 1.00 0.00 N ATOM 1388 CA LYS B 9 -1.680 -12.078 -4.139 1.00 0.00 C ATOM 1389 C LYS B 9 -2.531 -11.882 -5.389 1.00 0.00 C ATOM 1390 O LYS B 9 -2.891 -12.846 -6.065 1.00 0.00 O ATOM 1391 CB LYS B 9 -0.196 -11.984 -4.495 1.00 0.00 C ATOM 1392 CG LYS B 9 0.600 -11.110 -3.540 1.00 0.00 C ATOM 1393 CD LYS B 9 1.597 -11.930 -2.731 1.00 0.00 C ATOM 1394 CE LYS B 9 1.973 -11.239 -1.427 1.00 0.00 C ATOM 1395 NZ LYS B 9 0.790 -10.648 -0.744 1.00 0.00 N ATOM 0 H LYS B 9 -2.513 -13.998 -4.084 1.00 0.00 H new ATOM 0 HA LYS B 9 -1.929 -11.288 -3.430 1.00 0.00 H new ATOM 0 HB2 LYS B 9 0.233 -12.986 -4.501 1.00 0.00 H new ATOM 0 HB3 LYS B 9 -0.097 -11.589 -5.506 1.00 0.00 H new ATOM 0 HG2 LYS B 9 1.131 -10.343 -4.104 1.00 0.00 H new ATOM 0 HG3 LYS B 9 -0.082 -10.594 -2.864 1.00 0.00 H new ATOM 0 HD2 LYS B 9 1.170 -12.909 -2.513 1.00 0.00 H new ATOM 0 HD3 LYS B 9 2.495 -12.099 -3.325 1.00 0.00 H new ATOM 0 HE2 LYS B 9 2.453 -11.957 -0.762 1.00 0.00 H new ATOM 0 HE3 LYS B 9 2.703 -10.455 -1.630 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 0.966 -10.605 0.280 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 0.623 -9.688 -1.107 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 -0.047 -11.238 -0.927 1.00 0.00 H new ATOM 1409 N LYS B 10 -2.851 -10.629 -5.685 1.00 0.00 N ATOM 1410 CA LYS B 10 -3.663 -10.299 -6.852 1.00 0.00 C ATOM 1411 C LYS B 10 -2.991 -9.217 -7.694 1.00 0.00 C ATOM 1412 O LYS B 10 -2.389 -8.296 -7.155 1.00 0.00 O ATOM 1413 CB LYS B 10 -5.033 -9.806 -6.395 1.00 0.00 C ATOM 1414 CG LYS B 10 -5.906 -10.883 -5.773 1.00 0.00 C ATOM 1415 CD LYS B 10 -6.718 -10.333 -4.607 1.00 0.00 C ATOM 1416 CE LYS B 10 -8.166 -10.798 -4.664 1.00 0.00 C ATOM 1417 NZ LYS B 10 -8.422 -11.940 -3.744 1.00 0.00 N ATOM 0 H LYS B 10 -2.561 -9.822 -5.133 1.00 0.00 H new ATOM 0 HA LYS B 10 -3.773 -11.196 -7.462 1.00 0.00 H new ATOM 0 HB2 LYS B 10 -4.895 -9.003 -5.671 1.00 0.00 H new ATOM 0 HB3 LYS B 10 -5.557 -9.378 -7.250 1.00 0.00 H new ATOM 0 HG2 LYS B 10 -6.579 -11.289 -6.528 1.00 0.00 H new ATOM 0 HG3 LYS B 10 -5.281 -11.706 -5.427 1.00 0.00 H new ATOM 0 HD2 LYS B 10 -6.269 -10.654 -3.667 1.00 0.00 H new ATOM 0 HD3 LYS B 10 -6.684 -9.244 -4.621 1.00 0.00 H new ATOM 0 HE2 LYS B 10 -8.824 -9.969 -4.404 1.00 0.00 H new ATOM 0 HE3 LYS B 10 -8.412 -11.092 -5.684 1.00 0.00 H new ATOM 0 HZ1 LYS B 10 -8.784 -12.749 -4.288 1.00 0.00 H new ATOM 0 HZ2 LYS B 10 -7.536 -12.209 -3.270 1.00 0.00 H new ATOM 0 HZ3 LYS B 10 -9.125 -11.660 -3.031 1.00 0.00 H new ATOM 1431 N LYS B 11 -3.101 -9.305 -9.015 1.00 0.00 N ATOM 1432 CA LYS B 11 -2.496 -8.289 -9.867 1.00 0.00 C ATOM 1433 C LYS B 11 -3.217 -6.962 -9.669 1.00 0.00 C ATOM 1434 O LYS B 11 -4.352 -6.787 -10.111 1.00 0.00 O ATOM 1435 CB LYS B 11 -2.541 -8.696 -11.342 1.00 0.00 C ATOM 1436 CG LYS B 11 -1.978 -10.083 -11.609 1.00 0.00 C ATOM 1437 CD LYS B 11 -3.066 -11.145 -11.574 1.00 0.00 C ATOM 1438 CE LYS B 11 -2.817 -12.164 -10.474 1.00 0.00 C ATOM 1439 NZ LYS B 11 -4.082 -12.597 -9.820 1.00 0.00 N ATOM 0 H LYS B 11 -3.591 -10.050 -9.510 1.00 0.00 H new ATOM 0 HA LYS B 11 -1.449 -8.184 -9.583 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -3.574 -8.659 -11.689 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -1.982 -7.967 -11.928 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -1.487 -10.096 -12.582 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -1.217 -10.317 -10.865 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -4.034 -10.670 -11.418 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -3.111 -11.652 -12.538 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -2.309 -13.033 -10.893 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -2.150 -11.735 -9.726 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -3.860 -13.171 -8.981 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -4.628 -11.760 -9.533 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -4.642 -13.163 -10.489 1.00 0.00 H new ATOM 1453 N THR B 12 -2.551 -6.035 -8.991 1.00 0.00 N ATOM 1454 CA THR B 12 -3.128 -4.727 -8.720 1.00 0.00 C ATOM 1455 C THR B 12 -2.496 -3.663 -9.607 1.00 0.00 C ATOM 1456 O THR B 12 -1.322 -3.759 -9.960 1.00 0.00 O ATOM 1457 CB THR B 12 -2.945 -4.358 -7.248 1.00 0.00 C ATOM 1458 OG1 THR B 12 -3.218 -5.470 -6.414 1.00 0.00 O ATOM 1459 CG2 THR B 12 -3.837 -3.219 -6.802 1.00 0.00 C ATOM 0 H THR B 12 -1.610 -6.166 -8.619 1.00 0.00 H new ATOM 0 HA THR B 12 -4.194 -4.774 -8.942 1.00 0.00 H new ATOM 0 HB THR B 12 -1.906 -4.042 -7.156 1.00 0.00 H new ATOM 0 HG1 THR B 12 -3.979 -5.264 -5.833 1.00 0.00 H new ATOM 0 HG21 THR B 12 -3.657 -3.007 -5.748 1.00 0.00 H new ATOM 0 HG22 THR B 12 -3.616 -2.330 -7.393 1.00 0.00 H new ATOM 0 HG23 THR B 12 -4.881 -3.498 -6.943 1.00 0.00 H new ATOM 1467 N THR B 13 -3.276 -2.652 -9.971 1.00 0.00 N ATOM 1468 CA THR B 13 -2.769 -1.584 -10.823 1.00 0.00 C ATOM 1469 C THR B 13 -2.950 -0.212 -10.189 1.00 0.00 C ATOM 1470 O THR B 13 -3.983 0.084 -9.588 1.00 0.00 O ATOM 1471 CB THR B 13 -3.463 -1.599 -12.185 1.00 0.00 C ATOM 1472 OG1 THR B 13 -3.901 -2.905 -12.524 1.00 0.00 O ATOM 1473 CG2 THR B 13 -2.576 -1.100 -13.303 1.00 0.00 C ATOM 0 H THR B 13 -4.252 -2.550 -9.693 1.00 0.00 H new ATOM 0 HA THR B 13 -1.702 -1.768 -10.951 1.00 0.00 H new ATOM 0 HB THR B 13 -4.313 -0.924 -12.083 1.00 0.00 H new ATOM 0 HG1 THR B 13 -4.343 -2.885 -13.399 1.00 0.00 H new ATOM 0 HG21 THR B 13 -3.124 -1.134 -14.245 1.00 0.00 H new ATOM 0 HG22 THR B 13 -2.273 -0.074 -13.096 1.00 0.00 H new ATOM 0 HG23 THR B 13 -1.691 -1.732 -13.375 1.00 0.00 H new ATOM 1481 N LEU B 14 -1.940 0.629 -10.365 1.00 0.00 N ATOM 1482 CA LEU B 14 -1.966 1.991 -9.855 1.00 0.00 C ATOM 1483 C LEU B 14 -1.516 2.936 -10.956 1.00 0.00 C ATOM 1484 O LEU B 14 -0.542 2.660 -11.652 1.00 0.00 O ATOM 1485 CB LEU B 14 -1.060 2.148 -8.630 1.00 0.00 C ATOM 1486 CG LEU B 14 -0.869 0.892 -7.779 1.00 0.00 C ATOM 1487 CD1 LEU B 14 0.545 0.846 -7.228 1.00 0.00 C ATOM 1488 CD2 LEU B 14 -1.888 0.850 -6.647 1.00 0.00 C ATOM 0 H LEU B 14 -1.084 0.387 -10.863 1.00 0.00 H new ATOM 0 HA LEU B 14 -2.984 2.229 -9.545 1.00 0.00 H new ATOM 0 HB2 LEU B 14 -0.081 2.488 -8.967 1.00 0.00 H new ATOM 0 HB3 LEU B 14 -1.470 2.934 -7.996 1.00 0.00 H new ATOM 0 HG LEU B 14 -1.027 0.017 -8.409 1.00 0.00 H new ATOM 0 HD11 LEU B 14 0.671 -0.052 -6.623 1.00 0.00 H new ATOM 0 HD12 LEU B 14 1.257 0.831 -8.053 1.00 0.00 H new ATOM 0 HD13 LEU B 14 0.724 1.727 -6.611 1.00 0.00 H new ATOM 0 HD21 LEU B 14 -1.735 -0.051 -6.053 1.00 0.00 H new ATOM 0 HD22 LEU B 14 -1.764 1.728 -6.013 1.00 0.00 H new ATOM 0 HD23 LEU B 14 -2.895 0.843 -7.064 1.00 0.00 H new ATOM 1500 N ALA B 15 -2.231 4.034 -11.134 1.00 0.00 N ATOM 1501 CA ALA B 15 -1.888 4.978 -12.185 1.00 0.00 C ATOM 1502 C ALA B 15 -0.861 6.003 -11.719 1.00 0.00 C ATOM 1503 O ALA B 15 -1.211 7.095 -11.276 1.00 0.00 O ATOM 1504 CB ALA B 15 -3.139 5.670 -12.702 1.00 0.00 C ATOM 0 H ALA B 15 -3.043 4.292 -10.573 1.00 0.00 H new ATOM 0 HA ALA B 15 -1.433 4.413 -12.999 1.00 0.00 H new ATOM 0 HB1 ALA B 15 -2.867 6.374 -13.488 1.00 0.00 H new ATOM 0 HB2 ALA B 15 -3.827 4.926 -13.103 1.00 0.00 H new ATOM 0 HB3 ALA B 15 -3.621 6.207 -11.885 1.00 0.00 H new ATOM 1510 N PHE B 16 0.407 5.633 -11.857 1.00 0.00 N ATOM 1511 CA PHE B 16 1.534 6.489 -11.490 1.00 0.00 C ATOM 1512 C PHE B 16 2.819 5.856 -11.978 1.00 0.00 C ATOM 1513 O PHE B 16 2.813 4.751 -12.501 1.00 0.00 O ATOM 1514 CB PHE B 16 1.630 6.721 -9.978 1.00 0.00 C ATOM 1515 CG PHE B 16 0.570 7.633 -9.427 1.00 0.00 C ATOM 1516 CD1 PHE B 16 0.627 8.998 -9.655 1.00 0.00 C ATOM 1517 CD2 PHE B 16 -0.481 7.125 -8.680 1.00 0.00 C ATOM 1518 CE1 PHE B 16 -0.344 9.841 -9.149 1.00 0.00 C ATOM 1519 CE2 PHE B 16 -1.456 7.963 -8.171 1.00 0.00 C ATOM 1520 CZ PHE B 16 -1.387 9.322 -8.405 1.00 0.00 C ATOM 0 H PHE B 16 0.686 4.725 -12.229 1.00 0.00 H new ATOM 0 HA PHE B 16 1.374 7.459 -11.960 1.00 0.00 H new ATOM 0 HB2 PHE B 16 1.566 5.759 -9.469 1.00 0.00 H new ATOM 0 HB3 PHE B 16 2.610 7.140 -9.747 1.00 0.00 H new ATOM 0 HD1 PHE B 16 1.440 9.408 -10.235 1.00 0.00 H new ATOM 0 HD2 PHE B 16 -0.539 6.063 -8.493 1.00 0.00 H new ATOM 0 HE1 PHE B 16 -0.288 10.903 -9.334 1.00 0.00 H new ATOM 0 HE2 PHE B 16 -2.271 7.555 -7.591 1.00 0.00 H new ATOM 0 HZ PHE B 16 -2.147 9.979 -8.007 1.00 0.00 H new ATOM 1530 N ASP B 17 3.913 6.568 -11.825 1.00 0.00 N ATOM 1531 CA ASP B 17 5.215 6.089 -12.262 1.00 0.00 C ATOM 1532 C ASP B 17 6.147 7.260 -12.406 1.00 0.00 C ATOM 1533 O ASP B 17 7.332 7.169 -12.111 1.00 0.00 O ATOM 1534 CB ASP B 17 5.121 5.341 -13.594 1.00 0.00 C ATOM 1535 CG ASP B 17 5.216 3.836 -13.427 1.00 0.00 C ATOM 1536 OD1 ASP B 17 5.227 3.125 -14.454 1.00 0.00 O ATOM 1537 OD2 ASP B 17 5.279 3.368 -12.270 1.00 0.00 O ATOM 0 H ASP B 17 3.931 7.493 -11.396 1.00 0.00 H new ATOM 0 HA ASP B 17 5.593 5.393 -11.514 1.00 0.00 H new ATOM 0 HB2 ASP B 17 4.178 5.590 -14.080 1.00 0.00 H new ATOM 0 HB3 ASP B 17 5.919 5.681 -14.254 1.00 0.00 H new ATOM 1542 N GLU B 18 5.607 8.376 -12.846 1.00 0.00 N ATOM 1543 CA GLU B 18 6.422 9.557 -13.006 1.00 0.00 C ATOM 1544 C GLU B 18 7.278 9.763 -11.758 1.00 0.00 C ATOM 1545 O GLU B 18 8.511 9.709 -11.814 1.00 0.00 O ATOM 1546 CB GLU B 18 5.550 10.789 -13.260 1.00 0.00 C ATOM 1547 CG GLU B 18 6.350 12.050 -13.545 1.00 0.00 C ATOM 1548 CD GLU B 18 5.905 13.227 -12.699 1.00 0.00 C ATOM 1549 OE1 GLU B 18 5.778 13.060 -11.468 1.00 0.00 O ATOM 1550 OE2 GLU B 18 5.684 14.318 -13.268 1.00 0.00 O ATOM 0 H GLU B 18 4.624 8.489 -13.095 1.00 0.00 H new ATOM 0 HA GLU B 18 7.072 9.419 -13.870 1.00 0.00 H new ATOM 0 HB2 GLU B 18 4.889 10.589 -14.104 1.00 0.00 H new ATOM 0 HB3 GLU B 18 4.915 10.960 -12.391 1.00 0.00 H new ATOM 0 HG2 GLU B 18 7.407 11.855 -13.362 1.00 0.00 H new ATOM 0 HG3 GLU B 18 6.252 12.308 -14.600 1.00 0.00 H new ATOM 1557 N ASP B 19 6.612 9.962 -10.626 1.00 0.00 N ATOM 1558 CA ASP B 19 7.311 10.160 -9.363 1.00 0.00 C ATOM 1559 C ASP B 19 7.654 8.836 -8.700 1.00 0.00 C ATOM 1560 O ASP B 19 8.795 8.619 -8.292 1.00 0.00 O ATOM 1561 CB ASP B 19 6.473 11.022 -8.417 1.00 0.00 C ATOM 1562 CG ASP B 19 7.305 12.063 -7.694 1.00 0.00 C ATOM 1563 OD1 ASP B 19 8.343 11.691 -7.106 1.00 0.00 O ATOM 1564 OD2 ASP B 19 6.919 13.251 -7.714 1.00 0.00 O ATOM 0 H ASP B 19 5.595 9.990 -10.557 1.00 0.00 H new ATOM 0 HA ASP B 19 8.245 10.677 -9.582 1.00 0.00 H new ATOM 0 HB2 ASP B 19 5.686 11.519 -8.984 1.00 0.00 H new ATOM 0 HB3 ASP B 19 5.982 10.381 -7.685 1.00 0.00 H new ATOM 1569 N VAL B 20 6.672 7.951 -8.585 1.00 0.00 N ATOM 1570 CA VAL B 20 6.909 6.662 -7.959 1.00 0.00 C ATOM 1571 C VAL B 20 7.978 5.878 -8.717 1.00 0.00 C ATOM 1572 O VAL B 20 8.880 5.316 -8.106 1.00 0.00 O ATOM 1573 CB VAL B 20 5.618 5.824 -7.835 1.00 0.00 C ATOM 1574 CG1 VAL B 20 4.532 6.626 -7.136 1.00 0.00 C ATOM 1575 CG2 VAL B 20 5.136 5.354 -9.193 1.00 0.00 C ATOM 0 H VAL B 20 5.718 8.101 -8.913 1.00 0.00 H new ATOM 0 HA VAL B 20 7.266 6.863 -6.949 1.00 0.00 H new ATOM 0 HB VAL B 20 5.846 4.942 -7.236 1.00 0.00 H new ATOM 0 HG11 VAL B 20 3.628 6.022 -7.056 1.00 0.00 H new ATOM 0 HG12 VAL B 20 4.871 6.906 -6.139 1.00 0.00 H new ATOM 0 HG13 VAL B 20 4.317 7.526 -7.712 1.00 0.00 H new ATOM 0 HG21 VAL B 20 4.226 4.767 -9.073 1.00 0.00 H new ATOM 0 HG22 VAL B 20 4.930 6.218 -9.825 1.00 0.00 H new ATOM 0 HG23 VAL B 20 5.906 4.739 -9.659 1.00 0.00 H new ATOM 1585 N TYR B 21 7.896 5.857 -10.049 1.00 0.00 N ATOM 1586 CA TYR B 21 8.893 5.143 -10.844 1.00 0.00 C ATOM 1587 C TYR B 21 10.264 5.790 -10.679 1.00 0.00 C ATOM 1588 O TYR B 21 11.251 5.092 -10.445 1.00 0.00 O ATOM 1589 CB TYR B 21 8.514 5.074 -12.329 1.00 0.00 C ATOM 1590 CG TYR B 21 9.095 3.874 -13.043 1.00 0.00 C ATOM 1591 CD1 TYR B 21 8.387 2.683 -13.130 1.00 0.00 C ATOM 1592 CD2 TYR B 21 10.354 3.934 -13.628 1.00 0.00 C ATOM 1593 CE1 TYR B 21 8.916 1.584 -13.780 1.00 0.00 C ATOM 1594 CE2 TYR B 21 10.889 2.839 -14.280 1.00 0.00 C ATOM 1595 CZ TYR B 21 10.167 1.668 -14.353 1.00 0.00 C ATOM 1596 OH TYR B 21 10.697 0.576 -15.003 1.00 0.00 O ATOM 0 H TYR B 21 7.164 6.317 -10.590 1.00 0.00 H new ATOM 0 HA TYR B 21 8.929 4.119 -10.471 1.00 0.00 H new ATOM 0 HB2 TYR B 21 7.428 5.050 -12.418 1.00 0.00 H new ATOM 0 HB3 TYR B 21 8.854 5.983 -12.826 1.00 0.00 H new ATOM 0 HD1 TYR B 21 7.407 2.614 -12.682 1.00 0.00 H new ATOM 0 HD2 TYR B 21 10.923 4.850 -13.572 1.00 0.00 H new ATOM 0 HE1 TYR B 21 8.352 0.665 -13.839 1.00 0.00 H new ATOM 0 HE2 TYR B 21 11.869 2.901 -14.730 1.00 0.00 H new ATOM 0 HH TYR B 21 11.585 0.802 -15.351 1.00 0.00 H new ATOM 1606 N HIS B 22 10.338 7.124 -10.779 1.00 0.00 N ATOM 1607 CA HIS B 22 11.623 7.796 -10.607 1.00 0.00 C ATOM 1608 C HIS B 22 12.133 7.571 -9.193 1.00 0.00 C ATOM 1609 O HIS B 22 13.281 7.171 -8.995 1.00 0.00 O ATOM 1610 CB HIS B 22 11.507 9.292 -10.901 1.00 0.00 C ATOM 1611 CG HIS B 22 12.197 9.710 -12.162 1.00 0.00 C ATOM 1612 ND1 HIS B 22 11.921 9.152 -13.392 1.00 0.00 N ATOM 1613 CD2 HIS B 22 13.159 10.638 -12.379 1.00 0.00 C ATOM 1614 CE1 HIS B 22 12.683 9.717 -14.311 1.00 0.00 C ATOM 1615 NE2 HIS B 22 13.442 10.623 -13.723 1.00 0.00 N ATOM 0 H HIS B 22 9.548 7.739 -10.972 1.00 0.00 H new ATOM 0 HA HIS B 22 12.333 7.372 -11.317 1.00 0.00 H new ATOM 0 HB2 HIS B 22 10.453 9.560 -10.968 1.00 0.00 H new ATOM 0 HB3 HIS B 22 11.926 9.852 -10.065 1.00 0.00 H new ATOM 0 HD2 HIS B 22 13.618 11.272 -11.634 1.00 0.00 H new ATOM 0 HE1 HIS B 22 12.685 9.478 -15.364 1.00 0.00 H new ATOM 0 HE2 HIS B 22 14.128 11.216 -14.191 1.00 0.00 H new ATOM 1624 N THR B 23 11.272 7.802 -8.206 1.00 0.00 N ATOM 1625 CA THR B 23 11.653 7.589 -6.818 1.00 0.00 C ATOM 1626 C THR B 23 12.041 6.132 -6.616 1.00 0.00 C ATOM 1627 O THR B 23 13.010 5.825 -5.930 1.00 0.00 O ATOM 1628 CB THR B 23 10.520 7.960 -5.869 1.00 0.00 C ATOM 1629 OG1 THR B 23 9.333 7.263 -6.203 1.00 0.00 O ATOM 1630 CG2 THR B 23 10.200 9.440 -5.862 1.00 0.00 C ATOM 0 H THR B 23 10.317 8.133 -8.341 1.00 0.00 H new ATOM 0 HA THR B 23 12.503 8.233 -6.593 1.00 0.00 H new ATOM 0 HB THR B 23 10.875 7.679 -4.877 1.00 0.00 H new ATOM 0 HG1 THR B 23 8.929 7.667 -6.999 1.00 0.00 H new ATOM 0 HG21 THR B 23 9.385 9.633 -5.165 1.00 0.00 H new ATOM 0 HG22 THR B 23 11.082 10.001 -5.553 1.00 0.00 H new ATOM 0 HG23 THR B 23 9.903 9.753 -6.863 1.00 0.00 H new ATOM 1638 N LEU B 24 11.291 5.234 -7.249 1.00 0.00 N ATOM 1639 CA LEU B 24 11.581 3.809 -7.164 1.00 0.00 C ATOM 1640 C LEU B 24 13.003 3.537 -7.639 1.00 0.00 C ATOM 1641 O LEU B 24 13.576 2.487 -7.350 1.00 0.00 O ATOM 1642 CB LEU B 24 10.584 3.000 -8.003 1.00 0.00 C ATOM 1643 CG LEU B 24 9.543 2.218 -7.199 1.00 0.00 C ATOM 1644 CD1 LEU B 24 10.209 1.427 -6.087 1.00 0.00 C ATOM 1645 CD2 LEU B 24 8.492 3.153 -6.623 1.00 0.00 C ATOM 0 H LEU B 24 10.482 5.468 -7.824 1.00 0.00 H new ATOM 0 HA LEU B 24 11.486 3.500 -6.123 1.00 0.00 H new ATOM 0 HB2 LEU B 24 10.064 3.681 -8.677 1.00 0.00 H new ATOM 0 HB3 LEU B 24 11.141 2.299 -8.625 1.00 0.00 H new ATOM 0 HG LEU B 24 9.050 1.520 -7.875 1.00 0.00 H new ATOM 0 HD11 LEU B 24 9.452 0.878 -5.527 1.00 0.00 H new ATOM 0 HD12 LEU B 24 10.923 0.724 -6.517 1.00 0.00 H new ATOM 0 HD13 LEU B 24 10.731 2.110 -5.417 1.00 0.00 H new ATOM 0 HD21 LEU B 24 7.763 2.575 -6.056 1.00 0.00 H new ATOM 0 HD22 LEU B 24 8.971 3.878 -5.965 1.00 0.00 H new ATOM 0 HD23 LEU B 24 7.987 3.677 -7.435 1.00 0.00 H new ATOM 1657 N LYS B 25 13.565 4.490 -8.381 1.00 0.00 N ATOM 1658 CA LYS B 25 14.910 4.350 -8.903 1.00 0.00 C ATOM 1659 C LYS B 25 15.955 4.380 -7.793 1.00 0.00 C ATOM 1660 O LYS B 25 16.849 3.535 -7.759 1.00 0.00 O ATOM 1661 CB LYS B 25 15.204 5.444 -9.932 1.00 0.00 C ATOM 1662 CG LYS B 25 16.459 5.187 -10.751 1.00 0.00 C ATOM 1663 CD LYS B 25 16.424 3.818 -11.417 1.00 0.00 C ATOM 1664 CE LYS B 25 17.412 2.858 -10.773 1.00 0.00 C ATOM 1665 NZ LYS B 25 18.632 2.673 -11.606 1.00 0.00 N ATOM 0 H LYS B 25 13.104 5.365 -8.630 1.00 0.00 H new ATOM 0 HA LYS B 25 14.969 3.377 -9.390 1.00 0.00 H new ATOM 0 HB2 LYS B 25 14.352 5.535 -10.606 1.00 0.00 H new ATOM 0 HB3 LYS B 25 15.306 6.399 -9.416 1.00 0.00 H new ATOM 0 HG2 LYS B 25 16.562 5.960 -11.513 1.00 0.00 H new ATOM 0 HG3 LYS B 25 17.335 5.256 -10.106 1.00 0.00 H new ATOM 0 HD2 LYS B 25 15.417 3.405 -11.349 1.00 0.00 H new ATOM 0 HD3 LYS B 25 16.655 3.922 -12.477 1.00 0.00 H new ATOM 0 HE2 LYS B 25 17.697 3.236 -9.791 1.00 0.00 H new ATOM 0 HE3 LYS B 25 16.930 1.893 -10.616 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 19.279 2.012 -11.131 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 18.364 2.289 -12.534 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 19.107 3.589 -11.735 1.00 0.00 H new ATOM 1679 N LEU B 26 15.850 5.346 -6.881 1.00 0.00 N ATOM 1680 CA LEU B 26 16.812 5.435 -5.790 1.00 0.00 C ATOM 1681 C LEU B 26 16.595 4.290 -4.810 1.00 0.00 C ATOM 1682 O LEU B 26 17.542 3.628 -4.400 1.00 0.00 O ATOM 1683 CB LEU B 26 16.726 6.787 -5.082 1.00 0.00 C ATOM 1684 CG LEU B 26 15.362 7.111 -4.502 1.00 0.00 C ATOM 1685 CD1 LEU B 26 15.227 6.515 -3.112 1.00 0.00 C ATOM 1686 CD2 LEU B 26 15.130 8.614 -4.476 1.00 0.00 C ATOM 0 H LEU B 26 15.124 6.062 -6.876 1.00 0.00 H new ATOM 0 HA LEU B 26 17.815 5.352 -6.208 1.00 0.00 H new ATOM 0 HB2 LEU B 26 17.462 6.809 -4.279 1.00 0.00 H new ATOM 0 HB3 LEU B 26 17.001 7.570 -5.788 1.00 0.00 H new ATOM 0 HG LEU B 26 14.598 6.667 -5.141 1.00 0.00 H new ATOM 0 HD11 LEU B 26 14.244 6.755 -2.707 1.00 0.00 H new ATOM 0 HD12 LEU B 26 15.342 5.433 -3.167 1.00 0.00 H new ATOM 0 HD13 LEU B 26 15.998 6.929 -2.462 1.00 0.00 H new ATOM 0 HD21 LEU B 26 14.146 8.823 -4.056 1.00 0.00 H new ATOM 0 HD22 LEU B 26 15.895 9.090 -3.862 1.00 0.00 H new ATOM 0 HD23 LEU B 26 15.183 9.008 -5.491 1.00 0.00 H new ATOM 1698 N VAL B 27 15.339 4.047 -4.466 1.00 0.00 N ATOM 1699 CA VAL B 27 14.987 2.957 -3.559 1.00 0.00 C ATOM 1700 C VAL B 27 15.382 1.622 -4.148 1.00 0.00 C ATOM 1701 O VAL B 27 15.886 0.752 -3.447 1.00 0.00 O ATOM 1702 CB VAL B 27 13.480 2.909 -3.252 1.00 0.00 C ATOM 1703 CG1 VAL B 27 13.191 3.442 -1.867 1.00 0.00 C ATOM 1704 CG2 VAL B 27 12.699 3.669 -4.279 1.00 0.00 C ATOM 0 H VAL B 27 14.543 4.590 -4.800 1.00 0.00 H new ATOM 0 HA VAL B 27 15.531 3.149 -2.634 1.00 0.00 H new ATOM 0 HB VAL B 27 13.168 1.865 -3.288 1.00 0.00 H new ATOM 0 HG11 VAL B 27 12.119 3.397 -1.676 1.00 0.00 H new ATOM 0 HG12 VAL B 27 13.717 2.838 -1.128 1.00 0.00 H new ATOM 0 HG13 VAL B 27 13.528 4.476 -1.797 1.00 0.00 H new ATOM 0 HG21 VAL B 27 11.637 3.619 -4.039 1.00 0.00 H new ATOM 0 HG22 VAL B 27 13.022 4.710 -4.284 1.00 0.00 H new ATOM 0 HG23 VAL B 27 12.869 3.231 -5.263 1.00 0.00 H new ATOM 1714 N SER B 28 15.137 1.446 -5.436 1.00 0.00 N ATOM 1715 CA SER B 28 15.467 0.187 -6.067 1.00 0.00 C ATOM 1716 C SER B 28 16.967 -0.070 -6.022 1.00 0.00 C ATOM 1717 O SER B 28 17.407 -1.193 -5.761 1.00 0.00 O ATOM 1718 CB SER B 28 14.960 0.147 -7.510 1.00 0.00 C ATOM 1719 OG SER B 28 13.556 -0.042 -7.551 1.00 0.00 O ATOM 0 H SER B 28 14.720 2.145 -6.051 1.00 0.00 H new ATOM 0 HA SER B 28 14.968 -0.604 -5.508 1.00 0.00 H new ATOM 0 HB2 SER B 28 15.220 1.077 -8.016 1.00 0.00 H new ATOM 0 HB3 SER B 28 15.455 -0.660 -8.051 1.00 0.00 H new ATOM 0 HG SER B 28 13.106 0.804 -7.346 1.00 0.00 H new ATOM 1725 N VAL B 29 17.746 0.978 -6.266 1.00 0.00 N ATOM 1726 CA VAL B 29 19.193 0.877 -6.249 1.00 0.00 C ATOM 1727 C VAL B 29 19.706 0.843 -4.815 1.00 0.00 C ATOM 1728 O VAL B 29 20.557 0.027 -4.461 1.00 0.00 O ATOM 1729 CB VAL B 29 19.816 2.068 -7.015 1.00 0.00 C ATOM 1730 CG1 VAL B 29 20.640 2.966 -6.105 1.00 0.00 C ATOM 1731 CG2 VAL B 29 20.649 1.576 -8.189 1.00 0.00 C ATOM 0 H VAL B 29 17.393 1.911 -6.479 1.00 0.00 H new ATOM 0 HA VAL B 29 19.486 -0.050 -6.742 1.00 0.00 H new ATOM 0 HB VAL B 29 18.993 2.670 -7.400 1.00 0.00 H new ATOM 0 HG11 VAL B 29 21.058 3.788 -6.686 1.00 0.00 H new ATOM 0 HG12 VAL B 29 20.004 3.366 -5.316 1.00 0.00 H new ATOM 0 HG13 VAL B 29 21.450 2.388 -5.660 1.00 0.00 H new ATOM 0 HG21 VAL B 29 21.078 2.430 -8.714 1.00 0.00 H new ATOM 0 HG22 VAL B 29 21.451 0.935 -7.823 1.00 0.00 H new ATOM 0 HG23 VAL B 29 20.016 1.010 -8.873 1.00 0.00 H new ATOM 1741 N TYR B 30 19.184 1.750 -4.002 1.00 0.00 N ATOM 1742 CA TYR B 30 19.585 1.848 -2.605 1.00 0.00 C ATOM 1743 C TYR B 30 19.047 0.681 -1.785 1.00 0.00 C ATOM 1744 O TYR B 30 19.626 0.324 -0.760 1.00 0.00 O ATOM 1745 CB TYR B 30 19.111 3.168 -1.997 1.00 0.00 C ATOM 1746 CG TYR B 30 20.004 4.343 -2.330 1.00 0.00 C ATOM 1747 CD1 TYR B 30 19.532 5.405 -3.089 1.00 0.00 C ATOM 1748 CD2 TYR B 30 21.318 4.387 -1.884 1.00 0.00 C ATOM 1749 CE1 TYR B 30 20.346 6.479 -3.397 1.00 0.00 C ATOM 1750 CE2 TYR B 30 22.139 5.458 -2.186 1.00 0.00 C ATOM 1751 CZ TYR B 30 21.647 6.501 -2.943 1.00 0.00 C ATOM 1752 OH TYR B 30 22.460 7.569 -3.246 1.00 0.00 O ATOM 0 H TYR B 30 18.480 2.431 -4.286 1.00 0.00 H new ATOM 0 HA TYR B 30 20.674 1.812 -2.578 1.00 0.00 H new ATOM 0 HB2 TYR B 30 18.101 3.379 -2.349 1.00 0.00 H new ATOM 0 HB3 TYR B 30 19.055 3.060 -0.914 1.00 0.00 H new ATOM 0 HD1 TYR B 30 18.512 5.392 -3.445 1.00 0.00 H new ATOM 0 HD2 TYR B 30 21.705 3.571 -1.291 1.00 0.00 H new ATOM 0 HE1 TYR B 30 19.964 7.297 -3.990 1.00 0.00 H new ATOM 0 HE2 TYR B 30 23.159 5.478 -1.831 1.00 0.00 H new ATOM 0 HH TYR B 30 23.345 7.429 -2.849 1.00 0.00 H new ATOM 1762 N LEU B 31 17.942 0.082 -2.228 1.00 0.00 N ATOM 1763 CA LEU B 31 17.367 -1.040 -1.501 1.00 0.00 C ATOM 1764 C LEU B 31 17.590 -2.346 -2.260 1.00 0.00 C ATOM 1765 O LEU B 31 17.180 -3.413 -1.801 1.00 0.00 O ATOM 1766 CB LEU B 31 15.863 -0.829 -1.258 1.00 0.00 C ATOM 1767 CG LEU B 31 15.424 0.562 -0.750 1.00 0.00 C ATOM 1768 CD1 LEU B 31 14.359 0.419 0.326 1.00 0.00 C ATOM 1769 CD2 LEU B 31 16.598 1.375 -0.217 1.00 0.00 C ATOM 0 H LEU B 31 17.437 0.352 -3.072 1.00 0.00 H new ATOM 0 HA LEU B 31 17.870 -1.101 -0.536 1.00 0.00 H new ATOM 0 HB2 LEU B 31 15.337 -1.030 -2.191 1.00 0.00 H new ATOM 0 HB3 LEU B 31 15.528 -1.574 -0.537 1.00 0.00 H new ATOM 0 HG LEU B 31 15.010 1.101 -1.602 1.00 0.00 H new ATOM 0 HD11 LEU B 31 14.059 1.407 0.675 1.00 0.00 H new ATOM 0 HD12 LEU B 31 13.493 -0.099 -0.086 1.00 0.00 H new ATOM 0 HD13 LEU B 31 14.761 -0.154 1.162 1.00 0.00 H new ATOM 0 HD21 LEU B 31 16.241 2.345 0.129 1.00 0.00 H new ATOM 0 HD22 LEU B 31 17.063 0.842 0.613 1.00 0.00 H new ATOM 0 HD23 LEU B 31 17.331 1.520 -1.011 1.00 0.00 H new ATOM 1781 N ASN B 32 18.233 -2.261 -3.428 1.00 0.00 N ATOM 1782 CA ASN B 32 18.491 -3.443 -4.245 1.00 0.00 C ATOM 1783 C ASN B 32 17.222 -4.274 -4.364 1.00 0.00 C ATOM 1784 O ASN B 32 17.264 -5.504 -4.393 1.00 0.00 O ATOM 1785 CB ASN B 32 19.615 -4.282 -3.633 1.00 0.00 C ATOM 1786 CG ASN B 32 20.443 -4.992 -4.686 1.00 0.00 C ATOM 1787 OD1 ASN B 32 20.680 -4.459 -5.770 1.00 0.00 O ATOM 1788 ND2 ASN B 32 20.889 -6.203 -4.371 1.00 0.00 N ATOM 0 H ASN B 32 18.582 -1.389 -3.825 1.00 0.00 H new ATOM 0 HA ASN B 32 18.803 -3.122 -5.239 1.00 0.00 H new ATOM 0 HB2 ASN B 32 20.263 -3.638 -3.038 1.00 0.00 H new ATOM 0 HB3 ASN B 32 19.187 -5.019 -2.953 1.00 0.00 H new ATOM 0 HD21 ASN B 32 21.452 -6.729 -5.039 1.00 0.00 H new ATOM 0 HD22 ASN B 32 20.669 -6.607 -3.461 1.00 0.00 H new ATOM 1795 N ARG B 33 16.091 -3.580 -4.406 1.00 0.00 N ATOM 1796 CA ARG B 33 14.793 -4.236 -4.497 1.00 0.00 C ATOM 1797 C ARG B 33 14.060 -3.848 -5.772 1.00 0.00 C ATOM 1798 O ARG B 33 14.376 -2.839 -6.401 1.00 0.00 O ATOM 1799 CB ARG B 33 13.935 -3.865 -3.280 1.00 0.00 C ATOM 1800 CG ARG B 33 14.485 -4.395 -1.967 1.00 0.00 C ATOM 1801 CD ARG B 33 13.381 -4.948 -1.079 1.00 0.00 C ATOM 1802 NE ARG B 33 13.761 -4.947 0.332 1.00 0.00 N ATOM 1803 CZ ARG B 33 14.678 -5.759 0.854 1.00 0.00 C ATOM 1804 NH1 ARG B 33 15.308 -6.640 0.086 1.00 0.00 N ATOM 1805 NH2 ARG B 33 14.965 -5.691 2.147 1.00 0.00 N ATOM 0 H ARG B 33 16.047 -2.561 -4.378 1.00 0.00 H new ATOM 0 HA ARG B 33 14.964 -5.312 -4.517 1.00 0.00 H new ATOM 0 HB2 ARG B 33 13.854 -2.780 -3.219 1.00 0.00 H new ATOM 0 HB3 ARG B 33 12.926 -4.252 -3.425 1.00 0.00 H new ATOM 0 HG2 ARG B 33 15.217 -5.177 -2.168 1.00 0.00 H new ATOM 0 HG3 ARG B 33 15.009 -3.596 -1.442 1.00 0.00 H new ATOM 0 HD2 ARG B 33 12.477 -4.353 -1.211 1.00 0.00 H new ATOM 0 HD3 ARG B 33 13.142 -5.965 -1.389 1.00 0.00 H new ATOM 0 HE ARG B 33 13.296 -4.285 0.954 1.00 0.00 H new ATOM 0 HH11 ARG B 33 15.090 -6.697 -0.909 1.00 0.00 H new ATOM 0 HH12 ARG B 33 16.010 -7.260 0.491 1.00 0.00 H new ATOM 0 HH21 ARG B 33 14.483 -5.017 2.742 1.00 0.00 H new ATOM 0 HH22 ARG B 33 15.667 -6.313 2.547 1.00 0.00 H new ATOM 1819 N ASP B 34 13.061 -4.644 -6.134 1.00 0.00 N ATOM 1820 CA ASP B 34 12.260 -4.363 -7.314 1.00 0.00 C ATOM 1821 C ASP B 34 11.224 -3.309 -6.965 1.00 0.00 C ATOM 1822 O ASP B 34 10.725 -3.276 -5.840 1.00 0.00 O ATOM 1823 CB ASP B 34 11.578 -5.634 -7.822 1.00 0.00 C ATOM 1824 CG ASP B 34 12.554 -6.779 -8.014 1.00 0.00 C ATOM 1825 OD1 ASP B 34 13.082 -7.285 -7.001 1.00 0.00 O ATOM 1826 OD2 ASP B 34 12.791 -7.169 -9.176 1.00 0.00 O ATOM 0 H ASP B 34 12.789 -5.486 -5.627 1.00 0.00 H new ATOM 0 HA ASP B 34 12.907 -3.993 -8.109 1.00 0.00 H new ATOM 0 HB2 ASP B 34 10.804 -5.935 -7.115 1.00 0.00 H new ATOM 0 HB3 ASP B 34 11.080 -5.422 -8.768 1.00 0.00 H new ATOM 1831 N MET B 35 10.909 -2.438 -7.913 1.00 0.00 N ATOM 1832 CA MET B 35 9.947 -1.383 -7.668 1.00 0.00 C ATOM 1833 C MET B 35 8.667 -1.950 -7.056 1.00 0.00 C ATOM 1834 O MET B 35 8.006 -1.289 -6.258 1.00 0.00 O ATOM 1835 CB MET B 35 9.662 -0.622 -8.969 1.00 0.00 C ATOM 1836 CG MET B 35 8.190 -0.395 -9.240 1.00 0.00 C ATOM 1837 SD MET B 35 7.894 0.570 -10.735 1.00 0.00 S ATOM 1838 CE MET B 35 7.576 -0.733 -11.921 1.00 0.00 C ATOM 0 H MET B 35 11.305 -2.444 -8.853 1.00 0.00 H new ATOM 0 HA MET B 35 10.366 -0.679 -6.949 1.00 0.00 H new ATOM 0 HB2 MET B 35 10.167 0.343 -8.931 1.00 0.00 H new ATOM 0 HB3 MET B 35 10.093 -1.175 -9.803 1.00 0.00 H new ATOM 0 HG2 MET B 35 7.689 -1.359 -9.330 1.00 0.00 H new ATOM 0 HG3 MET B 35 7.743 0.118 -8.388 1.00 0.00 H new ATOM 0 HE1 MET B 35 6.851 -0.386 -12.657 1.00 0.00 H new ATOM 0 HE2 MET B 35 8.505 -1.001 -12.425 1.00 0.00 H new ATOM 0 HE3 MET B 35 7.178 -1.606 -11.404 1.00 0.00 H new ATOM 1848 N THR B 36 8.335 -3.184 -7.420 1.00 0.00 N ATOM 1849 CA THR B 36 7.146 -3.831 -6.885 1.00 0.00 C ATOM 1850 C THR B 36 7.387 -4.247 -5.438 1.00 0.00 C ATOM 1851 O THR B 36 6.471 -4.237 -4.620 1.00 0.00 O ATOM 1852 CB THR B 36 6.762 -5.054 -7.735 1.00 0.00 C ATOM 1853 OG1 THR B 36 7.592 -5.154 -8.877 1.00 0.00 O ATOM 1854 CG2 THR B 36 5.326 -5.051 -8.216 1.00 0.00 C ATOM 0 H THR B 36 8.869 -3.751 -8.078 1.00 0.00 H new ATOM 0 HA THR B 36 6.320 -3.121 -6.918 1.00 0.00 H new ATOM 0 HB THR B 36 6.893 -5.904 -7.066 1.00 0.00 H new ATOM 0 HG1 THR B 36 7.332 -5.939 -9.403 1.00 0.00 H new ATOM 0 HG21 THR B 36 5.138 -5.947 -8.807 1.00 0.00 H new ATOM 0 HG22 THR B 36 4.655 -5.036 -7.357 1.00 0.00 H new ATOM 0 HG23 THR B 36 5.150 -4.168 -8.830 1.00 0.00 H new ATOM 1862 N GLU B 37 8.631 -4.598 -5.128 1.00 0.00 N ATOM 1863 CA GLU B 37 8.992 -4.999 -3.774 1.00 0.00 C ATOM 1864 C GLU B 37 9.074 -3.777 -2.866 1.00 0.00 C ATOM 1865 O GLU B 37 8.649 -3.817 -1.713 1.00 0.00 O ATOM 1866 CB GLU B 37 10.330 -5.741 -3.776 1.00 0.00 C ATOM 1867 CG GLU B 37 10.411 -6.852 -2.741 1.00 0.00 C ATOM 1868 CD GLU B 37 10.382 -8.235 -3.365 1.00 0.00 C ATOM 1869 OE1 GLU B 37 11.471 -8.780 -3.648 1.00 0.00 O ATOM 1870 OE2 GLU B 37 9.274 -8.772 -3.568 1.00 0.00 O ATOM 0 H GLU B 37 9.403 -4.613 -5.794 1.00 0.00 H new ATOM 0 HA GLU B 37 8.221 -5.669 -3.395 1.00 0.00 H new ATOM 0 HB2 GLU B 37 10.500 -6.165 -4.766 1.00 0.00 H new ATOM 0 HB3 GLU B 37 11.133 -5.026 -3.593 1.00 0.00 H new ATOM 0 HG2 GLU B 37 11.328 -6.738 -2.162 1.00 0.00 H new ATOM 0 HG3 GLU B 37 9.579 -6.755 -2.043 1.00 0.00 H new ATOM 1877 N ILE B 38 9.618 -2.688 -3.404 1.00 0.00 N ATOM 1878 CA ILE B 38 9.752 -1.444 -2.655 1.00 0.00 C ATOM 1879 C ILE B 38 8.388 -0.790 -2.439 1.00 0.00 C ATOM 1880 O ILE B 38 8.058 -0.383 -1.325 1.00 0.00 O ATOM 1881 CB ILE B 38 10.656 -0.435 -3.395 1.00 0.00 C ATOM 1882 CG1 ILE B 38 12.121 -0.880 -3.407 1.00 0.00 C ATOM 1883 CG2 ILE B 38 10.548 0.947 -2.774 1.00 0.00 C ATOM 1884 CD1 ILE B 38 12.674 -1.068 -4.800 1.00 0.00 C ATOM 0 H ILE B 38 9.974 -2.643 -4.359 1.00 0.00 H new ATOM 0 HA ILE B 38 10.201 -1.701 -1.696 1.00 0.00 H new ATOM 0 HB ILE B 38 10.305 -0.395 -4.426 1.00 0.00 H new ATOM 0 HG12 ILE B 38 12.723 -0.139 -2.881 1.00 0.00 H new ATOM 0 HG13 ILE B 38 12.214 -1.816 -2.857 1.00 0.00 H new ATOM 0 HG21 ILE B 38 11.194 1.640 -3.313 1.00 0.00 H new ATOM 0 HG22 ILE B 38 9.516 1.293 -2.833 1.00 0.00 H new ATOM 0 HG23 ILE B 38 10.856 0.902 -1.729 1.00 0.00 H new ATOM 0 HD11 ILE B 38 13.716 -1.383 -4.738 1.00 0.00 H new ATOM 0 HD12 ILE B 38 12.094 -1.830 -5.322 1.00 0.00 H new ATOM 0 HD13 ILE B 38 12.612 -0.127 -5.346 1.00 0.00 H new ATOM 1896 N ILE B 39 7.603 -0.675 -3.512 1.00 0.00 N ATOM 1897 CA ILE B 39 6.290 -0.051 -3.419 1.00 0.00 C ATOM 1898 C ILE B 39 5.399 -0.815 -2.458 1.00 0.00 C ATOM 1899 O ILE B 39 4.606 -0.227 -1.724 1.00 0.00 O ATOM 1900 CB ILE B 39 5.590 0.016 -4.788 1.00 0.00 C ATOM 1901 CG1 ILE B 39 5.333 -1.397 -5.309 1.00 0.00 C ATOM 1902 CG2 ILE B 39 6.422 0.815 -5.776 1.00 0.00 C ATOM 1903 CD1 ILE B 39 3.937 -1.901 -5.012 1.00 0.00 C ATOM 0 H ILE B 39 7.854 -1.003 -4.445 1.00 0.00 H new ATOM 0 HA ILE B 39 6.451 0.963 -3.054 1.00 0.00 H new ATOM 0 HB ILE B 39 4.633 0.524 -4.671 1.00 0.00 H new ATOM 0 HG12 ILE B 39 5.496 -1.415 -6.387 1.00 0.00 H new ATOM 0 HG13 ILE B 39 6.059 -2.078 -4.865 1.00 0.00 H new ATOM 0 HG21 ILE B 39 5.910 0.851 -6.738 1.00 0.00 H new ATOM 0 HG22 ILE B 39 6.559 1.829 -5.400 1.00 0.00 H new ATOM 0 HG23 ILE B 39 7.395 0.340 -5.900 1.00 0.00 H new ATOM 0 HD11 ILE B 39 3.822 -2.910 -5.409 1.00 0.00 H new ATOM 0 HD12 ILE B 39 3.777 -1.915 -3.934 1.00 0.00 H new ATOM 0 HD13 ILE B 39 3.205 -1.242 -5.479 1.00 0.00 H new ATOM 1915 N GLU B 40 5.533 -2.133 -2.473 1.00 0.00 N ATOM 1916 CA GLU B 40 4.736 -2.977 -1.607 1.00 0.00 C ATOM 1917 C GLU B 40 5.351 -3.052 -0.220 1.00 0.00 C ATOM 1918 O GLU B 40 4.658 -3.326 0.759 1.00 0.00 O ATOM 1919 CB GLU B 40 4.594 -4.377 -2.198 1.00 0.00 C ATOM 1920 CG GLU B 40 3.158 -4.863 -2.256 1.00 0.00 C ATOM 1921 CD GLU B 40 2.253 -3.912 -3.013 1.00 0.00 C ATOM 1922 OE1 GLU B 40 1.593 -3.074 -2.363 1.00 0.00 O ATOM 1923 OE2 GLU B 40 2.204 -4.004 -4.258 1.00 0.00 O ATOM 0 H GLU B 40 6.185 -2.636 -3.075 1.00 0.00 H new ATOM 0 HA GLU B 40 3.743 -2.535 -1.524 1.00 0.00 H new ATOM 0 HB2 GLU B 40 5.013 -4.383 -3.204 1.00 0.00 H new ATOM 0 HB3 GLU B 40 5.183 -5.076 -1.604 1.00 0.00 H new ATOM 0 HG2 GLU B 40 3.129 -5.843 -2.732 1.00 0.00 H new ATOM 0 HG3 GLU B 40 2.779 -4.989 -1.242 1.00 0.00 H new ATOM 1930 N GLU B 41 6.651 -2.786 -0.131 1.00 0.00 N ATOM 1931 CA GLU B 41 7.321 -2.812 1.159 1.00 0.00 C ATOM 1932 C GLU B 41 7.136 -1.474 1.858 1.00 0.00 C ATOM 1933 O GLU B 41 7.070 -1.404 3.086 1.00 0.00 O ATOM 1934 CB GLU B 41 8.809 -3.120 0.991 1.00 0.00 C ATOM 1935 CG GLU B 41 9.114 -4.605 0.889 1.00 0.00 C ATOM 1936 CD GLU B 41 10.554 -4.876 0.506 1.00 0.00 C ATOM 1937 OE1 GLU B 41 11.400 -3.980 0.709 1.00 0.00 O ATOM 1938 OE2 GLU B 41 10.838 -5.985 0.005 1.00 0.00 O ATOM 0 H GLU B 41 7.250 -2.554 -0.923 1.00 0.00 H new ATOM 0 HA GLU B 41 6.878 -3.600 1.768 1.00 0.00 H new ATOM 0 HB2 GLU B 41 9.176 -2.620 0.095 1.00 0.00 H new ATOM 0 HB3 GLU B 41 9.356 -2.702 1.836 1.00 0.00 H new ATOM 0 HG2 GLU B 41 8.899 -5.083 1.845 1.00 0.00 H new ATOM 0 HG3 GLU B 41 8.453 -5.058 0.150 1.00 0.00 H new ATOM 1945 N ALA B 42 7.040 -0.413 1.062 1.00 0.00 N ATOM 1946 CA ALA B 42 6.850 0.925 1.602 1.00 0.00 C ATOM 1947 C ALA B 42 5.403 1.133 2.031 1.00 0.00 C ATOM 1948 O ALA B 42 5.131 1.766 3.051 1.00 0.00 O ATOM 1949 CB ALA B 42 7.256 1.970 0.574 1.00 0.00 C ATOM 0 H ALA B 42 7.091 -0.456 0.044 1.00 0.00 H new ATOM 0 HA ALA B 42 7.485 1.035 2.481 1.00 0.00 H new ATOM 0 HB1 ALA B 42 7.109 2.966 0.991 1.00 0.00 H new ATOM 0 HB2 ALA B 42 8.306 1.836 0.315 1.00 0.00 H new ATOM 0 HB3 ALA B 42 6.644 1.857 -0.321 1.00 0.00 H new ATOM 1955 N VAL B 43 4.479 0.595 1.242 1.00 0.00 N ATOM 1956 CA VAL B 43 3.055 0.719 1.535 1.00 0.00 C ATOM 1957 C VAL B 43 2.702 0.073 2.857 1.00 0.00 C ATOM 1958 O VAL B 43 2.235 0.731 3.788 1.00 0.00 O ATOM 1959 CB VAL B 43 2.183 0.056 0.440 1.00 0.00 C ATOM 1960 CG1 VAL B 43 2.668 -1.334 0.103 1.00 0.00 C ATOM 1961 CG2 VAL B 43 0.734 -0.019 0.878 1.00 0.00 C ATOM 0 H VAL B 43 4.690 0.069 0.394 1.00 0.00 H new ATOM 0 HA VAL B 43 2.851 1.789 1.574 1.00 0.00 H new ATOM 0 HB VAL B 43 2.266 0.680 -0.450 1.00 0.00 H new ATOM 0 HG11 VAL B 43 2.030 -1.765 -0.669 1.00 0.00 H new ATOM 0 HG12 VAL B 43 3.694 -1.283 -0.261 1.00 0.00 H new ATOM 0 HG13 VAL B 43 2.630 -1.959 0.995 1.00 0.00 H new ATOM 0 HG21 VAL B 43 0.141 -0.488 0.093 1.00 0.00 H new ATOM 0 HG22 VAL B 43 0.660 -0.610 1.791 1.00 0.00 H new ATOM 0 HG23 VAL B 43 0.358 0.987 1.065 1.00 0.00 H new ATOM 1971 N VAL B 44 2.913 -1.223 2.915 1.00 0.00 N ATOM 1972 CA VAL B 44 2.609 -1.996 4.097 1.00 0.00 C ATOM 1973 C VAL B 44 3.357 -1.449 5.298 1.00 0.00 C ATOM 1974 O VAL B 44 2.778 -1.234 6.360 1.00 0.00 O ATOM 1975 CB VAL B 44 2.959 -3.476 3.866 1.00 0.00 C ATOM 1976 CG1 VAL B 44 3.423 -4.153 5.150 1.00 0.00 C ATOM 1977 CG2 VAL B 44 1.780 -4.218 3.260 1.00 0.00 C ATOM 0 H VAL B 44 3.299 -1.769 2.145 1.00 0.00 H new ATOM 0 HA VAL B 44 1.541 -1.920 4.300 1.00 0.00 H new ATOM 0 HB VAL B 44 3.789 -3.511 3.161 1.00 0.00 H new ATOM 0 HG11 VAL B 44 3.661 -5.197 4.945 1.00 0.00 H new ATOM 0 HG12 VAL B 44 4.311 -3.646 5.528 1.00 0.00 H new ATOM 0 HG13 VAL B 44 2.630 -4.101 5.896 1.00 0.00 H new ATOM 0 HG21 VAL B 44 2.049 -5.263 3.105 1.00 0.00 H new ATOM 0 HG22 VAL B 44 0.927 -4.159 3.936 1.00 0.00 H new ATOM 0 HG23 VAL B 44 1.517 -3.765 2.304 1.00 0.00 H new ATOM 1987 N MET B 45 4.646 -1.212 5.124 1.00 0.00 N ATOM 1988 CA MET B 45 5.457 -0.677 6.202 1.00 0.00 C ATOM 1989 C MET B 45 4.889 0.650 6.684 1.00 0.00 C ATOM 1990 O MET B 45 4.967 0.967 7.871 1.00 0.00 O ATOM 1991 CB MET B 45 6.905 -0.498 5.751 1.00 0.00 C ATOM 1992 CG MET B 45 7.845 -0.132 6.884 1.00 0.00 C ATOM 1993 SD MET B 45 7.952 -1.425 8.137 1.00 0.00 S ATOM 1994 CE MET B 45 8.473 -0.475 9.562 1.00 0.00 C ATOM 0 H MET B 45 5.150 -1.380 4.253 1.00 0.00 H new ATOM 0 HA MET B 45 5.439 -1.388 7.028 1.00 0.00 H new ATOM 0 HB2 MET B 45 7.250 -1.421 5.286 1.00 0.00 H new ATOM 0 HB3 MET B 45 6.947 0.279 4.988 1.00 0.00 H new ATOM 0 HG2 MET B 45 8.839 0.061 6.480 1.00 0.00 H new ATOM 0 HG3 MET B 45 7.505 0.793 7.349 1.00 0.00 H new ATOM 0 HE1 MET B 45 7.964 -0.845 10.452 1.00 0.00 H new ATOM 0 HE2 MET B 45 9.550 -0.576 9.692 1.00 0.00 H new ATOM 0 HE3 MET B 45 8.223 0.575 9.411 1.00 0.00 H new ATOM 2004 N TRP B 46 4.299 1.422 5.768 1.00 0.00 N ATOM 2005 CA TRP B 46 3.713 2.700 6.144 1.00 0.00 C ATOM 2006 C TRP B 46 2.505 2.472 7.039 1.00 0.00 C ATOM 2007 O TRP B 46 2.455 2.964 8.167 1.00 0.00 O ATOM 2008 CB TRP B 46 3.305 3.500 4.907 1.00 0.00 C ATOM 2009 CG TRP B 46 2.757 4.854 5.240 1.00 0.00 C ATOM 2010 CD1 TRP B 46 1.482 5.297 5.032 1.00 0.00 C ATOM 2011 CD2 TRP B 46 3.466 5.941 5.845 1.00 0.00 C ATOM 2012 NE1 TRP B 46 1.357 6.595 5.468 1.00 0.00 N ATOM 2013 CE2 TRP B 46 2.562 7.011 5.973 1.00 0.00 C ATOM 2014 CE3 TRP B 46 4.779 6.113 6.293 1.00 0.00 C ATOM 2015 CZ2 TRP B 46 2.928 8.235 6.529 1.00 0.00 C ATOM 2016 CZ3 TRP B 46 5.141 7.327 6.845 1.00 0.00 C ATOM 2017 CH2 TRP B 46 4.219 8.374 6.959 1.00 0.00 C ATOM 0 H TRP B 46 4.217 1.186 4.779 1.00 0.00 H new ATOM 0 HA TRP B 46 4.462 3.274 6.689 1.00 0.00 H new ATOM 0 HB2 TRP B 46 4.170 3.615 4.254 1.00 0.00 H new ATOM 0 HB3 TRP B 46 2.556 2.938 4.349 1.00 0.00 H new ATOM 0 HD1 TRP B 46 0.688 4.713 4.590 1.00 0.00 H new ATOM 0 HE1 TRP B 46 0.507 7.157 5.423 1.00 0.00 H new ATOM 0 HE3 TRP B 46 5.498 5.311 6.209 1.00 0.00 H new ATOM 0 HZ2 TRP B 46 2.218 9.044 6.617 1.00 0.00 H new ATOM 0 HZ3 TRP B 46 6.153 7.470 7.194 1.00 0.00 H new ATOM 0 HH2 TRP B 46 4.533 9.311 7.395 1.00 0.00 H new ATOM 2028 N LEU B 47 1.541 1.705 6.541 1.00 0.00 N ATOM 2029 CA LEU B 47 0.343 1.398 7.315 1.00 0.00 C ATOM 2030 C LEU B 47 0.720 0.755 8.631 1.00 0.00 C ATOM 2031 O LEU B 47 0.177 1.082 9.683 1.00 0.00 O ATOM 2032 CB LEU B 47 -0.582 0.431 6.573 1.00 0.00 C ATOM 2033 CG LEU B 47 0.092 -0.583 5.651 1.00 0.00 C ATOM 2034 CD1 LEU B 47 0.165 -1.937 6.337 1.00 0.00 C ATOM 2035 CD2 LEU B 47 -0.662 -0.693 4.334 1.00 0.00 C ATOM 0 H LEU B 47 1.565 1.287 5.611 1.00 0.00 H new ATOM 0 HA LEU B 47 -0.177 2.342 7.477 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -1.168 -0.116 7.312 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -1.284 1.017 5.980 1.00 0.00 H new ATOM 0 HG LEU B 47 1.105 -0.242 5.435 1.00 0.00 H new ATOM 0 HD11 LEU B 47 0.647 -2.655 5.674 1.00 0.00 H new ATOM 0 HD12 LEU B 47 0.743 -1.848 7.257 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -0.842 -2.280 6.573 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -0.166 -1.420 3.691 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -1.685 -1.016 4.526 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -0.675 0.279 3.840 1.00 0.00 H new ATOM 2047 N ILE B 48 1.639 -0.190 8.550 1.00 0.00 N ATOM 2048 CA ILE B 48 2.083 -0.920 9.709 1.00 0.00 C ATOM 2049 C ILE B 48 2.722 -0.007 10.740 1.00 0.00 C ATOM 2050 O ILE B 48 2.491 -0.157 11.940 1.00 0.00 O ATOM 2051 CB ILE B 48 3.060 -2.029 9.285 1.00 0.00 C ATOM 2052 CG1 ILE B 48 2.433 -3.382 9.551 1.00 0.00 C ATOM 2053 CG2 ILE B 48 4.399 -1.901 9.994 1.00 0.00 C ATOM 2054 CD1 ILE B 48 1.115 -3.596 8.833 1.00 0.00 C ATOM 0 H ILE B 48 2.093 -0.467 7.680 1.00 0.00 H new ATOM 0 HA ILE B 48 1.209 -1.372 10.178 1.00 0.00 H new ATOM 0 HB ILE B 48 3.256 -1.927 8.218 1.00 0.00 H new ATOM 0 HG12 ILE B 48 3.132 -4.162 9.249 1.00 0.00 H new ATOM 0 HG13 ILE B 48 2.274 -3.494 10.624 1.00 0.00 H new ATOM 0 HG21 ILE B 48 5.062 -2.703 9.668 1.00 0.00 H new ATOM 0 HG22 ILE B 48 4.848 -0.938 9.752 1.00 0.00 H new ATOM 0 HG23 ILE B 48 4.248 -1.971 11.071 1.00 0.00 H new ATOM 0 HD11 ILE B 48 0.727 -4.586 9.072 1.00 0.00 H new ATOM 0 HD12 ILE B 48 0.399 -2.839 9.153 1.00 0.00 H new ATOM 0 HD13 ILE B 48 1.270 -3.517 7.757 1.00 0.00 H new ATOM 2066 N GLN B 49 3.531 0.931 10.277 1.00 0.00 N ATOM 2067 CA GLN B 49 4.194 1.844 11.184 1.00 0.00 C ATOM 2068 C GLN B 49 3.265 2.986 11.592 1.00 0.00 C ATOM 2069 O GLN B 49 3.543 3.701 12.552 1.00 0.00 O ATOM 2070 CB GLN B 49 5.480 2.397 10.555 1.00 0.00 C ATOM 2071 CG GLN B 49 5.253 3.488 9.515 1.00 0.00 C ATOM 2072 CD GLN B 49 6.364 4.519 9.502 1.00 0.00 C ATOM 2073 OE1 GLN B 49 6.114 5.717 9.366 1.00 0.00 O ATOM 2074 NE2 GLN B 49 7.602 4.059 9.641 1.00 0.00 N ATOM 0 H GLN B 49 3.741 1.077 9.290 1.00 0.00 H new ATOM 0 HA GLN B 49 4.460 1.287 12.082 1.00 0.00 H new ATOM 0 HB2 GLN B 49 6.116 2.793 11.347 1.00 0.00 H new ATOM 0 HB3 GLN B 49 6.025 1.576 10.089 1.00 0.00 H new ATOM 0 HG2 GLN B 49 5.173 3.033 8.528 1.00 0.00 H new ATOM 0 HG3 GLN B 49 4.304 3.984 9.715 1.00 0.00 H new ATOM 0 HE21 GLN B 49 7.765 3.058 9.751 1.00 0.00 H new ATOM 0 HE22 GLN B 49 8.390 4.707 9.638 1.00 0.00 H new ATOM 2083 N ASN B 50 2.174 3.165 10.848 1.00 0.00 N ATOM 2084 CA ASN B 50 1.224 4.238 11.135 1.00 0.00 C ATOM 2085 C ASN B 50 0.029 3.746 11.949 1.00 0.00 C ATOM 2086 O ASN B 50 -0.523 4.487 12.762 1.00 0.00 O ATOM 2087 CB ASN B 50 0.737 4.873 9.831 1.00 0.00 C ATOM 2088 CG ASN B 50 0.031 6.194 10.061 1.00 0.00 C ATOM 2089 OD1 ASN B 50 -0.631 6.388 11.080 1.00 0.00 O ATOM 2090 ND2 ASN B 50 0.166 7.111 9.109 1.00 0.00 N ATOM 0 H ASN B 50 1.927 2.584 10.047 1.00 0.00 H new ATOM 0 HA ASN B 50 1.748 4.983 11.734 1.00 0.00 H new ATOM 0 HB2 ASN B 50 1.587 5.029 9.166 1.00 0.00 H new ATOM 0 HB3 ASN B 50 0.059 4.185 9.326 1.00 0.00 H new ATOM 0 HD21 ASN B 50 -0.289 8.019 9.207 1.00 0.00 H new ATOM 0 HD22 ASN B 50 0.725 6.907 8.280 1.00 0.00 H new ATOM 2097 N LYS B 51 -0.377 2.502 11.717 1.00 0.00 N ATOM 2098 CA LYS B 51 -1.520 1.926 12.422 1.00 0.00 C ATOM 2099 C LYS B 51 -1.369 2.059 13.937 1.00 0.00 C ATOM 2100 O LYS B 51 -2.285 2.515 14.621 1.00 0.00 O ATOM 2101 CB LYS B 51 -1.698 0.455 12.036 1.00 0.00 C ATOM 2102 CG LYS B 51 -2.988 0.179 11.278 1.00 0.00 C ATOM 2103 CD LYS B 51 -2.917 0.691 9.845 1.00 0.00 C ATOM 2104 CE LYS B 51 -4.107 1.576 9.505 1.00 0.00 C ATOM 2105 NZ LYS B 51 -4.029 2.897 10.187 1.00 0.00 N ATOM 0 H LYS B 51 0.067 1.873 11.048 1.00 0.00 H new ATOM 0 HA LYS B 51 -2.408 2.483 12.124 1.00 0.00 H new ATOM 0 HB2 LYS B 51 -0.852 0.143 11.423 1.00 0.00 H new ATOM 0 HB3 LYS B 51 -1.679 -0.154 12.939 1.00 0.00 H new ATOM 0 HG2 LYS B 51 -3.185 -0.893 11.273 1.00 0.00 H new ATOM 0 HG3 LYS B 51 -3.823 0.654 11.794 1.00 0.00 H new ATOM 0 HD2 LYS B 51 -1.994 1.253 9.704 1.00 0.00 H new ATOM 0 HD3 LYS B 51 -2.884 -0.154 9.158 1.00 0.00 H new ATOM 0 HE2 LYS B 51 -4.151 1.726 8.426 1.00 0.00 H new ATOM 0 HE3 LYS B 51 -5.029 1.072 9.795 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 -4.652 3.575 9.703 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 -4.331 2.795 11.177 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 -3.049 3.245 10.158 1.00 0.00 H new ATOM 2119 N GLU B 52 -0.212 1.661 14.454 1.00 0.00 N ATOM 2120 CA GLU B 52 0.050 1.743 15.887 1.00 0.00 C ATOM 2121 C GLU B 52 0.583 3.122 16.268 1.00 0.00 C ATOM 2122 O GLU B 52 0.861 3.389 17.438 1.00 0.00 O ATOM 2123 CB GLU B 52 1.055 0.668 16.298 1.00 0.00 C ATOM 2124 CG GLU B 52 1.039 0.355 17.786 1.00 0.00 C ATOM 2125 CD GLU B 52 1.884 -0.853 18.137 1.00 0.00 C ATOM 2126 OE1 GLU B 52 2.663 -0.771 19.110 1.00 0.00 O ATOM 2127 OE2 GLU B 52 1.766 -1.883 17.440 1.00 0.00 O ATOM 0 H GLU B 52 0.558 1.279 13.904 1.00 0.00 H new ATOM 0 HA GLU B 52 -0.890 1.580 16.414 1.00 0.00 H new ATOM 0 HB2 GLU B 52 0.845 -0.245 15.741 1.00 0.00 H new ATOM 0 HB3 GLU B 52 2.056 0.992 16.014 1.00 0.00 H new ATOM 0 HG2 GLU B 52 1.402 1.221 18.339 1.00 0.00 H new ATOM 0 HG3 GLU B 52 0.012 0.180 18.106 1.00 0.00 H new ATOM 2134 N LYS B 53 0.734 3.990 15.273 1.00 0.00 N ATOM 2135 CA LYS B 53 1.246 5.333 15.496 1.00 0.00 C ATOM 2136 C LYS B 53 0.295 6.387 14.944 1.00 0.00 C ATOM 2137 O LYS B 53 0.725 7.461 14.524 1.00 0.00 O ATOM 2138 CB LYS B 53 2.628 5.488 14.866 1.00 0.00 C ATOM 2139 CG LYS B 53 3.749 5.531 15.886 1.00 0.00 C ATOM 2140 CD LYS B 53 4.003 6.948 16.381 1.00 0.00 C ATOM 2141 CE LYS B 53 2.765 7.556 17.030 1.00 0.00 C ATOM 2142 NZ LYS B 53 2.370 6.829 18.269 1.00 0.00 N ATOM 0 H LYS B 53 0.507 3.784 14.300 1.00 0.00 H new ATOM 0 HA LYS B 53 1.329 5.484 16.572 1.00 0.00 H new ATOM 0 HB2 LYS B 53 2.802 4.659 14.179 1.00 0.00 H new ATOM 0 HB3 LYS B 53 2.649 6.403 14.274 1.00 0.00 H new ATOM 0 HG2 LYS B 53 3.498 4.890 16.731 1.00 0.00 H new ATOM 0 HG3 LYS B 53 4.661 5.131 15.442 1.00 0.00 H new ATOM 0 HD2 LYS B 53 4.822 6.940 17.100 1.00 0.00 H new ATOM 0 HD3 LYS B 53 4.318 7.573 15.546 1.00 0.00 H new ATOM 0 HE2 LYS B 53 2.958 8.602 17.269 1.00 0.00 H new ATOM 0 HE3 LYS B 53 1.938 7.539 16.320 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 1.357 6.599 18.229 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 2.921 5.951 18.347 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 2.556 7.429 19.098 1.00 0.00 H new ATOM 2156 N LEU B 54 -0.997 6.080 14.937 1.00 0.00 N ATOM 2157 CA LEU B 54 -1.987 7.019 14.424 1.00 0.00 C ATOM 2158 C LEU B 54 -2.864 7.619 15.537 1.00 0.00 C ATOM 2159 O LEU B 54 -4.092 7.604 15.434 1.00 0.00 O ATOM 2160 CB LEU B 54 -2.870 6.320 13.385 1.00 0.00 C ATOM 2161 CG LEU B 54 -3.981 7.187 12.786 1.00 0.00 C ATOM 2162 CD1 LEU B 54 -3.787 7.349 11.286 1.00 0.00 C ATOM 2163 CD2 LEU B 54 -5.348 6.589 13.084 1.00 0.00 C ATOM 0 H LEU B 54 -1.381 5.198 15.277 1.00 0.00 H new ATOM 0 HA LEU B 54 -1.444 7.844 13.963 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -2.235 5.960 12.575 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -3.324 5.444 13.848 1.00 0.00 H new ATOM 0 HG LEU B 54 -3.929 8.173 13.247 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -4.587 7.968 10.880 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -2.826 7.825 11.093 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -3.809 6.369 10.808 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -6.124 7.220 12.650 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -5.410 5.590 12.653 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -5.491 6.528 14.163 1.00 0.00 H new ATOM 2175 N PRO B 55 -2.261 8.175 16.610 1.00 0.00 N ATOM 2176 CA PRO B 55 -3.027 8.788 17.700 1.00 0.00 C ATOM 2177 C PRO B 55 -3.968 9.870 17.190 1.00 0.00 C ATOM 2178 O PRO B 55 -3.814 10.361 16.071 1.00 0.00 O ATOM 2179 CB PRO B 55 -1.960 9.418 18.598 1.00 0.00 C ATOM 2180 CG PRO B 55 -0.701 8.698 18.278 1.00 0.00 C ATOM 2181 CD PRO B 55 -0.808 8.266 16.843 1.00 0.00 C ATOM 0 HA PRO B 55 -3.652 8.056 18.211 1.00 0.00 H new ATOM 0 HB2 PRO B 55 -1.863 10.486 18.403 1.00 0.00 H new ATOM 0 HB3 PRO B 55 -2.218 9.309 19.651 1.00 0.00 H new ATOM 0 HG2 PRO B 55 0.164 9.345 18.425 1.00 0.00 H new ATOM 0 HG3 PRO B 55 -0.569 7.837 18.933 1.00 0.00 H new ATOM 0 HD2 PRO B 55 -0.340 8.987 16.172 1.00 0.00 H new ATOM 0 HD3 PRO B 55 -0.315 7.308 16.676 1.00 0.00 H new ATOM 2189 N ASN B 56 -4.934 10.253 18.018 1.00 0.00 N ATOM 2190 CA ASN B 56 -5.887 11.293 17.644 1.00 0.00 C ATOM 2191 C ASN B 56 -5.155 12.545 17.158 1.00 0.00 C ATOM 2192 O ASN B 56 -5.699 13.331 16.382 1.00 0.00 O ATOM 2193 CB ASN B 56 -6.785 11.640 18.833 1.00 0.00 C ATOM 2194 CG ASN B 56 -7.839 12.672 18.479 1.00 0.00 C ATOM 2195 OD1 ASN B 56 -8.894 12.339 17.941 1.00 0.00 O ATOM 2196 ND2 ASN B 56 -7.556 13.934 18.782 1.00 0.00 N ATOM 0 H ASN B 56 -5.078 9.861 18.949 1.00 0.00 H new ATOM 0 HA ASN B 56 -6.506 10.915 16.830 1.00 0.00 H new ATOM 0 HB2 ASN B 56 -7.273 10.734 19.193 1.00 0.00 H new ATOM 0 HB3 ASN B 56 -6.171 12.017 19.651 1.00 0.00 H new ATOM 0 HD21 ASN B 56 -8.227 14.672 18.569 1.00 0.00 H new ATOM 0 HD22 ASN B 56 -6.668 14.165 19.228 1.00 0.00 H new ATOM 2203 N GLU B 57 -3.918 12.720 17.620 1.00 0.00 N ATOM 2204 CA GLU B 57 -3.111 13.872 17.232 1.00 0.00 C ATOM 2205 C GLU B 57 -2.574 13.710 15.813 1.00 0.00 C ATOM 2206 O GLU B 57 -2.396 14.693 15.092 1.00 0.00 O ATOM 2207 CB GLU B 57 -1.951 14.066 18.214 1.00 0.00 C ATOM 2208 CG GLU B 57 -0.907 12.963 18.155 1.00 0.00 C ATOM 2209 CD GLU B 57 -0.561 12.412 19.525 1.00 0.00 C ATOM 2210 OE1 GLU B 57 -0.688 13.162 20.516 1.00 0.00 O ATOM 2211 OE2 GLU B 57 -0.163 11.231 19.607 1.00 0.00 O ATOM 0 H GLU B 57 -3.454 12.078 18.263 1.00 0.00 H new ATOM 0 HA GLU B 57 -3.749 14.755 17.259 1.00 0.00 H new ATOM 0 HB2 GLU B 57 -1.469 15.022 18.008 1.00 0.00 H new ATOM 0 HB3 GLU B 57 -2.350 14.122 19.227 1.00 0.00 H new ATOM 0 HG2 GLU B 57 -1.275 12.154 17.524 1.00 0.00 H new ATOM 0 HG3 GLU B 57 -0.003 13.349 17.684 1.00 0.00 H new ATOM 2218 N LEU B 58 -2.323 12.466 15.412 1.00 0.00 N ATOM 2219 CA LEU B 58 -1.815 12.185 14.072 1.00 0.00 C ATOM 2220 C LEU B 58 -2.947 12.206 13.052 1.00 0.00 C ATOM 2221 O LEU B 58 -2.727 12.500 11.877 1.00 0.00 O ATOM 2222 CB LEU B 58 -1.114 10.825 14.033 1.00 0.00 C ATOM 2223 CG LEU B 58 0.402 10.885 13.822 1.00 0.00 C ATOM 2224 CD1 LEU B 58 1.135 10.653 15.135 1.00 0.00 C ATOM 2225 CD2 LEU B 58 0.839 9.866 12.780 1.00 0.00 C ATOM 0 H LEU B 58 -2.462 11.640 15.993 1.00 0.00 H new ATOM 0 HA LEU B 58 -1.094 12.962 13.818 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -1.315 10.302 14.968 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -1.554 10.229 13.233 1.00 0.00 H new ATOM 0 HG LEU B 58 0.657 11.880 13.457 1.00 0.00 H new ATOM 0 HD11 LEU B 58 2.211 10.699 14.964 1.00 0.00 H new ATOM 0 HD12 LEU B 58 0.848 11.422 15.853 1.00 0.00 H new ATOM 0 HD13 LEU B 58 0.872 9.672 15.530 1.00 0.00 H new ATOM 0 HD21 LEU B 58 1.919 9.924 12.644 1.00 0.00 H new ATOM 0 HD22 LEU B 58 0.569 8.864 13.115 1.00 0.00 H new ATOM 0 HD23 LEU B 58 0.343 10.078 11.833 1.00 0.00 H new ATOM 2237 N LYS B 59 -4.159 11.892 13.513 1.00 0.00 N ATOM 2238 CA LYS B 59 -5.337 11.871 12.649 1.00 0.00 C ATOM 2239 C LYS B 59 -5.332 13.042 11.665 1.00 0.00 C ATOM 2240 O LYS B 59 -5.476 12.842 10.460 1.00 0.00 O ATOM 2241 CB LYS B 59 -6.614 11.900 13.490 1.00 0.00 C ATOM 2242 CG LYS B 59 -7.868 11.556 12.703 1.00 0.00 C ATOM 2243 CD LYS B 59 -9.122 11.740 13.544 1.00 0.00 C ATOM 2244 CE LYS B 59 -10.240 12.384 12.742 1.00 0.00 C ATOM 2245 NZ LYS B 59 -11.111 11.368 12.087 1.00 0.00 N ATOM 0 H LYS B 59 -4.349 11.648 14.485 1.00 0.00 H new ATOM 0 HA LYS B 59 -5.308 10.946 12.073 1.00 0.00 H new ATOM 0 HB2 LYS B 59 -6.510 11.198 14.317 1.00 0.00 H new ATOM 0 HB3 LYS B 59 -6.729 12.892 13.926 1.00 0.00 H new ATOM 0 HG2 LYS B 59 -7.927 12.188 11.817 1.00 0.00 H new ATOM 0 HG3 LYS B 59 -7.809 10.524 12.356 1.00 0.00 H new ATOM 0 HD2 LYS B 59 -9.454 10.773 13.921 1.00 0.00 H new ATOM 0 HD3 LYS B 59 -8.892 12.358 14.412 1.00 0.00 H new ATOM 0 HE2 LYS B 59 -10.844 13.010 13.399 1.00 0.00 H new ATOM 0 HE3 LYS B 59 -9.812 13.038 11.983 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 -11.861 11.848 11.550 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 -10.540 10.786 11.441 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 -11.540 10.759 12.813 1.00 0.00 H new ATOM 2259 N PRO B 60 -5.164 14.283 12.156 1.00 0.00 N ATOM 2260 CA PRO B 60 -5.142 15.464 11.291 1.00 0.00 C ATOM 2261 C PRO B 60 -3.943 15.472 10.351 1.00 0.00 C ATOM 2262 O PRO B 60 -4.001 16.048 9.265 1.00 0.00 O ATOM 2263 CB PRO B 60 -5.065 16.637 12.272 1.00 0.00 C ATOM 2264 CG PRO B 60 -4.487 16.055 13.517 1.00 0.00 C ATOM 2265 CD PRO B 60 -4.986 14.639 13.579 1.00 0.00 C ATOM 0 HA PRO B 60 -6.015 15.501 10.639 1.00 0.00 H new ATOM 0 HB2 PRO B 60 -4.438 17.438 11.882 1.00 0.00 H new ATOM 0 HB3 PRO B 60 -6.051 17.064 12.456 1.00 0.00 H new ATOM 0 HG2 PRO B 60 -3.398 16.085 13.493 1.00 0.00 H new ATOM 0 HG3 PRO B 60 -4.802 16.619 14.395 1.00 0.00 H new ATOM 0 HD2 PRO B 60 -4.271 13.981 14.073 1.00 0.00 H new ATOM 0 HD3 PRO B 60 -5.922 14.565 14.133 1.00 0.00 H new ATOM 2273 N LYS B 61 -2.858 14.823 10.764 1.00 0.00 N ATOM 2274 CA LYS B 61 -1.661 14.762 9.935 1.00 0.00 C ATOM 2275 C LYS B 61 -1.878 13.835 8.747 1.00 0.00 C ATOM 2276 O LYS B 61 -1.232 13.980 7.711 1.00 0.00 O ATOM 2277 CB LYS B 61 -0.447 14.303 10.743 1.00 0.00 C ATOM 2278 CG LYS B 61 0.878 14.699 10.110 1.00 0.00 C ATOM 2279 CD LYS B 61 1.459 13.568 9.280 1.00 0.00 C ATOM 2280 CE LYS B 61 2.324 12.641 10.122 1.00 0.00 C ATOM 2281 NZ LYS B 61 3.668 12.433 9.515 1.00 0.00 N ATOM 0 H LYS B 61 -2.784 14.337 11.658 1.00 0.00 H new ATOM 0 HA LYS B 61 -1.464 15.769 9.567 1.00 0.00 H new ATOM 0 HB2 LYS B 61 -0.504 14.727 11.746 1.00 0.00 H new ATOM 0 HB3 LYS B 61 -0.480 13.219 10.853 1.00 0.00 H new ATOM 0 HG2 LYS B 61 0.733 15.577 9.480 1.00 0.00 H new ATOM 0 HG3 LYS B 61 1.586 14.980 10.890 1.00 0.00 H new ATOM 0 HD2 LYS B 61 0.650 12.997 8.825 1.00 0.00 H new ATOM 0 HD3 LYS B 61 2.054 13.982 8.466 1.00 0.00 H new ATOM 0 HE2 LYS B 61 2.438 13.059 11.122 1.00 0.00 H new ATOM 0 HE3 LYS B 61 1.823 11.679 10.234 1.00 0.00 H new ATOM 0 HZ1 LYS B 61 3.742 11.458 9.161 1.00 0.00 H new ATOM 0 HZ2 LYS B 61 3.799 13.098 8.726 1.00 0.00 H new ATOM 0 HZ3 LYS B 61 4.402 12.598 10.233 1.00 0.00 H new ATOM 2295 N ILE B 62 -2.809 12.893 8.884 1.00 0.00 N ATOM 2296 CA ILE B 62 -3.109 11.974 7.795 1.00 0.00 C ATOM 2297 C ILE B 62 -3.442 12.774 6.540 1.00 0.00 C ATOM 2298 O ILE B 62 -3.164 12.344 5.418 1.00 0.00 O ATOM 2299 CB ILE B 62 -4.272 11.020 8.160 1.00 0.00 C ATOM 2300 CG1 ILE B 62 -3.736 9.820 8.941 1.00 0.00 C ATOM 2301 CG2 ILE B 62 -5.021 10.552 6.917 1.00 0.00 C ATOM 2302 CD1 ILE B 62 -2.865 10.208 10.115 1.00 0.00 C ATOM 0 H ILE B 62 -3.362 12.749 9.729 1.00 0.00 H new ATOM 0 HA ILE B 62 -2.232 11.354 7.610 1.00 0.00 H new ATOM 0 HB ILE B 62 -4.977 11.569 8.784 1.00 0.00 H new ATOM 0 HG12 ILE B 62 -4.576 9.226 9.302 1.00 0.00 H new ATOM 0 HG13 ILE B 62 -3.162 9.184 8.267 1.00 0.00 H new ATOM 0 HG21 ILE B 62 -5.831 9.884 7.210 1.00 0.00 H new ATOM 0 HG22 ILE B 62 -5.434 11.415 6.394 1.00 0.00 H new ATOM 0 HG23 ILE B 62 -4.335 10.022 6.257 1.00 0.00 H new ATOM 0 HD11 ILE B 62 -2.519 9.309 10.624 1.00 0.00 H new ATOM 0 HD12 ILE B 62 -2.006 10.776 9.759 1.00 0.00 H new ATOM 0 HD13 ILE B 62 -3.442 10.819 10.809 1.00 0.00 H new ATOM 2314 N ASP B 63 -3.998 13.966 6.746 1.00 0.00 N ATOM 2315 CA ASP B 63 -4.322 14.852 5.648 1.00 0.00 C ATOM 2316 C ASP B 63 -3.023 15.384 5.066 1.00 0.00 C ATOM 2317 O ASP B 63 -2.874 15.512 3.853 1.00 0.00 O ATOM 2318 CB ASP B 63 -5.209 16.004 6.131 1.00 0.00 C ATOM 2319 CG ASP B 63 -6.528 16.067 5.387 1.00 0.00 C ATOM 2320 OD1 ASP B 63 -6.505 16.231 4.149 1.00 0.00 O ATOM 2321 OD2 ASP B 63 -7.585 15.953 6.042 1.00 0.00 O ATOM 0 H ASP B 63 -4.231 14.334 7.668 1.00 0.00 H new ATOM 0 HA ASP B 63 -4.876 14.309 4.882 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -5.401 15.888 7.198 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -4.677 16.947 6.003 1.00 0.00 H new ATOM 2326 N GLU B 64 -2.070 15.657 5.958 1.00 0.00 N ATOM 2327 CA GLU B 64 -0.757 16.139 5.559 1.00 0.00 C ATOM 2328 C GLU B 64 -0.069 15.087 4.701 1.00 0.00 C ATOM 2329 O GLU B 64 0.572 15.401 3.703 1.00 0.00 O ATOM 2330 CB GLU B 64 0.093 16.457 6.793 1.00 0.00 C ATOM 2331 CG GLU B 64 -0.028 17.899 7.259 1.00 0.00 C ATOM 2332 CD GLU B 64 -0.857 18.036 8.522 1.00 0.00 C ATOM 2333 OE1 GLU B 64 -0.335 17.719 9.611 1.00 0.00 O ATOM 2334 OE2 GLU B 64 -2.027 18.460 8.421 1.00 0.00 O ATOM 0 H GLU B 64 -2.189 15.550 6.965 1.00 0.00 H new ATOM 0 HA GLU B 64 -0.874 17.055 4.979 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -0.201 15.795 7.607 1.00 0.00 H new ATOM 0 HB3 GLU B 64 1.138 16.242 6.569 1.00 0.00 H new ATOM 0 HG2 GLU B 64 0.968 18.304 7.437 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -0.478 18.497 6.466 1.00 0.00 H new ATOM 2341 N ILE B 65 -0.232 13.830 5.096 1.00 0.00 N ATOM 2342 CA ILE B 65 0.347 12.704 4.373 1.00 0.00 C ATOM 2343 C ILE B 65 -0.117 12.689 2.920 1.00 0.00 C ATOM 2344 O ILE B 65 0.693 12.542 2.007 1.00 0.00 O ATOM 2345 CB ILE B 65 -0.050 11.369 5.042 1.00 0.00 C ATOM 2346 CG1 ILE B 65 0.345 11.381 6.521 1.00 0.00 C ATOM 2347 CG2 ILE B 65 0.594 10.191 4.325 1.00 0.00 C ATOM 2348 CD1 ILE B 65 1.758 11.864 6.756 1.00 0.00 C ATOM 0 H ILE B 65 -0.767 13.563 5.923 1.00 0.00 H new ATOM 0 HA ILE B 65 1.431 12.819 4.400 1.00 0.00 H new ATOM 0 HB ILE B 65 -1.132 11.256 4.970 1.00 0.00 H new ATOM 0 HG12 ILE B 65 -0.347 12.020 7.070 1.00 0.00 H new ATOM 0 HG13 ILE B 65 0.240 10.375 6.927 1.00 0.00 H new ATOM 0 HG21 ILE B 65 0.300 9.262 4.814 1.00 0.00 H new ATOM 0 HG22 ILE B 65 0.265 10.174 3.286 1.00 0.00 H new ATOM 0 HG23 ILE B 65 1.679 10.292 4.361 1.00 0.00 H new ATOM 0 HD11 ILE B 65 1.975 11.848 7.824 1.00 0.00 H new ATOM 0 HD12 ILE B 65 2.457 11.211 6.234 1.00 0.00 H new ATOM 0 HD13 ILE B 65 1.862 12.882 6.380 1.00 0.00 H new ATOM 2360 N SER B 66 -1.424 12.829 2.716 1.00 0.00 N ATOM 2361 CA SER B 66 -1.997 12.814 1.371 1.00 0.00 C ATOM 2362 C SER B 66 -1.908 14.178 0.686 1.00 0.00 C ATOM 2363 O SER B 66 -1.752 14.252 -0.531 1.00 0.00 O ATOM 2364 CB SER B 66 -3.456 12.358 1.426 1.00 0.00 C ATOM 2365 OG SER B 66 -3.717 11.369 0.445 1.00 0.00 O ATOM 0 H SER B 66 -2.107 12.954 3.463 1.00 0.00 H new ATOM 0 HA SER B 66 -1.411 12.111 0.780 1.00 0.00 H new ATOM 0 HB2 SER B 66 -3.679 11.961 2.416 1.00 0.00 H new ATOM 0 HB3 SER B 66 -4.114 13.213 1.270 1.00 0.00 H new ATOM 0 HG SER B 66 -4.157 11.782 -0.327 1.00 0.00 H new ATOM 2371 N LYS B 67 -2.024 15.252 1.459 1.00 0.00 N ATOM 2372 CA LYS B 67 -1.968 16.596 0.891 1.00 0.00 C ATOM 2373 C LYS B 67 -0.526 17.044 0.646 1.00 0.00 C ATOM 2374 O LYS B 67 -0.275 17.906 -0.194 1.00 0.00 O ATOM 2375 CB LYS B 67 -2.698 17.598 1.794 1.00 0.00 C ATOM 2376 CG LYS B 67 -1.946 17.949 3.066 1.00 0.00 C ATOM 2377 CD LYS B 67 -1.684 19.445 3.167 1.00 0.00 C ATOM 2378 CE LYS B 67 -2.809 20.159 3.898 1.00 0.00 C ATOM 2379 NZ LYS B 67 -3.936 20.500 2.986 1.00 0.00 N ATOM 0 H LYS B 67 -2.156 15.221 2.470 1.00 0.00 H new ATOM 0 HA LYS B 67 -2.474 16.566 -0.074 1.00 0.00 H new ATOM 0 HB2 LYS B 67 -2.882 18.512 1.230 1.00 0.00 H new ATOM 0 HB3 LYS B 67 -3.671 17.187 2.062 1.00 0.00 H new ATOM 0 HG2 LYS B 67 -2.521 17.620 3.932 1.00 0.00 H new ATOM 0 HG3 LYS B 67 -0.999 17.411 3.090 1.00 0.00 H new ATOM 0 HD2 LYS B 67 -0.743 19.616 3.689 1.00 0.00 H new ATOM 0 HD3 LYS B 67 -1.574 19.865 2.167 1.00 0.00 H new ATOM 0 HE2 LYS B 67 -3.175 19.527 4.707 1.00 0.00 H new ATOM 0 HE3 LYS B 67 -2.424 21.070 4.355 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 -4.682 20.986 3.523 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 -3.593 21.124 2.228 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 -4.321 19.629 2.569 1.00 0.00 H new ATOM 2393 N ARG B 68 0.419 16.451 1.371 1.00 0.00 N ATOM 2394 CA ARG B 68 1.829 16.796 1.205 1.00 0.00 C ATOM 2395 C ARG B 68 2.513 15.827 0.250 1.00 0.00 C ATOM 2396 O ARG B 68 3.502 16.176 -0.394 1.00 0.00 O ATOM 2397 CB ARG B 68 2.560 16.801 2.549 1.00 0.00 C ATOM 2398 CG ARG B 68 1.981 17.784 3.552 1.00 0.00 C ATOM 2399 CD ARG B 68 2.500 17.516 4.958 1.00 0.00 C ATOM 2400 NE ARG B 68 3.856 18.025 5.148 1.00 0.00 N ATOM 2401 CZ ARG B 68 4.436 18.162 6.338 1.00 0.00 C ATOM 2402 NH1 ARG B 68 3.783 17.830 7.444 1.00 0.00 N ATOM 2403 NH2 ARG B 68 5.674 18.632 6.421 1.00 0.00 N ATOM 0 H ARG B 68 0.237 15.735 2.074 1.00 0.00 H new ATOM 0 HA ARG B 68 1.873 17.800 0.783 1.00 0.00 H new ATOM 0 HB2 ARG B 68 2.527 15.798 2.975 1.00 0.00 H new ATOM 0 HB3 ARG B 68 3.610 17.042 2.381 1.00 0.00 H new ATOM 0 HG2 ARG B 68 2.237 18.801 3.256 1.00 0.00 H new ATOM 0 HG3 ARG B 68 0.893 17.715 3.545 1.00 0.00 H new ATOM 0 HD2 ARG B 68 1.834 17.980 5.685 1.00 0.00 H new ATOM 0 HD3 ARG B 68 2.485 16.443 5.151 1.00 0.00 H new ATOM 0 HE ARG B 68 4.389 18.291 4.320 1.00 0.00 H new ATOM 0 HH11 ARG B 68 2.831 17.468 7.385 1.00 0.00 H new ATOM 0 HH12 ARG B 68 4.233 17.937 8.353 1.00 0.00 H new ATOM 0 HH21 ARG B 68 6.180 18.888 5.573 1.00 0.00 H new ATOM 0 HH22 ARG B 68 6.119 18.737 7.333 1.00 0.00 H new ATOM 2417 N PHE B 69 1.983 14.609 0.154 1.00 0.00 N ATOM 2418 CA PHE B 69 2.552 13.600 -0.734 1.00 0.00 C ATOM 2419 C PHE B 69 2.715 14.165 -2.149 1.00 0.00 C ATOM 2420 O PHE B 69 3.580 13.732 -2.908 1.00 0.00 O ATOM 2421 CB PHE B 69 1.683 12.328 -0.721 1.00 0.00 C ATOM 2422 CG PHE B 69 0.975 12.022 -2.016 1.00 0.00 C ATOM 2423 CD1 PHE B 69 1.244 10.852 -2.706 1.00 0.00 C ATOM 2424 CD2 PHE B 69 0.036 12.899 -2.533 1.00 0.00 C ATOM 2425 CE1 PHE B 69 0.592 10.562 -3.890 1.00 0.00 C ATOM 2426 CE2 PHE B 69 -0.620 12.615 -3.717 1.00 0.00 C ATOM 2427 CZ PHE B 69 -0.341 11.445 -4.395 1.00 0.00 C ATOM 0 H PHE B 69 1.165 14.299 0.678 1.00 0.00 H new ATOM 0 HA PHE B 69 3.544 13.326 -0.375 1.00 0.00 H new ATOM 0 HB2 PHE B 69 2.314 11.478 -0.461 1.00 0.00 H new ATOM 0 HB3 PHE B 69 0.937 12.424 0.068 1.00 0.00 H new ATOM 0 HD1 PHE B 69 1.972 10.157 -2.314 1.00 0.00 H new ATOM 0 HD2 PHE B 69 -0.186 13.815 -2.006 1.00 0.00 H new ATOM 0 HE1 PHE B 69 0.812 9.646 -4.419 1.00 0.00 H new ATOM 0 HE2 PHE B 69 -1.349 13.307 -4.111 1.00 0.00 H new ATOM 0 HZ PHE B 69 -0.852 11.221 -5.320 1.00 0.00 H new ATOM 2437 N PHE B 70 1.889 15.155 -2.480 1.00 0.00 N ATOM 2438 CA PHE B 70 1.953 15.805 -3.783 1.00 0.00 C ATOM 2439 C PHE B 70 2.389 17.258 -3.616 1.00 0.00 C ATOM 2440 O PHE B 70 1.575 18.177 -3.718 1.00 0.00 O ATOM 2441 CB PHE B 70 0.595 15.741 -4.486 1.00 0.00 C ATOM 2442 CG PHE B 70 0.699 15.526 -5.970 1.00 0.00 C ATOM 2443 CD1 PHE B 70 0.526 14.263 -6.514 1.00 0.00 C ATOM 2444 CD2 PHE B 70 0.971 16.585 -6.820 1.00 0.00 C ATOM 2445 CE1 PHE B 70 0.621 14.062 -7.878 1.00 0.00 C ATOM 2446 CE2 PHE B 70 1.067 16.391 -8.184 1.00 0.00 C ATOM 2447 CZ PHE B 70 0.892 15.127 -8.715 1.00 0.00 C ATOM 0 H PHE B 70 1.167 15.524 -1.861 1.00 0.00 H new ATOM 0 HA PHE B 70 2.683 15.280 -4.399 1.00 0.00 H new ATOM 0 HB2 PHE B 70 0.007 14.934 -4.050 1.00 0.00 H new ATOM 0 HB3 PHE B 70 0.053 16.668 -4.298 1.00 0.00 H new ATOM 0 HD1 PHE B 70 0.315 13.426 -5.865 1.00 0.00 H new ATOM 0 HD2 PHE B 70 1.110 17.575 -6.411 1.00 0.00 H new ATOM 0 HE1 PHE B 70 0.483 13.073 -8.289 1.00 0.00 H new ATOM 0 HE2 PHE B 70 1.279 17.226 -8.835 1.00 0.00 H new ATOM 0 HZ PHE B 70 0.967 14.972 -9.781 1.00 0.00 H new ATOM 2457 N PRO B 71 3.685 17.484 -3.344 1.00 0.00 N ATOM 2458 CA PRO B 71 4.228 18.832 -3.149 1.00 0.00 C ATOM 2459 C PRO B 71 4.279 19.631 -4.446 1.00 0.00 C ATOM 2460 O PRO B 71 3.787 19.185 -5.482 1.00 0.00 O ATOM 2461 CB PRO B 71 5.641 18.569 -2.624 1.00 0.00 C ATOM 2462 CG PRO B 71 6.001 17.231 -3.164 1.00 0.00 C ATOM 2463 CD PRO B 71 4.722 16.443 -3.200 1.00 0.00 C ATOM 0 HA PRO B 71 3.612 19.428 -2.476 1.00 0.00 H new ATOM 0 HB2 PRO B 71 6.339 19.334 -2.964 1.00 0.00 H new ATOM 0 HB3 PRO B 71 5.666 18.576 -1.534 1.00 0.00 H new ATOM 0 HG2 PRO B 71 6.435 17.316 -4.160 1.00 0.00 H new ATOM 0 HG3 PRO B 71 6.743 16.742 -2.533 1.00 0.00 H new ATOM 0 HD2 PRO B 71 4.706 15.741 -4.034 1.00 0.00 H new ATOM 0 HD3 PRO B 71 4.583 15.860 -2.290 1.00 0.00 H new ATOM 2471 N ALA B 72 4.879 20.815 -4.382 1.00 0.00 N ATOM 2472 CA ALA B 72 4.996 21.677 -5.552 1.00 0.00 C ATOM 2473 C ALA B 72 6.400 22.262 -5.665 1.00 0.00 C ATOM 2474 O ALA B 72 6.647 23.395 -5.252 1.00 0.00 O ATOM 2475 CB ALA B 72 3.957 22.789 -5.493 1.00 0.00 C ATOM 0 H ALA B 72 5.292 21.199 -3.532 1.00 0.00 H new ATOM 0 HA ALA B 72 4.813 21.072 -6.440 1.00 0.00 H new ATOM 0 HB1 ALA B 72 4.055 23.426 -6.372 1.00 0.00 H new ATOM 0 HB2 ALA B 72 2.958 22.353 -5.470 1.00 0.00 H new ATOM 0 HB3 ALA B 72 4.113 23.385 -4.594 1.00 0.00 H new ATOM 2481 N LYS B 73 7.317 21.481 -6.227 1.00 0.00 N ATOM 2482 CA LYS B 73 8.697 21.921 -6.395 1.00 0.00 C ATOM 2483 C LYS B 73 9.267 21.428 -7.721 1.00 0.00 C ATOM 2484 O LYS B 73 10.503 21.488 -7.892 1.00 0.00 O ATOM 2485 CB LYS B 73 9.559 21.418 -5.236 1.00 0.00 C ATOM 2486 CG LYS B 73 9.617 22.378 -4.059 1.00 0.00 C ATOM 2487 CD LYS B 73 10.635 21.928 -3.023 1.00 0.00 C ATOM 2488 CE LYS B 73 10.662 22.866 -1.827 1.00 0.00 C ATOM 2489 NZ LYS B 73 11.989 22.869 -1.153 1.00 0.00 N ATOM 2490 OXT LYS B 73 8.474 20.983 -8.577 1.00 0.00 O ATOM 0 H LYS B 73 7.129 20.540 -6.574 1.00 0.00 H new ATOM 0 HA LYS B 73 8.707 23.011 -6.399 1.00 0.00 H new ATOM 0 HB2 LYS B 73 9.169 20.460 -4.893 1.00 0.00 H new ATOM 0 HB3 LYS B 73 10.571 21.239 -5.598 1.00 0.00 H new ATOM 0 HG2 LYS B 73 9.874 23.376 -4.414 1.00 0.00 H new ATOM 0 HG3 LYS B 73 8.632 22.448 -3.597 1.00 0.00 H new ATOM 0 HD2 LYS B 73 10.395 20.918 -2.690 1.00 0.00 H new ATOM 0 HD3 LYS B 73 11.625 21.887 -3.477 1.00 0.00 H new ATOM 0 HE2 LYS B 73 10.418 23.877 -2.153 1.00 0.00 H new ATOM 0 HE3 LYS B 73 9.894 22.567 -1.114 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 11.966 23.521 -0.343 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 12.211 21.909 -0.819 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 12.719 23.179 -1.826 1.00 0.00 H new TER 2504 LYS B 73