USER MOD reduce.3.24.130724 H: found=0, std=0, add=1738, rem=0, adj=64 USER MOD reduce.3.24.130724 removed 1734 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 25 SER OG : rot -88:sc= 0.412 USER MOD Set 1.2: B 47 CYS SG : rot -100:sc= -8.44! USER MOD Set 2.1: B 44 THR OG1 : rot -131:sc= 1.5 USER MOD Set 2.2: B 68 CYS SG : rot -178:sc= -6.95! USER MOD Set 3.1: B 35 TYR OH : rot -88:sc= -1.36 USER MOD Set 3.2: B 72 GLN : amide:sc= -5.98 K(o=-7.3,f=-9.7!) USER MOD Set 4.1: A 35 TYR OH : rot -90:sc= -1.39 USER MOD Set 4.2: A 72 GLN : amide:sc= -5.82 K(o=-7.2,f=-9.7!) USER MOD Set 5.1: A 25 SER OG : rot -87:sc= 0.415 USER MOD Set 5.2: A 47 CYS SG : rot -92:sc= -8.59! USER MOD Set 6.1: A 44 THR OG1 : rot -133:sc= 1.29! USER MOD Set 6.2: A 68 CYS SG : rot 175:sc= -6.48! USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 168:sc= -0.0193 (180deg=-0.281) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 ASN : amide:sc= -1.99 K(o=-2,f=-1.1!) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 ASN : amide:sc= -0.718! C(o=-0.72!,f=-1.5!) USER MOD Single : A 33 GLN : amide:sc= -0.511 X(o=-0.51,f=-1) USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=-0.00047) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 SER OG : rot 180:sc= -0.0453 USER MOD Single : A 42 GLN : amide:sc= -0.709 X(o=-0.71,f=-0.29) USER MOD Single : A 45 SER OG : rot -88:sc= 1.1 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 50 HIS : no HD1:sc= -1.02 K(o=-1,f=-0.16) USER MOD Single : A 51 CYS SG : rot 50:sc= -6.35! USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= -0.0701 (180deg=-0.0701) USER MOD Single : A 56 THR OG1 : rot -77:sc= 1.27 USER MOD Single : A 59 ASN : amide:sc= -4.51 K(o=-4.5,f=-3.9!) USER MOD Single : A 60 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0243) USER MOD Single : A 63 LYS NZ :NH3+ 173:sc= -0.125 (180deg=-0.247) USER MOD Single : A 64 TYR OH : rot -130:sc= -2.62 USER MOD Single : A 67 THR OG1 : rot 54:sc= -0.382! USER MOD Single : A 71 MET CE :methyl 165:sc= -5.85! (180deg=-7.45!) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 ASN : amide:sc= -0.524 K(o=-0.52,f=-6.4!) USER MOD Single : A 79 HIS : no HD1:sc= -0.103 X(o=-0.1,f=0) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 CYS SG : rot -82:sc= -11.8! USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 THR OG1 : rot 69:sc= 1.12 USER MOD Single : A 90 THR OG1 : rot 45:sc= -0.184 USER MOD Single : A 93 SER OG : rot 31:sc= 0.633 USER MOD Single : A 95 THR OG1 : rot 61:sc= -3.85! USER MOD Single : A 100 ASN : amide:sc= -3.33 K(o=-3.3,f=-5.2!) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 MET CE :methyl -126:sc= -8.55! (180deg=-10.3!) USER MOD Single : A 104 TYR OH : rot 180:sc= -0.0444 USER MOD Single : A 105 CYS SG : rot -3:sc= 0.536 USER MOD Single : A 107 CYS SG : rot 180:sc= -0.825 USER MOD Single : A 108 THR OG1 : rot 180:sc= -0.943 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 169:sc= -0.0103 (180deg=-0.287) USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD Single : B 20 ASN : amide:sc= -1.99 K(o=-2,f=-1.1!) USER MOD Single : B 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 31 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 32 ASN : amide:sc= -0.706! C(o=-0.71!,f=-1.6!) USER MOD Single : B 33 GLN : amide:sc= -0.545 X(o=-0.55,f=-0.9) USER MOD Single : B 34 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 36 SER OG : rot 180:sc= 0 USER MOD Single : B 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 41 SER OG : rot 180:sc= -0.0503 USER MOD Single : B 42 GLN : amide:sc= -0.759 X(o=-0.76,f=-0.29) USER MOD Single : B 45 SER OG : rot -71:sc= 1.09 USER MOD Single : B 46 SER OG : rot 180:sc= 0 USER MOD Single : B 50 HIS : no HD1:sc= -1.05 K(o=-1.1,f=-0.16) USER MOD Single : B 51 CYS SG : rot -26:sc= -6.49! USER MOD Single : B 53 LYS NZ :NH3+ 180:sc= -0.0656 (180deg=-0.0656) USER MOD Single : B 56 THR OG1 : rot -70:sc= 1.27 USER MOD Single : B 59 ASN : amide:sc= -4.25 X(o=-4.3,f=-3.8!) USER MOD Single : B 60 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0115) USER MOD Single : B 63 LYS NZ :NH3+ 173:sc= -0.115 (180deg=-0.231) USER MOD Single : B 64 TYR OH : rot -127:sc= -2.63 USER MOD Single : B 67 THR OG1 : rot 49:sc= -0.636! USER MOD Single : B 71 MET CE :methyl 164:sc= -5.58! (180deg=-7.22!) USER MOD Single : B 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 74 ASN : amide:sc= -0.506 K(o=-0.51,f=-6.3!) USER MOD Single : B 79 HIS : no HD1:sc= -0.121 X(o=-0.12,f=0) USER MOD Single : B 80 THR OG1 : rot 180:sc= 0 USER MOD Single : B 83 SER OG : rot 180:sc= 0 USER MOD Single : B 84 CYS SG : rot -83:sc= -11.7! USER MOD Single : B 88 SER OG : rot 180:sc= 0 USER MOD Single : B 89 THR OG1 : rot 54:sc= 1.13 USER MOD Single : B 90 THR OG1 : rot 51:sc= -0.0799 USER MOD Single : B 93 SER OG : rot 40:sc= 0.686 USER MOD Single : B 95 THR OG1 : rot 58:sc= -3.84! USER MOD Single : B 100 ASN : amide:sc= -3.38 K(o=-3.4,f=-5.4!) USER MOD Single : B 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 102 SER OG : rot 180:sc= 0 USER MOD Single : B 103 MET CE :methyl -134:sc= -8.51 (180deg=-10.2!) USER MOD Single : B 104 TYR OH : rot 180:sc= -0.0416 USER MOD Single : B 105 CYS SG : rot 4:sc= 0.533 USER MOD Single : B 107 CYS SG : rot 180:sc= -0.788 USER MOD Single : B 108 THR OG1 : rot 180:sc= -0.928 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 33.629 1.199 -9.372 1.00 0.00 N ATOM 2 CA MET A 1 32.552 2.204 -9.180 1.00 0.00 C ATOM 3 C MET A 1 32.080 2.769 -10.515 1.00 0.00 C ATOM 4 O MET A 1 31.760 3.953 -10.621 1.00 0.00 O ATOM 5 CB MET A 1 33.089 3.329 -8.292 1.00 0.00 C ATOM 6 CG MET A 1 34.330 4.005 -8.849 1.00 0.00 C ATOM 7 SD MET A 1 34.782 5.491 -7.934 1.00 0.00 S ATOM 8 CE MET A 1 36.545 5.556 -8.241 1.00 0.00 C ATOM 0 H1 MET A 1 34.069 0.982 -8.455 1.00 0.00 H new ATOM 0 H2 MET A 1 33.225 0.330 -9.776 1.00 0.00 H new ATOM 0 H3 MET A 1 34.348 1.580 -10.020 1.00 0.00 H new ATOM 0 HA MET A 1 31.696 1.725 -8.705 1.00 0.00 H new ATOM 0 HB2 MET A 1 32.308 4.077 -8.156 1.00 0.00 H new ATOM 0 HB3 MET A 1 33.318 2.924 -7.306 1.00 0.00 H new ATOM 0 HG2 MET A 1 35.163 3.302 -8.827 1.00 0.00 H new ATOM 0 HG3 MET A 1 34.160 4.264 -9.894 1.00 0.00 H new ATOM 0 HE1 MET A 1 36.970 6.425 -7.738 1.00 0.00 H new ATOM 0 HE2 MET A 1 37.015 4.650 -7.859 1.00 0.00 H new ATOM 0 HE3 MET A 1 36.725 5.633 -9.313 1.00 0.00 H new ATOM 18 N GLU A 2 32.039 1.915 -11.533 1.00 0.00 N ATOM 19 CA GLU A 2 31.606 2.330 -12.862 1.00 0.00 C ATOM 20 C GLU A 2 30.183 1.857 -13.141 1.00 0.00 C ATOM 21 O GLU A 2 29.923 0.657 -13.229 1.00 0.00 O ATOM 22 CB GLU A 2 32.556 1.779 -13.926 1.00 0.00 C ATOM 23 CG GLU A 2 32.197 2.202 -15.341 1.00 0.00 C ATOM 24 CD GLU A 2 32.772 1.273 -16.392 1.00 0.00 C ATOM 25 OE1 GLU A 2 33.996 1.025 -16.358 1.00 0.00 O ATOM 26 OE2 GLU A 2 32.000 0.791 -17.247 1.00 0.00 O ATOM 0 H GLU A 2 32.300 0.932 -11.463 1.00 0.00 H new ATOM 0 HA GLU A 2 31.623 3.419 -12.899 1.00 0.00 H new ATOM 0 HB2 GLU A 2 33.570 2.111 -13.703 1.00 0.00 H new ATOM 0 HB3 GLU A 2 32.558 0.690 -13.871 1.00 0.00 H new ATOM 0 HG2 GLU A 2 31.112 2.232 -15.443 1.00 0.00 H new ATOM 0 HG3 GLU A 2 32.562 3.214 -15.517 1.00 0.00 H new ATOM 33 N GLY A 3 29.264 2.808 -13.281 1.00 0.00 N ATOM 34 CA GLY A 3 27.878 2.468 -13.549 1.00 0.00 C ATOM 35 C GLY A 3 26.915 3.178 -12.617 1.00 0.00 C ATOM 36 O GLY A 3 25.764 3.426 -12.977 1.00 0.00 O ATOM 0 H GLY A 3 29.454 3.808 -13.214 1.00 0.00 H new ATOM 0 HA2 GLY A 3 27.637 2.726 -14.580 1.00 0.00 H new ATOM 0 HA3 GLY A 3 27.746 1.391 -13.451 1.00 0.00 H new ATOM 40 N VAL A 4 27.384 3.503 -11.417 1.00 0.00 N ATOM 41 CA VAL A 4 26.555 4.187 -10.432 1.00 0.00 C ATOM 42 C VAL A 4 26.323 5.642 -10.828 1.00 0.00 C ATOM 43 O VAL A 4 27.268 6.425 -10.932 1.00 0.00 O ATOM 44 CB VAL A 4 27.192 4.140 -9.028 1.00 0.00 C ATOM 45 CG1 VAL A 4 26.244 4.718 -7.987 1.00 0.00 C ATOM 46 CG2 VAL A 4 27.588 2.716 -8.663 1.00 0.00 C ATOM 0 H VAL A 4 28.334 3.304 -11.103 1.00 0.00 H new ATOM 0 HA VAL A 4 25.599 3.664 -10.403 1.00 0.00 H new ATOM 0 HB VAL A 4 28.095 4.751 -9.044 1.00 0.00 H new ATOM 0 HG11 VAL A 4 26.713 4.675 -7.004 1.00 0.00 H new ATOM 0 HG12 VAL A 4 26.018 5.755 -8.236 1.00 0.00 H new ATOM 0 HG13 VAL A 4 25.321 4.139 -7.974 1.00 0.00 H new ATOM 0 HG21 VAL A 4 28.035 2.706 -7.669 1.00 0.00 H new ATOM 0 HG22 VAL A 4 26.703 2.079 -8.669 1.00 0.00 H new ATOM 0 HG23 VAL A 4 28.310 2.342 -9.389 1.00 0.00 H new ATOM 56 N ASP A 5 25.061 5.999 -11.049 1.00 0.00 N ATOM 57 CA ASP A 5 24.706 7.359 -11.435 1.00 0.00 C ATOM 58 C ASP A 5 23.970 8.075 -10.299 1.00 0.00 C ATOM 59 O ASP A 5 22.778 7.851 -10.095 1.00 0.00 O ATOM 60 CB ASP A 5 23.831 7.339 -12.690 1.00 0.00 C ATOM 61 CG ASP A 5 24.153 8.479 -13.635 1.00 0.00 C ATOM 62 OD1 ASP A 5 23.922 9.647 -13.258 1.00 0.00 O ATOM 63 OD2 ASP A 5 24.634 8.204 -14.755 1.00 0.00 O ATOM 0 H ASP A 5 24.267 5.364 -10.967 1.00 0.00 H new ATOM 0 HA ASP A 5 25.626 7.903 -11.647 1.00 0.00 H new ATOM 0 HB2 ASP A 5 23.967 6.390 -13.209 1.00 0.00 H new ATOM 0 HB3 ASP A 5 22.782 7.396 -12.400 1.00 0.00 H new ATOM 68 N PRO A 6 24.666 8.943 -9.531 1.00 0.00 N ATOM 69 CA PRO A 6 24.052 9.672 -8.416 1.00 0.00 C ATOM 70 C PRO A 6 22.993 10.668 -8.883 1.00 0.00 C ATOM 71 O PRO A 6 23.279 11.566 -9.675 1.00 0.00 O ATOM 72 CB PRO A 6 25.229 10.414 -7.762 1.00 0.00 C ATOM 73 CG PRO A 6 26.457 9.763 -8.303 1.00 0.00 C ATOM 74 CD PRO A 6 26.093 9.279 -9.675 1.00 0.00 C ATOM 0 HA PRO A 6 23.532 8.996 -7.737 1.00 0.00 H new ATOM 0 HB2 PRO A 6 25.208 11.476 -8.005 1.00 0.00 H new ATOM 0 HB3 PRO A 6 25.188 10.335 -6.676 1.00 0.00 H new ATOM 0 HG2 PRO A 6 27.287 10.468 -8.345 1.00 0.00 H new ATOM 0 HG3 PRO A 6 26.773 8.936 -7.668 1.00 0.00 H new ATOM 0 HD2 PRO A 6 26.254 10.047 -10.431 1.00 0.00 H new ATOM 0 HD3 PRO A 6 26.685 8.413 -9.969 1.00 0.00 H new ATOM 82 N ALA A 7 21.769 10.500 -8.382 1.00 0.00 N ATOM 83 CA ALA A 7 20.651 11.380 -8.737 1.00 0.00 C ATOM 84 C ALA A 7 20.225 11.179 -10.183 1.00 0.00 C ATOM 85 O ALA A 7 19.115 10.726 -10.457 1.00 0.00 O ATOM 86 CB ALA A 7 21.011 12.844 -8.488 1.00 0.00 C ATOM 0 H ALA A 7 21.524 9.759 -7.725 1.00 0.00 H new ATOM 0 HA ALA A 7 19.809 11.115 -8.097 1.00 0.00 H new ATOM 0 HB1 ALA A 7 20.166 13.478 -8.759 1.00 0.00 H new ATOM 0 HB2 ALA A 7 21.248 12.986 -7.434 1.00 0.00 H new ATOM 0 HB3 ALA A 7 21.876 13.114 -9.094 1.00 0.00 H new ATOM 92 N VAL A 8 21.120 11.528 -11.101 1.00 0.00 N ATOM 93 CA VAL A 8 20.863 11.407 -12.542 1.00 0.00 C ATOM 94 C VAL A 8 19.815 12.412 -12.984 1.00 0.00 C ATOM 95 O VAL A 8 20.089 13.326 -13.762 1.00 0.00 O ATOM 96 CB VAL A 8 20.371 9.997 -12.982 1.00 0.00 C ATOM 97 CG1 VAL A 8 20.911 9.657 -14.360 1.00 0.00 C ATOM 98 CG2 VAL A 8 20.751 8.916 -11.987 1.00 0.00 C ATOM 0 H VAL A 8 22.042 11.902 -10.874 1.00 0.00 H new ATOM 0 HA VAL A 8 21.827 11.594 -13.014 1.00 0.00 H new ATOM 0 HB VAL A 8 19.282 10.033 -13.018 1.00 0.00 H new ATOM 0 HG11 VAL A 8 20.559 8.668 -14.655 1.00 0.00 H new ATOM 0 HG12 VAL A 8 20.561 10.397 -15.080 1.00 0.00 H new ATOM 0 HG13 VAL A 8 22.001 9.662 -14.335 1.00 0.00 H new ATOM 0 HG21 VAL A 8 20.385 7.952 -12.340 1.00 0.00 H new ATOM 0 HG22 VAL A 8 21.836 8.878 -11.888 1.00 0.00 H new ATOM 0 HG23 VAL A 8 20.305 9.141 -11.018 1.00 0.00 H new ATOM 108 N GLU A 9 18.604 12.209 -12.490 1.00 0.00 N ATOM 109 CA GLU A 9 17.480 13.055 -12.825 1.00 0.00 C ATOM 110 C GLU A 9 16.996 13.839 -11.608 1.00 0.00 C ATOM 111 O GLU A 9 16.158 13.363 -10.845 1.00 0.00 O ATOM 112 CB GLU A 9 16.361 12.178 -13.385 1.00 0.00 C ATOM 113 CG GLU A 9 16.255 12.218 -14.900 1.00 0.00 C ATOM 114 CD GLU A 9 15.079 13.045 -15.380 1.00 0.00 C ATOM 115 OE1 GLU A 9 13.933 12.559 -15.286 1.00 0.00 O ATOM 116 OE2 GLU A 9 15.304 14.182 -15.849 1.00 0.00 O ATOM 0 H GLU A 9 18.377 11.452 -11.846 1.00 0.00 H new ATOM 0 HA GLU A 9 17.788 13.785 -13.574 1.00 0.00 H new ATOM 0 HB2 GLU A 9 16.525 11.148 -13.068 1.00 0.00 H new ATOM 0 HB3 GLU A 9 15.412 12.496 -12.954 1.00 0.00 H new ATOM 0 HG2 GLU A 9 17.176 12.628 -15.314 1.00 0.00 H new ATOM 0 HG3 GLU A 9 16.159 11.201 -15.281 1.00 0.00 H new ATOM 123 N GLU A 10 17.530 15.044 -11.436 1.00 0.00 N ATOM 124 CA GLU A 10 17.153 15.893 -10.313 1.00 0.00 C ATOM 125 C GLU A 10 15.776 16.508 -10.536 1.00 0.00 C ATOM 126 O GLU A 10 15.547 17.203 -11.526 1.00 0.00 O ATOM 127 CB GLU A 10 18.191 16.999 -10.110 1.00 0.00 C ATOM 128 CG GLU A 10 18.421 17.360 -8.651 1.00 0.00 C ATOM 129 CD GLU A 10 19.283 16.342 -7.929 1.00 0.00 C ATOM 130 OE1 GLU A 10 20.261 15.857 -8.535 1.00 0.00 O ATOM 131 OE2 GLU A 10 18.982 16.034 -6.757 1.00 0.00 O ATOM 0 H GLU A 10 18.225 15.454 -12.060 1.00 0.00 H new ATOM 0 HA GLU A 10 17.115 15.272 -9.418 1.00 0.00 H new ATOM 0 HB2 GLU A 10 19.137 16.683 -10.551 1.00 0.00 H new ATOM 0 HB3 GLU A 10 17.870 17.890 -10.649 1.00 0.00 H new ATOM 0 HG2 GLU A 10 18.896 18.339 -8.593 1.00 0.00 H new ATOM 0 HG3 GLU A 10 17.459 17.441 -8.144 1.00 0.00 H new ATOM 138 N ALA A 11 14.861 16.248 -9.607 1.00 0.00 N ATOM 139 CA ALA A 11 13.505 16.776 -9.700 1.00 0.00 C ATOM 140 C ALA A 11 13.377 18.091 -8.939 1.00 0.00 C ATOM 141 O ALA A 11 14.216 18.417 -8.100 1.00 0.00 O ATOM 142 CB ALA A 11 12.506 15.758 -9.172 1.00 0.00 C ATOM 0 H ALA A 11 15.034 15.675 -8.781 1.00 0.00 H new ATOM 0 HA ALA A 11 13.287 16.971 -10.750 1.00 0.00 H new ATOM 0 HB1 ALA A 11 11.498 16.165 -9.247 1.00 0.00 H new ATOM 0 HB2 ALA A 11 12.573 14.843 -9.761 1.00 0.00 H new ATOM 0 HB3 ALA A 11 12.730 15.535 -8.129 1.00 0.00 H new ATOM 148 N ALA A 12 12.321 18.843 -9.241 1.00 0.00 N ATOM 149 CA ALA A 12 12.078 20.126 -8.589 1.00 0.00 C ATOM 150 C ALA A 12 13.194 21.119 -8.893 1.00 0.00 C ATOM 151 O ALA A 12 14.370 20.836 -8.668 1.00 0.00 O ATOM 152 CB ALA A 12 11.925 19.941 -7.086 1.00 0.00 C ATOM 0 H ALA A 12 11.619 18.585 -9.935 1.00 0.00 H new ATOM 0 HA ALA A 12 11.148 20.533 -8.987 1.00 0.00 H new ATOM 0 HB1 ALA A 12 11.744 20.908 -6.617 1.00 0.00 H new ATOM 0 HB2 ALA A 12 11.084 19.277 -6.885 1.00 0.00 H new ATOM 0 HB3 ALA A 12 12.837 19.505 -6.678 1.00 0.00 H new ATOM 158 N PHE A 13 12.815 22.285 -9.407 1.00 0.00 N ATOM 159 CA PHE A 13 13.781 23.325 -9.745 1.00 0.00 C ATOM 160 C PHE A 13 13.656 24.522 -8.804 1.00 0.00 C ATOM 161 O PHE A 13 14.626 25.246 -8.577 1.00 0.00 O ATOM 162 CB PHE A 13 13.586 23.778 -11.192 1.00 0.00 C ATOM 163 CG PHE A 13 14.693 24.657 -11.701 1.00 0.00 C ATOM 164 CD1 PHE A 13 15.924 24.118 -12.038 1.00 0.00 C ATOM 165 CD2 PHE A 13 14.503 26.022 -11.841 1.00 0.00 C ATOM 166 CE1 PHE A 13 16.945 24.924 -12.506 1.00 0.00 C ATOM 167 CE2 PHE A 13 15.520 26.834 -12.309 1.00 0.00 C ATOM 168 CZ PHE A 13 16.742 26.283 -12.641 1.00 0.00 C ATOM 0 H PHE A 13 11.845 22.534 -9.599 1.00 0.00 H new ATOM 0 HA PHE A 13 14.780 22.904 -9.632 1.00 0.00 H new ATOM 0 HB2 PHE A 13 13.508 22.899 -11.832 1.00 0.00 H new ATOM 0 HB3 PHE A 13 12.641 24.315 -11.272 1.00 0.00 H new ATOM 0 HD1 PHE A 13 16.088 23.056 -11.934 1.00 0.00 H new ATOM 0 HD2 PHE A 13 13.549 26.457 -11.582 1.00 0.00 H new ATOM 0 HE1 PHE A 13 17.900 24.491 -12.766 1.00 0.00 H new ATOM 0 HE2 PHE A 13 15.359 27.897 -12.415 1.00 0.00 H new ATOM 0 HZ PHE A 13 17.538 26.915 -13.006 1.00 0.00 H new ATOM 178 N VAL A 14 12.459 24.728 -8.262 1.00 0.00 N ATOM 179 CA VAL A 14 12.216 25.840 -7.352 1.00 0.00 C ATOM 180 C VAL A 14 12.574 25.466 -5.918 1.00 0.00 C ATOM 181 O VAL A 14 12.640 24.286 -5.573 1.00 0.00 O ATOM 182 CB VAL A 14 10.744 26.294 -7.401 1.00 0.00 C ATOM 183 CG1 VAL A 14 10.549 27.575 -6.605 1.00 0.00 C ATOM 184 CG2 VAL A 14 10.291 26.481 -8.842 1.00 0.00 C ATOM 0 H VAL A 14 11.644 24.140 -8.438 1.00 0.00 H new ATOM 0 HA VAL A 14 12.853 26.662 -7.679 1.00 0.00 H new ATOM 0 HB VAL A 14 10.130 25.516 -6.947 1.00 0.00 H new ATOM 0 HG11 VAL A 14 9.503 27.878 -6.653 1.00 0.00 H new ATOM 0 HG12 VAL A 14 10.830 27.404 -5.566 1.00 0.00 H new ATOM 0 HG13 VAL A 14 11.174 28.363 -7.025 1.00 0.00 H new ATOM 0 HG21 VAL A 14 9.249 26.802 -8.857 1.00 0.00 H new ATOM 0 HG22 VAL A 14 10.911 27.238 -9.323 1.00 0.00 H new ATOM 0 HG23 VAL A 14 10.388 25.538 -9.379 1.00 0.00 H new ATOM 194 N ALA A 15 12.804 26.476 -5.086 1.00 0.00 N ATOM 195 CA ALA A 15 13.155 26.253 -3.688 1.00 0.00 C ATOM 196 C ALA A 15 14.470 25.484 -3.568 1.00 0.00 C ATOM 197 O ALA A 15 14.544 24.455 -2.895 1.00 0.00 O ATOM 198 CB ALA A 15 12.032 25.512 -2.974 1.00 0.00 C ATOM 0 H ALA A 15 12.754 27.458 -5.356 1.00 0.00 H new ATOM 0 HA ALA A 15 13.291 27.224 -3.211 1.00 0.00 H new ATOM 0 HB1 ALA A 15 12.307 25.352 -1.931 1.00 0.00 H new ATOM 0 HB2 ALA A 15 11.118 26.104 -3.022 1.00 0.00 H new ATOM 0 HB3 ALA A 15 11.866 24.549 -3.457 1.00 0.00 H new ATOM 204 N ASP A 16 15.509 25.996 -4.222 1.00 0.00 N ATOM 205 CA ASP A 16 16.823 25.361 -4.186 1.00 0.00 C ATOM 206 C ASP A 16 17.339 25.270 -2.753 1.00 0.00 C ATOM 207 O ASP A 16 18.045 24.324 -2.393 1.00 0.00 O ATOM 208 CB ASP A 16 17.814 26.143 -5.049 1.00 0.00 C ATOM 209 CG ASP A 16 18.870 25.249 -5.671 1.00 0.00 C ATOM 210 OD1 ASP A 16 19.746 24.759 -4.928 1.00 0.00 O ATOM 211 OD2 ASP A 16 18.820 25.039 -6.901 1.00 0.00 O ATOM 0 H ASP A 16 15.467 26.847 -4.782 1.00 0.00 H new ATOM 0 HA ASP A 16 16.725 24.351 -4.585 1.00 0.00 H new ATOM 0 HB2 ASP A 16 17.272 26.664 -5.838 1.00 0.00 H new ATOM 0 HB3 ASP A 16 18.300 26.905 -4.440 1.00 0.00 H new ATOM 216 N ASP A 17 16.974 26.257 -1.937 1.00 0.00 N ATOM 217 CA ASP A 17 17.392 26.295 -0.539 1.00 0.00 C ATOM 218 C ASP A 17 16.973 25.020 0.184 1.00 0.00 C ATOM 219 O ASP A 17 17.743 24.452 0.950 1.00 0.00 O ATOM 220 CB ASP A 17 16.792 27.514 0.163 1.00 0.00 C ATOM 221 CG ASP A 17 17.601 28.774 -0.076 1.00 0.00 C ATOM 222 OD1 ASP A 17 18.733 28.859 0.443 1.00 0.00 O ATOM 223 OD2 ASP A 17 17.102 29.675 -0.783 1.00 0.00 O ATOM 0 H ASP A 17 16.388 27.042 -2.222 1.00 0.00 H new ATOM 0 HA ASP A 17 18.479 26.369 -0.511 1.00 0.00 H new ATOM 0 HB2 ASP A 17 15.772 27.668 -0.190 1.00 0.00 H new ATOM 0 HB3 ASP A 17 16.733 27.321 1.234 1.00 0.00 H new ATOM 228 N VAL A 18 15.750 24.574 -0.075 1.00 0.00 N ATOM 229 CA VAL A 18 15.232 23.357 0.540 1.00 0.00 C ATOM 230 C VAL A 18 15.722 22.124 -0.207 1.00 0.00 C ATOM 231 O VAL A 18 15.922 21.063 0.384 1.00 0.00 O ATOM 232 CB VAL A 18 13.694 23.350 0.561 1.00 0.00 C ATOM 233 CG1 VAL A 18 13.176 22.199 1.408 1.00 0.00 C ATOM 234 CG2 VAL A 18 13.161 24.680 1.071 1.00 0.00 C ATOM 0 H VAL A 18 15.097 25.037 -0.707 1.00 0.00 H new ATOM 0 HA VAL A 18 15.601 23.334 1.566 1.00 0.00 H new ATOM 0 HB VAL A 18 13.336 23.209 -0.459 1.00 0.00 H new ATOM 0 HG11 VAL A 18 12.086 22.211 1.411 1.00 0.00 H new ATOM 0 HG12 VAL A 18 13.528 21.255 0.993 1.00 0.00 H new ATOM 0 HG13 VAL A 18 13.542 22.305 2.429 1.00 0.00 H new ATOM 0 HG21 VAL A 18 12.071 24.656 1.079 1.00 0.00 H new ATOM 0 HG22 VAL A 18 13.527 24.855 2.083 1.00 0.00 H new ATOM 0 HG23 VAL A 18 13.502 25.483 0.418 1.00 0.00 H new ATOM 244 N SER A 19 15.905 22.273 -1.515 1.00 0.00 N ATOM 245 CA SER A 19 16.363 21.174 -2.356 1.00 0.00 C ATOM 246 C SER A 19 17.700 20.618 -1.874 1.00 0.00 C ATOM 247 O SER A 19 17.886 19.404 -1.815 1.00 0.00 O ATOM 248 CB SER A 19 16.489 21.639 -3.808 1.00 0.00 C ATOM 249 OG SER A 19 16.757 20.549 -4.671 1.00 0.00 O ATOM 0 H SER A 19 15.743 23.146 -2.016 1.00 0.00 H new ATOM 0 HA SER A 19 15.622 20.377 -2.291 1.00 0.00 H new ATOM 0 HB2 SER A 19 15.567 22.133 -4.116 1.00 0.00 H new ATOM 0 HB3 SER A 19 17.288 22.376 -3.889 1.00 0.00 H new ATOM 0 HG SER A 19 16.831 20.872 -5.593 1.00 0.00 H new ATOM 255 N ASN A 20 18.631 21.506 -1.536 1.00 0.00 N ATOM 256 CA ASN A 20 19.948 21.074 -1.072 1.00 0.00 C ATOM 257 C ASN A 20 19.850 20.376 0.289 1.00 0.00 C ATOM 258 O ASN A 20 20.569 19.415 0.550 1.00 0.00 O ATOM 259 CB ASN A 20 20.935 22.270 -1.057 1.00 0.00 C ATOM 260 CG ASN A 20 21.160 22.905 0.313 1.00 0.00 C ATOM 261 OD1 ASN A 20 22.278 22.916 0.827 1.00 0.00 O ATOM 262 ND2 ASN A 20 20.097 23.432 0.903 1.00 0.00 N ATOM 0 H ASN A 20 18.502 22.517 -1.573 1.00 0.00 H new ATOM 0 HA ASN A 20 20.344 20.337 -1.771 1.00 0.00 H new ATOM 0 HB2 ASN A 20 21.896 21.933 -1.447 1.00 0.00 H new ATOM 0 HB3 ASN A 20 20.565 23.035 -1.739 1.00 0.00 H new ATOM 0 HD21 ASN A 20 20.187 23.869 1.820 1.00 0.00 H new ATOM 0 HD22 ASN A 20 19.189 23.400 0.440 1.00 0.00 H new ATOM 269 N ILE A 21 18.954 20.864 1.143 1.00 0.00 N ATOM 270 CA ILE A 21 18.762 20.289 2.473 1.00 0.00 C ATOM 271 C ILE A 21 18.434 18.798 2.390 1.00 0.00 C ATOM 272 O ILE A 21 19.056 17.980 3.067 1.00 0.00 O ATOM 273 CB ILE A 21 17.625 21.027 3.237 1.00 0.00 C ATOM 274 CG1 ILE A 21 17.993 22.492 3.449 1.00 0.00 C ATOM 275 CG2 ILE A 21 17.323 20.371 4.581 1.00 0.00 C ATOM 276 CD1 ILE A 21 16.901 23.297 4.114 1.00 0.00 C ATOM 0 H ILE A 21 18.348 21.658 0.938 1.00 0.00 H new ATOM 0 HA ILE A 21 19.698 20.413 3.017 1.00 0.00 H new ATOM 0 HB ILE A 21 16.727 20.962 2.623 1.00 0.00 H new ATOM 0 HG12 ILE A 21 18.896 22.547 4.057 1.00 0.00 H new ATOM 0 HG13 ILE A 21 18.230 22.942 2.485 1.00 0.00 H new ATOM 0 HG21 ILE A 21 16.524 20.918 5.081 1.00 0.00 H new ATOM 0 HG22 ILE A 21 17.012 19.339 4.420 1.00 0.00 H new ATOM 0 HG23 ILE A 21 18.218 20.387 5.203 1.00 0.00 H new ATOM 0 HD11 ILE A 21 17.231 24.329 4.233 1.00 0.00 H new ATOM 0 HD12 ILE A 21 16.003 23.272 3.496 1.00 0.00 H new ATOM 0 HD13 ILE A 21 16.680 22.871 5.093 1.00 0.00 H new ATOM 288 N ILE A 22 17.440 18.453 1.583 1.00 0.00 N ATOM 289 CA ILE A 22 17.032 17.060 1.456 1.00 0.00 C ATOM 290 C ILE A 22 18.144 16.188 0.869 1.00 0.00 C ATOM 291 O ILE A 22 18.445 15.127 1.406 1.00 0.00 O ATOM 292 CB ILE A 22 15.706 16.900 0.649 1.00 0.00 C ATOM 293 CG1 ILE A 22 15.925 16.942 -0.874 1.00 0.00 C ATOM 294 CG2 ILE A 22 14.702 17.968 1.061 1.00 0.00 C ATOM 295 CD1 ILE A 22 16.348 15.611 -1.460 1.00 0.00 C ATOM 0 H ILE A 22 16.907 19.109 1.013 1.00 0.00 H new ATOM 0 HA ILE A 22 16.837 16.707 2.469 1.00 0.00 H new ATOM 0 HB ILE A 22 15.311 15.913 0.889 1.00 0.00 H new ATOM 0 HG12 ILE A 22 15.003 17.266 -1.357 1.00 0.00 H new ATOM 0 HG13 ILE A 22 16.685 17.689 -1.103 1.00 0.00 H new ATOM 0 HG21 ILE A 22 13.782 17.843 0.489 1.00 0.00 H new ATOM 0 HG22 ILE A 22 14.484 17.871 2.125 1.00 0.00 H new ATOM 0 HG23 ILE A 22 15.120 18.955 0.865 1.00 0.00 H new ATOM 0 HD11 ILE A 22 16.484 15.714 -2.537 1.00 0.00 H new ATOM 0 HD12 ILE A 22 17.286 15.294 -1.004 1.00 0.00 H new ATOM 0 HD13 ILE A 22 15.578 14.865 -1.262 1.00 0.00 H new ATOM 307 N LYS A 23 18.763 16.632 -0.223 1.00 0.00 N ATOM 308 CA LYS A 23 19.829 15.864 -0.847 1.00 0.00 C ATOM 309 C LYS A 23 20.962 15.632 0.124 1.00 0.00 C ATOM 310 O LYS A 23 21.359 14.497 0.385 1.00 0.00 O ATOM 311 CB LYS A 23 20.345 16.594 -2.069 1.00 0.00 C ATOM 312 CG LYS A 23 19.310 16.682 -3.164 1.00 0.00 C ATOM 313 CD LYS A 23 19.769 17.553 -4.324 1.00 0.00 C ATOM 314 CE LYS A 23 20.294 18.914 -3.880 1.00 0.00 C ATOM 315 NZ LYS A 23 20.673 19.766 -5.042 1.00 0.00 N ATOM 0 H LYS A 23 18.544 17.513 -0.688 1.00 0.00 H new ATOM 0 HA LYS A 23 19.425 14.897 -1.146 1.00 0.00 H new ATOM 0 HB2 LYS A 23 20.656 17.599 -1.784 1.00 0.00 H new ATOM 0 HB3 LYS A 23 21.229 16.082 -2.449 1.00 0.00 H new ATOM 0 HG2 LYS A 23 19.087 15.680 -3.531 1.00 0.00 H new ATOM 0 HG3 LYS A 23 18.384 17.085 -2.754 1.00 0.00 H new ATOM 0 HD2 LYS A 23 20.551 17.031 -4.875 1.00 0.00 H new ATOM 0 HD3 LYS A 23 18.937 17.698 -5.013 1.00 0.00 H new ATOM 0 HE2 LYS A 23 19.532 19.423 -3.289 1.00 0.00 H new ATOM 0 HE3 LYS A 23 21.160 18.776 -3.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 21.025 20.683 -4.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 21.418 19.292 -5.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 19.841 19.919 -5.647 1.00 0.00 H new ATOM 329 N GLU A 24 21.455 16.726 0.681 1.00 0.00 N ATOM 330 CA GLU A 24 22.531 16.667 1.670 1.00 0.00 C ATOM 331 C GLU A 24 22.178 15.666 2.768 1.00 0.00 C ATOM 332 O GLU A 24 23.044 14.973 3.303 1.00 0.00 O ATOM 333 CB GLU A 24 22.776 18.056 2.275 1.00 0.00 C ATOM 334 CG GLU A 24 23.977 18.776 1.686 1.00 0.00 C ATOM 335 CD GLU A 24 23.663 19.452 0.366 1.00 0.00 C ATOM 336 OE1 GLU A 24 23.773 18.785 -0.684 1.00 0.00 O ATOM 337 OE2 GLU A 24 23.304 20.648 0.383 1.00 0.00 O ATOM 0 H GLU A 24 21.130 17.669 0.468 1.00 0.00 H new ATOM 0 HA GLU A 24 23.445 16.339 1.175 1.00 0.00 H new ATOM 0 HB2 GLU A 24 21.887 18.669 2.126 1.00 0.00 H new ATOM 0 HB3 GLU A 24 22.917 17.954 3.351 1.00 0.00 H new ATOM 0 HG2 GLU A 24 24.333 19.522 2.396 1.00 0.00 H new ATOM 0 HG3 GLU A 24 24.788 18.062 1.540 1.00 0.00 H new ATOM 344 N SER A 25 20.889 15.597 3.087 1.00 0.00 N ATOM 345 CA SER A 25 20.399 14.683 4.107 1.00 0.00 C ATOM 346 C SER A 25 20.429 13.240 3.615 1.00 0.00 C ATOM 347 O SER A 25 20.896 12.370 4.332 1.00 0.00 O ATOM 348 CB SER A 25 18.978 15.066 4.527 1.00 0.00 C ATOM 349 OG SER A 25 18.590 14.371 5.699 1.00 0.00 O ATOM 0 H SER A 25 20.164 16.167 2.650 1.00 0.00 H new ATOM 0 HA SER A 25 21.059 14.761 4.971 1.00 0.00 H new ATOM 0 HB2 SER A 25 18.924 16.140 4.702 1.00 0.00 H new ATOM 0 HB3 SER A 25 18.283 14.840 3.719 1.00 0.00 H new ATOM 0 HG SER A 25 18.211 13.501 5.453 1.00 0.00 H new ATOM 355 N ILE A 26 19.950 12.978 2.389 1.00 0.00 N ATOM 356 CA ILE A 26 19.964 11.607 1.854 1.00 0.00 C ATOM 357 C ILE A 26 21.398 11.100 1.826 1.00 0.00 C ATOM 358 O ILE A 26 21.679 9.953 2.164 1.00 0.00 O ATOM 359 CB ILE A 26 19.314 11.519 0.432 1.00 0.00 C ATOM 360 CG1 ILE A 26 17.811 11.279 0.558 1.00 0.00 C ATOM 361 CG2 ILE A 26 19.927 10.413 -0.439 1.00 0.00 C ATOM 362 CD1 ILE A 26 17.000 12.547 0.617 1.00 0.00 C ATOM 0 H ILE A 26 19.557 13.679 1.761 1.00 0.00 H new ATOM 0 HA ILE A 26 19.362 10.977 2.508 1.00 0.00 H new ATOM 0 HB ILE A 26 19.511 12.472 -0.059 1.00 0.00 H new ATOM 0 HG12 ILE A 26 17.475 10.682 -0.290 1.00 0.00 H new ATOM 0 HG13 ILE A 26 17.619 10.693 1.457 1.00 0.00 H new ATOM 0 HG21 ILE A 26 19.435 10.402 -1.412 1.00 0.00 H new ATOM 0 HG22 ILE A 26 20.992 10.603 -0.573 1.00 0.00 H new ATOM 0 HG23 ILE A 26 19.789 9.448 0.048 1.00 0.00 H new ATOM 0 HD11 ILE A 26 15.942 12.299 0.706 1.00 0.00 H new ATOM 0 HD12 ILE A 26 17.308 13.136 1.481 1.00 0.00 H new ATOM 0 HD13 ILE A 26 17.162 13.125 -0.293 1.00 0.00 H new ATOM 374 N ASP A 27 22.306 11.980 1.442 1.00 0.00 N ATOM 375 CA ASP A 27 23.715 11.641 1.387 1.00 0.00 C ATOM 376 C ASP A 27 24.151 11.019 2.718 1.00 0.00 C ATOM 377 O ASP A 27 24.913 10.062 2.754 1.00 0.00 O ATOM 378 CB ASP A 27 24.521 12.912 1.086 1.00 0.00 C ATOM 379 CG ASP A 27 26.022 12.691 1.130 1.00 0.00 C ATOM 380 OD1 ASP A 27 26.556 12.458 2.235 1.00 0.00 O ATOM 381 OD2 ASP A 27 26.663 12.751 0.059 1.00 0.00 O ATOM 0 H ASP A 27 22.091 12.937 1.163 1.00 0.00 H new ATOM 0 HA ASP A 27 23.895 10.912 0.597 1.00 0.00 H new ATOM 0 HB2 ASP A 27 24.244 13.286 0.100 1.00 0.00 H new ATOM 0 HB3 ASP A 27 24.252 13.684 1.807 1.00 0.00 H new ATOM 386 N ALA A 28 23.627 11.565 3.803 1.00 0.00 N ATOM 387 CA ALA A 28 23.935 11.075 5.142 1.00 0.00 C ATOM 388 C ALA A 28 22.963 9.981 5.587 1.00 0.00 C ATOM 389 O ALA A 28 23.367 8.956 6.136 1.00 0.00 O ATOM 390 CB ALA A 28 23.894 12.237 6.124 1.00 0.00 C ATOM 0 H ALA A 28 22.981 12.354 3.785 1.00 0.00 H new ATOM 0 HA ALA A 28 24.933 10.636 5.121 1.00 0.00 H new ATOM 0 HB1 ALA A 28 24.124 11.875 7.126 1.00 0.00 H new ATOM 0 HB2 ALA A 28 24.629 12.987 5.832 1.00 0.00 H new ATOM 0 HB3 ALA A 28 22.899 12.683 6.119 1.00 0.00 H new ATOM 396 N VAL A 29 21.681 10.222 5.339 1.00 0.00 N ATOM 397 CA VAL A 29 20.609 9.312 5.699 1.00 0.00 C ATOM 398 C VAL A 29 20.700 8.001 4.897 1.00 0.00 C ATOM 399 O VAL A 29 20.025 7.028 5.218 1.00 0.00 O ATOM 400 CB VAL A 29 19.242 10.073 5.534 1.00 0.00 C ATOM 401 CG1 VAL A 29 18.053 9.222 5.111 1.00 0.00 C ATOM 402 CG2 VAL A 29 18.890 10.809 6.822 1.00 0.00 C ATOM 0 H VAL A 29 21.356 11.070 4.875 1.00 0.00 H new ATOM 0 HA VAL A 29 20.694 9.003 6.741 1.00 0.00 H new ATOM 0 HB VAL A 29 19.418 10.762 4.708 1.00 0.00 H new ATOM 0 HG11 VAL A 29 17.166 9.851 5.029 1.00 0.00 H new ATOM 0 HG12 VAL A 29 18.261 8.760 4.146 1.00 0.00 H new ATOM 0 HG13 VAL A 29 17.879 8.445 5.855 1.00 0.00 H new ATOM 0 HG21 VAL A 29 17.942 11.332 6.695 1.00 0.00 H new ATOM 0 HG22 VAL A 29 18.803 10.092 7.638 1.00 0.00 H new ATOM 0 HG23 VAL A 29 19.674 11.530 7.055 1.00 0.00 H new ATOM 412 N LEU A 30 21.564 7.961 3.871 1.00 0.00 N ATOM 413 CA LEU A 30 21.733 6.747 3.078 1.00 0.00 C ATOM 414 C LEU A 30 23.191 6.270 3.050 1.00 0.00 C ATOM 415 O LEU A 30 23.440 5.068 2.962 1.00 0.00 O ATOM 416 CB LEU A 30 21.219 6.958 1.653 1.00 0.00 C ATOM 417 CG LEU A 30 19.696 6.918 1.514 1.00 0.00 C ATOM 418 CD1 LEU A 30 19.144 5.630 2.081 1.00 0.00 C ATOM 419 CD2 LEU A 30 19.066 8.082 2.239 1.00 0.00 C ATOM 0 H LEU A 30 22.146 8.746 3.579 1.00 0.00 H new ATOM 0 HA LEU A 30 21.143 5.967 3.560 1.00 0.00 H new ATOM 0 HB2 LEU A 30 21.579 7.921 1.290 1.00 0.00 H new ATOM 0 HB3 LEU A 30 21.650 6.192 1.008 1.00 0.00 H new ATOM 0 HG LEU A 30 19.457 6.979 0.452 1.00 0.00 H new ATOM 0 HD11 LEU A 30 18.059 5.620 1.973 1.00 0.00 H new ATOM 0 HD12 LEU A 30 19.570 4.783 1.543 1.00 0.00 H new ATOM 0 HD13 LEU A 30 19.404 5.556 3.137 1.00 0.00 H new ATOM 0 HD21 LEU A 30 17.983 8.036 2.129 1.00 0.00 H new ATOM 0 HD22 LEU A 30 19.325 8.035 3.297 1.00 0.00 H new ATOM 0 HD23 LEU A 30 19.435 9.017 1.816 1.00 0.00 H new ATOM 431 N GLN A 31 24.159 7.193 3.112 1.00 0.00 N ATOM 432 CA GLN A 31 25.568 6.795 3.076 1.00 0.00 C ATOM 433 C GLN A 31 26.109 6.428 4.458 1.00 0.00 C ATOM 434 O GLN A 31 27.120 5.733 4.559 1.00 0.00 O ATOM 435 CB GLN A 31 26.432 7.896 2.470 1.00 0.00 C ATOM 436 CG GLN A 31 27.783 7.413 2.017 1.00 0.00 C ATOM 437 CD GLN A 31 28.563 8.470 1.261 1.00 0.00 C ATOM 438 OE1 GLN A 31 28.156 8.908 0.185 1.00 0.00 O ATOM 439 NE2 GLN A 31 29.692 8.888 1.821 1.00 0.00 N ATOM 0 H GLN A 31 23.997 8.197 3.186 1.00 0.00 H new ATOM 0 HA GLN A 31 25.617 5.905 2.449 1.00 0.00 H new ATOM 0 HB2 GLN A 31 25.907 8.334 1.621 1.00 0.00 H new ATOM 0 HB3 GLN A 31 26.566 8.689 3.206 1.00 0.00 H new ATOM 0 HG2 GLN A 31 28.360 7.095 2.885 1.00 0.00 H new ATOM 0 HG3 GLN A 31 27.656 6.537 1.380 1.00 0.00 H new ATOM 0 HE21 GLN A 31 29.993 8.498 2.714 1.00 0.00 H new ATOM 0 HE22 GLN A 31 30.258 9.599 1.358 1.00 0.00 H new ATOM 448 N ASN A 32 25.457 6.897 5.524 1.00 0.00 N ATOM 449 CA ASN A 32 25.927 6.596 6.881 1.00 0.00 C ATOM 450 C ASN A 32 26.111 5.087 7.101 1.00 0.00 C ATOM 451 O ASN A 32 26.877 4.670 7.969 1.00 0.00 O ATOM 452 CB ASN A 32 24.973 7.181 7.936 1.00 0.00 C ATOM 453 CG ASN A 32 23.665 6.418 8.060 1.00 0.00 C ATOM 454 OD1 ASN A 32 23.485 5.632 8.989 1.00 0.00 O ATOM 455 ND2 ASN A 32 22.748 6.646 7.126 1.00 0.00 N ATOM 0 H ASN A 32 24.618 7.476 5.479 1.00 0.00 H new ATOM 0 HA ASN A 32 26.903 7.068 6.995 1.00 0.00 H new ATOM 0 HB2 ASN A 32 25.474 7.187 8.904 1.00 0.00 H new ATOM 0 HB3 ASN A 32 24.756 8.219 7.683 1.00 0.00 H new ATOM 0 HD21 ASN A 32 21.852 6.160 7.162 1.00 0.00 H new ATOM 0 HD22 ASN A 32 22.940 7.307 6.373 1.00 0.00 H new ATOM 462 N GLN A 33 25.405 4.276 6.314 1.00 0.00 N ATOM 463 CA GLN A 33 25.501 2.823 6.436 1.00 0.00 C ATOM 464 C GLN A 33 25.439 2.164 5.055 1.00 0.00 C ATOM 465 O GLN A 33 25.439 2.850 4.032 1.00 0.00 O ATOM 466 CB GLN A 33 24.370 2.301 7.331 1.00 0.00 C ATOM 467 CG GLN A 33 24.795 1.213 8.311 1.00 0.00 C ATOM 468 CD GLN A 33 26.018 1.596 9.122 1.00 0.00 C ATOM 469 OE1 GLN A 33 27.146 1.257 8.763 1.00 0.00 O ATOM 470 NE2 GLN A 33 25.800 2.307 10.222 1.00 0.00 N ATOM 0 H GLN A 33 24.764 4.599 5.589 1.00 0.00 H new ATOM 0 HA GLN A 33 26.458 2.569 6.892 1.00 0.00 H new ATOM 0 HB2 GLN A 33 23.952 3.136 7.893 1.00 0.00 H new ATOM 0 HB3 GLN A 33 23.572 1.912 6.698 1.00 0.00 H new ATOM 0 HG2 GLN A 33 23.969 0.998 8.988 1.00 0.00 H new ATOM 0 HG3 GLN A 33 25.003 0.296 7.760 1.00 0.00 H new ATOM 0 HE21 GLN A 33 24.848 2.566 10.482 1.00 0.00 H new ATOM 0 HE22 GLN A 33 26.584 2.594 10.807 1.00 0.00 H new ATOM 479 N GLN A 34 25.392 0.834 5.031 1.00 0.00 N ATOM 480 CA GLN A 34 25.337 0.089 3.778 1.00 0.00 C ATOM 481 C GLN A 34 23.917 0.055 3.217 1.00 0.00 C ATOM 482 O GLN A 34 22.997 0.633 3.797 1.00 0.00 O ATOM 483 CB GLN A 34 25.850 -1.338 3.987 1.00 0.00 C ATOM 484 CG GLN A 34 26.690 -1.858 2.832 1.00 0.00 C ATOM 485 CD GLN A 34 28.176 -1.821 3.129 1.00 0.00 C ATOM 486 OE1 GLN A 34 28.668 -2.551 3.989 1.00 0.00 O ATOM 487 NE2 GLN A 34 28.900 -0.965 2.417 1.00 0.00 N ATOM 0 H GLN A 34 25.391 0.250 5.867 1.00 0.00 H new ATOM 0 HA GLN A 34 25.976 0.598 3.057 1.00 0.00 H new ATOM 0 HB2 GLN A 34 26.443 -1.372 4.901 1.00 0.00 H new ATOM 0 HB3 GLN A 34 24.999 -2.003 4.135 1.00 0.00 H new ATOM 0 HG2 GLN A 34 26.394 -2.882 2.605 1.00 0.00 H new ATOM 0 HG3 GLN A 34 26.486 -1.262 1.942 1.00 0.00 H new ATOM 0 HE21 GLN A 34 28.451 -0.379 1.714 1.00 0.00 H new ATOM 0 HE22 GLN A 34 29.905 -0.894 2.573 1.00 0.00 H new ATOM 496 N TYR A 35 23.750 -0.618 2.081 1.00 0.00 N ATOM 497 CA TYR A 35 22.445 -0.719 1.437 1.00 0.00 C ATOM 498 C TYR A 35 21.642 -1.897 1.987 1.00 0.00 C ATOM 499 O TYR A 35 21.977 -3.059 1.752 1.00 0.00 O ATOM 500 CB TYR A 35 22.624 -0.865 -0.080 1.00 0.00 C ATOM 501 CG TYR A 35 21.327 -1.042 -0.844 1.00 0.00 C ATOM 502 CD1 TYR A 35 20.602 0.057 -1.287 1.00 0.00 C ATOM 503 CD2 TYR A 35 20.835 -2.311 -1.125 1.00 0.00 C ATOM 504 CE1 TYR A 35 19.421 -0.105 -1.988 1.00 0.00 C ATOM 505 CE2 TYR A 35 19.654 -2.480 -1.824 1.00 0.00 C ATOM 506 CZ TYR A 35 18.953 -1.374 -2.254 1.00 0.00 C ATOM 507 OH TYR A 35 17.779 -1.538 -2.952 1.00 0.00 O ATOM 0 H TYR A 35 24.502 -1.101 1.589 1.00 0.00 H new ATOM 0 HA TYR A 35 21.889 0.194 1.651 1.00 0.00 H new ATOM 0 HB2 TYR A 35 23.139 0.017 -0.460 1.00 0.00 H new ATOM 0 HB3 TYR A 35 23.269 -1.721 -0.278 1.00 0.00 H new ATOM 0 HD1 TYR A 35 20.966 1.053 -1.081 1.00 0.00 H new ATOM 0 HD2 TYR A 35 21.384 -3.179 -0.792 1.00 0.00 H new ATOM 0 HE1 TYR A 35 18.868 0.759 -2.326 1.00 0.00 H new ATOM 0 HE2 TYR A 35 19.283 -3.473 -2.032 1.00 0.00 H new ATOM 0 HH TYR A 35 17.027 -1.574 -2.324 1.00 0.00 H new ATOM 517 N SER A 36 20.569 -1.581 2.705 1.00 0.00 N ATOM 518 CA SER A 36 19.693 -2.597 3.280 1.00 0.00 C ATOM 519 C SER A 36 18.235 -2.252 2.990 1.00 0.00 C ATOM 520 O SER A 36 17.806 -1.126 3.231 1.00 0.00 O ATOM 521 CB SER A 36 19.919 -2.706 4.790 1.00 0.00 C ATOM 522 OG SER A 36 20.809 -3.766 5.097 1.00 0.00 O ATOM 0 H SER A 36 20.283 -0.622 2.904 1.00 0.00 H new ATOM 0 HA SER A 36 19.928 -3.559 2.825 1.00 0.00 H new ATOM 0 HB2 SER A 36 20.322 -1.767 5.169 1.00 0.00 H new ATOM 0 HB3 SER A 36 18.966 -2.870 5.293 1.00 0.00 H new ATOM 0 HG SER A 36 20.938 -3.814 6.067 1.00 0.00 H new ATOM 528 N GLU A 37 17.475 -3.212 2.468 1.00 0.00 N ATOM 529 CA GLU A 37 16.069 -2.970 2.149 1.00 0.00 C ATOM 530 C GLU A 37 15.294 -2.511 3.381 1.00 0.00 C ATOM 531 O GLU A 37 14.463 -1.606 3.303 1.00 0.00 O ATOM 532 CB GLU A 37 15.411 -4.215 1.563 1.00 0.00 C ATOM 533 CG GLU A 37 13.979 -3.966 1.117 1.00 0.00 C ATOM 534 CD GLU A 37 13.778 -4.184 -0.371 1.00 0.00 C ATOM 535 OE1 GLU A 37 14.771 -4.092 -1.123 1.00 0.00 O ATOM 536 OE2 GLU A 37 12.629 -4.446 -0.783 1.00 0.00 O ATOM 0 H GLU A 37 17.804 -4.155 2.259 1.00 0.00 H new ATOM 0 HA GLU A 37 16.043 -2.177 1.402 1.00 0.00 H new ATOM 0 HB2 GLU A 37 15.997 -4.565 0.713 1.00 0.00 H new ATOM 0 HB3 GLU A 37 15.422 -5.012 2.307 1.00 0.00 H new ATOM 0 HG2 GLU A 37 13.311 -4.627 1.669 1.00 0.00 H new ATOM 0 HG3 GLU A 37 13.697 -2.944 1.371 1.00 0.00 H new ATOM 543 N ALA A 38 15.576 -3.124 4.523 1.00 0.00 N ATOM 544 CA ALA A 38 14.912 -2.752 5.767 1.00 0.00 C ATOM 545 C ALA A 38 15.122 -1.269 6.061 1.00 0.00 C ATOM 546 O ALA A 38 14.285 -0.615 6.685 1.00 0.00 O ATOM 547 CB ALA A 38 15.445 -3.590 6.913 1.00 0.00 C ATOM 0 H ALA A 38 16.257 -3.878 4.615 1.00 0.00 H new ATOM 0 HA ALA A 38 13.843 -2.937 5.659 1.00 0.00 H new ATOM 0 HB1 ALA A 38 14.943 -3.304 7.837 1.00 0.00 H new ATOM 0 HB2 ALA A 38 15.259 -4.645 6.710 1.00 0.00 H new ATOM 0 HB3 ALA A 38 16.517 -3.424 7.017 1.00 0.00 H new ATOM 553 N LYS A 39 16.255 -0.754 5.598 1.00 0.00 N ATOM 554 CA LYS A 39 16.616 0.639 5.786 1.00 0.00 C ATOM 555 C LYS A 39 16.206 1.490 4.574 1.00 0.00 C ATOM 556 O LYS A 39 16.075 2.709 4.677 1.00 0.00 O ATOM 557 CB LYS A 39 18.127 0.726 6.012 1.00 0.00 C ATOM 558 CG LYS A 39 18.513 1.009 7.451 1.00 0.00 C ATOM 559 CD LYS A 39 18.028 -0.086 8.380 1.00 0.00 C ATOM 560 CE LYS A 39 18.949 -1.295 8.345 1.00 0.00 C ATOM 561 NZ LYS A 39 18.860 -2.096 9.597 1.00 0.00 N ATOM 0 H LYS A 39 16.948 -1.295 5.081 1.00 0.00 H new ATOM 0 HA LYS A 39 16.085 1.032 6.653 1.00 0.00 H new ATOM 0 HB2 LYS A 39 18.587 -0.212 5.700 1.00 0.00 H new ATOM 0 HB3 LYS A 39 18.536 1.510 5.374 1.00 0.00 H new ATOM 0 HG2 LYS A 39 19.597 1.099 7.527 1.00 0.00 H new ATOM 0 HG3 LYS A 39 18.091 1.965 7.761 1.00 0.00 H new ATOM 0 HD2 LYS A 39 17.969 0.299 9.398 1.00 0.00 H new ATOM 0 HD3 LYS A 39 17.020 -0.387 8.094 1.00 0.00 H new ATOM 0 HE2 LYS A 39 18.691 -1.924 7.493 1.00 0.00 H new ATOM 0 HE3 LYS A 39 19.977 -0.964 8.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 19.503 -2.911 9.534 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 19.131 -1.504 10.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 17.885 -2.433 9.725 1.00 0.00 H new ATOM 575 N VAL A 40 16.013 0.835 3.424 1.00 0.00 N ATOM 576 CA VAL A 40 15.627 1.515 2.186 1.00 0.00 C ATOM 577 C VAL A 40 14.414 2.436 2.400 1.00 0.00 C ATOM 578 O VAL A 40 14.227 3.405 1.663 1.00 0.00 O ATOM 579 CB VAL A 40 15.358 0.461 1.062 1.00 0.00 C ATOM 580 CG1 VAL A 40 14.404 0.954 -0.025 1.00 0.00 C ATOM 581 CG2 VAL A 40 16.675 0.022 0.440 1.00 0.00 C ATOM 0 H VAL A 40 16.119 -0.175 3.327 1.00 0.00 H new ATOM 0 HA VAL A 40 16.452 2.154 1.871 1.00 0.00 H new ATOM 0 HB VAL A 40 14.864 -0.384 1.542 1.00 0.00 H new ATOM 0 HG11 VAL A 40 14.265 0.170 -0.770 1.00 0.00 H new ATOM 0 HG12 VAL A 40 13.442 1.205 0.422 1.00 0.00 H new ATOM 0 HG13 VAL A 40 14.824 1.839 -0.503 1.00 0.00 H new ATOM 0 HG21 VAL A 40 16.481 -0.712 -0.342 1.00 0.00 H new ATOM 0 HG22 VAL A 40 17.180 0.887 0.009 1.00 0.00 H new ATOM 0 HG23 VAL A 40 17.309 -0.424 1.207 1.00 0.00 H new ATOM 591 N SER A 41 13.597 2.133 3.404 1.00 0.00 N ATOM 592 CA SER A 41 12.415 2.944 3.693 1.00 0.00 C ATOM 593 C SER A 41 12.565 3.691 5.011 1.00 0.00 C ATOM 594 O SER A 41 12.008 4.773 5.187 1.00 0.00 O ATOM 595 CB SER A 41 11.164 2.066 3.731 1.00 0.00 C ATOM 596 OG SER A 41 9.999 2.826 3.462 1.00 0.00 O ATOM 0 H SER A 41 13.729 1.337 4.029 1.00 0.00 H new ATOM 0 HA SER A 41 12.313 3.679 2.895 1.00 0.00 H new ATOM 0 HB2 SER A 41 11.256 1.264 2.998 1.00 0.00 H new ATOM 0 HB3 SER A 41 11.076 1.595 4.710 1.00 0.00 H new ATOM 0 HG SER A 41 9.213 2.241 3.491 1.00 0.00 H new ATOM 602 N GLN A 42 13.320 3.111 5.934 1.00 0.00 N ATOM 603 CA GLN A 42 13.535 3.734 7.230 1.00 0.00 C ATOM 604 C GLN A 42 14.506 4.896 7.118 1.00 0.00 C ATOM 605 O GLN A 42 14.392 5.879 7.848 1.00 0.00 O ATOM 606 CB GLN A 42 14.053 2.711 8.241 1.00 0.00 C ATOM 607 CG GLN A 42 12.979 1.766 8.757 1.00 0.00 C ATOM 608 CD GLN A 42 11.926 2.476 9.585 1.00 0.00 C ATOM 609 OE1 GLN A 42 12.042 2.573 10.807 1.00 0.00 O ATOM 610 NE2 GLN A 42 10.890 2.977 8.922 1.00 0.00 N ATOM 0 H GLN A 42 13.791 2.215 5.809 1.00 0.00 H new ATOM 0 HA GLN A 42 12.577 4.118 7.581 1.00 0.00 H new ATOM 0 HB2 GLN A 42 14.848 2.126 7.778 1.00 0.00 H new ATOM 0 HB3 GLN A 42 14.496 3.239 9.085 1.00 0.00 H new ATOM 0 HG2 GLN A 42 12.499 1.272 7.912 1.00 0.00 H new ATOM 0 HG3 GLN A 42 13.445 0.987 9.360 1.00 0.00 H new ATOM 0 HE21 GLN A 42 10.835 2.873 7.909 1.00 0.00 H new ATOM 0 HE22 GLN A 42 10.150 3.465 9.426 1.00 0.00 H new ATOM 619 N TRP A 43 15.458 4.796 6.195 1.00 0.00 N ATOM 620 CA TRP A 43 16.425 5.870 6.009 1.00 0.00 C ATOM 621 C TRP A 43 15.718 7.156 5.643 1.00 0.00 C ATOM 622 O TRP A 43 15.849 8.160 6.331 1.00 0.00 O ATOM 623 CB TRP A 43 17.433 5.538 4.916 1.00 0.00 C ATOM 624 CG TRP A 43 18.587 4.707 5.373 1.00 0.00 C ATOM 625 CD1 TRP A 43 19.172 3.716 4.656 1.00 0.00 C ATOM 626 CD2 TRP A 43 19.313 4.790 6.618 1.00 0.00 C ATOM 627 NE1 TRP A 43 20.193 3.157 5.369 1.00 0.00 N ATOM 628 CE2 TRP A 43 20.304 3.793 6.574 1.00 0.00 C ATOM 629 CE3 TRP A 43 19.226 5.592 7.767 1.00 0.00 C ATOM 630 CZ2 TRP A 43 21.194 3.573 7.620 1.00 0.00 C ATOM 631 CZ3 TRP A 43 20.113 5.372 8.802 1.00 0.00 C ATOM 632 CH2 TRP A 43 21.084 4.369 8.723 1.00 0.00 C ATOM 0 H TRP A 43 15.579 3.996 5.574 1.00 0.00 H new ATOM 0 HA TRP A 43 16.958 5.989 6.953 1.00 0.00 H new ATOM 0 HB2 TRP A 43 16.918 5.012 4.112 1.00 0.00 H new ATOM 0 HB3 TRP A 43 17.815 6.468 4.496 1.00 0.00 H new ATOM 0 HD1 TRP A 43 18.873 3.413 3.664 1.00 0.00 H new ATOM 0 HE1 TRP A 43 20.781 2.386 5.052 1.00 0.00 H new ATOM 0 HE3 TRP A 43 18.478 6.368 7.840 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 21.946 2.800 7.561 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 20.056 5.986 9.689 1.00 0.00 H new ATOM 0 HH2 TRP A 43 21.761 4.221 9.552 1.00 0.00 H new ATOM 643 N THR A 44 14.940 7.108 4.566 1.00 0.00 N ATOM 644 CA THR A 44 14.197 8.278 4.111 1.00 0.00 C ATOM 645 C THR A 44 13.335 8.850 5.243 1.00 0.00 C ATOM 646 O THR A 44 13.006 10.037 5.247 1.00 0.00 O ATOM 647 CB THR A 44 13.372 7.923 2.860 1.00 0.00 C ATOM 648 OG1 THR A 44 13.246 9.046 2.012 1.00 0.00 O ATOM 649 CG2 THR A 44 11.980 7.384 3.133 1.00 0.00 C ATOM 0 H THR A 44 14.808 6.274 3.994 1.00 0.00 H new ATOM 0 HA THR A 44 14.898 9.063 3.828 1.00 0.00 H new ATOM 0 HB THR A 44 13.937 7.118 2.389 1.00 0.00 H new ATOM 0 HG1 THR A 44 12.312 9.140 1.730 1.00 0.00 H new ATOM 0 HG21 THR A 44 11.483 7.165 2.188 1.00 0.00 H new ATOM 0 HG22 THR A 44 12.053 6.471 3.725 1.00 0.00 H new ATOM 0 HG23 THR A 44 11.403 8.128 3.683 1.00 0.00 H new ATOM 657 N SER A 45 13.018 8.007 6.224 1.00 0.00 N ATOM 658 CA SER A 45 12.254 8.438 7.381 1.00 0.00 C ATOM 659 C SER A 45 13.158 9.315 8.238 1.00 0.00 C ATOM 660 O SER A 45 12.744 10.356 8.748 1.00 0.00 O ATOM 661 CB SER A 45 11.739 7.221 8.163 1.00 0.00 C ATOM 662 OG SER A 45 12.606 6.870 9.230 1.00 0.00 O ATOM 0 H SER A 45 13.281 7.022 6.236 1.00 0.00 H new ATOM 0 HA SER A 45 11.379 9.011 7.074 1.00 0.00 H new ATOM 0 HB2 SER A 45 10.747 7.437 8.558 1.00 0.00 H new ATOM 0 HB3 SER A 45 11.635 6.373 7.486 1.00 0.00 H new ATOM 0 HG SER A 45 13.294 6.253 8.903 1.00 0.00 H new ATOM 668 N SER A 46 14.420 8.897 8.336 1.00 0.00 N ATOM 669 CA SER A 46 15.427 9.646 9.067 1.00 0.00 C ATOM 670 C SER A 46 15.754 10.913 8.298 1.00 0.00 C ATOM 671 O SER A 46 16.018 11.960 8.888 1.00 0.00 O ATOM 672 CB SER A 46 16.690 8.806 9.269 1.00 0.00 C ATOM 673 OG SER A 46 16.681 8.169 10.536 1.00 0.00 O ATOM 0 H SER A 46 14.765 8.036 7.912 1.00 0.00 H new ATOM 0 HA SER A 46 15.037 9.904 10.052 1.00 0.00 H new ATOM 0 HB2 SER A 46 16.762 8.056 8.482 1.00 0.00 H new ATOM 0 HB3 SER A 46 17.571 9.442 9.184 1.00 0.00 H new ATOM 0 HG SER A 46 17.497 7.637 10.640 1.00 0.00 H new ATOM 679 N CYS A 47 15.698 10.822 6.970 1.00 0.00 N ATOM 680 CA CYS A 47 15.947 11.974 6.126 1.00 0.00 C ATOM 681 C CYS A 47 14.861 12.997 6.363 1.00 0.00 C ATOM 682 O CYS A 47 15.113 14.196 6.409 1.00 0.00 O ATOM 683 CB CYS A 47 15.973 11.586 4.649 1.00 0.00 C ATOM 684 SG CYS A 47 17.391 12.240 3.759 1.00 0.00 S ATOM 0 H CYS A 47 15.483 9.963 6.463 1.00 0.00 H new ATOM 0 HA CYS A 47 16.922 12.389 6.380 1.00 0.00 H new ATOM 0 HB2 CYS A 47 15.973 10.499 4.567 1.00 0.00 H new ATOM 0 HB3 CYS A 47 15.060 11.942 4.172 1.00 0.00 H new ATOM 0 HG CYS A 47 17.081 13.386 3.230 1.00 0.00 H new ATOM 690 N LEU A 48 13.644 12.498 6.532 1.00 0.00 N ATOM 691 CA LEU A 48 12.508 13.351 6.790 1.00 0.00 C ATOM 692 C LEU A 48 12.696 14.073 8.106 1.00 0.00 C ATOM 693 O LEU A 48 12.363 15.253 8.224 1.00 0.00 O ATOM 694 CB LEU A 48 11.206 12.532 6.761 1.00 0.00 C ATOM 695 CG LEU A 48 10.368 12.646 5.477 1.00 0.00 C ATOM 696 CD1 LEU A 48 11.233 12.928 4.249 1.00 0.00 C ATOM 697 CD2 LEU A 48 9.548 11.378 5.265 1.00 0.00 C ATOM 0 H LEU A 48 13.425 11.503 6.494 1.00 0.00 H new ATOM 0 HA LEU A 48 12.432 14.104 6.006 1.00 0.00 H new ATOM 0 HB2 LEU A 48 11.456 11.483 6.916 1.00 0.00 H new ATOM 0 HB3 LEU A 48 10.587 12.840 7.604 1.00 0.00 H new ATOM 0 HG LEU A 48 9.694 13.494 5.603 1.00 0.00 H new ATOM 0 HD11 LEU A 48 10.598 13.000 3.366 1.00 0.00 H new ATOM 0 HD12 LEU A 48 11.768 13.867 4.389 1.00 0.00 H new ATOM 0 HD13 LEU A 48 11.950 12.118 4.115 1.00 0.00 H new ATOM 0 HD21 LEU A 48 8.960 11.473 4.352 1.00 0.00 H new ATOM 0 HD22 LEU A 48 10.217 10.522 5.178 1.00 0.00 H new ATOM 0 HD23 LEU A 48 8.880 11.231 6.113 1.00 0.00 H new ATOM 709 N GLU A 49 13.283 13.386 9.080 1.00 0.00 N ATOM 710 CA GLU A 49 13.557 14.030 10.349 1.00 0.00 C ATOM 711 C GLU A 49 14.788 14.914 10.211 1.00 0.00 C ATOM 712 O GLU A 49 14.879 15.973 10.825 1.00 0.00 O ATOM 713 CB GLU A 49 13.735 13.044 11.491 1.00 0.00 C ATOM 714 CG GLU A 49 13.572 13.732 12.832 1.00 0.00 C ATOM 715 CD GLU A 49 14.260 12.994 13.964 1.00 0.00 C ATOM 716 OE1 GLU A 49 14.251 11.745 13.952 1.00 0.00 O ATOM 717 OE2 GLU A 49 14.807 13.666 14.864 1.00 0.00 O ATOM 0 H GLU A 49 13.570 12.409 9.015 1.00 0.00 H new ATOM 0 HA GLU A 49 12.687 14.635 10.602 1.00 0.00 H new ATOM 0 HB2 GLU A 49 13.005 12.240 11.399 1.00 0.00 H new ATOM 0 HB3 GLU A 49 14.722 12.586 11.431 1.00 0.00 H new ATOM 0 HG2 GLU A 49 13.975 14.743 12.767 1.00 0.00 H new ATOM 0 HG3 GLU A 49 12.510 13.826 13.059 1.00 0.00 H new ATOM 724 N HIS A 50 15.723 14.483 9.368 1.00 0.00 N ATOM 725 CA HIS A 50 16.934 15.253 9.112 1.00 0.00 C ATOM 726 C HIS A 50 16.678 16.337 8.052 1.00 0.00 C ATOM 727 O HIS A 50 17.587 17.079 7.683 1.00 0.00 O ATOM 728 CB HIS A 50 18.064 14.330 8.653 1.00 0.00 C ATOM 729 CG HIS A 50 18.637 13.493 9.755 1.00 0.00 C ATOM 730 ND1 HIS A 50 19.320 14.027 10.828 1.00 0.00 N ATOM 731 CD2 HIS A 50 18.626 12.153 9.947 1.00 0.00 C ATOM 732 CE1 HIS A 50 19.705 13.051 11.631 1.00 0.00 C ATOM 733 NE2 HIS A 50 19.296 11.905 11.120 1.00 0.00 N ATOM 0 H HIS A 50 15.664 13.605 8.852 1.00 0.00 H new ATOM 0 HA HIS A 50 17.229 15.740 10.041 1.00 0.00 H new ATOM 0 HB2 HIS A 50 17.690 13.674 7.867 1.00 0.00 H new ATOM 0 HB3 HIS A 50 18.859 14.933 8.214 1.00 0.00 H new ATOM 0 HD2 HIS A 50 18.175 11.416 9.299 1.00 0.00 H new ATOM 0 HE1 HIS A 50 20.260 13.171 12.550 1.00 0.00 H new ATOM 0 HE2 HIS A 50 19.452 10.984 11.530 1.00 0.00 H new ATOM 742 N CYS A 51 15.426 16.437 7.587 1.00 0.00 N ATOM 743 CA CYS A 51 15.036 17.433 6.608 1.00 0.00 C ATOM 744 C CYS A 51 14.200 18.467 7.329 1.00 0.00 C ATOM 745 O CYS A 51 14.417 19.673 7.217 1.00 0.00 O ATOM 746 CB CYS A 51 14.206 16.798 5.480 1.00 0.00 C ATOM 747 SG CYS A 51 13.861 17.924 4.112 1.00 0.00 S ATOM 0 H CYS A 51 14.665 15.827 7.884 1.00 0.00 H new ATOM 0 HA CYS A 51 15.922 17.881 6.158 1.00 0.00 H new ATOM 0 HB2 CYS A 51 14.737 15.926 5.097 1.00 0.00 H new ATOM 0 HB3 CYS A 51 13.262 16.441 5.892 1.00 0.00 H new ATOM 0 HG CYS A 51 14.966 18.491 3.728 1.00 0.00 H new ATOM 753 N ILE A 52 13.251 17.952 8.099 1.00 0.00 N ATOM 754 CA ILE A 52 12.365 18.769 8.888 1.00 0.00 C ATOM 755 C ILE A 52 13.159 19.558 9.934 1.00 0.00 C ATOM 756 O ILE A 52 12.965 20.759 10.080 1.00 0.00 O ATOM 757 CB ILE A 52 11.286 17.867 9.553 1.00 0.00 C ATOM 758 CG1 ILE A 52 10.130 18.674 10.110 1.00 0.00 C ATOM 759 CG2 ILE A 52 11.875 16.989 10.639 1.00 0.00 C ATOM 760 CD1 ILE A 52 10.523 19.587 11.231 1.00 0.00 C ATOM 0 H ILE A 52 13.081 16.950 8.188 1.00 0.00 H new ATOM 0 HA ILE A 52 11.862 19.491 8.245 1.00 0.00 H new ATOM 0 HB ILE A 52 10.901 17.224 8.761 1.00 0.00 H new ATOM 0 HG12 ILE A 52 9.690 19.266 9.307 1.00 0.00 H new ATOM 0 HG13 ILE A 52 9.357 17.991 10.462 1.00 0.00 H new ATOM 0 HG21 ILE A 52 11.088 16.375 11.077 1.00 0.00 H new ATOM 0 HG22 ILE A 52 12.642 16.344 10.210 1.00 0.00 H new ATOM 0 HG23 ILE A 52 12.320 17.616 11.412 1.00 0.00 H new ATOM 0 HD11 ILE A 52 9.646 20.133 11.580 1.00 0.00 H new ATOM 0 HD12 ILE A 52 10.935 18.999 12.051 1.00 0.00 H new ATOM 0 HD13 ILE A 52 11.274 20.294 10.878 1.00 0.00 H new ATOM 772 N LYS A 53 14.061 18.875 10.645 1.00 0.00 N ATOM 773 CA LYS A 53 14.886 19.512 11.672 1.00 0.00 C ATOM 774 C LYS A 53 15.701 20.664 11.094 1.00 0.00 C ATOM 775 O LYS A 53 15.951 21.660 11.772 1.00 0.00 O ATOM 776 CB LYS A 53 15.825 18.480 12.317 1.00 0.00 C ATOM 777 CG LYS A 53 15.270 17.823 13.578 1.00 0.00 C ATOM 778 CD LYS A 53 13.870 17.274 13.371 1.00 0.00 C ATOM 779 CE LYS A 53 12.807 18.240 13.878 1.00 0.00 C ATOM 780 NZ LYS A 53 11.522 17.548 14.171 1.00 0.00 N ATOM 0 H LYS A 53 14.238 17.877 10.526 1.00 0.00 H new ATOM 0 HA LYS A 53 14.217 19.916 12.432 1.00 0.00 H new ATOM 0 HB2 LYS A 53 16.048 17.703 11.586 1.00 0.00 H new ATOM 0 HB3 LYS A 53 16.768 18.968 12.562 1.00 0.00 H new ATOM 0 HG2 LYS A 53 15.933 17.015 13.886 1.00 0.00 H new ATOM 0 HG3 LYS A 53 15.256 18.551 14.389 1.00 0.00 H new ATOM 0 HD2 LYS A 53 13.709 17.078 12.311 1.00 0.00 H new ATOM 0 HD3 LYS A 53 13.772 16.320 13.890 1.00 0.00 H new ATOM 0 HE2 LYS A 53 13.167 18.735 14.780 1.00 0.00 H new ATOM 0 HE3 LYS A 53 12.639 19.018 13.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 10.825 18.240 14.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 11.165 17.097 13.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 11.677 16.823 14.900 1.00 0.00 H new ATOM 794 N ARG A 54 16.110 20.523 9.841 1.00 0.00 N ATOM 795 CA ARG A 54 16.897 21.556 9.176 1.00 0.00 C ATOM 796 C ARG A 54 16.010 22.742 8.812 1.00 0.00 C ATOM 797 O ARG A 54 16.371 23.906 9.023 1.00 0.00 O ATOM 798 CB ARG A 54 17.566 20.983 7.920 1.00 0.00 C ATOM 799 CG ARG A 54 19.076 21.159 7.902 1.00 0.00 C ATOM 800 CD ARG A 54 19.491 22.414 7.146 1.00 0.00 C ATOM 801 NE ARG A 54 20.442 22.119 6.076 1.00 0.00 N ATOM 802 CZ ARG A 54 21.006 23.047 5.302 1.00 0.00 C ATOM 803 NH1 ARG A 54 20.717 24.333 5.466 1.00 0.00 N ATOM 804 NH2 ARG A 54 21.864 22.685 4.358 1.00 0.00 N ATOM 0 H ARG A 54 15.911 19.706 9.264 1.00 0.00 H new ATOM 0 HA ARG A 54 17.674 21.901 9.858 1.00 0.00 H new ATOM 0 HB2 ARG A 54 17.331 19.921 7.845 1.00 0.00 H new ATOM 0 HB3 ARG A 54 17.142 21.466 7.040 1.00 0.00 H new ATOM 0 HG2 ARG A 54 19.448 21.212 8.925 1.00 0.00 H new ATOM 0 HG3 ARG A 54 19.538 20.287 7.439 1.00 0.00 H new ATOM 0 HD2 ARG A 54 18.607 22.892 6.724 1.00 0.00 H new ATOM 0 HD3 ARG A 54 19.937 23.125 7.841 1.00 0.00 H new ATOM 0 HE ARG A 54 20.689 21.143 5.911 1.00 0.00 H new ATOM 0 HH11 ARG A 54 20.058 24.619 6.190 1.00 0.00 H new ATOM 0 HH12 ARG A 54 21.154 25.034 4.868 1.00 0.00 H new ATOM 0 HH21 ARG A 54 22.091 21.699 4.226 1.00 0.00 H new ATOM 0 HH22 ARG A 54 22.297 23.392 3.764 1.00 0.00 H new ATOM 818 N LEU A 55 14.841 22.431 8.269 1.00 0.00 N ATOM 819 CA LEU A 55 13.885 23.452 7.874 1.00 0.00 C ATOM 820 C LEU A 55 13.479 24.311 9.062 1.00 0.00 C ATOM 821 O LEU A 55 13.167 25.490 8.911 1.00 0.00 O ATOM 822 CB LEU A 55 12.666 22.797 7.230 1.00 0.00 C ATOM 823 CG LEU A 55 12.965 22.123 5.892 1.00 0.00 C ATOM 824 CD1 LEU A 55 11.765 21.335 5.389 1.00 0.00 C ATOM 825 CD2 LEU A 55 13.404 23.158 4.869 1.00 0.00 C ATOM 0 H LEU A 55 14.532 21.475 8.092 1.00 0.00 H new ATOM 0 HA LEU A 55 14.357 24.109 7.143 1.00 0.00 H new ATOM 0 HB2 LEU A 55 12.258 22.056 7.917 1.00 0.00 H new ATOM 0 HB3 LEU A 55 11.895 23.553 7.082 1.00 0.00 H new ATOM 0 HG LEU A 55 13.780 21.415 6.042 1.00 0.00 H new ATOM 0 HD11 LEU A 55 12.010 20.868 4.435 1.00 0.00 H new ATOM 0 HD12 LEU A 55 11.506 20.564 6.115 1.00 0.00 H new ATOM 0 HD13 LEU A 55 10.918 22.008 5.256 1.00 0.00 H new ATOM 0 HD21 LEU A 55 13.614 22.665 3.920 1.00 0.00 H new ATOM 0 HD22 LEU A 55 12.610 23.891 4.729 1.00 0.00 H new ATOM 0 HD23 LEU A 55 14.304 23.661 5.223 1.00 0.00 H new ATOM 837 N THR A 56 13.505 23.717 10.248 1.00 0.00 N ATOM 838 CA THR A 56 13.162 24.439 11.464 1.00 0.00 C ATOM 839 C THR A 56 14.272 25.426 11.797 1.00 0.00 C ATOM 840 O THR A 56 14.018 26.527 12.286 1.00 0.00 O ATOM 841 CB THR A 56 12.946 23.465 12.626 1.00 0.00 C ATOM 842 OG1 THR A 56 14.184 23.077 13.196 1.00 0.00 O ATOM 843 CG2 THR A 56 12.215 22.204 12.218 1.00 0.00 C ATOM 0 H THR A 56 13.759 22.740 10.393 1.00 0.00 H new ATOM 0 HA THR A 56 12.232 24.985 11.304 1.00 0.00 H new ATOM 0 HB THR A 56 12.334 24.007 13.347 1.00 0.00 H new ATOM 0 HG1 THR A 56 14.617 22.414 12.618 1.00 0.00 H new ATOM 0 HG21 THR A 56 12.094 21.556 13.086 1.00 0.00 H new ATOM 0 HG22 THR A 56 11.234 22.465 11.820 1.00 0.00 H new ATOM 0 HG23 THR A 56 12.790 21.682 11.453 1.00 0.00 H new ATOM 851 N ALA A 57 15.507 25.025 11.504 1.00 0.00 N ATOM 852 CA ALA A 57 16.663 25.873 11.744 1.00 0.00 C ATOM 853 C ALA A 57 16.608 27.095 10.838 1.00 0.00 C ATOM 854 O ALA A 57 16.894 28.213 11.264 1.00 0.00 O ATOM 855 CB ALA A 57 17.950 25.095 11.513 1.00 0.00 C ATOM 0 H ALA A 57 15.729 24.115 11.099 1.00 0.00 H new ATOM 0 HA ALA A 57 16.647 26.205 12.782 1.00 0.00 H new ATOM 0 HB1 ALA A 57 18.806 25.745 11.697 1.00 0.00 H new ATOM 0 HB2 ALA A 57 17.988 24.244 12.193 1.00 0.00 H new ATOM 0 HB3 ALA A 57 17.980 24.738 10.483 1.00 0.00 H new ATOM 861 N LEU A 58 16.221 26.870 9.584 1.00 0.00 N ATOM 862 CA LEU A 58 16.109 27.949 8.617 1.00 0.00 C ATOM 863 C LEU A 58 14.855 28.778 8.890 1.00 0.00 C ATOM 864 O LEU A 58 14.875 30.005 8.802 1.00 0.00 O ATOM 865 CB LEU A 58 16.074 27.373 7.199 1.00 0.00 C ATOM 866 CG LEU A 58 17.396 27.445 6.436 1.00 0.00 C ATOM 867 CD1 LEU A 58 17.922 28.872 6.413 1.00 0.00 C ATOM 868 CD2 LEU A 58 18.421 26.508 7.056 1.00 0.00 C ATOM 0 H LEU A 58 15.981 25.949 9.218 1.00 0.00 H new ATOM 0 HA LEU A 58 16.977 28.601 8.710 1.00 0.00 H new ATOM 0 HB2 LEU A 58 15.761 26.330 7.255 1.00 0.00 H new ATOM 0 HB3 LEU A 58 15.313 27.904 6.627 1.00 0.00 H new ATOM 0 HG LEU A 58 17.218 27.128 5.408 1.00 0.00 H new ATOM 0 HD11 LEU A 58 18.864 28.904 5.865 1.00 0.00 H new ATOM 0 HD12 LEU A 58 17.195 29.520 5.923 1.00 0.00 H new ATOM 0 HD13 LEU A 58 18.084 29.216 7.434 1.00 0.00 H new ATOM 0 HD21 LEU A 58 19.356 26.572 6.500 1.00 0.00 H new ATOM 0 HD22 LEU A 58 18.595 26.794 8.093 1.00 0.00 H new ATOM 0 HD23 LEU A 58 18.047 25.485 7.020 1.00 0.00 H new ATOM 880 N ASN A 59 13.765 28.086 9.228 1.00 0.00 N ATOM 881 CA ASN A 59 12.479 28.725 9.532 1.00 0.00 C ATOM 882 C ASN A 59 12.131 29.834 8.534 1.00 0.00 C ATOM 883 O ASN A 59 12.076 31.011 8.892 1.00 0.00 O ATOM 884 CB ASN A 59 12.488 29.283 10.958 1.00 0.00 C ATOM 885 CG ASN A 59 13.533 30.364 11.157 1.00 0.00 C ATOM 886 OD1 ASN A 59 13.246 31.554 11.021 1.00 0.00 O ATOM 887 ND2 ASN A 59 14.753 29.955 11.482 1.00 0.00 N ATOM 0 H ASN A 59 13.747 27.069 9.299 1.00 0.00 H new ATOM 0 HA ASN A 59 11.710 27.958 9.447 1.00 0.00 H new ATOM 0 HB2 ASN A 59 11.503 29.688 11.192 1.00 0.00 H new ATOM 0 HB3 ASN A 59 12.673 28.470 11.661 1.00 0.00 H new ATOM 0 HD21 ASN A 59 15.497 30.637 11.630 1.00 0.00 H new ATOM 0 HD22 ASN A 59 14.947 28.959 11.584 1.00 0.00 H new ATOM 894 N LYS A 60 11.893 29.447 7.285 1.00 0.00 N ATOM 895 CA LYS A 60 11.546 30.412 6.246 1.00 0.00 C ATOM 896 C LYS A 60 11.227 29.714 4.920 1.00 0.00 C ATOM 897 O LYS A 60 12.131 29.437 4.133 1.00 0.00 O ATOM 898 CB LYS A 60 12.690 31.408 6.044 1.00 0.00 C ATOM 899 CG LYS A 60 12.277 32.663 5.293 1.00 0.00 C ATOM 900 CD LYS A 60 13.487 33.480 4.867 1.00 0.00 C ATOM 901 CE LYS A 60 13.286 34.098 3.493 1.00 0.00 C ATOM 902 NZ LYS A 60 12.136 35.044 3.471 1.00 0.00 N ATOM 0 H LYS A 60 11.933 28.478 6.968 1.00 0.00 H new ATOM 0 HA LYS A 60 10.654 30.946 6.574 1.00 0.00 H new ATOM 0 HB2 LYS A 60 13.090 31.692 7.017 1.00 0.00 H new ATOM 0 HB3 LYS A 60 13.496 30.917 5.499 1.00 0.00 H new ATOM 0 HG2 LYS A 60 11.695 32.387 4.414 1.00 0.00 H new ATOM 0 HG3 LYS A 60 11.630 33.271 5.926 1.00 0.00 H new ATOM 0 HD2 LYS A 60 13.671 34.267 5.598 1.00 0.00 H new ATOM 0 HD3 LYS A 60 14.371 32.843 4.855 1.00 0.00 H new ATOM 0 HE2 LYS A 60 14.194 34.623 3.195 1.00 0.00 H new ATOM 0 HE3 LYS A 60 13.120 33.308 2.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 12.095 35.519 2.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 11.252 34.520 3.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 12.257 35.755 4.221 1.00 0.00 H new ATOM 916 N PRO A 61 9.935 29.419 4.641 1.00 0.00 N ATOM 917 CA PRO A 61 8.806 29.723 5.537 1.00 0.00 C ATOM 918 C PRO A 61 8.744 28.779 6.736 1.00 0.00 C ATOM 919 O PRO A 61 9.689 28.037 7.002 1.00 0.00 O ATOM 920 CB PRO A 61 7.590 29.525 4.640 1.00 0.00 C ATOM 921 CG PRO A 61 8.019 28.496 3.655 1.00 0.00 C ATOM 922 CD PRO A 61 9.481 28.752 3.404 1.00 0.00 C ATOM 0 HA PRO A 61 8.881 30.721 5.968 1.00 0.00 H new ATOM 0 HB2 PRO A 61 6.725 29.191 5.212 1.00 0.00 H new ATOM 0 HB3 PRO A 61 7.306 30.454 4.146 1.00 0.00 H new ATOM 0 HG2 PRO A 61 7.860 27.491 4.045 1.00 0.00 H new ATOM 0 HG3 PRO A 61 7.444 28.575 2.732 1.00 0.00 H new ATOM 0 HD2 PRO A 61 10.025 27.825 3.226 1.00 0.00 H new ATOM 0 HD3 PRO A 61 9.633 29.384 2.529 1.00 0.00 H new ATOM 930 N PHE A 62 7.626 28.814 7.458 1.00 0.00 N ATOM 931 CA PHE A 62 7.443 27.963 8.629 1.00 0.00 C ATOM 932 C PHE A 62 6.758 26.650 8.254 1.00 0.00 C ATOM 933 O PHE A 62 7.325 25.572 8.432 1.00 0.00 O ATOM 934 CB PHE A 62 6.620 28.694 9.691 1.00 0.00 C ATOM 935 CG PHE A 62 7.414 29.692 10.485 1.00 0.00 C ATOM 936 CD1 PHE A 62 7.849 30.872 9.903 1.00 0.00 C ATOM 937 CD2 PHE A 62 7.726 29.451 11.814 1.00 0.00 C ATOM 938 CE1 PHE A 62 8.579 31.793 10.631 1.00 0.00 C ATOM 939 CE2 PHE A 62 8.456 30.366 12.547 1.00 0.00 C ATOM 940 CZ PHE A 62 8.883 31.539 11.955 1.00 0.00 C ATOM 0 H PHE A 62 6.834 29.423 7.252 1.00 0.00 H new ATOM 0 HA PHE A 62 8.428 27.732 9.034 1.00 0.00 H new ATOM 0 HB2 PHE A 62 5.789 29.206 9.206 1.00 0.00 H new ATOM 0 HB3 PHE A 62 6.188 27.961 10.372 1.00 0.00 H new ATOM 0 HD1 PHE A 62 7.615 31.075 8.868 1.00 0.00 H new ATOM 0 HD2 PHE A 62 7.394 28.536 12.282 1.00 0.00 H new ATOM 0 HE1 PHE A 62 8.911 32.709 10.166 1.00 0.00 H new ATOM 0 HE2 PHE A 62 8.693 30.165 13.581 1.00 0.00 H new ATOM 0 HZ PHE A 62 9.454 32.256 12.526 1.00 0.00 H new ATOM 950 N LYS A 63 5.536 26.748 7.735 1.00 0.00 N ATOM 951 CA LYS A 63 4.772 25.568 7.336 1.00 0.00 C ATOM 952 C LYS A 63 5.546 24.732 6.319 1.00 0.00 C ATOM 953 O LYS A 63 5.491 24.992 5.116 1.00 0.00 O ATOM 954 CB LYS A 63 3.424 25.988 6.746 1.00 0.00 C ATOM 955 CG LYS A 63 2.376 26.316 7.797 1.00 0.00 C ATOM 956 CD LYS A 63 0.972 25.998 7.307 1.00 0.00 C ATOM 957 CE LYS A 63 -0.037 26.034 8.443 1.00 0.00 C ATOM 958 NZ LYS A 63 0.122 27.250 9.288 1.00 0.00 N ATOM 0 H LYS A 63 5.053 27.633 7.581 1.00 0.00 H new ATOM 0 HA LYS A 63 4.602 24.958 8.224 1.00 0.00 H new ATOM 0 HB2 LYS A 63 3.572 26.859 6.108 1.00 0.00 H new ATOM 0 HB3 LYS A 63 3.050 25.186 6.109 1.00 0.00 H new ATOM 0 HG2 LYS A 63 2.582 25.750 8.706 1.00 0.00 H new ATOM 0 HG3 LYS A 63 2.440 27.372 8.058 1.00 0.00 H new ATOM 0 HD2 LYS A 63 0.682 26.715 6.539 1.00 0.00 H new ATOM 0 HD3 LYS A 63 0.963 25.012 6.842 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -1.047 26.006 8.033 1.00 0.00 H new ATOM 0 HE3 LYS A 63 0.081 25.144 9.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -0.656 27.298 9.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 1.030 27.205 9.793 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 0.103 28.097 8.685 1.00 0.00 H new ATOM 972 N TYR A 64 6.274 23.731 6.810 1.00 0.00 N ATOM 973 CA TYR A 64 7.065 22.869 5.942 1.00 0.00 C ATOM 974 C TYR A 64 6.671 21.403 6.096 1.00 0.00 C ATOM 975 O TYR A 64 6.713 20.852 7.195 1.00 0.00 O ATOM 976 CB TYR A 64 8.556 23.037 6.264 1.00 0.00 C ATOM 977 CG TYR A 64 9.309 23.881 5.262 1.00 0.00 C ATOM 978 CD1 TYR A 64 9.488 23.446 3.956 1.00 0.00 C ATOM 979 CD2 TYR A 64 9.845 25.108 5.626 1.00 0.00 C ATOM 980 CE1 TYR A 64 10.181 24.214 3.038 1.00 0.00 C ATOM 981 CE2 TYR A 64 10.538 25.882 4.715 1.00 0.00 C ATOM 982 CZ TYR A 64 10.703 25.431 3.423 1.00 0.00 C ATOM 983 OH TYR A 64 11.393 26.198 2.514 1.00 0.00 O ATOM 0 H TYR A 64 6.331 23.499 7.802 1.00 0.00 H new ATOM 0 HA TYR A 64 6.871 23.164 4.911 1.00 0.00 H new ATOM 0 HB2 TYR A 64 8.656 23.488 7.251 1.00 0.00 H new ATOM 0 HB3 TYR A 64 9.020 22.052 6.315 1.00 0.00 H new ATOM 0 HD1 TYR A 64 9.080 22.493 3.652 1.00 0.00 H new ATOM 0 HD2 TYR A 64 9.718 25.464 6.638 1.00 0.00 H new ATOM 0 HE1 TYR A 64 10.313 23.863 2.025 1.00 0.00 H new ATOM 0 HE2 TYR A 64 10.948 26.835 5.014 1.00 0.00 H new ATOM 0 HH TYR A 64 12.248 26.477 2.903 1.00 0.00 H new ATOM 993 N VAL A 65 6.335 20.759 4.983 1.00 0.00 N ATOM 994 CA VAL A 65 5.989 19.340 5.000 1.00 0.00 C ATOM 995 C VAL A 65 7.108 18.563 4.339 1.00 0.00 C ATOM 996 O VAL A 65 7.741 19.055 3.406 1.00 0.00 O ATOM 997 CB VAL A 65 4.656 18.976 4.281 1.00 0.00 C ATOM 998 CG1 VAL A 65 3.830 18.029 5.131 1.00 0.00 C ATOM 999 CG2 VAL A 65 3.839 20.194 3.901 1.00 0.00 C ATOM 0 H VAL A 65 6.295 21.194 4.061 1.00 0.00 H new ATOM 0 HA VAL A 65 5.850 19.081 6.050 1.00 0.00 H new ATOM 0 HB VAL A 65 4.931 18.478 3.351 1.00 0.00 H new ATOM 0 HG11 VAL A 65 2.903 17.787 4.611 1.00 0.00 H new ATOM 0 HG12 VAL A 65 4.395 17.114 5.310 1.00 0.00 H new ATOM 0 HG13 VAL A 65 3.598 18.504 6.084 1.00 0.00 H new ATOM 0 HG21 VAL A 65 2.922 19.877 3.404 1.00 0.00 H new ATOM 0 HG22 VAL A 65 3.588 20.758 4.799 1.00 0.00 H new ATOM 0 HG23 VAL A 65 4.418 20.825 3.226 1.00 0.00 H new ATOM 1009 N VAL A 66 7.366 17.362 4.820 1.00 0.00 N ATOM 1010 CA VAL A 66 8.431 16.553 4.249 1.00 0.00 C ATOM 1011 C VAL A 66 7.973 15.130 3.983 1.00 0.00 C ATOM 1012 O VAL A 66 7.856 14.331 4.903 1.00 0.00 O ATOM 1013 CB VAL A 66 9.687 16.505 5.149 1.00 0.00 C ATOM 1014 CG1 VAL A 66 10.926 16.318 4.294 1.00 0.00 C ATOM 1015 CG2 VAL A 66 9.820 17.760 6.008 1.00 0.00 C ATOM 0 H VAL A 66 6.862 16.928 5.593 1.00 0.00 H new ATOM 0 HA VAL A 66 8.692 17.038 3.308 1.00 0.00 H new ATOM 0 HB VAL A 66 9.581 15.657 5.826 1.00 0.00 H new ATOM 0 HG11 VAL A 66 11.808 16.285 4.934 1.00 0.00 H new ATOM 0 HG12 VAL A 66 10.846 15.384 3.737 1.00 0.00 H new ATOM 0 HG13 VAL A 66 11.015 17.150 3.596 1.00 0.00 H new ATOM 0 HG21 VAL A 66 10.715 17.685 6.625 1.00 0.00 H new ATOM 0 HG22 VAL A 66 9.896 18.636 5.363 1.00 0.00 H new ATOM 0 HG23 VAL A 66 8.944 17.856 6.650 1.00 0.00 H new ATOM 1025 N THR A 67 7.732 14.804 2.721 1.00 0.00 N ATOM 1026 CA THR A 67 7.318 13.444 2.368 1.00 0.00 C ATOM 1027 C THR A 67 8.224 12.858 1.303 1.00 0.00 C ATOM 1028 O THR A 67 8.838 13.582 0.527 1.00 0.00 O ATOM 1029 CB THR A 67 5.869 13.395 1.903 1.00 0.00 C ATOM 1030 OG1 THR A 67 5.541 12.101 1.427 1.00 0.00 O ATOM 1031 CG2 THR A 67 5.576 14.372 0.801 1.00 0.00 C ATOM 0 H THR A 67 7.813 15.447 1.933 1.00 0.00 H new ATOM 0 HA THR A 67 7.402 12.842 3.273 1.00 0.00 H new ATOM 0 HB THR A 67 5.270 13.658 2.775 1.00 0.00 H new ATOM 0 HG1 THR A 67 5.750 11.436 2.116 1.00 0.00 H new ATOM 0 HG21 THR A 67 4.528 14.291 0.512 1.00 0.00 H new ATOM 0 HG22 THR A 67 5.779 15.385 1.149 1.00 0.00 H new ATOM 0 HG23 THR A 67 6.208 14.151 -0.059 1.00 0.00 H new ATOM 1039 N CYS A 68 8.313 11.535 1.290 1.00 0.00 N ATOM 1040 CA CYS A 68 9.154 10.834 0.336 1.00 0.00 C ATOM 1041 C CYS A 68 8.614 9.438 0.054 1.00 0.00 C ATOM 1042 O CYS A 68 7.920 8.848 0.879 1.00 0.00 O ATOM 1043 CB CYS A 68 10.585 10.736 0.866 1.00 0.00 C ATOM 1044 SG CYS A 68 10.698 10.244 2.594 1.00 0.00 S ATOM 0 H CYS A 68 7.809 10.925 1.934 1.00 0.00 H new ATOM 0 HA CYS A 68 9.152 11.401 -0.595 1.00 0.00 H new ATOM 0 HB2 CYS A 68 11.137 10.019 0.259 1.00 0.00 H new ATOM 0 HB3 CYS A 68 11.074 11.702 0.742 1.00 0.00 H new ATOM 0 HG CYS A 68 11.947 10.085 2.919 1.00 0.00 H new ATOM 1050 N ILE A 69 8.946 8.921 -1.115 1.00 0.00 N ATOM 1051 CA ILE A 69 8.515 7.596 -1.530 1.00 0.00 C ATOM 1052 C ILE A 69 9.714 6.796 -2.043 1.00 0.00 C ATOM 1053 O ILE A 69 10.594 7.340 -2.707 1.00 0.00 O ATOM 1054 CB ILE A 69 7.427 7.700 -2.626 1.00 0.00 C ATOM 1055 CG1 ILE A 69 6.181 8.386 -2.065 1.00 0.00 C ATOM 1056 CG2 ILE A 69 7.066 6.333 -3.196 1.00 0.00 C ATOM 1057 CD1 ILE A 69 6.216 9.894 -2.182 1.00 0.00 C ATOM 0 H ILE A 69 9.521 9.406 -1.804 1.00 0.00 H new ATOM 0 HA ILE A 69 8.087 7.079 -0.671 1.00 0.00 H new ATOM 0 HB ILE A 69 7.833 8.299 -3.441 1.00 0.00 H new ATOM 0 HG12 ILE A 69 5.302 8.010 -2.589 1.00 0.00 H new ATOM 0 HG13 ILE A 69 6.068 8.114 -1.016 1.00 0.00 H new ATOM 0 HG21 ILE A 69 6.299 6.449 -3.962 1.00 0.00 H new ATOM 0 HG22 ILE A 69 7.953 5.877 -3.636 1.00 0.00 H new ATOM 0 HG23 ILE A 69 6.688 5.694 -2.398 1.00 0.00 H new ATOM 0 HD11 ILE A 69 5.300 10.313 -1.764 1.00 0.00 H new ATOM 0 HD12 ILE A 69 7.075 10.282 -1.635 1.00 0.00 H new ATOM 0 HD13 ILE A 69 6.298 10.176 -3.232 1.00 0.00 H new ATOM 1069 N ILE A 70 9.751 5.508 -1.722 1.00 0.00 N ATOM 1070 CA ILE A 70 10.852 4.654 -2.152 1.00 0.00 C ATOM 1071 C ILE A 70 10.435 3.737 -3.296 1.00 0.00 C ATOM 1072 O ILE A 70 9.366 3.129 -3.263 1.00 0.00 O ATOM 1073 CB ILE A 70 11.397 3.802 -0.990 1.00 0.00 C ATOM 1074 CG1 ILE A 70 10.296 2.917 -0.408 1.00 0.00 C ATOM 1075 CG2 ILE A 70 11.988 4.698 0.088 1.00 0.00 C ATOM 1076 CD1 ILE A 70 10.805 1.910 0.602 1.00 0.00 C ATOM 0 H ILE A 70 9.037 5.034 -1.169 1.00 0.00 H new ATOM 0 HA ILE A 70 11.641 5.320 -2.501 1.00 0.00 H new ATOM 0 HB ILE A 70 12.185 3.155 -1.375 1.00 0.00 H new ATOM 0 HG12 ILE A 70 9.545 3.549 0.067 1.00 0.00 H new ATOM 0 HG13 ILE A 70 9.799 2.387 -1.220 1.00 0.00 H new ATOM 0 HG21 ILE A 70 12.369 4.083 0.903 1.00 0.00 H new ATOM 0 HG22 ILE A 70 12.802 5.287 -0.334 1.00 0.00 H new ATOM 0 HG23 ILE A 70 11.216 5.367 0.469 1.00 0.00 H new ATOM 0 HD11 ILE A 70 9.971 1.315 0.975 1.00 0.00 H new ATOM 0 HD12 ILE A 70 11.534 1.254 0.126 1.00 0.00 H new ATOM 0 HD13 ILE A 70 11.276 2.435 1.433 1.00 0.00 H new ATOM 1088 N MET A 71 11.292 3.644 -4.308 1.00 0.00 N ATOM 1089 CA MET A 71 11.023 2.802 -5.469 1.00 0.00 C ATOM 1090 C MET A 71 12.084 1.713 -5.598 1.00 0.00 C ATOM 1091 O MET A 71 13.227 1.986 -5.970 1.00 0.00 O ATOM 1092 CB MET A 71 10.982 3.649 -6.741 1.00 0.00 C ATOM 1093 CG MET A 71 10.086 3.074 -7.828 1.00 0.00 C ATOM 1094 SD MET A 71 10.890 3.009 -9.442 1.00 0.00 S ATOM 1095 CE MET A 71 12.381 2.103 -9.038 1.00 0.00 C ATOM 0 H MET A 71 12.181 4.143 -4.348 1.00 0.00 H new ATOM 0 HA MET A 71 10.052 2.327 -5.331 1.00 0.00 H new ATOM 0 HB2 MET A 71 10.636 4.651 -6.489 1.00 0.00 H new ATOM 0 HB3 MET A 71 11.994 3.751 -7.132 1.00 0.00 H new ATOM 0 HG2 MET A 71 9.776 2.069 -7.542 1.00 0.00 H new ATOM 0 HG3 MET A 71 9.181 3.678 -7.903 1.00 0.00 H new ATOM 0 HE1 MET A 71 12.852 1.749 -9.955 1.00 0.00 H new ATOM 0 HE2 MET A 71 13.071 2.757 -8.505 1.00 0.00 H new ATOM 0 HE3 MET A 71 12.129 1.250 -8.408 1.00 0.00 H new ATOM 1105 N GLN A 72 11.700 0.481 -5.280 1.00 0.00 N ATOM 1106 CA GLN A 72 12.619 -0.650 -5.350 1.00 0.00 C ATOM 1107 C GLN A 72 12.657 -1.248 -6.755 1.00 0.00 C ATOM 1108 O GLN A 72 11.681 -1.172 -7.500 1.00 0.00 O ATOM 1109 CB GLN A 72 12.213 -1.724 -4.339 1.00 0.00 C ATOM 1110 CG GLN A 72 13.394 -2.424 -3.689 1.00 0.00 C ATOM 1111 CD GLN A 72 13.730 -1.854 -2.325 1.00 0.00 C ATOM 1112 OE1 GLN A 72 14.876 -1.495 -2.054 1.00 0.00 O ATOM 1113 NE2 GLN A 72 12.729 -1.766 -1.457 1.00 0.00 N ATOM 0 H GLN A 72 10.758 0.240 -4.971 1.00 0.00 H new ATOM 0 HA GLN A 72 13.617 -0.285 -5.108 1.00 0.00 H new ATOM 0 HB2 GLN A 72 11.600 -1.267 -3.562 1.00 0.00 H new ATOM 0 HB3 GLN A 72 11.592 -2.467 -4.840 1.00 0.00 H new ATOM 0 HG2 GLN A 72 13.172 -3.487 -3.590 1.00 0.00 H new ATOM 0 HG3 GLN A 72 14.265 -2.339 -4.339 1.00 0.00 H new ATOM 0 HE21 GLN A 72 11.794 -2.075 -1.723 1.00 0.00 H new ATOM 0 HE22 GLN A 72 12.895 -1.389 -0.524 1.00 0.00 H new ATOM 1122 N LYS A 73 13.794 -1.846 -7.101 1.00 0.00 N ATOM 1123 CA LYS A 73 13.972 -2.464 -8.412 1.00 0.00 C ATOM 1124 C LYS A 73 13.873 -1.428 -9.527 1.00 0.00 C ATOM 1125 O LYS A 73 13.047 -0.519 -9.472 1.00 0.00 O ATOM 1126 CB LYS A 73 12.932 -3.565 -8.629 1.00 0.00 C ATOM 1127 CG LYS A 73 13.432 -4.711 -9.493 1.00 0.00 C ATOM 1128 CD LYS A 73 13.156 -4.458 -10.967 1.00 0.00 C ATOM 1129 CE LYS A 73 13.791 -5.525 -11.845 1.00 0.00 C ATOM 1130 NZ LYS A 73 12.805 -6.561 -12.261 1.00 0.00 N ATOM 0 H LYS A 73 14.608 -1.916 -6.490 1.00 0.00 H new ATOM 0 HA LYS A 73 14.969 -2.904 -8.441 1.00 0.00 H new ATOM 0 HB2 LYS A 73 12.624 -3.959 -7.660 1.00 0.00 H new ATOM 0 HB3 LYS A 73 12.046 -3.131 -9.093 1.00 0.00 H new ATOM 0 HG2 LYS A 73 14.503 -4.843 -9.340 1.00 0.00 H new ATOM 0 HG3 LYS A 73 12.949 -5.638 -9.185 1.00 0.00 H new ATOM 0 HD2 LYS A 73 12.080 -4.438 -11.138 1.00 0.00 H new ATOM 0 HD3 LYS A 73 13.542 -3.478 -11.247 1.00 0.00 H new ATOM 0 HE2 LYS A 73 14.222 -5.057 -12.730 1.00 0.00 H new ATOM 0 HE3 LYS A 73 14.610 -6.000 -11.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 13.277 -7.270 -12.858 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 12.412 -7.025 -11.417 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 12.036 -6.112 -12.799 1.00 0.00 H new ATOM 1144 N ASN A 74 14.722 -1.575 -10.539 1.00 0.00 N ATOM 1145 CA ASN A 74 14.732 -0.653 -11.668 1.00 0.00 C ATOM 1146 C ASN A 74 13.809 -1.142 -12.780 1.00 0.00 C ATOM 1147 O ASN A 74 14.165 -2.037 -13.546 1.00 0.00 O ATOM 1148 CB ASN A 74 16.154 -0.489 -12.209 1.00 0.00 C ATOM 1149 CG ASN A 74 16.826 -1.821 -12.481 1.00 0.00 C ATOM 1150 OD1 ASN A 74 16.234 -2.882 -12.279 1.00 0.00 O ATOM 1151 ND2 ASN A 74 18.071 -1.772 -12.941 1.00 0.00 N ATOM 0 H ASN A 74 15.412 -2.324 -10.600 1.00 0.00 H new ATOM 0 HA ASN A 74 14.370 0.313 -11.316 1.00 0.00 H new ATOM 0 HB2 ASN A 74 16.125 0.095 -13.129 1.00 0.00 H new ATOM 0 HB3 ASN A 74 16.750 0.076 -11.492 1.00 0.00 H new ATOM 0 HD21 ASN A 74 18.575 -2.636 -13.141 1.00 0.00 H new ATOM 0 HD22 ASN A 74 18.523 -0.871 -13.094 1.00 0.00 H new ATOM 1158 N GLY A 75 12.624 -0.548 -12.861 1.00 0.00 N ATOM 1159 CA GLY A 75 11.669 -0.936 -13.884 1.00 0.00 C ATOM 1160 C GLY A 75 10.233 -0.723 -13.448 1.00 0.00 C ATOM 1161 O GLY A 75 9.353 -0.495 -14.278 1.00 0.00 O ATOM 0 H GLY A 75 12.307 0.195 -12.238 1.00 0.00 H new ATOM 0 HA2 GLY A 75 11.859 -0.362 -14.791 1.00 0.00 H new ATOM 0 HA3 GLY A 75 11.817 -1.986 -14.135 1.00 0.00 H new ATOM 1165 N ALA A 76 9.995 -0.799 -12.143 1.00 0.00 N ATOM 1166 CA ALA A 76 8.656 -0.613 -11.599 1.00 0.00 C ATOM 1167 C ALA A 76 8.201 0.835 -11.743 1.00 0.00 C ATOM 1168 O ALA A 76 8.851 1.753 -11.243 1.00 0.00 O ATOM 1169 CB ALA A 76 8.615 -1.038 -10.140 1.00 0.00 C ATOM 0 H ALA A 76 10.712 -0.988 -11.443 1.00 0.00 H new ATOM 0 HA ALA A 76 7.970 -1.240 -12.168 1.00 0.00 H new ATOM 0 HB1 ALA A 76 7.609 -0.893 -9.747 1.00 0.00 H new ATOM 0 HB2 ALA A 76 8.888 -2.090 -10.060 1.00 0.00 H new ATOM 0 HB3 ALA A 76 9.319 -0.436 -9.566 1.00 0.00 H new ATOM 1175 N GLY A 77 7.080 1.033 -12.429 1.00 0.00 N ATOM 1176 CA GLY A 77 6.557 2.373 -12.625 1.00 0.00 C ATOM 1177 C GLY A 77 6.022 2.975 -11.341 1.00 0.00 C ATOM 1178 O GLY A 77 5.480 2.265 -10.495 1.00 0.00 O ATOM 0 H GLY A 77 6.524 0.290 -12.853 1.00 0.00 H new ATOM 0 HA2 GLY A 77 7.344 3.013 -13.023 1.00 0.00 H new ATOM 0 HA3 GLY A 77 5.761 2.345 -13.370 1.00 0.00 H new ATOM 1182 N LEU A 78 6.174 4.286 -11.195 1.00 0.00 N ATOM 1183 CA LEU A 78 5.702 4.980 -10.003 1.00 0.00 C ATOM 1184 C LEU A 78 5.044 6.307 -10.366 1.00 0.00 C ATOM 1185 O LEU A 78 5.565 7.067 -11.182 1.00 0.00 O ATOM 1186 CB LEU A 78 6.864 5.222 -9.036 1.00 0.00 C ATOM 1187 CG LEU A 78 6.487 5.934 -7.736 1.00 0.00 C ATOM 1188 CD1 LEU A 78 6.043 4.928 -6.686 1.00 0.00 C ATOM 1189 CD2 LEU A 78 7.658 6.760 -7.225 1.00 0.00 C ATOM 0 H LEU A 78 6.620 4.889 -11.886 1.00 0.00 H new ATOM 0 HA LEU A 78 4.957 4.349 -9.518 1.00 0.00 H new ATOM 0 HB2 LEU A 78 7.317 4.262 -8.788 1.00 0.00 H new ATOM 0 HB3 LEU A 78 7.625 5.811 -9.547 1.00 0.00 H new ATOM 0 HG LEU A 78 5.654 6.606 -7.939 1.00 0.00 H new ATOM 0 HD11 LEU A 78 5.779 5.453 -5.768 1.00 0.00 H new ATOM 0 HD12 LEU A 78 5.176 4.379 -7.052 1.00 0.00 H new ATOM 0 HD13 LEU A 78 6.856 4.230 -6.484 1.00 0.00 H new ATOM 0 HD21 LEU A 78 7.374 7.260 -6.299 1.00 0.00 H new ATOM 0 HD22 LEU A 78 8.510 6.106 -7.037 1.00 0.00 H new ATOM 0 HD23 LEU A 78 7.931 7.506 -7.972 1.00 0.00 H new ATOM 1201 N HIS A 79 3.898 6.580 -9.751 1.00 0.00 N ATOM 1202 CA HIS A 79 3.166 7.815 -10.005 1.00 0.00 C ATOM 1203 C HIS A 79 2.383 8.243 -8.766 1.00 0.00 C ATOM 1204 O HIS A 79 1.813 7.410 -8.061 1.00 0.00 O ATOM 1205 CB HIS A 79 2.220 7.635 -11.195 1.00 0.00 C ATOM 1206 CG HIS A 79 2.758 8.196 -12.475 1.00 0.00 C ATOM 1207 ND1 HIS A 79 2.817 7.472 -13.648 1.00 0.00 N ATOM 1208 CD2 HIS A 79 3.262 9.419 -12.765 1.00 0.00 C ATOM 1209 CE1 HIS A 79 3.336 8.225 -14.601 1.00 0.00 C ATOM 1210 NE2 HIS A 79 3.612 9.411 -14.092 1.00 0.00 N ATOM 0 H HIS A 79 3.456 5.961 -9.072 1.00 0.00 H new ATOM 0 HA HIS A 79 3.886 8.598 -10.243 1.00 0.00 H new ATOM 0 HB2 HIS A 79 2.017 6.573 -11.330 1.00 0.00 H new ATOM 0 HB3 HIS A 79 1.268 8.115 -10.968 1.00 0.00 H new ATOM 0 HD2 HIS A 79 3.369 10.247 -12.080 1.00 0.00 H new ATOM 0 HE1 HIS A 79 3.506 7.922 -15.624 1.00 0.00 H new ATOM 0 HE2 HIS A 79 4.019 10.195 -14.602 1.00 0.00 H new ATOM 1219 N THR A 80 2.366 9.546 -8.505 1.00 0.00 N ATOM 1220 CA THR A 80 1.659 10.086 -7.348 1.00 0.00 C ATOM 1221 C THR A 80 0.680 11.181 -7.765 1.00 0.00 C ATOM 1222 O THR A 80 0.882 11.857 -8.773 1.00 0.00 O ATOM 1223 CB THR A 80 2.663 10.644 -6.336 1.00 0.00 C ATOM 1224 OG1 THR A 80 3.748 9.751 -6.162 1.00 0.00 O ATOM 1225 CG2 THR A 80 2.062 10.905 -4.971 1.00 0.00 C ATOM 0 H THR A 80 2.834 10.248 -9.079 1.00 0.00 H new ATOM 0 HA THR A 80 1.092 9.277 -6.888 1.00 0.00 H new ATOM 0 HB THR A 80 2.994 11.594 -6.756 1.00 0.00 H new ATOM 0 HG1 THR A 80 4.379 10.126 -5.513 1.00 0.00 H new ATOM 0 HG21 THR A 80 2.829 11.299 -4.305 1.00 0.00 H new ATOM 0 HG22 THR A 80 1.253 11.630 -5.062 1.00 0.00 H new ATOM 0 HG23 THR A 80 1.670 9.974 -4.562 1.00 0.00 H new ATOM 1233 N ALA A 81 -0.372 11.359 -6.971 1.00 0.00 N ATOM 1234 CA ALA A 81 -1.375 12.381 -7.243 1.00 0.00 C ATOM 1235 C ALA A 81 -1.795 13.035 -5.941 1.00 0.00 C ATOM 1236 O ALA A 81 -1.869 12.371 -4.909 1.00 0.00 O ATOM 1237 CB ALA A 81 -2.584 11.788 -7.953 1.00 0.00 C ATOM 0 H ALA A 81 -0.551 10.807 -6.132 1.00 0.00 H new ATOM 0 HA ALA A 81 -0.939 13.132 -7.902 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -3.316 12.573 -8.143 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -2.270 11.348 -8.899 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -3.033 11.018 -7.326 1.00 0.00 H new ATOM 1243 N ALA A 82 -2.048 14.336 -5.974 1.00 0.00 N ATOM 1244 CA ALA A 82 -2.437 15.034 -4.761 1.00 0.00 C ATOM 1245 C ALA A 82 -3.162 16.340 -5.034 1.00 0.00 C ATOM 1246 O ALA A 82 -2.676 17.204 -5.764 1.00 0.00 O ATOM 1247 CB ALA A 82 -1.217 15.281 -3.903 1.00 0.00 C ATOM 0 H ALA A 82 -1.992 14.918 -6.810 1.00 0.00 H new ATOM 0 HA ALA A 82 -3.143 14.393 -4.233 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -1.512 15.805 -2.994 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -0.758 14.328 -3.640 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -0.500 15.889 -4.456 1.00 0.00 H new ATOM 1253 N SER A 83 -4.318 16.477 -4.404 1.00 0.00 N ATOM 1254 CA SER A 83 -5.125 17.674 -4.519 1.00 0.00 C ATOM 1255 C SER A 83 -5.145 18.380 -3.171 1.00 0.00 C ATOM 1256 O SER A 83 -5.632 17.833 -2.181 1.00 0.00 O ATOM 1257 CB SER A 83 -6.547 17.308 -4.950 1.00 0.00 C ATOM 1258 OG SER A 83 -7.296 18.466 -5.281 1.00 0.00 O ATOM 0 H SER A 83 -4.720 15.760 -3.800 1.00 0.00 H new ATOM 0 HA SER A 83 -4.700 18.337 -5.273 1.00 0.00 H new ATOM 0 HB2 SER A 83 -6.509 16.639 -5.809 1.00 0.00 H new ATOM 0 HB3 SER A 83 -7.046 16.767 -4.146 1.00 0.00 H new ATOM 0 HG SER A 83 -8.200 18.204 -5.555 1.00 0.00 H new ATOM 1264 N CYS A 84 -4.599 19.587 -3.127 1.00 0.00 N ATOM 1265 CA CYS A 84 -4.543 20.344 -1.886 1.00 0.00 C ATOM 1266 C CYS A 84 -5.675 21.358 -1.810 1.00 0.00 C ATOM 1267 O CYS A 84 -6.047 21.964 -2.815 1.00 0.00 O ATOM 1268 CB CYS A 84 -3.188 21.045 -1.757 1.00 0.00 C ATOM 1269 SG CYS A 84 -2.214 20.508 -0.330 1.00 0.00 S ATOM 0 H CYS A 84 -4.190 20.061 -3.933 1.00 0.00 H new ATOM 0 HA CYS A 84 -4.661 19.647 -1.056 1.00 0.00 H new ATOM 0 HB2 CYS A 84 -2.611 20.868 -2.665 1.00 0.00 H new ATOM 0 HB3 CYS A 84 -3.352 22.120 -1.688 1.00 0.00 H new ATOM 0 HG CYS A 84 -2.615 21.141 0.732 1.00 0.00 H new ATOM 1275 N TRP A 85 -6.222 21.534 -0.614 1.00 0.00 N ATOM 1276 CA TRP A 85 -7.318 22.477 -0.421 1.00 0.00 C ATOM 1277 C TRP A 85 -6.828 23.931 -0.413 1.00 0.00 C ATOM 1278 O TRP A 85 -7.635 24.856 -0.324 1.00 0.00 O ATOM 1279 CB TRP A 85 -8.052 22.176 0.884 1.00 0.00 C ATOM 1280 CG TRP A 85 -9.536 22.293 0.752 1.00 0.00 C ATOM 1281 CD1 TRP A 85 -10.312 21.703 -0.198 1.00 0.00 C ATOM 1282 CD2 TRP A 85 -10.421 23.046 1.589 1.00 0.00 C ATOM 1283 NE1 TRP A 85 -11.628 22.040 -0.007 1.00 0.00 N ATOM 1284 CE2 TRP A 85 -11.722 22.864 1.085 1.00 0.00 C ATOM 1285 CE3 TRP A 85 -10.241 23.854 2.714 1.00 0.00 C ATOM 1286 CZ2 TRP A 85 -12.837 23.461 1.668 1.00 0.00 C ATOM 1287 CZ3 TRP A 85 -11.348 24.447 3.292 1.00 0.00 C ATOM 1288 CH2 TRP A 85 -12.632 24.247 2.769 1.00 0.00 C ATOM 0 H TRP A 85 -5.929 21.042 0.230 1.00 0.00 H new ATOM 0 HA TRP A 85 -8.001 22.357 -1.262 1.00 0.00 H new ATOM 0 HB2 TRP A 85 -7.799 21.168 1.214 1.00 0.00 H new ATOM 0 HB3 TRP A 85 -7.705 22.861 1.657 1.00 0.00 H new ATOM 0 HD1 TRP A 85 -9.945 21.063 -0.987 1.00 0.00 H new ATOM 0 HE1 TRP A 85 -12.410 21.728 -0.584 1.00 0.00 H new ATOM 0 HE3 TRP A 85 -9.255 24.013 3.125 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 -13.828 23.309 1.266 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 -11.221 25.075 4.161 1.00 0.00 H new ATOM 0 HH2 TRP A 85 -13.477 24.723 3.244 1.00 0.00 H new ATOM 1299 N TRP A 86 -5.513 24.136 -0.502 1.00 0.00 N ATOM 1300 CA TRP A 86 -4.949 25.485 -0.501 1.00 0.00 C ATOM 1301 C TRP A 86 -3.995 25.668 -1.677 1.00 0.00 C ATOM 1302 O TRP A 86 -3.707 24.718 -2.405 1.00 0.00 O ATOM 1303 CB TRP A 86 -4.213 25.767 0.817 1.00 0.00 C ATOM 1304 CG TRP A 86 -4.815 25.075 2.004 1.00 0.00 C ATOM 1305 CD1 TRP A 86 -5.821 25.536 2.801 1.00 0.00 C ATOM 1306 CD2 TRP A 86 -4.455 23.788 2.514 1.00 0.00 C ATOM 1307 NE1 TRP A 86 -6.108 24.614 3.776 1.00 0.00 N ATOM 1308 CE2 TRP A 86 -5.282 23.532 3.622 1.00 0.00 C ATOM 1309 CE3 TRP A 86 -3.512 22.825 2.140 1.00 0.00 C ATOM 1310 CZ2 TRP A 86 -5.195 22.354 4.359 1.00 0.00 C ATOM 1311 CZ3 TRP A 86 -3.426 21.658 2.874 1.00 0.00 C ATOM 1312 CH2 TRP A 86 -4.264 21.430 3.973 1.00 0.00 C ATOM 0 H TRP A 86 -4.822 23.389 -0.575 1.00 0.00 H new ATOM 0 HA TRP A 86 -5.772 26.193 -0.600 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -3.173 25.457 0.716 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -4.209 26.842 0.998 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -6.319 26.487 2.682 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -6.821 24.718 4.498 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -2.863 22.991 1.293 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -5.841 22.176 5.206 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -2.700 20.908 2.596 1.00 0.00 H new ATOM 0 HH2 TRP A 86 -4.173 20.507 4.526 1.00 0.00 H new ATOM 1323 N ASP A 87 -3.507 26.892 -1.858 1.00 0.00 N ATOM 1324 CA ASP A 87 -2.586 27.187 -2.950 1.00 0.00 C ATOM 1325 C ASP A 87 -1.963 28.571 -2.792 1.00 0.00 C ATOM 1326 O ASP A 87 -0.764 28.749 -3.007 1.00 0.00 O ATOM 1327 CB ASP A 87 -3.312 27.095 -4.294 1.00 0.00 C ATOM 1328 CG ASP A 87 -2.431 26.532 -5.391 1.00 0.00 C ATOM 1329 OD1 ASP A 87 -1.739 27.325 -6.062 1.00 0.00 O ATOM 1330 OD2 ASP A 87 -2.433 25.297 -5.578 1.00 0.00 O ATOM 0 H ASP A 87 -3.733 27.691 -1.266 1.00 0.00 H new ATOM 0 HA ASP A 87 -1.786 26.447 -2.920 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -4.196 26.467 -4.184 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -3.660 28.086 -4.584 1.00 0.00 H new ATOM 1335 N SER A 88 -2.784 29.549 -2.423 1.00 0.00 N ATOM 1336 CA SER A 88 -2.308 30.917 -2.246 1.00 0.00 C ATOM 1337 C SER A 88 -1.231 30.988 -1.168 1.00 0.00 C ATOM 1338 O SER A 88 -0.329 31.823 -1.233 1.00 0.00 O ATOM 1339 CB SER A 88 -3.471 31.840 -1.881 1.00 0.00 C ATOM 1340 OG SER A 88 -3.090 33.201 -1.970 1.00 0.00 O ATOM 0 H SER A 88 -3.779 29.421 -2.241 1.00 0.00 H new ATOM 0 HA SER A 88 -1.872 31.246 -3.189 1.00 0.00 H new ATOM 0 HB2 SER A 88 -4.312 31.651 -2.547 1.00 0.00 H new ATOM 0 HB3 SER A 88 -3.810 31.620 -0.869 1.00 0.00 H new ATOM 0 HG SER A 88 -3.852 33.770 -1.733 1.00 0.00 H new ATOM 1346 N THR A 89 -1.327 30.104 -0.180 1.00 0.00 N ATOM 1347 CA THR A 89 -0.358 30.065 0.908 1.00 0.00 C ATOM 1348 C THR A 89 0.540 28.839 0.784 1.00 0.00 C ATOM 1349 O THR A 89 1.756 28.927 0.941 1.00 0.00 O ATOM 1350 CB THR A 89 -1.070 30.061 2.262 1.00 0.00 C ATOM 1351 OG1 THR A 89 -0.163 29.748 3.304 1.00 0.00 O ATOM 1352 CG2 THR A 89 -2.215 29.074 2.341 1.00 0.00 C ATOM 0 H THR A 89 -2.067 29.405 -0.111 1.00 0.00 H new ATOM 0 HA THR A 89 0.262 30.959 0.842 1.00 0.00 H new ATOM 0 HB THR A 89 -1.474 31.067 2.374 1.00 0.00 H new ATOM 0 HG1 THR A 89 0.473 30.485 3.417 1.00 0.00 H new ATOM 0 HG21 THR A 89 -2.673 29.126 3.329 1.00 0.00 H new ATOM 0 HG22 THR A 89 -2.959 29.318 1.583 1.00 0.00 H new ATOM 0 HG23 THR A 89 -1.839 28.066 2.168 1.00 0.00 H new ATOM 1360 N THR A 90 -0.074 27.696 0.502 1.00 0.00 N ATOM 1361 CA THR A 90 0.658 26.445 0.357 1.00 0.00 C ATOM 1362 C THR A 90 1.349 26.370 -0.997 1.00 0.00 C ATOM 1363 O THR A 90 0.858 25.723 -1.921 1.00 0.00 O ATOM 1364 CB THR A 90 -0.291 25.256 0.524 1.00 0.00 C ATOM 1365 OG1 THR A 90 -1.286 25.254 -0.486 1.00 0.00 O ATOM 1366 CG2 THR A 90 -0.988 25.242 1.866 1.00 0.00 C ATOM 0 H THR A 90 -1.082 27.611 0.369 1.00 0.00 H new ATOM 0 HA THR A 90 1.421 26.408 1.134 1.00 0.00 H new ATOM 0 HB THR A 90 0.337 24.369 0.448 1.00 0.00 H new ATOM 0 HG1 THR A 90 -0.871 25.439 -1.354 1.00 0.00 H new ATOM 0 HG21 THR A 90 -1.647 24.376 1.925 1.00 0.00 H new ATOM 0 HG22 THR A 90 -0.245 25.187 2.661 1.00 0.00 H new ATOM 0 HG23 THR A 90 -1.575 26.153 1.981 1.00 0.00 H new ATOM 1374 N ASP A 91 2.492 27.040 -1.112 1.00 0.00 N ATOM 1375 CA ASP A 91 3.243 27.047 -2.360 1.00 0.00 C ATOM 1376 C ASP A 91 4.716 26.719 -2.137 1.00 0.00 C ATOM 1377 O ASP A 91 5.558 27.613 -2.053 1.00 0.00 O ATOM 1378 CB ASP A 91 3.111 28.405 -3.054 1.00 0.00 C ATOM 1379 CG ASP A 91 3.696 28.400 -4.452 1.00 0.00 C ATOM 1380 OD1 ASP A 91 4.938 28.424 -4.576 1.00 0.00 O ATOM 1381 OD2 ASP A 91 2.912 28.373 -5.423 1.00 0.00 O ATOM 0 H ASP A 91 2.916 27.582 -0.359 1.00 0.00 H new ATOM 0 HA ASP A 91 2.820 26.271 -2.999 1.00 0.00 H new ATOM 0 HB2 ASP A 91 2.058 28.683 -3.105 1.00 0.00 H new ATOM 0 HB3 ASP A 91 3.613 29.166 -2.456 1.00 0.00 H new ATOM 1386 N GLY A 92 5.019 25.427 -2.045 1.00 0.00 N ATOM 1387 CA GLY A 92 6.397 25.003 -1.836 1.00 0.00 C ATOM 1388 C GLY A 92 6.713 23.615 -2.384 1.00 0.00 C ATOM 1389 O GLY A 92 7.860 23.342 -2.739 1.00 0.00 O ATOM 0 H GLY A 92 4.341 24.668 -2.111 1.00 0.00 H new ATOM 0 HA2 GLY A 92 7.063 25.727 -2.305 1.00 0.00 H new ATOM 0 HA3 GLY A 92 6.612 25.017 -0.767 1.00 0.00 H new ATOM 1393 N SER A 93 5.704 22.733 -2.430 1.00 0.00 N ATOM 1394 CA SER A 93 5.855 21.351 -2.913 1.00 0.00 C ATOM 1395 C SER A 93 6.879 21.197 -4.043 1.00 0.00 C ATOM 1396 O SER A 93 6.667 21.666 -5.162 1.00 0.00 O ATOM 1397 CB SER A 93 4.502 20.823 -3.388 1.00 0.00 C ATOM 1398 OG SER A 93 4.003 21.596 -4.466 1.00 0.00 O ATOM 0 H SER A 93 4.755 22.959 -2.132 1.00 0.00 H new ATOM 0 HA SER A 93 6.230 20.773 -2.069 1.00 0.00 H new ATOM 0 HB2 SER A 93 4.602 19.783 -3.698 1.00 0.00 H new ATOM 0 HB3 SER A 93 3.790 20.842 -2.563 1.00 0.00 H new ATOM 0 HG SER A 93 4.752 21.948 -4.991 1.00 0.00 H new ATOM 1404 N ARG A 94 7.979 20.517 -3.733 1.00 0.00 N ATOM 1405 CA ARG A 94 9.038 20.265 -4.705 1.00 0.00 C ATOM 1406 C ARG A 94 9.635 18.878 -4.470 1.00 0.00 C ATOM 1407 O ARG A 94 10.201 18.610 -3.410 1.00 0.00 O ATOM 1408 CB ARG A 94 10.123 21.345 -4.612 1.00 0.00 C ATOM 1409 CG ARG A 94 10.155 22.272 -5.815 1.00 0.00 C ATOM 1410 CD ARG A 94 9.209 23.448 -5.639 1.00 0.00 C ATOM 1411 NE ARG A 94 8.534 23.799 -6.887 1.00 0.00 N ATOM 1412 CZ ARG A 94 7.514 24.655 -6.971 1.00 0.00 C ATOM 1413 NH1 ARG A 94 7.045 25.257 -5.883 1.00 0.00 N ATOM 1414 NH2 ARG A 94 6.963 24.911 -8.149 1.00 0.00 N ATOM 0 H ARG A 94 8.161 20.128 -2.808 1.00 0.00 H new ATOM 0 HA ARG A 94 8.614 20.300 -5.708 1.00 0.00 H new ATOM 0 HB2 ARG A 94 9.960 21.936 -3.711 1.00 0.00 H new ATOM 0 HB3 ARG A 94 11.096 20.864 -4.507 1.00 0.00 H new ATOM 0 HG2 ARG A 94 11.170 22.640 -5.965 1.00 0.00 H new ATOM 0 HG3 ARG A 94 9.882 21.715 -6.712 1.00 0.00 H new ATOM 0 HD2 ARG A 94 8.465 23.204 -4.880 1.00 0.00 H new ATOM 0 HD3 ARG A 94 9.767 24.310 -5.273 1.00 0.00 H new ATOM 0 HE ARG A 94 8.863 23.362 -7.748 1.00 0.00 H new ATOM 0 HH11 ARG A 94 7.465 25.066 -4.973 1.00 0.00 H new ATOM 0 HH12 ARG A 94 6.265 25.910 -5.958 1.00 0.00 H new ATOM 0 HH21 ARG A 94 7.319 24.454 -8.989 1.00 0.00 H new ATOM 0 HH22 ARG A 94 6.183 25.565 -8.216 1.00 0.00 H new ATOM 1428 N THR A 95 9.480 17.993 -5.451 1.00 0.00 N ATOM 1429 CA THR A 95 9.978 16.625 -5.330 1.00 0.00 C ATOM 1430 C THR A 95 11.394 16.468 -5.876 1.00 0.00 C ATOM 1431 O THR A 95 11.799 17.159 -6.810 1.00 0.00 O ATOM 1432 CB THR A 95 9.037 15.660 -6.042 1.00 0.00 C ATOM 1433 OG1 THR A 95 9.496 14.327 -5.912 1.00 0.00 O ATOM 1434 CG2 THR A 95 8.894 15.955 -7.511 1.00 0.00 C ATOM 0 H THR A 95 9.015 18.197 -6.336 1.00 0.00 H new ATOM 0 HA THR A 95 10.013 16.390 -4.266 1.00 0.00 H new ATOM 0 HB THR A 95 8.066 15.789 -5.564 1.00 0.00 H new ATOM 0 HG1 THR A 95 9.524 14.082 -4.964 1.00 0.00 H new ATOM 0 HG21 THR A 95 8.212 15.234 -7.962 1.00 0.00 H new ATOM 0 HG22 THR A 95 8.498 16.962 -7.643 1.00 0.00 H new ATOM 0 HG23 THR A 95 9.869 15.883 -7.993 1.00 0.00 H new ATOM 1442 N VAL A 96 12.132 15.531 -5.283 1.00 0.00 N ATOM 1443 CA VAL A 96 13.502 15.237 -5.691 1.00 0.00 C ATOM 1444 C VAL A 96 13.646 13.753 -5.990 1.00 0.00 C ATOM 1445 O VAL A 96 12.998 12.926 -5.352 1.00 0.00 O ATOM 1446 CB VAL A 96 14.521 15.616 -4.599 1.00 0.00 C ATOM 1447 CG1 VAL A 96 15.939 15.528 -5.139 1.00 0.00 C ATOM 1448 CG2 VAL A 96 14.239 17.007 -4.056 1.00 0.00 C ATOM 0 H VAL A 96 11.797 14.957 -4.509 1.00 0.00 H new ATOM 0 HA VAL A 96 13.708 15.831 -6.581 1.00 0.00 H new ATOM 0 HB VAL A 96 14.421 14.906 -3.778 1.00 0.00 H new ATOM 0 HG11 VAL A 96 16.645 15.799 -4.354 1.00 0.00 H new ATOM 0 HG12 VAL A 96 16.139 14.509 -5.471 1.00 0.00 H new ATOM 0 HG13 VAL A 96 16.051 16.212 -5.980 1.00 0.00 H new ATOM 0 HG21 VAL A 96 14.971 17.253 -3.287 1.00 0.00 H new ATOM 0 HG22 VAL A 96 14.306 17.734 -4.865 1.00 0.00 H new ATOM 0 HG23 VAL A 96 13.238 17.034 -3.626 1.00 0.00 H new ATOM 1458 N ARG A 97 14.484 13.411 -6.962 1.00 0.00 N ATOM 1459 CA ARG A 97 14.680 12.012 -7.327 1.00 0.00 C ATOM 1460 C ARG A 97 16.146 11.596 -7.222 1.00 0.00 C ATOM 1461 O ARG A 97 16.981 12.008 -8.026 1.00 0.00 O ATOM 1462 CB ARG A 97 14.169 11.759 -8.746 1.00 0.00 C ATOM 1463 CG ARG A 97 12.765 12.288 -8.991 1.00 0.00 C ATOM 1464 CD ARG A 97 11.727 11.179 -8.923 1.00 0.00 C ATOM 1465 NE ARG A 97 10.439 11.598 -9.475 1.00 0.00 N ATOM 1466 CZ ARG A 97 9.432 10.766 -9.743 1.00 0.00 C ATOM 1467 NH1 ARG A 97 9.554 9.462 -9.516 1.00 0.00 N ATOM 1468 NH2 ARG A 97 8.299 11.239 -10.242 1.00 0.00 N ATOM 0 H ARG A 97 15.034 14.075 -7.507 1.00 0.00 H new ATOM 0 HA ARG A 97 14.110 11.408 -6.621 1.00 0.00 H new ATOM 0 HB2 ARG A 97 14.852 12.223 -9.457 1.00 0.00 H new ATOM 0 HB3 ARG A 97 14.184 10.687 -8.943 1.00 0.00 H new ATOM 0 HG2 ARG A 97 12.530 13.053 -8.251 1.00 0.00 H new ATOM 0 HG3 ARG A 97 12.722 12.767 -9.969 1.00 0.00 H new ATOM 0 HD2 ARG A 97 12.090 10.309 -9.470 1.00 0.00 H new ATOM 0 HD3 ARG A 97 11.594 10.871 -7.886 1.00 0.00 H new ATOM 0 HE ARG A 97 10.302 12.590 -9.667 1.00 0.00 H new ATOM 0 HH11 ARG A 97 10.423 9.090 -9.134 1.00 0.00 H new ATOM 0 HH12 ARG A 97 8.778 8.833 -9.724 1.00 0.00 H new ATOM 0 HH21 ARG A 97 8.198 12.238 -10.421 1.00 0.00 H new ATOM 0 HH22 ARG A 97 7.528 10.604 -10.448 1.00 0.00 H new ATOM 1482 N TRP A 98 16.438 10.754 -6.234 1.00 0.00 N ATOM 1483 CA TRP A 98 17.791 10.246 -6.021 1.00 0.00 C ATOM 1484 C TRP A 98 17.913 8.860 -6.662 1.00 0.00 C ATOM 1485 O TRP A 98 17.001 8.041 -6.558 1.00 0.00 O ATOM 1486 CB TRP A 98 18.076 10.140 -4.513 1.00 0.00 C ATOM 1487 CG TRP A 98 18.977 11.198 -3.940 1.00 0.00 C ATOM 1488 CD1 TRP A 98 18.783 11.872 -2.770 1.00 0.00 C ATOM 1489 CD2 TRP A 98 20.214 11.693 -4.479 1.00 0.00 C ATOM 1490 NE1 TRP A 98 19.823 12.736 -2.543 1.00 0.00 N ATOM 1491 CE2 TRP A 98 20.702 12.658 -3.578 1.00 0.00 C ATOM 1492 CE3 TRP A 98 20.956 11.420 -5.627 1.00 0.00 C ATOM 1493 CZ2 TRP A 98 21.888 13.350 -3.786 1.00 0.00 C ATOM 1494 CZ3 TRP A 98 22.139 12.107 -5.837 1.00 0.00 C ATOM 1495 CH2 TRP A 98 22.595 13.064 -4.921 1.00 0.00 C ATOM 0 H TRP A 98 15.751 10.407 -5.564 1.00 0.00 H new ATOM 0 HA TRP A 98 18.511 10.928 -6.474 1.00 0.00 H new ATOM 0 HB2 TRP A 98 17.126 10.172 -3.980 1.00 0.00 H new ATOM 0 HB3 TRP A 98 18.521 9.165 -4.314 1.00 0.00 H new ATOM 0 HD1 TRP A 98 17.933 11.744 -2.117 1.00 0.00 H new ATOM 0 HE1 TRP A 98 19.922 13.341 -1.728 1.00 0.00 H new ATOM 0 HE3 TRP A 98 20.614 10.685 -6.340 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 22.239 14.086 -3.078 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 22.721 11.902 -6.723 1.00 0.00 H new ATOM 0 HH2 TRP A 98 23.521 13.585 -5.115 1.00 0.00 H new ATOM 1506 N GLU A 99 19.036 8.605 -7.319 1.00 0.00 N ATOM 1507 CA GLU A 99 19.265 7.321 -7.968 1.00 0.00 C ATOM 1508 C GLU A 99 20.736 6.927 -7.879 1.00 0.00 C ATOM 1509 O GLU A 99 21.619 7.784 -7.897 1.00 0.00 O ATOM 1510 CB GLU A 99 18.817 7.385 -9.430 1.00 0.00 C ATOM 1511 CG GLU A 99 17.451 6.764 -9.676 1.00 0.00 C ATOM 1512 CD GLU A 99 16.504 7.695 -10.409 1.00 0.00 C ATOM 1513 OE1 GLU A 99 16.898 8.231 -11.466 1.00 0.00 O ATOM 1514 OE2 GLU A 99 15.368 7.887 -9.925 1.00 0.00 O ATOM 0 H GLU A 99 19.803 9.270 -7.417 1.00 0.00 H new ATOM 0 HA GLU A 99 18.677 6.561 -7.452 1.00 0.00 H new ATOM 0 HB2 GLU A 99 18.796 8.427 -9.750 1.00 0.00 H new ATOM 0 HB3 GLU A 99 19.555 6.876 -10.050 1.00 0.00 H new ATOM 0 HG2 GLU A 99 17.572 5.848 -10.254 1.00 0.00 H new ATOM 0 HG3 GLU A 99 17.008 6.482 -8.721 1.00 0.00 H new ATOM 1521 N ASN A 100 20.993 5.627 -7.778 1.00 0.00 N ATOM 1522 CA ASN A 100 22.359 5.124 -7.682 1.00 0.00 C ATOM 1523 C ASN A 100 22.632 4.067 -8.747 1.00 0.00 C ATOM 1524 O ASN A 100 23.604 4.166 -9.495 1.00 0.00 O ATOM 1525 CB ASN A 100 22.621 4.545 -6.290 1.00 0.00 C ATOM 1526 CG ASN A 100 21.504 3.636 -5.815 1.00 0.00 C ATOM 1527 OD1 ASN A 100 20.328 3.994 -5.876 1.00 0.00 O ATOM 1528 ND2 ASN A 100 21.868 2.452 -5.336 1.00 0.00 N ATOM 0 H ASN A 100 20.274 4.903 -7.760 1.00 0.00 H new ATOM 0 HA ASN A 100 23.035 5.962 -7.850 1.00 0.00 H new ATOM 0 HB2 ASN A 100 23.557 3.987 -6.303 1.00 0.00 H new ATOM 0 HB3 ASN A 100 22.747 5.362 -5.579 1.00 0.00 H new ATOM 0 HD21 ASN A 100 21.161 1.798 -5.000 1.00 0.00 H new ATOM 0 HD22 ASN A 100 22.855 2.196 -5.304 1.00 0.00 H new ATOM 1535 N LYS A 101 21.773 3.056 -8.809 1.00 0.00 N ATOM 1536 CA LYS A 101 21.931 1.982 -9.784 1.00 0.00 C ATOM 1537 C LYS A 101 20.597 1.313 -10.092 1.00 0.00 C ATOM 1538 O LYS A 101 20.274 1.059 -11.252 1.00 0.00 O ATOM 1539 CB LYS A 101 22.927 0.942 -9.266 1.00 0.00 C ATOM 1540 CG LYS A 101 22.639 0.479 -7.847 1.00 0.00 C ATOM 1541 CD LYS A 101 21.838 -0.813 -7.833 1.00 0.00 C ATOM 1542 CE LYS A 101 22.743 -2.030 -7.727 1.00 0.00 C ATOM 1543 NZ LYS A 101 22.165 -3.075 -6.836 1.00 0.00 N ATOM 0 H LYS A 101 20.962 2.957 -8.198 1.00 0.00 H new ATOM 0 HA LYS A 101 22.313 2.420 -10.706 1.00 0.00 H new ATOM 0 HB2 LYS A 101 22.916 0.078 -9.931 1.00 0.00 H new ATOM 0 HB3 LYS A 101 23.932 1.362 -9.305 1.00 0.00 H new ATOM 0 HG2 LYS A 101 23.578 0.332 -7.314 1.00 0.00 H new ATOM 0 HG3 LYS A 101 22.089 1.255 -7.315 1.00 0.00 H new ATOM 0 HD2 LYS A 101 21.142 -0.802 -6.994 1.00 0.00 H new ATOM 0 HD3 LYS A 101 21.240 -0.881 -8.742 1.00 0.00 H new ATOM 0 HE2 LYS A 101 22.906 -2.449 -8.720 1.00 0.00 H new ATOM 0 HE3 LYS A 101 23.718 -1.726 -7.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 22.812 -3.888 -6.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 22.033 -2.683 -5.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 21.247 -3.384 -7.214 1.00 0.00 H new ATOM 1557 N SER A 102 19.827 1.025 -9.049 1.00 0.00 N ATOM 1558 CA SER A 102 18.530 0.379 -9.217 1.00 0.00 C ATOM 1559 C SER A 102 17.510 0.915 -8.217 1.00 0.00 C ATOM 1560 O SER A 102 16.372 1.214 -8.579 1.00 0.00 O ATOM 1561 CB SER A 102 18.669 -1.136 -9.056 1.00 0.00 C ATOM 1562 OG SER A 102 17.461 -1.798 -9.390 1.00 0.00 O ATOM 0 H SER A 102 20.077 1.228 -8.081 1.00 0.00 H new ATOM 0 HA SER A 102 18.173 0.604 -10.222 1.00 0.00 H new ATOM 0 HB2 SER A 102 19.475 -1.500 -9.693 1.00 0.00 H new ATOM 0 HB3 SER A 102 18.944 -1.372 -8.028 1.00 0.00 H new ATOM 0 HG SER A 102 17.577 -2.765 -9.280 1.00 0.00 H new ATOM 1568 N MET A 103 17.921 1.032 -6.960 1.00 0.00 N ATOM 1569 CA MET A 103 17.037 1.531 -5.913 1.00 0.00 C ATOM 1570 C MET A 103 16.894 3.046 -5.997 1.00 0.00 C ATOM 1571 O MET A 103 17.852 3.783 -5.761 1.00 0.00 O ATOM 1572 CB MET A 103 17.569 1.132 -4.535 1.00 0.00 C ATOM 1573 CG MET A 103 16.476 0.932 -3.497 1.00 0.00 C ATOM 1574 SD MET A 103 15.658 2.475 -3.048 1.00 0.00 S ATOM 1575 CE MET A 103 13.939 1.986 -3.147 1.00 0.00 C ATOM 0 H MET A 103 18.859 0.789 -6.641 1.00 0.00 H new ATOM 0 HA MET A 103 16.054 1.084 -6.059 1.00 0.00 H new ATOM 0 HB2 MET A 103 18.143 0.210 -4.629 1.00 0.00 H new ATOM 0 HB3 MET A 103 18.257 1.901 -4.183 1.00 0.00 H new ATOM 0 HG2 MET A 103 15.736 0.232 -3.884 1.00 0.00 H new ATOM 0 HG3 MET A 103 16.906 0.480 -2.604 1.00 0.00 H new ATOM 0 HE1 MET A 103 13.404 2.668 -3.808 1.00 0.00 H new ATOM 0 HE2 MET A 103 13.871 0.972 -3.540 1.00 0.00 H new ATOM 0 HE3 MET A 103 13.493 2.020 -2.153 1.00 0.00 H new ATOM 1585 N TYR A 104 15.693 3.507 -6.332 1.00 0.00 N ATOM 1586 CA TYR A 104 15.431 4.938 -6.444 1.00 0.00 C ATOM 1587 C TYR A 104 14.689 5.452 -5.216 1.00 0.00 C ATOM 1588 O TYR A 104 13.858 4.749 -4.641 1.00 0.00 O ATOM 1589 CB TYR A 104 14.618 5.237 -7.710 1.00 0.00 C ATOM 1590 CG TYR A 104 15.094 4.510 -8.958 1.00 0.00 C ATOM 1591 CD1 TYR A 104 16.395 4.026 -9.071 1.00 0.00 C ATOM 1592 CD2 TYR A 104 14.232 4.314 -10.030 1.00 0.00 C ATOM 1593 CE1 TYR A 104 16.818 3.370 -10.212 1.00 0.00 C ATOM 1594 CE2 TYR A 104 14.648 3.658 -11.174 1.00 0.00 C ATOM 1595 CZ TYR A 104 15.942 3.189 -11.259 1.00 0.00 C ATOM 1596 OH TYR A 104 16.360 2.536 -12.396 1.00 0.00 O ATOM 0 H TYR A 104 14.888 2.913 -6.530 1.00 0.00 H new ATOM 0 HA TYR A 104 16.390 5.452 -6.510 1.00 0.00 H new ATOM 0 HB2 TYR A 104 13.576 4.973 -7.527 1.00 0.00 H new ATOM 0 HB3 TYR A 104 14.646 6.310 -7.898 1.00 0.00 H new ATOM 0 HD1 TYR A 104 17.086 4.166 -8.253 1.00 0.00 H new ATOM 0 HD2 TYR A 104 13.218 4.681 -9.969 1.00 0.00 H new ATOM 0 HE1 TYR A 104 17.831 3.001 -10.282 1.00 0.00 H new ATOM 0 HE2 TYR A 104 13.963 3.514 -11.997 1.00 0.00 H new ATOM 0 HH TYR A 104 15.621 2.491 -13.038 1.00 0.00 H new ATOM 1606 N CYS A 105 14.996 6.682 -4.817 1.00 0.00 N ATOM 1607 CA CYS A 105 14.357 7.289 -3.654 1.00 0.00 C ATOM 1608 C CYS A 105 13.898 8.711 -3.963 1.00 0.00 C ATOM 1609 O CYS A 105 14.714 9.595 -4.223 1.00 0.00 O ATOM 1610 CB CYS A 105 15.320 7.298 -2.465 1.00 0.00 C ATOM 1611 SG CYS A 105 15.912 5.659 -1.984 1.00 0.00 S ATOM 0 H CYS A 105 15.682 7.277 -5.281 1.00 0.00 H new ATOM 0 HA CYS A 105 13.481 6.692 -3.400 1.00 0.00 H new ATOM 0 HB2 CYS A 105 16.177 7.925 -2.710 1.00 0.00 H new ATOM 0 HB3 CYS A 105 14.822 7.758 -1.611 1.00 0.00 H new ATOM 0 HG CYS A 105 15.343 4.757 -2.727 1.00 0.00 H new ATOM 1617 N ILE A 106 12.586 8.924 -3.931 1.00 0.00 N ATOM 1618 CA ILE A 106 12.019 10.237 -4.205 1.00 0.00 C ATOM 1619 C ILE A 106 11.614 10.933 -2.905 1.00 0.00 C ATOM 1620 O ILE A 106 11.011 10.325 -2.025 1.00 0.00 O ATOM 1621 CB ILE A 106 10.802 10.129 -5.165 1.00 0.00 C ATOM 1622 CG1 ILE A 106 10.062 11.467 -5.307 1.00 0.00 C ATOM 1623 CG2 ILE A 106 9.844 9.050 -4.696 1.00 0.00 C ATOM 1624 CD1 ILE A 106 9.546 11.710 -6.705 1.00 0.00 C ATOM 0 H ILE A 106 11.897 8.203 -3.718 1.00 0.00 H new ATOM 0 HA ILE A 106 12.786 10.838 -4.694 1.00 0.00 H new ATOM 0 HB ILE A 106 11.190 9.859 -6.147 1.00 0.00 H new ATOM 0 HG12 ILE A 106 9.226 11.490 -4.608 1.00 0.00 H new ATOM 0 HG13 ILE A 106 10.733 12.279 -5.027 1.00 0.00 H new ATOM 0 HG21 ILE A 106 8.999 8.991 -5.382 1.00 0.00 H new ATOM 0 HG22 ILE A 106 10.360 8.090 -4.672 1.00 0.00 H new ATOM 0 HG23 ILE A 106 9.484 9.293 -3.696 1.00 0.00 H new ATOM 0 HD11 ILE A 106 9.033 12.671 -6.741 1.00 0.00 H new ATOM 0 HD12 ILE A 106 10.382 11.718 -7.405 1.00 0.00 H new ATOM 0 HD13 ILE A 106 8.851 10.917 -6.979 1.00 0.00 H new ATOM 1636 N CYS A 107 11.955 12.212 -2.792 1.00 0.00 N ATOM 1637 CA CYS A 107 11.625 12.988 -1.604 1.00 0.00 C ATOM 1638 C CYS A 107 11.168 14.391 -1.979 1.00 0.00 C ATOM 1639 O CYS A 107 11.898 15.138 -2.631 1.00 0.00 O ATOM 1640 CB CYS A 107 12.827 13.066 -0.665 1.00 0.00 C ATOM 1641 SG CYS A 107 12.504 13.957 0.876 1.00 0.00 S ATOM 0 H CYS A 107 12.460 12.733 -3.509 1.00 0.00 H new ATOM 0 HA CYS A 107 10.806 12.483 -1.091 1.00 0.00 H new ATOM 0 HB2 CYS A 107 13.154 12.054 -0.425 1.00 0.00 H new ATOM 0 HB3 CYS A 107 13.651 13.552 -1.187 1.00 0.00 H new ATOM 0 HG CYS A 107 13.580 13.967 1.605 1.00 0.00 H new ATOM 1647 N THR A 108 9.960 14.748 -1.560 1.00 0.00 N ATOM 1648 CA THR A 108 9.413 16.067 -1.850 1.00 0.00 C ATOM 1649 C THR A 108 9.295 16.912 -0.588 1.00 0.00 C ATOM 1650 O THR A 108 8.876 16.428 0.469 1.00 0.00 O ATOM 1651 CB THR A 108 8.045 15.955 -2.556 1.00 0.00 C ATOM 1652 OG1 THR A 108 7.766 17.136 -3.284 1.00 0.00 O ATOM 1653 CG2 THR A 108 6.867 15.708 -1.624 1.00 0.00 C ATOM 0 H THR A 108 9.342 14.143 -1.019 1.00 0.00 H new ATOM 0 HA THR A 108 10.109 16.567 -2.524 1.00 0.00 H new ATOM 0 HB THR A 108 8.144 15.085 -3.205 1.00 0.00 H new ATOM 0 HG1 THR A 108 6.896 17.049 -3.727 1.00 0.00 H new ATOM 0 HG21 THR A 108 5.949 15.644 -2.208 1.00 0.00 H new ATOM 0 HG22 THR A 108 7.020 14.774 -1.084 1.00 0.00 H new ATOM 0 HG23 THR A 108 6.788 16.530 -0.912 1.00 0.00 H new ATOM 1661 N VAL A 109 9.642 18.182 -0.721 1.00 0.00 N ATOM 1662 CA VAL A 109 9.555 19.117 0.388 1.00 0.00 C ATOM 1663 C VAL A 109 8.473 20.136 0.093 1.00 0.00 C ATOM 1664 O VAL A 109 8.497 20.797 -0.946 1.00 0.00 O ATOM 1665 CB VAL A 109 10.885 19.870 0.670 1.00 0.00 C ATOM 1666 CG1 VAL A 109 11.121 19.976 2.168 1.00 0.00 C ATOM 1667 CG2 VAL A 109 12.068 19.202 -0.012 1.00 0.00 C ATOM 0 H VAL A 109 9.988 18.590 -1.590 1.00 0.00 H new ATOM 0 HA VAL A 109 9.324 18.529 1.277 1.00 0.00 H new ATOM 0 HB VAL A 109 10.794 20.873 0.253 1.00 0.00 H new ATOM 0 HG11 VAL A 109 12.056 20.505 2.353 1.00 0.00 H new ATOM 0 HG12 VAL A 109 10.298 20.522 2.628 1.00 0.00 H new ATOM 0 HG13 VAL A 109 11.179 18.976 2.599 1.00 0.00 H new ATOM 0 HG21 VAL A 109 12.978 19.759 0.210 1.00 0.00 H new ATOM 0 HG22 VAL A 109 12.170 18.180 0.354 1.00 0.00 H new ATOM 0 HG23 VAL A 109 11.906 19.187 -1.090 1.00 0.00 H new ATOM 1677 N PHE A 110 7.523 20.252 0.997 1.00 0.00 N ATOM 1678 CA PHE A 110 6.432 21.185 0.819 1.00 0.00 C ATOM 1679 C PHE A 110 6.669 22.446 1.645 1.00 0.00 C ATOM 1680 O PHE A 110 6.409 22.479 2.847 1.00 0.00 O ATOM 1681 CB PHE A 110 5.125 20.505 1.221 1.00 0.00 C ATOM 1682 CG PHE A 110 4.436 19.790 0.093 1.00 0.00 C ATOM 1683 CD1 PHE A 110 5.139 18.924 -0.729 1.00 0.00 C ATOM 1684 CD2 PHE A 110 3.083 19.979 -0.138 1.00 0.00 C ATOM 1685 CE1 PHE A 110 4.505 18.260 -1.762 1.00 0.00 C ATOM 1686 CE2 PHE A 110 2.444 19.317 -1.169 1.00 0.00 C ATOM 1687 CZ PHE A 110 3.155 18.457 -1.981 1.00 0.00 C ATOM 0 H PHE A 110 7.485 19.712 1.862 1.00 0.00 H new ATOM 0 HA PHE A 110 6.371 21.483 -0.228 1.00 0.00 H new ATOM 0 HB2 PHE A 110 5.329 19.791 2.019 1.00 0.00 H new ATOM 0 HB3 PHE A 110 4.448 21.255 1.630 1.00 0.00 H new ATOM 0 HD1 PHE A 110 6.194 18.766 -0.561 1.00 0.00 H new ATOM 0 HD2 PHE A 110 2.522 20.651 0.494 1.00 0.00 H new ATOM 0 HE1 PHE A 110 5.064 17.588 -2.397 1.00 0.00 H new ATOM 0 HE2 PHE A 110 1.389 19.473 -1.339 1.00 0.00 H new ATOM 0 HZ PHE A 110 2.657 17.938 -2.787 1.00 0.00 H new ATOM 1697 N GLY A 111 7.161 23.482 0.975 1.00 0.00 N ATOM 1698 CA GLY A 111 7.430 24.752 1.633 1.00 0.00 C ATOM 1699 C GLY A 111 6.229 25.668 1.581 1.00 0.00 C ATOM 1700 O GLY A 111 6.149 26.564 0.740 1.00 0.00 O ATOM 0 H GLY A 111 7.381 23.466 -0.021 1.00 0.00 H new ATOM 0 HA2 GLY A 111 7.708 24.573 2.672 1.00 0.00 H new ATOM 0 HA3 GLY A 111 8.280 25.238 1.155 1.00 0.00 H new ATOM 1704 N LEU A 112 5.282 25.419 2.467 1.00 0.00 N ATOM 1705 CA LEU A 112 4.053 26.190 2.516 1.00 0.00 C ATOM 1706 C LEU A 112 4.265 27.523 3.225 1.00 0.00 C ATOM 1707 O LEU A 112 4.830 27.576 4.319 1.00 0.00 O ATOM 1708 CB LEU A 112 2.971 25.369 3.228 1.00 0.00 C ATOM 1709 CG LEU A 112 2.448 24.121 2.482 1.00 0.00 C ATOM 1710 CD1 LEU A 112 3.505 23.479 1.594 1.00 0.00 C ATOM 1711 CD2 LEU A 112 1.944 23.092 3.468 1.00 0.00 C ATOM 0 H LEU A 112 5.342 24.681 3.169 1.00 0.00 H new ATOM 0 HA LEU A 112 3.734 26.409 1.497 1.00 0.00 H new ATOM 0 HB2 LEU A 112 3.365 25.049 4.193 1.00 0.00 H new ATOM 0 HB3 LEU A 112 2.124 26.025 3.431 1.00 0.00 H new ATOM 0 HG LEU A 112 1.636 24.463 1.841 1.00 0.00 H new ATOM 0 HD11 LEU A 112 3.081 22.607 1.095 1.00 0.00 H new ATOM 0 HD12 LEU A 112 3.838 24.199 0.846 1.00 0.00 H new ATOM 0 HD13 LEU A 112 4.354 23.171 2.204 1.00 0.00 H new ATOM 0 HD21 LEU A 112 1.579 22.219 2.928 1.00 0.00 H new ATOM 0 HD22 LEU A 112 2.757 22.795 4.131 1.00 0.00 H new ATOM 0 HD23 LEU A 112 1.133 23.519 4.057 1.00 0.00 H new ATOM 1723 N ALA A 113 3.810 28.597 2.593 1.00 0.00 N ATOM 1724 CA ALA A 113 3.945 29.936 3.150 1.00 0.00 C ATOM 1725 C ALA A 113 3.066 30.116 4.383 1.00 0.00 C ATOM 1726 O ALA A 113 2.001 30.730 4.314 1.00 0.00 O ATOM 1727 CB ALA A 113 3.595 30.975 2.097 1.00 0.00 C ATOM 0 H ALA A 113 3.341 28.566 1.688 1.00 0.00 H new ATOM 0 HA ALA A 113 4.982 30.072 3.457 1.00 0.00 H new ATOM 0 HB1 ALA A 113 3.699 31.973 2.522 1.00 0.00 H new ATOM 0 HB2 ALA A 113 4.268 30.871 1.246 1.00 0.00 H new ATOM 0 HB3 ALA A 113 2.567 30.826 1.767 1.00 0.00 H new ATOM 1733 N ILE A 114 3.519 29.582 5.513 1.00 0.00 N ATOM 1734 CA ILE A 114 2.775 29.687 6.764 1.00 0.00 C ATOM 1735 C ILE A 114 1.363 29.125 6.621 1.00 0.00 C ATOM 1736 O ILE A 114 1.019 28.677 5.508 1.00 0.00 O ATOM 1737 CB ILE A 114 2.683 31.150 7.242 1.00 0.00 C ATOM 1738 CG1 ILE A 114 4.062 31.810 7.204 1.00 0.00 C ATOM 1739 CG2 ILE A 114 2.097 31.213 8.645 1.00 0.00 C ATOM 1740 CD1 ILE A 114 4.018 33.312 7.380 1.00 0.00 C ATOM 0 H ILE A 114 4.399 29.072 5.588 1.00 0.00 H new ATOM 0 HA ILE A 114 3.322 29.101 7.502 1.00 0.00 H new ATOM 0 HB ILE A 114 2.022 31.696 6.569 1.00 0.00 H new ATOM 0 HG12 ILE A 114 4.684 31.378 7.988 1.00 0.00 H new ATOM 0 HG13 ILE A 114 4.541 31.578 6.253 1.00 0.00 H new ATOM 0 HG21 ILE A 114 2.038 32.252 8.969 1.00 0.00 H new ATOM 0 HG22 ILE A 114 1.098 30.777 8.642 1.00 0.00 H new ATOM 0 HG23 ILE A 114 2.734 30.655 9.331 1.00 0.00 H new ATOM 0 HD11 ILE A 114 5.031 33.713 7.342 1.00 0.00 H new ATOM 0 HD12 ILE A 114 3.423 33.755 6.581 1.00 0.00 H new ATOM 0 HD13 ILE A 114 3.568 33.552 8.343 1.00 0.00 H new TER 1752 ILE A 114 ATOM 1753 N MET B 1 -17.134 -14.224 -11.764 1.00 0.00 N ATOM 1754 CA MET B 1 -16.749 -13.122 -10.844 1.00 0.00 C ATOM 1755 C MET B 1 -16.285 -13.664 -9.496 1.00 0.00 C ATOM 1756 O MET B 1 -16.549 -13.069 -8.452 1.00 0.00 O ATOM 1757 CB MET B 1 -17.957 -12.202 -10.654 1.00 0.00 C ATOM 1758 CG MET B 1 -19.187 -12.916 -10.117 1.00 0.00 C ATOM 1759 SD MET B 1 -20.502 -11.775 -9.647 1.00 0.00 S ATOM 1760 CE MET B 1 -21.944 -12.817 -9.854 1.00 0.00 C ATOM 0 H1 MET B 1 -17.617 -13.829 -12.596 1.00 0.00 H new ATOM 0 H2 MET B 1 -16.281 -14.736 -12.069 1.00 0.00 H new ATOM 0 H3 MET B 1 -17.774 -14.880 -11.272 1.00 0.00 H new ATOM 0 HA MET B 1 -15.917 -12.568 -11.279 1.00 0.00 H new ATOM 0 HB2 MET B 1 -17.687 -11.398 -9.970 1.00 0.00 H new ATOM 0 HB3 MET B 1 -18.204 -11.739 -11.609 1.00 0.00 H new ATOM 0 HG2 MET B 1 -19.562 -13.605 -10.874 1.00 0.00 H new ATOM 0 HG3 MET B 1 -18.905 -13.516 -9.252 1.00 0.00 H new ATOM 0 HE1 MET B 1 -22.841 -12.252 -9.601 1.00 0.00 H new ATOM 0 HE2 MET B 1 -22.006 -13.151 -10.890 1.00 0.00 H new ATOM 0 HE3 MET B 1 -21.864 -13.684 -9.198 1.00 0.00 H new ATOM 1770 N GLU B 2 -15.591 -14.798 -9.527 1.00 0.00 N ATOM 1771 CA GLU B 2 -15.089 -15.419 -8.307 1.00 0.00 C ATOM 1772 C GLU B 2 -13.594 -15.167 -8.143 1.00 0.00 C ATOM 1773 O GLU B 2 -12.784 -15.641 -8.939 1.00 0.00 O ATOM 1774 CB GLU B 2 -15.364 -16.924 -8.326 1.00 0.00 C ATOM 1775 CG GLU B 2 -14.907 -17.642 -7.068 1.00 0.00 C ATOM 1776 CD GLU B 2 -14.690 -19.126 -7.290 1.00 0.00 C ATOM 1777 OE1 GLU B 2 -15.614 -19.791 -7.804 1.00 0.00 O ATOM 1778 OE2 GLU B 2 -13.596 -19.624 -6.952 1.00 0.00 O ATOM 0 H GLU B 2 -15.364 -15.304 -10.383 1.00 0.00 H new ATOM 0 HA GLU B 2 -15.610 -14.971 -7.461 1.00 0.00 H new ATOM 0 HB2 GLU B 2 -16.433 -17.088 -8.459 1.00 0.00 H new ATOM 0 HB3 GLU B 2 -14.864 -17.365 -9.188 1.00 0.00 H new ATOM 0 HG2 GLU B 2 -13.980 -17.192 -6.714 1.00 0.00 H new ATOM 0 HG3 GLU B 2 -15.650 -17.501 -6.283 1.00 0.00 H new ATOM 1785 N GLY B 3 -13.234 -14.415 -7.107 1.00 0.00 N ATOM 1786 CA GLY B 3 -11.837 -14.112 -6.858 1.00 0.00 C ATOM 1787 C GLY B 3 -11.593 -12.633 -6.635 1.00 0.00 C ATOM 1788 O GLY B 3 -10.649 -12.251 -5.943 1.00 0.00 O ATOM 0 H GLY B 3 -13.886 -14.010 -6.435 1.00 0.00 H new ATOM 0 HA2 GLY B 3 -11.498 -14.668 -5.984 1.00 0.00 H new ATOM 0 HA3 GLY B 3 -11.239 -14.452 -7.703 1.00 0.00 H new ATOM 1792 N VAL B 4 -12.443 -11.798 -7.223 1.00 0.00 N ATOM 1793 CA VAL B 4 -12.314 -10.352 -7.085 1.00 0.00 C ATOM 1794 C VAL B 4 -12.709 -9.899 -5.683 1.00 0.00 C ATOM 1795 O VAL B 4 -13.852 -10.080 -5.262 1.00 0.00 O ATOM 1796 CB VAL B 4 -13.181 -9.606 -8.121 1.00 0.00 C ATOM 1797 CG1 VAL B 4 -12.915 -8.109 -8.068 1.00 0.00 C ATOM 1798 CG2 VAL B 4 -12.930 -10.148 -9.523 1.00 0.00 C ATOM 0 H VAL B 4 -13.229 -12.098 -7.800 1.00 0.00 H new ATOM 0 HA VAL B 4 -11.266 -10.109 -7.261 1.00 0.00 H new ATOM 0 HB VAL B 4 -14.229 -9.774 -7.872 1.00 0.00 H new ATOM 0 HG11 VAL B 4 -13.537 -7.603 -8.806 1.00 0.00 H new ATOM 0 HG12 VAL B 4 -13.153 -7.732 -7.073 1.00 0.00 H new ATOM 0 HG13 VAL B 4 -11.864 -7.918 -8.286 1.00 0.00 H new ATOM 0 HG21 VAL B 4 -13.551 -9.609 -10.238 1.00 0.00 H new ATOM 0 HG22 VAL B 4 -11.880 -10.015 -9.782 1.00 0.00 H new ATOM 0 HG23 VAL B 4 -13.180 -11.209 -9.553 1.00 0.00 H new ATOM 1808 N ASP B 5 -11.757 -9.312 -4.964 1.00 0.00 N ATOM 1809 CA ASP B 5 -12.007 -8.835 -3.609 1.00 0.00 C ATOM 1810 C ASP B 5 -12.009 -7.303 -3.561 1.00 0.00 C ATOM 1811 O ASP B 5 -10.947 -6.683 -3.554 1.00 0.00 O ATOM 1812 CB ASP B 5 -10.945 -9.383 -2.654 1.00 0.00 C ATOM 1813 CG ASP B 5 -11.520 -9.751 -1.300 1.00 0.00 C ATOM 1814 OD1 ASP B 5 -11.974 -8.835 -0.581 1.00 0.00 O ATOM 1815 OD2 ASP B 5 -11.518 -10.952 -0.960 1.00 0.00 O ATOM 0 H ASP B 5 -10.806 -9.156 -5.297 1.00 0.00 H new ATOM 0 HA ASP B 5 -12.989 -9.192 -3.298 1.00 0.00 H new ATOM 0 HB2 ASP B 5 -10.479 -10.262 -3.099 1.00 0.00 H new ATOM 0 HB3 ASP B 5 -10.160 -8.638 -2.522 1.00 0.00 H new ATOM 1820 N PRO B 6 -13.199 -6.666 -3.534 1.00 0.00 N ATOM 1821 CA PRO B 6 -13.306 -5.202 -3.493 1.00 0.00 C ATOM 1822 C PRO B 6 -12.768 -4.614 -2.191 1.00 0.00 C ATOM 1823 O PRO B 6 -13.237 -4.954 -1.105 1.00 0.00 O ATOM 1824 CB PRO B 6 -14.814 -4.934 -3.614 1.00 0.00 C ATOM 1825 CG PRO B 6 -15.407 -6.216 -4.093 1.00 0.00 C ATOM 1826 CD PRO B 6 -14.527 -7.302 -3.550 1.00 0.00 C ATOM 0 HA PRO B 6 -12.716 -4.738 -4.284 1.00 0.00 H new ATOM 0 HB2 PRO B 6 -15.239 -4.639 -2.655 1.00 0.00 H new ATOM 0 HB3 PRO B 6 -15.014 -4.123 -4.314 1.00 0.00 H new ATOM 0 HG2 PRO B 6 -16.432 -6.329 -3.739 1.00 0.00 H new ATOM 0 HG3 PRO B 6 -15.441 -6.248 -5.182 1.00 0.00 H new ATOM 0 HD2 PRO B 6 -14.838 -7.615 -2.553 1.00 0.00 H new ATOM 0 HD3 PRO B 6 -14.543 -8.190 -4.182 1.00 0.00 H new ATOM 1834 N ALA B 7 -11.780 -3.727 -2.312 1.00 0.00 N ATOM 1835 CA ALA B 7 -11.165 -3.077 -1.151 1.00 0.00 C ATOM 1836 C ALA B 7 -10.348 -4.065 -0.331 1.00 0.00 C ATOM 1837 O ALA B 7 -9.127 -3.947 -0.234 1.00 0.00 O ATOM 1838 CB ALA B 7 -12.224 -2.410 -0.275 1.00 0.00 C ATOM 0 H ALA B 7 -11.385 -3.440 -3.208 1.00 0.00 H new ATOM 0 HA ALA B 7 -10.490 -2.308 -1.526 1.00 0.00 H new ATOM 0 HB1 ALA B 7 -11.743 -1.935 0.580 1.00 0.00 H new ATOM 0 HB2 ALA B 7 -12.756 -1.657 -0.857 1.00 0.00 H new ATOM 0 HB3 ALA B 7 -12.930 -3.162 0.078 1.00 0.00 H new ATOM 1844 N VAL B 8 -11.039 -5.033 0.260 1.00 0.00 N ATOM 1845 CA VAL B 8 -10.406 -6.062 1.095 1.00 0.00 C ATOM 1846 C VAL B 8 -9.886 -5.455 2.387 1.00 0.00 C ATOM 1847 O VAL B 8 -10.357 -5.773 3.479 1.00 0.00 O ATOM 1848 CB VAL B 8 -9.212 -6.786 0.408 1.00 0.00 C ATOM 1849 CG1 VAL B 8 -9.161 -8.242 0.839 1.00 0.00 C ATOM 1850 CG2 VAL B 8 -9.268 -6.689 -1.105 1.00 0.00 C ATOM 0 H VAL B 8 -12.051 -5.132 0.178 1.00 0.00 H new ATOM 0 HA VAL B 8 -11.190 -6.796 1.280 1.00 0.00 H new ATOM 0 HB VAL B 8 -8.302 -6.279 0.729 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -8.321 -8.737 0.351 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -9.036 -8.297 1.920 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -10.089 -8.738 0.555 1.00 0.00 H new ATOM 0 HG21 VAL B 8 -8.413 -7.210 -1.535 1.00 0.00 H new ATOM 0 HG22 VAL B 8 -10.190 -7.146 -1.465 1.00 0.00 H new ATOM 0 HG23 VAL B 8 -9.242 -5.641 -1.404 1.00 0.00 H new ATOM 1860 N GLU B 9 -8.892 -4.596 2.239 1.00 0.00 N ATOM 1861 CA GLU B 9 -8.259 -3.942 3.365 1.00 0.00 C ATOM 1862 C GLU B 9 -8.527 -2.440 3.354 1.00 0.00 C ATOM 1863 O GLU B 9 -7.785 -1.672 2.744 1.00 0.00 O ATOM 1864 CB GLU B 9 -6.760 -4.227 3.312 1.00 0.00 C ATOM 1865 CG GLU B 9 -6.311 -5.311 4.277 1.00 0.00 C ATOM 1866 CD GLU B 9 -5.590 -4.753 5.488 1.00 0.00 C ATOM 1867 OE1 GLU B 9 -4.415 -4.353 5.348 1.00 0.00 O ATOM 1868 OE2 GLU B 9 -6.202 -4.713 6.576 1.00 0.00 O ATOM 0 H GLU B 9 -8.503 -4.334 1.333 1.00 0.00 H new ATOM 0 HA GLU B 9 -8.677 -4.334 4.293 1.00 0.00 H new ATOM 0 HB2 GLU B 9 -6.491 -4.521 2.298 1.00 0.00 H new ATOM 0 HB3 GLU B 9 -6.216 -3.308 3.532 1.00 0.00 H new ATOM 0 HG2 GLU B 9 -7.180 -5.881 4.607 1.00 0.00 H new ATOM 0 HG3 GLU B 9 -5.653 -6.006 3.756 1.00 0.00 H new ATOM 1875 N GLU B 10 -9.593 -2.029 4.033 1.00 0.00 N ATOM 1876 CA GLU B 10 -9.958 -0.618 4.102 1.00 0.00 C ATOM 1877 C GLU B 10 -9.031 0.137 5.048 1.00 0.00 C ATOM 1878 O GLU B 10 -8.919 -0.200 6.227 1.00 0.00 O ATOM 1879 CB GLU B 10 -11.410 -0.467 4.563 1.00 0.00 C ATOM 1880 CG GLU B 10 -12.139 0.693 3.906 1.00 0.00 C ATOM 1881 CD GLU B 10 -12.566 0.384 2.483 1.00 0.00 C ATOM 1882 OE1 GLU B 10 -13.009 -0.756 2.232 1.00 0.00 O ATOM 1883 OE2 GLU B 10 -12.458 1.282 1.623 1.00 0.00 O ATOM 0 H GLU B 10 -10.219 -2.652 4.543 1.00 0.00 H new ATOM 0 HA GLU B 10 -9.855 -0.192 3.104 1.00 0.00 H new ATOM 0 HB2 GLU B 10 -11.948 -1.391 4.350 1.00 0.00 H new ATOM 0 HB3 GLU B 10 -11.427 -0.330 5.644 1.00 0.00 H new ATOM 0 HG2 GLU B 10 -13.018 0.947 4.498 1.00 0.00 H new ATOM 0 HG3 GLU B 10 -11.492 1.570 3.905 1.00 0.00 H new ATOM 1890 N ALA B 11 -8.369 1.162 4.523 1.00 0.00 N ATOM 1891 CA ALA B 11 -7.451 1.969 5.319 1.00 0.00 C ATOM 1892 C ALA B 11 -8.156 3.190 5.896 1.00 0.00 C ATOM 1893 O ALA B 11 -9.230 3.575 5.432 1.00 0.00 O ATOM 1894 CB ALA B 11 -6.256 2.392 4.478 1.00 0.00 C ATOM 0 H ALA B 11 -8.451 1.454 3.549 1.00 0.00 H new ATOM 0 HA ALA B 11 -7.097 1.361 6.151 1.00 0.00 H new ATOM 0 HB1 ALA B 11 -5.579 2.994 5.084 1.00 0.00 H new ATOM 0 HB2 ALA B 11 -5.732 1.506 4.119 1.00 0.00 H new ATOM 0 HB3 ALA B 11 -6.600 2.980 3.627 1.00 0.00 H new ATOM 1900 N ALA B 12 -7.546 3.794 6.912 1.00 0.00 N ATOM 1901 CA ALA B 12 -8.111 4.974 7.560 1.00 0.00 C ATOM 1902 C ALA B 12 -9.449 4.653 8.219 1.00 0.00 C ATOM 1903 O ALA B 12 -10.364 4.140 7.574 1.00 0.00 O ATOM 1904 CB ALA B 12 -8.272 6.109 6.557 1.00 0.00 C ATOM 0 H ALA B 12 -6.657 3.484 7.306 1.00 0.00 H new ATOM 0 HA ALA B 12 -7.418 5.292 8.339 1.00 0.00 H new ATOM 0 HB1 ALA B 12 -8.694 6.980 7.058 1.00 0.00 H new ATOM 0 HB2 ALA B 12 -7.299 6.367 6.140 1.00 0.00 H new ATOM 0 HB3 ALA B 12 -8.938 5.793 5.754 1.00 0.00 H new ATOM 1910 N PHE B 13 -9.553 4.958 9.507 1.00 0.00 N ATOM 1911 CA PHE B 13 -10.778 4.703 10.259 1.00 0.00 C ATOM 1912 C PHE B 13 -11.475 6.009 10.639 1.00 0.00 C ATOM 1913 O PHE B 13 -12.694 6.042 10.811 1.00 0.00 O ATOM 1914 CB PHE B 13 -10.466 3.895 11.520 1.00 0.00 C ATOM 1915 CG PHE B 13 -11.690 3.373 12.216 1.00 0.00 C ATOM 1916 CD1 PHE B 13 -12.390 2.294 11.700 1.00 0.00 C ATOM 1917 CD2 PHE B 13 -12.142 3.961 13.388 1.00 0.00 C ATOM 1918 CE1 PHE B 13 -13.517 1.811 12.338 1.00 0.00 C ATOM 1919 CE2 PHE B 13 -13.268 3.482 14.030 1.00 0.00 C ATOM 1920 CZ PHE B 13 -13.956 2.406 13.504 1.00 0.00 C ATOM 0 H PHE B 13 -8.804 5.383 10.054 1.00 0.00 H new ATOM 0 HA PHE B 13 -11.450 4.129 9.621 1.00 0.00 H new ATOM 0 HB2 PHE B 13 -9.823 3.056 11.254 1.00 0.00 H new ATOM 0 HB3 PHE B 13 -9.903 4.521 12.213 1.00 0.00 H new ATOM 0 HD1 PHE B 13 -12.051 1.825 10.788 1.00 0.00 H new ATOM 0 HD2 PHE B 13 -11.608 4.803 13.804 1.00 0.00 H new ATOM 0 HE1 PHE B 13 -14.053 0.969 11.925 1.00 0.00 H new ATOM 0 HE2 PHE B 13 -13.610 3.948 14.942 1.00 0.00 H new ATOM 0 HZ PHE B 13 -14.836 2.030 14.004 1.00 0.00 H new ATOM 1930 N VAL B 14 -10.698 7.080 10.771 1.00 0.00 N ATOM 1931 CA VAL B 14 -11.247 8.381 11.133 1.00 0.00 C ATOM 1932 C VAL B 14 -11.730 9.136 9.899 1.00 0.00 C ATOM 1933 O VAL B 14 -11.314 8.845 8.778 1.00 0.00 O ATOM 1934 CB VAL B 14 -10.207 9.241 11.876 1.00 0.00 C ATOM 1935 CG1 VAL B 14 -10.850 10.508 12.422 1.00 0.00 C ATOM 1936 CG2 VAL B 14 -9.554 8.443 12.993 1.00 0.00 C ATOM 0 H VAL B 14 -9.687 7.072 10.633 1.00 0.00 H new ATOM 0 HA VAL B 14 -12.093 8.196 11.795 1.00 0.00 H new ATOM 0 HB VAL B 14 -9.432 9.532 11.167 1.00 0.00 H new ATOM 0 HG11 VAL B 14 -10.099 11.102 12.943 1.00 0.00 H new ATOM 0 HG12 VAL B 14 -11.265 11.089 11.599 1.00 0.00 H new ATOM 0 HG13 VAL B 14 -11.647 10.241 13.116 1.00 0.00 H new ATOM 0 HG21 VAL B 14 -8.822 9.067 13.506 1.00 0.00 H new ATOM 0 HG22 VAL B 14 -10.316 8.119 13.702 1.00 0.00 H new ATOM 0 HG23 VAL B 14 -9.055 7.570 12.573 1.00 0.00 H new ATOM 1946 N ALA B 15 -12.612 10.108 10.113 1.00 0.00 N ATOM 1947 CA ALA B 15 -13.152 10.906 9.018 1.00 0.00 C ATOM 1948 C ALA B 15 -13.927 10.033 8.033 1.00 0.00 C ATOM 1949 O ALA B 15 -13.670 10.054 6.828 1.00 0.00 O ATOM 1950 CB ALA B 15 -12.031 11.653 8.307 1.00 0.00 C ATOM 0 H ALA B 15 -12.968 10.362 11.035 1.00 0.00 H new ATOM 0 HA ALA B 15 -13.846 11.635 9.437 1.00 0.00 H new ATOM 0 HB1 ALA B 15 -12.448 12.245 7.492 1.00 0.00 H new ATOM 0 HB2 ALA B 15 -11.528 12.313 9.014 1.00 0.00 H new ATOM 0 HB3 ALA B 15 -11.314 10.937 7.906 1.00 0.00 H new ATOM 1956 N ASP B 16 -14.884 9.269 8.553 1.00 0.00 N ATOM 1957 CA ASP B 16 -15.701 8.393 7.719 1.00 0.00 C ATOM 1958 C ASP B 16 -16.452 9.198 6.664 1.00 0.00 C ATOM 1959 O ASP B 16 -16.690 8.718 5.552 1.00 0.00 O ATOM 1960 CB ASP B 16 -16.692 7.612 8.583 1.00 0.00 C ATOM 1961 CG ASP B 16 -17.005 6.243 8.012 1.00 0.00 C ATOM 1962 OD1 ASP B 16 -17.697 6.176 6.975 1.00 0.00 O ATOM 1963 OD2 ASP B 16 -16.556 5.238 8.602 1.00 0.00 O ATOM 0 H ASP B 16 -15.112 9.239 9.547 1.00 0.00 H new ATOM 0 HA ASP B 16 -15.040 7.690 7.213 1.00 0.00 H new ATOM 0 HB2 ASP B 16 -16.283 7.499 9.587 1.00 0.00 H new ATOM 0 HB3 ASP B 16 -17.616 8.183 8.677 1.00 0.00 H new ATOM 1968 N ASP B 17 -16.815 10.429 7.018 1.00 0.00 N ATOM 1969 CA ASP B 17 -17.536 11.312 6.105 1.00 0.00 C ATOM 1970 C ASP B 17 -16.759 11.495 4.807 1.00 0.00 C ATOM 1971 O ASP B 17 -17.330 11.461 3.723 1.00 0.00 O ATOM 1972 CB ASP B 17 -17.783 12.670 6.763 1.00 0.00 C ATOM 1973 CG ASP B 17 -19.004 12.663 7.662 1.00 0.00 C ATOM 1974 OD1 ASP B 17 -20.130 12.558 7.133 1.00 0.00 O ATOM 1975 OD2 ASP B 17 -18.833 12.761 8.895 1.00 0.00 O ATOM 0 H ASP B 17 -16.621 10.838 7.932 1.00 0.00 H new ATOM 0 HA ASP B 17 -18.496 10.852 5.873 1.00 0.00 H new ATOM 0 HB2 ASP B 17 -16.907 12.953 7.347 1.00 0.00 H new ATOM 0 HB3 ASP B 17 -17.909 13.428 5.990 1.00 0.00 H new ATOM 1980 N VAL B 18 -15.451 11.681 4.929 1.00 0.00 N ATOM 1981 CA VAL B 18 -14.590 11.856 3.764 1.00 0.00 C ATOM 1982 C VAL B 18 -14.231 10.509 3.150 1.00 0.00 C ATOM 1983 O VAL B 18 -14.045 10.394 1.939 1.00 0.00 O ATOM 1984 CB VAL B 18 -13.293 12.598 4.131 1.00 0.00 C ATOM 1985 CG1 VAL B 18 -12.521 12.978 2.877 1.00 0.00 C ATOM 1986 CG2 VAL B 18 -13.601 13.828 4.970 1.00 0.00 C ATOM 0 H VAL B 18 -14.962 11.715 5.823 1.00 0.00 H new ATOM 0 HA VAL B 18 -15.147 12.451 3.041 1.00 0.00 H new ATOM 0 HB VAL B 18 -12.669 11.929 4.724 1.00 0.00 H new ATOM 0 HG11 VAL B 18 -11.607 13.502 3.157 1.00 0.00 H new ATOM 0 HG12 VAL B 18 -12.266 12.077 2.319 1.00 0.00 H new ATOM 0 HG13 VAL B 18 -13.136 13.628 2.254 1.00 0.00 H new ATOM 0 HG21 VAL B 18 -12.672 14.340 5.220 1.00 0.00 H new ATOM 0 HG22 VAL B 18 -14.246 14.501 4.405 1.00 0.00 H new ATOM 0 HG23 VAL B 18 -14.107 13.526 5.887 1.00 0.00 H new ATOM 1996 N SER B 19 -14.130 9.493 4.001 1.00 0.00 N ATOM 1997 CA SER B 19 -13.785 8.149 3.555 1.00 0.00 C ATOM 1998 C SER B 19 -14.770 7.636 2.508 1.00 0.00 C ATOM 1999 O SER B 19 -14.367 7.055 1.502 1.00 0.00 O ATOM 2000 CB SER B 19 -13.748 7.191 4.746 1.00 0.00 C ATOM 2001 OG SER B 19 -13.242 5.923 4.366 1.00 0.00 O ATOM 0 H SER B 19 -14.283 9.576 5.006 1.00 0.00 H new ATOM 0 HA SER B 19 -12.798 8.196 3.096 1.00 0.00 H new ATOM 0 HB2 SER B 19 -13.126 7.612 5.536 1.00 0.00 H new ATOM 0 HB3 SER B 19 -14.751 7.077 5.156 1.00 0.00 H new ATOM 0 HG SER B 19 -13.227 5.330 5.146 1.00 0.00 H new ATOM 2007 N ASN B 20 -16.062 7.844 2.748 1.00 0.00 N ATOM 2008 CA ASN B 20 -17.085 7.382 1.812 1.00 0.00 C ATOM 2009 C ASN B 20 -17.011 8.154 0.490 1.00 0.00 C ATOM 2010 O ASN B 20 -17.228 7.587 -0.576 1.00 0.00 O ATOM 2011 CB ASN B 20 -18.489 7.455 2.465 1.00 0.00 C ATOM 2012 CG ASN B 20 -19.322 8.672 2.073 1.00 0.00 C ATOM 2013 OD1 ASN B 20 -20.400 8.538 1.494 1.00 0.00 O ATOM 2014 ND2 ASN B 20 -18.822 9.859 2.386 1.00 0.00 N ATOM 0 H ASN B 20 -16.423 8.324 3.572 1.00 0.00 H new ATOM 0 HA ASN B 20 -16.895 6.336 1.572 1.00 0.00 H new ATOM 0 HB2 ASN B 20 -19.043 6.554 2.201 1.00 0.00 H new ATOM 0 HB3 ASN B 20 -18.370 7.449 3.548 1.00 0.00 H new ATOM 0 HD21 ASN B 20 -19.335 10.708 2.147 1.00 0.00 H new ATOM 0 HD22 ASN B 20 -17.924 9.924 2.866 1.00 0.00 H new ATOM 2021 N ILE B 21 -16.700 9.445 0.575 1.00 0.00 N ATOM 2022 CA ILE B 21 -16.598 10.295 -0.612 1.00 0.00 C ATOM 2023 C ILE B 21 -15.592 9.727 -1.613 1.00 0.00 C ATOM 2024 O ILE B 21 -15.900 9.583 -2.797 1.00 0.00 O ATOM 2025 CB ILE B 21 -16.179 11.741 -0.222 1.00 0.00 C ATOM 2026 CG1 ILE B 21 -17.237 12.376 0.674 1.00 0.00 C ATOM 2027 CG2 ILE B 21 -15.948 12.618 -1.451 1.00 0.00 C ATOM 2028 CD1 ILE B 21 -16.863 13.758 1.160 1.00 0.00 C ATOM 0 H ILE B 21 -16.514 9.928 1.454 1.00 0.00 H new ATOM 0 HA ILE B 21 -17.583 10.321 -1.079 1.00 0.00 H new ATOM 0 HB ILE B 21 -15.237 11.670 0.321 1.00 0.00 H new ATOM 0 HG12 ILE B 21 -18.178 12.434 0.127 1.00 0.00 H new ATOM 0 HG13 ILE B 21 -17.408 11.730 1.535 1.00 0.00 H new ATOM 0 HG21 ILE B 21 -15.657 13.619 -1.134 1.00 0.00 H new ATOM 0 HG22 ILE B 21 -15.155 12.186 -2.062 1.00 0.00 H new ATOM 0 HG23 ILE B 21 -16.866 12.675 -2.035 1.00 0.00 H new ATOM 0 HD11 ILE B 21 -17.660 14.150 1.792 1.00 0.00 H new ATOM 0 HD12 ILE B 21 -15.938 13.704 1.734 1.00 0.00 H new ATOM 0 HD13 ILE B 21 -16.720 14.418 0.305 1.00 0.00 H new ATOM 2040 N ILE B 22 -14.388 9.430 -1.144 1.00 0.00 N ATOM 2041 CA ILE B 22 -13.351 8.911 -2.026 1.00 0.00 C ATOM 2042 C ILE B 22 -13.730 7.550 -2.617 1.00 0.00 C ATOM 2043 O ILE B 22 -13.616 7.347 -3.820 1.00 0.00 O ATOM 2044 CB ILE B 22 -11.955 8.853 -1.334 1.00 0.00 C ATOM 2045 CG1 ILE B 22 -11.779 7.610 -0.445 1.00 0.00 C ATOM 2046 CG2 ILE B 22 -11.717 10.117 -0.516 1.00 0.00 C ATOM 2047 CD1 ILE B 22 -11.358 6.374 -1.212 1.00 0.00 C ATOM 0 H ILE B 22 -14.107 9.538 -0.169 1.00 0.00 H new ATOM 0 HA ILE B 22 -13.272 9.619 -2.851 1.00 0.00 H new ATOM 0 HB ILE B 22 -11.214 8.784 -2.130 1.00 0.00 H new ATOM 0 HG12 ILE B 22 -11.034 7.824 0.321 1.00 0.00 H new ATOM 0 HG13 ILE B 22 -12.717 7.406 0.071 1.00 0.00 H new ATOM 0 HG21 ILE B 22 -10.739 10.063 -0.039 1.00 0.00 H new ATOM 0 HG22 ILE B 22 -11.753 10.987 -1.172 1.00 0.00 H new ATOM 0 HG23 ILE B 22 -12.489 10.207 0.248 1.00 0.00 H new ATOM 0 HD11 ILE B 22 -11.253 5.536 -0.523 1.00 0.00 H new ATOM 0 HD12 ILE B 22 -12.114 6.135 -1.960 1.00 0.00 H new ATOM 0 HD13 ILE B 22 -10.404 6.560 -1.706 1.00 0.00 H new ATOM 2059 N LYS B 23 -14.190 6.622 -1.779 1.00 0.00 N ATOM 2060 CA LYS B 23 -14.570 5.302 -2.257 1.00 0.00 C ATOM 2061 C LYS B 23 -15.659 5.401 -3.298 1.00 0.00 C ATOM 2062 O LYS B 23 -15.521 4.908 -4.418 1.00 0.00 O ATOM 2063 CB LYS B 23 -15.046 4.451 -1.099 1.00 0.00 C ATOM 2064 CG LYS B 23 -13.941 4.147 -0.117 1.00 0.00 C ATOM 2065 CD LYS B 23 -14.451 3.433 1.125 1.00 0.00 C ATOM 2066 CE LYS B 23 -15.650 4.124 1.764 1.00 0.00 C ATOM 2067 NZ LYS B 23 -16.084 3.438 3.012 1.00 0.00 N ATOM 0 H LYS B 23 -14.306 6.762 -0.775 1.00 0.00 H new ATOM 0 HA LYS B 23 -13.696 4.838 -2.713 1.00 0.00 H new ATOM 0 HB2 LYS B 23 -15.856 4.965 -0.582 1.00 0.00 H new ATOM 0 HB3 LYS B 23 -15.455 3.516 -1.482 1.00 0.00 H new ATOM 0 HG2 LYS B 23 -13.186 3.530 -0.603 1.00 0.00 H new ATOM 0 HG3 LYS B 23 -13.453 5.076 0.176 1.00 0.00 H new ATOM 0 HD2 LYS B 23 -14.726 2.412 0.862 1.00 0.00 H new ATOM 0 HD3 LYS B 23 -13.645 3.368 1.856 1.00 0.00 H new ATOM 0 HE2 LYS B 23 -15.395 5.160 1.988 1.00 0.00 H new ATOM 0 HE3 LYS B 23 -16.477 4.146 1.055 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 -16.901 3.938 3.417 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 -16.351 2.457 2.794 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 -15.303 3.440 3.699 1.00 0.00 H new ATOM 2081 N GLU B 24 -16.733 6.075 -2.923 1.00 0.00 N ATOM 2082 CA GLU B 24 -17.861 6.291 -3.829 1.00 0.00 C ATOM 2083 C GLU B 24 -17.363 6.852 -5.161 1.00 0.00 C ATOM 2084 O GLU B 24 -17.899 6.540 -6.224 1.00 0.00 O ATOM 2085 CB GLU B 24 -18.878 7.251 -3.196 1.00 0.00 C ATOM 2086 CG GLU B 24 -20.086 6.551 -2.596 1.00 0.00 C ATOM 2087 CD GLU B 24 -19.810 5.997 -1.212 1.00 0.00 C ATOM 2088 OE1 GLU B 24 -19.325 4.850 -1.119 1.00 0.00 O ATOM 2089 OE2 GLU B 24 -20.080 6.710 -0.222 1.00 0.00 O ATOM 0 H GLU B 24 -16.853 6.485 -1.997 1.00 0.00 H new ATOM 0 HA GLU B 24 -18.353 5.335 -4.010 1.00 0.00 H new ATOM 0 HB2 GLU B 24 -18.382 7.831 -2.418 1.00 0.00 H new ATOM 0 HB3 GLU B 24 -19.217 7.958 -3.953 1.00 0.00 H new ATOM 0 HG2 GLU B 24 -20.919 7.252 -2.543 1.00 0.00 H new ATOM 0 HG3 GLU B 24 -20.395 5.739 -3.254 1.00 0.00 H new ATOM 2096 N SER B 25 -16.322 7.675 -5.080 1.00 0.00 N ATOM 2097 CA SER B 25 -15.730 8.278 -6.264 1.00 0.00 C ATOM 2098 C SER B 25 -14.948 7.250 -7.075 1.00 0.00 C ATOM 2099 O SER B 25 -15.109 7.190 -8.284 1.00 0.00 O ATOM 2100 CB SER B 25 -14.818 9.441 -5.870 1.00 0.00 C ATOM 2101 OG SER B 25 -14.452 10.211 -7.003 1.00 0.00 O ATOM 0 H SER B 25 -15.872 7.939 -4.203 1.00 0.00 H new ATOM 0 HA SER B 25 -16.540 8.657 -6.887 1.00 0.00 H new ATOM 0 HB2 SER B 25 -15.326 10.076 -5.144 1.00 0.00 H new ATOM 0 HB3 SER B 25 -13.922 9.056 -5.384 1.00 0.00 H new ATOM 0 HG SER B 25 -13.649 9.828 -7.413 1.00 0.00 H new ATOM 2107 N ILE B 26 -14.113 6.429 -6.421 1.00 0.00 N ATOM 2108 CA ILE B 26 -13.341 5.408 -7.148 1.00 0.00 C ATOM 2109 C ILE B 26 -14.304 4.482 -7.875 1.00 0.00 C ATOM 2110 O ILE B 26 -14.081 4.098 -9.020 1.00 0.00 O ATOM 2111 CB ILE B 26 -12.395 4.594 -6.200 1.00 0.00 C ATOM 2112 CG1 ILE B 26 -11.044 5.297 -6.082 1.00 0.00 C ATOM 2113 CG2 ILE B 26 -12.170 3.152 -6.673 1.00 0.00 C ATOM 2114 CD1 ILE B 26 -10.975 6.289 -4.950 1.00 0.00 C ATOM 0 H ILE B 26 -13.956 6.449 -5.413 1.00 0.00 H new ATOM 0 HA ILE B 26 -12.698 5.913 -7.869 1.00 0.00 H new ATOM 0 HB ILE B 26 -12.891 4.548 -5.230 1.00 0.00 H new ATOM 0 HG12 ILE B 26 -10.265 4.547 -5.944 1.00 0.00 H new ATOM 0 HG13 ILE B 26 -10.829 5.812 -7.018 1.00 0.00 H new ATOM 0 HG21 ILE B 26 -11.507 2.640 -5.976 1.00 0.00 H new ATOM 0 HG22 ILE B 26 -13.126 2.630 -6.715 1.00 0.00 H new ATOM 0 HG23 ILE B 26 -11.717 3.161 -7.664 1.00 0.00 H new ATOM 0 HD11 ILE B 26 -9.987 6.748 -4.928 1.00 0.00 H new ATOM 0 HD12 ILE B 26 -11.731 7.061 -5.096 1.00 0.00 H new ATOM 0 HD13 ILE B 26 -11.158 5.777 -4.005 1.00 0.00 H new ATOM 2126 N ASP B 27 -15.391 4.148 -7.203 1.00 0.00 N ATOM 2127 CA ASP B 27 -16.407 3.288 -7.780 1.00 0.00 C ATOM 2128 C ASP B 27 -16.813 3.819 -9.159 1.00 0.00 C ATOM 2129 O ASP B 27 -17.010 3.061 -10.099 1.00 0.00 O ATOM 2130 CB ASP B 27 -17.614 3.240 -6.834 1.00 0.00 C ATOM 2131 CG ASP B 27 -18.788 2.463 -7.404 1.00 0.00 C ATOM 2132 OD1 ASP B 27 -19.404 2.948 -8.376 1.00 0.00 O ATOM 2133 OD2 ASP B 27 -19.089 1.372 -6.877 1.00 0.00 O ATOM 0 H ASP B 27 -15.593 4.461 -6.253 1.00 0.00 H new ATOM 0 HA ASP B 27 -16.016 2.278 -7.907 1.00 0.00 H new ATOM 0 HB2 ASP B 27 -17.310 2.787 -5.890 1.00 0.00 H new ATOM 0 HB3 ASP B 27 -17.934 4.258 -6.611 1.00 0.00 H new ATOM 2138 N ALA B 28 -16.900 5.136 -9.262 1.00 0.00 N ATOM 2139 CA ALA B 28 -17.263 5.791 -10.514 1.00 0.00 C ATOM 2140 C ALA B 28 -16.035 6.105 -11.371 1.00 0.00 C ATOM 2141 O ALA B 28 -16.027 5.878 -12.580 1.00 0.00 O ATOM 2142 CB ALA B 28 -18.025 7.072 -10.207 1.00 0.00 C ATOM 0 H ALA B 28 -16.723 5.778 -8.489 1.00 0.00 H new ATOM 0 HA ALA B 28 -17.892 5.108 -11.085 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -18.298 7.565 -11.140 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -18.928 6.833 -9.645 1.00 0.00 H new ATOM 0 HB3 ALA B 28 -17.395 7.737 -9.616 1.00 0.00 H new ATOM 2148 N VAL B 29 -15.005 6.632 -10.717 1.00 0.00 N ATOM 2149 CA VAL B 29 -13.758 7.012 -11.357 1.00 0.00 C ATOM 2150 C VAL B 29 -13.013 5.777 -11.897 1.00 0.00 C ATOM 2151 O VAL B 29 -12.062 5.910 -12.662 1.00 0.00 O ATOM 2152 CB VAL B 29 -12.924 7.872 -10.337 1.00 0.00 C ATOM 2153 CG1 VAL B 29 -11.411 7.736 -10.434 1.00 0.00 C ATOM 2154 CG2 VAL B 29 -13.297 9.345 -10.461 1.00 0.00 C ATOM 0 H VAL B 29 -15.017 6.808 -9.712 1.00 0.00 H new ATOM 0 HA VAL B 29 -13.943 7.628 -12.237 1.00 0.00 H new ATOM 0 HB VAL B 29 -13.193 7.466 -9.362 1.00 0.00 H new ATOM 0 HG11 VAL B 29 -10.940 8.372 -9.685 1.00 0.00 H new ATOM 0 HG12 VAL B 29 -11.127 6.698 -10.259 1.00 0.00 H new ATOM 0 HG13 VAL B 29 -11.081 8.040 -11.428 1.00 0.00 H new ATOM 0 HG21 VAL B 29 -12.713 9.929 -9.750 1.00 0.00 H new ATOM 0 HG22 VAL B 29 -13.086 9.690 -11.473 1.00 0.00 H new ATOM 0 HG23 VAL B 29 -14.359 9.471 -10.248 1.00 0.00 H new ATOM 2164 N LEU B 30 -13.467 4.570 -11.530 1.00 0.00 N ATOM 2165 CA LEU B 30 -12.836 3.348 -12.020 1.00 0.00 C ATOM 2166 C LEU B 30 -13.833 2.424 -12.731 1.00 0.00 C ATOM 2167 O LEU B 30 -13.451 1.706 -13.656 1.00 0.00 O ATOM 2168 CB LEU B 30 -12.145 2.600 -10.878 1.00 0.00 C ATOM 2169 CG LEU B 30 -10.806 3.199 -10.445 1.00 0.00 C ATOM 2170 CD1 LEU B 30 -9.870 3.322 -11.627 1.00 0.00 C ATOM 2171 CD2 LEU B 30 -11.006 4.566 -9.835 1.00 0.00 C ATOM 0 H LEU B 30 -14.258 4.420 -10.904 1.00 0.00 H new ATOM 0 HA LEU B 30 -12.088 3.649 -12.754 1.00 0.00 H new ATOM 0 HB2 LEU B 30 -12.814 2.578 -10.018 1.00 0.00 H new ATOM 0 HB3 LEU B 30 -11.984 1.566 -11.183 1.00 0.00 H new ATOM 0 HG LEU B 30 -10.369 2.531 -9.703 1.00 0.00 H new ATOM 0 HD11 LEU B 30 -8.923 3.750 -11.298 1.00 0.00 H new ATOM 0 HD12 LEU B 30 -9.693 2.335 -12.055 1.00 0.00 H new ATOM 0 HD13 LEU B 30 -10.319 3.969 -12.381 1.00 0.00 H new ATOM 0 HD21 LEU B 30 -10.041 4.975 -9.534 1.00 0.00 H new ATOM 0 HD22 LEU B 30 -11.467 5.228 -10.568 1.00 0.00 H new ATOM 0 HD23 LEU B 30 -11.654 4.484 -8.962 1.00 0.00 H new ATOM 2183 N GLN B 31 -15.103 2.420 -12.308 1.00 0.00 N ATOM 2184 CA GLN B 31 -16.095 1.548 -12.942 1.00 0.00 C ATOM 2185 C GLN B 31 -16.723 2.182 -14.183 1.00 0.00 C ATOM 2186 O GLN B 31 -17.272 1.472 -15.025 1.00 0.00 O ATOM 2187 CB GLN B 31 -17.195 1.166 -11.957 1.00 0.00 C ATOM 2188 CG GLN B 31 -17.994 -0.034 -12.392 1.00 0.00 C ATOM 2189 CD GLN B 31 -18.964 -0.511 -11.330 1.00 0.00 C ATOM 2190 OE1 GLN B 31 -18.558 -0.943 -10.250 1.00 0.00 O ATOM 2191 NE2 GLN B 31 -20.255 -0.434 -11.630 1.00 0.00 N ATOM 0 H GLN B 31 -15.461 2.997 -11.547 1.00 0.00 H new ATOM 0 HA GLN B 31 -15.559 0.653 -13.256 1.00 0.00 H new ATOM 0 HB2 GLN B 31 -16.747 0.962 -10.984 1.00 0.00 H new ATOM 0 HB3 GLN B 31 -17.867 2.014 -11.827 1.00 0.00 H new ATOM 0 HG2 GLN B 31 -18.547 0.213 -13.298 1.00 0.00 H new ATOM 0 HG3 GLN B 31 -17.312 -0.846 -12.646 1.00 0.00 H new ATOM 0 HE21 GLN B 31 -20.547 -0.069 -12.537 1.00 0.00 H new ATOM 0 HE22 GLN B 31 -20.955 -0.739 -10.954 1.00 0.00 H new ATOM 2200 N ASN B 32 -16.661 3.509 -14.303 1.00 0.00 N ATOM 2201 CA ASN B 32 -17.254 4.185 -15.461 1.00 0.00 C ATOM 2202 C ASN B 32 -16.749 3.598 -16.787 1.00 0.00 C ATOM 2203 O ASN B 32 -17.416 3.711 -17.816 1.00 0.00 O ATOM 2204 CB ASN B 32 -16.992 5.699 -15.409 1.00 0.00 C ATOM 2205 CG ASN B 32 -15.556 6.076 -15.737 1.00 0.00 C ATOM 2206 OD1 ASN B 32 -15.264 6.520 -16.846 1.00 0.00 O ATOM 2207 ND2 ASN B 32 -14.657 5.902 -14.775 1.00 0.00 N ATOM 0 H ASN B 32 -16.215 4.129 -13.627 1.00 0.00 H new ATOM 0 HA ASN B 32 -18.330 4.017 -15.414 1.00 0.00 H new ATOM 0 HB2 ASN B 32 -17.660 6.200 -16.110 1.00 0.00 H new ATOM 0 HB3 ASN B 32 -17.238 6.069 -14.414 1.00 0.00 H new ATOM 0 HD21 ASN B 32 -13.679 6.140 -14.942 1.00 0.00 H new ATOM 0 HD22 ASN B 32 -14.944 5.531 -13.870 1.00 0.00 H new ATOM 2214 N GLN B 33 -15.573 2.974 -16.757 1.00 0.00 N ATOM 2215 CA GLN B 33 -14.994 2.378 -17.959 1.00 0.00 C ATOM 2216 C GLN B 33 -14.285 1.066 -17.619 1.00 0.00 C ATOM 2217 O GLN B 33 -14.354 0.591 -16.485 1.00 0.00 O ATOM 2218 CB GLN B 33 -14.016 3.365 -18.610 1.00 0.00 C ATOM 2219 CG GLN B 33 -14.104 3.426 -20.130 1.00 0.00 C ATOM 2220 CD GLN B 33 -15.522 3.634 -20.629 1.00 0.00 C ATOM 2221 OE1 GLN B 33 -16.223 2.676 -20.955 1.00 0.00 O ATOM 2222 NE2 GLN B 33 -15.949 4.889 -20.693 1.00 0.00 N ATOM 0 H GLN B 33 -15.004 2.868 -15.917 1.00 0.00 H new ATOM 0 HA GLN B 33 -15.795 2.158 -18.665 1.00 0.00 H new ATOM 0 HB2 GLN B 33 -14.201 4.361 -18.207 1.00 0.00 H new ATOM 0 HB3 GLN B 33 -13.000 3.091 -18.327 1.00 0.00 H new ATOM 0 HG2 GLN B 33 -13.473 4.237 -20.494 1.00 0.00 H new ATOM 0 HG3 GLN B 33 -13.708 2.501 -20.550 1.00 0.00 H new ATOM 0 HE21 GLN B 33 -15.333 5.652 -20.412 1.00 0.00 H new ATOM 0 HE22 GLN B 33 -16.893 5.090 -21.023 1.00 0.00 H new ATOM 2231 N GLN B 34 -13.609 0.481 -18.605 1.00 0.00 N ATOM 2232 CA GLN B 34 -12.895 -0.778 -18.407 1.00 0.00 C ATOM 2233 C GLN B 34 -11.541 -0.545 -17.742 1.00 0.00 C ATOM 2234 O GLN B 34 -11.183 0.587 -17.419 1.00 0.00 O ATOM 2235 CB GLN B 34 -12.704 -1.493 -19.747 1.00 0.00 C ATOM 2236 CG GLN B 34 -12.878 -3.001 -19.660 1.00 0.00 C ATOM 2237 CD GLN B 34 -14.224 -3.463 -20.181 1.00 0.00 C ATOM 2238 OE1 GLN B 34 -14.509 -3.365 -21.375 1.00 0.00 O ATOM 2239 NE2 GLN B 34 -15.063 -3.969 -19.286 1.00 0.00 N ATOM 0 H GLN B 34 -13.541 0.859 -19.550 1.00 0.00 H new ATOM 0 HA GLN B 34 -13.495 -1.405 -17.748 1.00 0.00 H new ATOM 0 HB2 GLN B 34 -13.418 -1.094 -20.468 1.00 0.00 H new ATOM 0 HB3 GLN B 34 -11.707 -1.272 -20.129 1.00 0.00 H new ATOM 0 HG2 GLN B 34 -12.086 -3.488 -20.229 1.00 0.00 H new ATOM 0 HG3 GLN B 34 -12.766 -3.317 -18.623 1.00 0.00 H new ATOM 0 HE21 GLN B 34 -14.787 -4.032 -18.306 1.00 0.00 H new ATOM 0 HE22 GLN B 34 -15.984 -4.295 -19.578 1.00 0.00 H new ATOM 2248 N TYR B 35 -10.797 -1.628 -17.532 1.00 0.00 N ATOM 2249 CA TYR B 35 -9.486 -1.545 -16.897 1.00 0.00 C ATOM 2250 C TYR B 35 -8.387 -1.268 -17.922 1.00 0.00 C ATOM 2251 O TYR B 35 -8.061 -2.120 -18.748 1.00 0.00 O ATOM 2252 CB TYR B 35 -9.188 -2.848 -16.145 1.00 0.00 C ATOM 2253 CG TYR B 35 -7.819 -2.894 -15.498 1.00 0.00 C ATOM 2254 CD1 TYR B 35 -7.617 -2.400 -14.215 1.00 0.00 C ATOM 2255 CD2 TYR B 35 -6.730 -3.435 -16.172 1.00 0.00 C ATOM 2256 CE1 TYR B 35 -6.368 -2.445 -13.622 1.00 0.00 C ATOM 2257 CE2 TYR B 35 -5.480 -3.484 -15.586 1.00 0.00 C ATOM 2258 CZ TYR B 35 -5.304 -2.987 -14.312 1.00 0.00 C ATOM 2259 OH TYR B 35 -4.061 -3.035 -13.725 1.00 0.00 O ATOM 0 H TYR B 35 -11.080 -2.573 -17.792 1.00 0.00 H new ATOM 0 HA TYR B 35 -9.503 -0.714 -16.192 1.00 0.00 H new ATOM 0 HB2 TYR B 35 -9.946 -2.991 -15.375 1.00 0.00 H new ATOM 0 HB3 TYR B 35 -9.277 -3.683 -16.839 1.00 0.00 H new ATOM 0 HD1 TYR B 35 -8.448 -1.974 -13.672 1.00 0.00 H new ATOM 0 HD2 TYR B 35 -6.864 -3.824 -17.171 1.00 0.00 H new ATOM 0 HE1 TYR B 35 -6.227 -2.058 -12.624 1.00 0.00 H new ATOM 0 HE2 TYR B 35 -4.645 -3.909 -16.123 1.00 0.00 H new ATOM 0 HH TYR B 35 -3.578 -2.204 -13.914 1.00 0.00 H new ATOM 2269 N SER B 36 -7.811 -0.072 -17.844 1.00 0.00 N ATOM 2270 CA SER B 36 -6.733 0.331 -18.741 1.00 0.00 C ATOM 2271 C SER B 36 -5.594 0.954 -17.941 1.00 0.00 C ATOM 2272 O SER B 36 -5.826 1.840 -17.121 1.00 0.00 O ATOM 2273 CB SER B 36 -7.250 1.324 -19.785 1.00 0.00 C ATOM 2274 OG SER B 36 -7.575 0.667 -20.997 1.00 0.00 O ATOM 0 H SER B 36 -8.076 0.640 -17.163 1.00 0.00 H new ATOM 0 HA SER B 36 -6.360 -0.553 -19.259 1.00 0.00 H new ATOM 0 HB2 SER B 36 -8.131 1.837 -19.399 1.00 0.00 H new ATOM 0 HB3 SER B 36 -6.494 2.086 -19.972 1.00 0.00 H new ATOM 0 HG SER B 36 -7.904 1.323 -21.647 1.00 0.00 H new ATOM 2280 N GLU B 37 -4.365 0.492 -18.168 1.00 0.00 N ATOM 2281 CA GLU B 37 -3.214 1.024 -17.442 1.00 0.00 C ATOM 2282 C GLU B 37 -3.085 2.531 -17.636 1.00 0.00 C ATOM 2283 O GLU B 37 -2.794 3.266 -16.694 1.00 0.00 O ATOM 2284 CB GLU B 37 -1.922 0.338 -17.874 1.00 0.00 C ATOM 2285 CG GLU B 37 -0.719 0.787 -17.059 1.00 0.00 C ATOM 2286 CD GLU B 37 -0.075 -0.346 -16.283 1.00 0.00 C ATOM 2287 OE1 GLU B 37 -0.768 -1.348 -16.011 1.00 0.00 O ATOM 2288 OE2 GLU B 37 1.123 -0.231 -15.949 1.00 0.00 O ATOM 0 H GLU B 37 -4.142 -0.241 -18.841 1.00 0.00 H new ATOM 0 HA GLU B 37 -3.382 0.821 -16.384 1.00 0.00 H new ATOM 0 HB2 GLU B 37 -2.039 -0.741 -17.778 1.00 0.00 H new ATOM 0 HB3 GLU B 37 -1.740 0.546 -18.928 1.00 0.00 H new ATOM 0 HG2 GLU B 37 0.020 1.230 -17.726 1.00 0.00 H new ATOM 0 HG3 GLU B 37 -1.029 1.567 -16.363 1.00 0.00 H new ATOM 2295 N ALA B 38 -3.318 2.994 -18.857 1.00 0.00 N ATOM 2296 CA ALA B 38 -3.246 4.422 -19.152 1.00 0.00 C ATOM 2297 C ALA B 38 -4.200 5.203 -18.252 1.00 0.00 C ATOM 2298 O ALA B 38 -3.959 6.363 -17.920 1.00 0.00 O ATOM 2299 CB ALA B 38 -3.585 4.669 -20.609 1.00 0.00 C ATOM 0 H ALA B 38 -3.557 2.407 -19.656 1.00 0.00 H new ATOM 0 HA ALA B 38 -2.230 4.766 -18.960 1.00 0.00 H new ATOM 0 HB1 ALA B 38 -3.529 5.737 -20.820 1.00 0.00 H new ATOM 0 HB2 ALA B 38 -2.876 4.136 -21.243 1.00 0.00 H new ATOM 0 HB3 ALA B 38 -4.594 4.312 -20.813 1.00 0.00 H new ATOM 2305 N LYS B 39 -5.284 4.541 -17.867 1.00 0.00 N ATOM 2306 CA LYS B 39 -6.297 5.130 -17.009 1.00 0.00 C ATOM 2307 C LYS B 39 -6.051 4.778 -15.534 1.00 0.00 C ATOM 2308 O LYS B 39 -6.544 5.460 -14.636 1.00 0.00 O ATOM 2309 CB LYS B 39 -7.669 4.624 -17.457 1.00 0.00 C ATOM 2310 CG LYS B 39 -8.489 5.661 -18.199 1.00 0.00 C ATOM 2311 CD LYS B 39 -7.793 6.112 -19.467 1.00 0.00 C ATOM 2312 CE LYS B 39 -7.989 5.114 -20.597 1.00 0.00 C ATOM 2313 NZ LYS B 39 -7.847 5.753 -21.934 1.00 0.00 N ATOM 0 H LYS B 39 -5.483 3.579 -18.143 1.00 0.00 H new ATOM 0 HA LYS B 39 -6.253 6.216 -17.095 1.00 0.00 H new ATOM 0 HB2 LYS B 39 -7.533 3.754 -18.099 1.00 0.00 H new ATOM 0 HB3 LYS B 39 -8.227 4.291 -16.582 1.00 0.00 H new ATOM 0 HG2 LYS B 39 -9.466 5.246 -18.446 1.00 0.00 H new ATOM 0 HG3 LYS B 39 -8.663 6.521 -17.552 1.00 0.00 H new ATOM 0 HD2 LYS B 39 -8.180 7.085 -19.769 1.00 0.00 H new ATOM 0 HD3 LYS B 39 -6.728 6.239 -19.273 1.00 0.00 H new ATOM 0 HE2 LYS B 39 -7.261 4.309 -20.500 1.00 0.00 H new ATOM 0 HE3 LYS B 39 -8.977 4.662 -20.514 1.00 0.00 H new ATOM 0 HZ1 LYS B 39 -7.988 5.039 -22.677 1.00 0.00 H new ATOM 0 HZ2 LYS B 39 -8.559 6.505 -22.037 1.00 0.00 H new ATOM 0 HZ3 LYS B 39 -6.895 6.163 -22.024 1.00 0.00 H new ATOM 2327 N VAL B 40 -5.290 3.705 -15.296 1.00 0.00 N ATOM 2328 CA VAL B 40 -4.977 3.248 -13.941 1.00 0.00 C ATOM 2329 C VAL B 40 -4.443 4.394 -13.064 1.00 0.00 C ATOM 2330 O VAL B 40 -4.561 4.348 -11.840 1.00 0.00 O ATOM 2331 CB VAL B 40 -3.970 2.053 -14.002 1.00 0.00 C ATOM 2332 CG1 VAL B 40 -3.127 1.897 -12.738 1.00 0.00 C ATOM 2333 CG2 VAL B 40 -4.717 0.761 -14.293 1.00 0.00 C ATOM 0 H VAL B 40 -4.877 3.133 -16.033 1.00 0.00 H new ATOM 0 HA VAL B 40 -5.898 2.901 -13.473 1.00 0.00 H new ATOM 0 HB VAL B 40 -3.273 2.277 -14.809 1.00 0.00 H new ATOM 0 HG11 VAL B 40 -2.452 1.049 -12.853 1.00 0.00 H new ATOM 0 HG12 VAL B 40 -2.545 2.804 -12.575 1.00 0.00 H new ATOM 0 HG13 VAL B 40 -3.781 1.727 -11.883 1.00 0.00 H new ATOM 0 HG21 VAL B 40 -4.009 -0.067 -14.334 1.00 0.00 H new ATOM 0 HG22 VAL B 40 -5.446 0.577 -13.504 1.00 0.00 H new ATOM 0 HG23 VAL B 40 -5.232 0.846 -15.250 1.00 0.00 H new ATOM 2343 N SER B 41 -3.861 5.411 -13.691 1.00 0.00 N ATOM 2344 CA SER B 41 -3.319 6.550 -12.953 1.00 0.00 C ATOM 2345 C SER B 41 -4.131 7.812 -13.211 1.00 0.00 C ATOM 2346 O SER B 41 -4.218 8.690 -12.352 1.00 0.00 O ATOM 2347 CB SER B 41 -1.857 6.783 -13.330 1.00 0.00 C ATOM 2348 OG SER B 41 -1.167 7.468 -12.300 1.00 0.00 O ATOM 0 H SER B 41 -3.752 5.472 -14.703 1.00 0.00 H new ATOM 0 HA SER B 41 -3.380 6.317 -11.890 1.00 0.00 H new ATOM 0 HB2 SER B 41 -1.371 5.827 -13.523 1.00 0.00 H new ATOM 0 HB3 SER B 41 -1.804 7.360 -14.253 1.00 0.00 H new ATOM 0 HG SER B 41 -0.233 7.603 -12.566 1.00 0.00 H new ATOM 2354 N GLN B 42 -4.722 7.901 -14.393 1.00 0.00 N ATOM 2355 CA GLN B 42 -5.524 9.060 -14.749 1.00 0.00 C ATOM 2356 C GLN B 42 -6.866 9.029 -14.039 1.00 0.00 C ATOM 2357 O GLN B 42 -7.419 10.073 -13.701 1.00 0.00 O ATOM 2358 CB GLN B 42 -5.728 9.131 -16.262 1.00 0.00 C ATOM 2359 CG GLN B 42 -4.504 9.614 -17.022 1.00 0.00 C ATOM 2360 CD GLN B 42 -4.159 11.058 -16.714 1.00 0.00 C ATOM 2361 OE1 GLN B 42 -4.608 11.975 -17.401 1.00 0.00 O ATOM 2362 NE2 GLN B 42 -3.356 11.267 -15.677 1.00 0.00 N ATOM 0 H GLN B 42 -4.661 7.187 -15.119 1.00 0.00 H new ATOM 0 HA GLN B 42 -4.986 9.952 -14.428 1.00 0.00 H new ATOM 0 HB2 GLN B 42 -6.006 8.143 -16.629 1.00 0.00 H new ATOM 0 HB3 GLN B 42 -6.564 9.797 -16.476 1.00 0.00 H new ATOM 0 HG2 GLN B 42 -3.653 8.980 -16.773 1.00 0.00 H new ATOM 0 HG3 GLN B 42 -4.680 9.507 -18.092 1.00 0.00 H new ATOM 0 HE21 GLN B 42 -3.007 10.477 -15.135 1.00 0.00 H new ATOM 0 HE22 GLN B 42 -3.088 12.218 -15.423 1.00 0.00 H new ATOM 2371 N TRP B 43 -7.394 7.831 -13.802 1.00 0.00 N ATOM 2372 CA TRP B 43 -8.671 7.707 -13.115 1.00 0.00 C ATOM 2373 C TRP B 43 -8.593 8.333 -11.741 1.00 0.00 C ATOM 2374 O TRP B 43 -9.352 9.239 -11.421 1.00 0.00 O ATOM 2375 CB TRP B 43 -9.092 6.250 -12.966 1.00 0.00 C ATOM 2376 CG TRP B 43 -9.787 5.682 -14.159 1.00 0.00 C ATOM 2377 CD1 TRP B 43 -9.631 4.420 -14.632 1.00 0.00 C ATOM 2378 CD2 TRP B 43 -10.748 6.322 -15.024 1.00 0.00 C ATOM 2379 NE1 TRP B 43 -10.406 4.232 -15.738 1.00 0.00 N ATOM 2380 CE2 TRP B 43 -11.102 5.376 -16.003 1.00 0.00 C ATOM 2381 CE3 TRP B 43 -11.344 7.593 -15.079 1.00 0.00 C ATOM 2382 CZ2 TRP B 43 -12.012 5.654 -17.019 1.00 0.00 C ATOM 2383 CZ3 TRP B 43 -12.249 7.863 -16.089 1.00 0.00 C ATOM 2384 CH2 TRP B 43 -12.572 6.899 -17.048 1.00 0.00 C ATOM 0 H TRP B 43 -6.964 6.946 -14.072 1.00 0.00 H new ATOM 0 HA TRP B 43 -9.413 8.226 -13.722 1.00 0.00 H new ATOM 0 HB2 TRP B 43 -8.207 5.649 -12.756 1.00 0.00 H new ATOM 0 HB3 TRP B 43 -9.750 6.162 -12.101 1.00 0.00 H new ATOM 0 HD1 TRP B 43 -8.986 3.672 -14.195 1.00 0.00 H new ATOM 0 HE1 TRP B 43 -10.458 3.371 -16.282 1.00 0.00 H new ATOM 0 HE3 TRP B 43 -11.099 8.346 -14.345 1.00 0.00 H new ATOM 0 HZ2 TRP B 43 -12.267 4.910 -17.759 1.00 0.00 H new ATOM 0 HZ3 TRP B 43 -12.715 8.836 -16.138 1.00 0.00 H new ATOM 0 HH2 TRP B 43 -13.278 7.144 -17.827 1.00 0.00 H new ATOM 2395 N THR B 44 -7.644 7.861 -10.937 1.00 0.00 N ATOM 2396 CA THR B 44 -7.458 8.384 -9.590 1.00 0.00 C ATOM 2397 C THR B 44 -7.285 9.910 -9.615 1.00 0.00 C ATOM 2398 O THR B 44 -7.571 10.593 -8.633 1.00 0.00 O ATOM 2399 CB THR B 44 -6.280 7.667 -8.905 1.00 0.00 C ATOM 2400 OG1 THR B 44 -6.495 7.579 -7.510 1.00 0.00 O ATOM 2401 CG2 THR B 44 -4.918 8.297 -9.130 1.00 0.00 C ATOM 0 H THR B 44 -6.994 7.119 -11.196 1.00 0.00 H new ATOM 0 HA THR B 44 -8.352 8.183 -8.999 1.00 0.00 H new ATOM 0 HB THR B 44 -6.257 6.685 -9.377 1.00 0.00 H new ATOM 0 HG1 THR B 44 -5.692 7.879 -7.036 1.00 0.00 H new ATOM 0 HG21 THR B 44 -4.158 7.717 -8.606 1.00 0.00 H new ATOM 0 HG22 THR B 44 -4.694 8.309 -10.197 1.00 0.00 H new ATOM 0 HG23 THR B 44 -4.922 9.318 -8.749 1.00 0.00 H new ATOM 2409 N SER B 45 -6.863 10.432 -10.766 1.00 0.00 N ATOM 2410 CA SER B 45 -6.711 11.866 -10.939 1.00 0.00 C ATOM 2411 C SER B 45 -8.104 12.478 -11.011 1.00 0.00 C ATOM 2412 O SER B 45 -8.377 13.523 -10.422 1.00 0.00 O ATOM 2413 CB SER B 45 -5.895 12.166 -12.204 1.00 0.00 C ATOM 2414 OG SER B 45 -6.727 12.411 -13.328 1.00 0.00 O ATOM 0 H SER B 45 -6.622 9.879 -11.589 1.00 0.00 H new ATOM 0 HA SER B 45 -6.167 12.301 -10.100 1.00 0.00 H new ATOM 0 HB2 SER B 45 -5.259 13.033 -12.028 1.00 0.00 H new ATOM 0 HB3 SER B 45 -5.235 11.325 -12.418 1.00 0.00 H new ATOM 0 HG SER B 45 -7.151 11.574 -13.610 1.00 0.00 H new ATOM 2420 N SER B 46 -8.996 11.769 -11.704 1.00 0.00 N ATOM 2421 CA SER B 46 -10.385 12.180 -11.823 1.00 0.00 C ATOM 2422 C SER B 46 -11.070 12.000 -10.481 1.00 0.00 C ATOM 2423 O SER B 46 -11.936 12.787 -10.104 1.00 0.00 O ATOM 2424 CB SER B 46 -11.102 11.362 -12.900 1.00 0.00 C ATOM 2425 OG SER B 46 -11.110 12.048 -14.140 1.00 0.00 O ATOM 0 H SER B 46 -8.773 10.902 -12.193 1.00 0.00 H new ATOM 0 HA SER B 46 -10.425 13.229 -12.117 1.00 0.00 H new ATOM 0 HB2 SER B 46 -10.608 10.397 -13.018 1.00 0.00 H new ATOM 0 HB3 SER B 46 -12.126 11.160 -12.586 1.00 0.00 H new ATOM 0 HG SER B 46 -11.572 11.504 -14.812 1.00 0.00 H new ATOM 2431 N CYS B 47 -10.646 10.976 -9.741 1.00 0.00 N ATOM 2432 CA CYS B 47 -11.192 10.726 -8.421 1.00 0.00 C ATOM 2433 C CYS B 47 -10.819 11.875 -7.513 1.00 0.00 C ATOM 2434 O CYS B 47 -11.612 12.321 -6.692 1.00 0.00 O ATOM 2435 CB CYS B 47 -10.660 9.418 -7.839 1.00 0.00 C ATOM 2436 SG CYS B 47 -11.945 8.357 -7.164 1.00 0.00 S ATOM 0 H CYS B 47 -9.930 10.313 -10.037 1.00 0.00 H new ATOM 0 HA CYS B 47 -12.276 10.641 -8.501 1.00 0.00 H new ATOM 0 HB2 CYS B 47 -10.124 8.875 -8.617 1.00 0.00 H new ATOM 0 HB3 CYS B 47 -9.939 9.646 -7.054 1.00 0.00 H new ATOM 0 HG CYS B 47 -11.979 8.486 -5.871 1.00 0.00 H new ATOM 2442 N LEU B 48 -9.598 12.359 -7.690 1.00 0.00 N ATOM 2443 CA LEU B 48 -9.108 13.472 -6.911 1.00 0.00 C ATOM 2444 C LEU B 48 -9.937 14.704 -7.197 1.00 0.00 C ATOM 2445 O LEU B 48 -10.246 15.474 -6.287 1.00 0.00 O ATOM 2446 CB LEU B 48 -7.614 13.704 -7.191 1.00 0.00 C ATOM 2447 CG LEU B 48 -6.638 13.174 -6.127 1.00 0.00 C ATOM 2448 CD1 LEU B 48 -7.195 11.956 -5.393 1.00 0.00 C ATOM 2449 CD2 LEU B 48 -5.293 12.840 -6.759 1.00 0.00 C ATOM 0 H LEU B 48 -8.932 11.993 -8.370 1.00 0.00 H new ATOM 0 HA LEU B 48 -9.206 13.245 -5.849 1.00 0.00 H new ATOM 0 HB2 LEU B 48 -7.367 13.239 -8.145 1.00 0.00 H new ATOM 0 HB3 LEU B 48 -7.448 14.775 -7.306 1.00 0.00 H new ATOM 0 HG LEU B 48 -6.501 13.965 -5.390 1.00 0.00 H new ATOM 0 HD11 LEU B 48 -6.472 11.616 -4.651 1.00 0.00 H new ATOM 0 HD12 LEU B 48 -8.126 12.226 -4.895 1.00 0.00 H new ATOM 0 HD13 LEU B 48 -7.385 11.156 -6.108 1.00 0.00 H new ATOM 0 HD21 LEU B 48 -4.614 12.466 -5.993 1.00 0.00 H new ATOM 0 HD22 LEU B 48 -5.430 12.077 -7.525 1.00 0.00 H new ATOM 0 HD23 LEU B 48 -4.871 13.737 -7.212 1.00 0.00 H new ATOM 2461 N GLU B 49 -10.351 14.862 -8.449 1.00 0.00 N ATOM 2462 CA GLU B 49 -11.204 15.983 -8.788 1.00 0.00 C ATOM 2463 C GLU B 49 -12.629 15.686 -8.341 1.00 0.00 C ATOM 2464 O GLU B 49 -13.361 16.578 -7.925 1.00 0.00 O ATOM 2465 CB GLU B 49 -11.174 16.331 -10.266 1.00 0.00 C ATOM 2466 CG GLU B 49 -11.698 17.733 -10.505 1.00 0.00 C ATOM 2467 CD GLU B 49 -12.212 17.942 -11.915 1.00 0.00 C ATOM 2468 OE1 GLU B 49 -11.609 17.384 -12.856 1.00 0.00 O ATOM 2469 OE2 GLU B 49 -13.217 18.665 -12.080 1.00 0.00 O ATOM 0 H GLU B 49 -10.115 14.243 -9.225 1.00 0.00 H new ATOM 0 HA GLU B 49 -10.818 16.856 -8.262 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -10.154 16.251 -10.641 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -11.776 15.614 -10.824 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -12.501 17.940 -9.797 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -10.903 18.451 -10.304 1.00 0.00 H new ATOM 2476 N HIS B 50 -13.004 14.410 -8.397 1.00 0.00 N ATOM 2477 CA HIS B 50 -14.327 13.982 -7.961 1.00 0.00 C ATOM 2478 C HIS B 50 -14.358 13.777 -6.438 1.00 0.00 C ATOM 2479 O HIS B 50 -15.386 13.395 -5.879 1.00 0.00 O ATOM 2480 CB HIS B 50 -14.728 12.688 -8.671 1.00 0.00 C ATOM 2481 CG HIS B 50 -15.091 12.884 -10.110 1.00 0.00 C ATOM 2482 ND1 HIS B 50 -16.188 13.613 -10.518 1.00 0.00 N ATOM 2483 CD2 HIS B 50 -14.494 12.442 -11.243 1.00 0.00 C ATOM 2484 CE1 HIS B 50 -16.251 13.610 -11.838 1.00 0.00 C ATOM 2485 NE2 HIS B 50 -15.235 12.907 -12.301 1.00 0.00 N ATOM 0 H HIS B 50 -12.409 13.656 -8.740 1.00 0.00 H new ATOM 0 HA HIS B 50 -15.040 14.764 -8.220 1.00 0.00 H new ATOM 0 HB2 HIS B 50 -13.904 11.977 -8.606 1.00 0.00 H new ATOM 0 HB3 HIS B 50 -15.575 12.244 -8.148 1.00 0.00 H new ATOM 0 HD2 HIS B 50 -13.602 11.837 -11.303 1.00 0.00 H new ATOM 0 HE1 HIS B 50 -17.006 14.100 -12.436 1.00 0.00 H new ATOM 0 HE2 HIS B 50 -15.033 12.737 -13.286 1.00 0.00 H new ATOM 2494 N CYS B 51 -13.234 14.061 -5.770 1.00 0.00 N ATOM 2495 CA CYS B 51 -13.132 13.943 -4.328 1.00 0.00 C ATOM 2496 C CYS B 51 -13.096 15.345 -3.764 1.00 0.00 C ATOM 2497 O CYS B 51 -13.823 15.692 -2.833 1.00 0.00 O ATOM 2498 CB CYS B 51 -11.848 13.197 -3.928 1.00 0.00 C ATOM 2499 SG CYS B 51 -11.748 12.817 -2.166 1.00 0.00 S ATOM 0 H CYS B 51 -12.376 14.378 -6.222 1.00 0.00 H new ATOM 0 HA CYS B 51 -13.980 13.379 -3.940 1.00 0.00 H new ATOM 0 HB2 CYS B 51 -11.787 12.268 -4.495 1.00 0.00 H new ATOM 0 HB3 CYS B 51 -10.985 13.800 -4.210 1.00 0.00 H new ATOM 0 HG CYS B 51 -12.456 13.677 -1.496 1.00 0.00 H new ATOM 2505 N ILE B 52 -12.244 16.153 -4.380 1.00 0.00 N ATOM 2506 CA ILE B 52 -12.081 17.535 -4.009 1.00 0.00 C ATOM 2507 C ILE B 52 -13.387 18.304 -4.233 1.00 0.00 C ATOM 2508 O ILE B 52 -13.829 19.040 -3.358 1.00 0.00 O ATOM 2509 CB ILE B 52 -10.909 18.153 -4.823 1.00 0.00 C ATOM 2510 CG1 ILE B 52 -10.455 19.484 -4.255 1.00 0.00 C ATOM 2511 CG2 ILE B 52 -11.260 18.312 -6.289 1.00 0.00 C ATOM 2512 CD1 ILE B 52 -11.500 20.554 -4.328 1.00 0.00 C ATOM 0 H ILE B 52 -11.648 15.858 -5.153 1.00 0.00 H new ATOM 0 HA ILE B 52 -11.839 17.604 -2.949 1.00 0.00 H new ATOM 0 HB ILE B 52 -10.082 17.448 -4.740 1.00 0.00 H new ATOM 0 HG12 ILE B 52 -10.162 19.345 -3.215 1.00 0.00 H new ATOM 0 HG13 ILE B 52 -9.568 19.816 -4.794 1.00 0.00 H new ATOM 0 HG21 ILE B 52 -10.414 18.747 -6.821 1.00 0.00 H new ATOM 0 HG22 ILE B 52 -11.494 17.336 -6.715 1.00 0.00 H new ATOM 0 HG23 ILE B 52 -12.126 18.967 -6.387 1.00 0.00 H new ATOM 0 HD11 ILE B 52 -11.105 21.477 -3.904 1.00 0.00 H new ATOM 0 HD12 ILE B 52 -11.777 20.722 -5.369 1.00 0.00 H new ATOM 0 HD13 ILE B 52 -12.379 20.243 -3.764 1.00 0.00 H new ATOM 2524 N LYS B 53 -14.002 18.115 -5.404 1.00 0.00 N ATOM 2525 CA LYS B 53 -15.257 18.787 -5.742 1.00 0.00 C ATOM 2526 C LYS B 53 -16.346 18.471 -4.722 1.00 0.00 C ATOM 2527 O LYS B 53 -17.200 19.310 -4.432 1.00 0.00 O ATOM 2528 CB LYS B 53 -15.722 18.376 -7.146 1.00 0.00 C ATOM 2529 CG LYS B 53 -15.257 19.307 -8.263 1.00 0.00 C ATOM 2530 CD LYS B 53 -13.763 19.572 -8.207 1.00 0.00 C ATOM 2531 CE LYS B 53 -13.451 20.888 -7.509 1.00 0.00 C ATOM 2532 NZ LYS B 53 -12.111 21.414 -7.890 1.00 0.00 N ATOM 0 H LYS B 53 -13.648 17.499 -6.136 1.00 0.00 H new ATOM 0 HA LYS B 53 -15.074 19.861 -5.725 1.00 0.00 H new ATOM 0 HB2 LYS B 53 -15.360 17.369 -7.355 1.00 0.00 H new ATOM 0 HB3 LYS B 53 -16.811 18.332 -7.156 1.00 0.00 H new ATOM 0 HG2 LYS B 53 -15.510 18.868 -9.228 1.00 0.00 H new ATOM 0 HG3 LYS B 53 -15.795 20.253 -8.192 1.00 0.00 H new ATOM 0 HD2 LYS B 53 -13.268 18.755 -7.682 1.00 0.00 H new ATOM 0 HD3 LYS B 53 -13.359 19.592 -9.219 1.00 0.00 H new ATOM 0 HE2 LYS B 53 -14.215 21.623 -7.762 1.00 0.00 H new ATOM 0 HE3 LYS B 53 -13.491 20.745 -6.429 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 -11.936 22.311 -7.394 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 -11.379 20.724 -7.626 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 -12.080 21.575 -8.917 1.00 0.00 H new ATOM 2546 N ARG B 54 -16.313 17.261 -4.181 1.00 0.00 N ATOM 2547 CA ARG B 54 -17.300 16.840 -3.193 1.00 0.00 C ATOM 2548 C ARG B 54 -17.023 17.509 -1.851 1.00 0.00 C ATOM 2549 O ARG B 54 -17.933 18.014 -1.183 1.00 0.00 O ATOM 2550 CB ARG B 54 -17.280 15.314 -3.044 1.00 0.00 C ATOM 2551 CG ARG B 54 -18.633 14.661 -3.278 1.00 0.00 C ATOM 2552 CD ARG B 54 -19.389 14.446 -1.975 1.00 0.00 C ATOM 2553 NE ARG B 54 -19.785 13.049 -1.796 1.00 0.00 N ATOM 2554 CZ ARG B 54 -20.507 12.603 -0.768 1.00 0.00 C ATOM 2555 NH1 ARG B 54 -20.913 13.435 0.186 1.00 0.00 N ATOM 2556 NH2 ARG B 54 -20.824 11.318 -0.692 1.00 0.00 N ATOM 0 H ARG B 54 -15.615 16.553 -4.408 1.00 0.00 H new ATOM 0 HA ARG B 54 -18.290 17.144 -3.534 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -16.559 14.898 -3.748 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -16.932 15.060 -2.043 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -19.228 15.286 -3.945 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -18.493 13.703 -3.779 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -18.764 14.756 -1.138 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -20.276 15.079 -1.962 1.00 0.00 H new ATOM 0 HE ARG B 54 -19.490 12.374 -2.502 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -20.672 14.425 0.136 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -21.465 13.083 0.968 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -20.516 10.673 -1.419 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -21.376 10.975 0.094 1.00 0.00 H new ATOM 2570 N LEU B 55 -15.753 17.512 -1.471 1.00 0.00 N ATOM 2571 CA LEU B 55 -15.331 18.117 -0.218 1.00 0.00 C ATOM 2572 C LEU B 55 -15.692 19.594 -0.175 1.00 0.00 C ATOM 2573 O LEU B 55 -15.950 20.149 0.891 1.00 0.00 O ATOM 2574 CB LEU B 55 -13.830 17.915 -0.026 1.00 0.00 C ATOM 2575 CG LEU B 55 -13.429 16.457 0.187 1.00 0.00 C ATOM 2576 CD1 LEU B 55 -11.916 16.294 0.189 1.00 0.00 C ATOM 2577 CD2 LEU B 55 -14.035 15.928 1.477 1.00 0.00 C ATOM 0 H LEU B 55 -14.995 17.100 -2.016 1.00 0.00 H new ATOM 0 HA LEU B 55 -15.858 17.628 0.601 1.00 0.00 H new ATOM 0 HB2 LEU B 55 -13.306 18.303 -0.899 1.00 0.00 H new ATOM 0 HB3 LEU B 55 -13.500 18.502 0.831 1.00 0.00 H new ATOM 0 HG LEU B 55 -13.819 15.871 -0.645 1.00 0.00 H new ATOM 0 HD11 LEU B 55 -11.663 15.245 0.343 1.00 0.00 H new ATOM 0 HD12 LEU B 55 -11.513 16.628 -0.767 1.00 0.00 H new ATOM 0 HD13 LEU B 55 -11.487 16.892 0.993 1.00 0.00 H new ATOM 0 HD21 LEU B 55 -13.741 14.888 1.617 1.00 0.00 H new ATOM 0 HD22 LEU B 55 -13.677 16.522 2.318 1.00 0.00 H new ATOM 0 HD23 LEU B 55 -15.122 15.994 1.422 1.00 0.00 H new ATOM 2589 N THR B 56 -15.730 20.221 -1.343 1.00 0.00 N ATOM 2590 CA THR B 56 -16.086 21.628 -1.436 1.00 0.00 C ATOM 2591 C THR B 56 -17.575 21.793 -1.161 1.00 0.00 C ATOM 2592 O THR B 56 -18.004 22.772 -0.553 1.00 0.00 O ATOM 2593 CB THR B 56 -15.733 22.185 -2.819 1.00 0.00 C ATOM 2594 OG1 THR B 56 -16.736 21.859 -3.765 1.00 0.00 O ATOM 2595 CG2 THR B 56 -14.417 21.661 -3.352 1.00 0.00 C ATOM 0 H THR B 56 -15.519 19.778 -2.237 1.00 0.00 H new ATOM 0 HA THR B 56 -15.519 22.188 -0.693 1.00 0.00 H new ATOM 0 HB THR B 56 -15.654 23.264 -2.684 1.00 0.00 H new ATOM 0 HG1 THR B 56 -16.713 20.896 -3.947 1.00 0.00 H new ATOM 0 HG21 THR B 56 -14.224 22.093 -4.334 1.00 0.00 H new ATOM 0 HG22 THR B 56 -13.613 21.937 -2.670 1.00 0.00 H new ATOM 0 HG23 THR B 56 -14.465 20.575 -3.436 1.00 0.00 H new ATOM 2603 N ALA B 57 -18.353 20.807 -1.601 1.00 0.00 N ATOM 2604 CA ALA B 57 -19.792 20.818 -1.388 1.00 0.00 C ATOM 2605 C ALA B 57 -20.098 20.695 0.097 1.00 0.00 C ATOM 2606 O ALA B 57 -20.977 21.379 0.622 1.00 0.00 O ATOM 2607 CB ALA B 57 -20.451 19.686 -2.164 1.00 0.00 C ATOM 0 H ALA B 57 -18.008 19.991 -2.107 1.00 0.00 H new ATOM 0 HA ALA B 57 -20.195 21.763 -1.752 1.00 0.00 H new ATOM 0 HB1 ALA B 57 -21.528 19.707 -1.995 1.00 0.00 H new ATOM 0 HB2 ALA B 57 -20.249 19.808 -3.228 1.00 0.00 H new ATOM 0 HB3 ALA B 57 -20.049 18.731 -1.826 1.00 0.00 H new ATOM 2613 N LEU B 58 -19.352 19.825 0.774 1.00 0.00 N ATOM 2614 CA LEU B 58 -19.527 19.620 2.202 1.00 0.00 C ATOM 2615 C LEU B 58 -18.929 20.789 2.982 1.00 0.00 C ATOM 2616 O LEU B 58 -19.506 21.256 3.965 1.00 0.00 O ATOM 2617 CB LEU B 58 -18.869 18.303 2.621 1.00 0.00 C ATOM 2618 CG LEU B 58 -19.829 17.126 2.803 1.00 0.00 C ATOM 2619 CD1 LEU B 58 -20.944 17.490 3.772 1.00 0.00 C ATOM 2620 CD2 LEU B 58 -20.405 16.697 1.462 1.00 0.00 C ATOM 0 H LEU B 58 -18.621 19.252 0.352 1.00 0.00 H new ATOM 0 HA LEU B 58 -20.592 19.568 2.426 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -18.125 18.032 1.872 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -18.335 18.464 3.557 1.00 0.00 H new ATOM 0 HG LEU B 58 -19.271 16.289 3.222 1.00 0.00 H new ATOM 0 HD11 LEU B 58 -21.617 16.640 3.889 1.00 0.00 H new ATOM 0 HD12 LEU B 58 -20.515 17.748 4.740 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -21.501 18.343 3.383 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -21.086 15.859 1.610 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -20.947 17.530 1.016 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -19.595 16.394 0.798 1.00 0.00 H new ATOM 2632 N ASN B 59 -17.766 21.257 2.527 1.00 0.00 N ATOM 2633 CA ASN B 59 -17.059 22.381 3.153 1.00 0.00 C ATOM 2634 C ASN B 59 -17.042 22.277 4.681 1.00 0.00 C ATOM 2635 O ASN B 59 -17.642 23.096 5.377 1.00 0.00 O ATOM 2636 CB ASN B 59 -17.688 23.709 2.720 1.00 0.00 C ATOM 2637 CG ASN B 59 -19.132 23.844 3.163 1.00 0.00 C ATOM 2638 OD1 ASN B 59 -19.420 24.402 4.222 1.00 0.00 O ATOM 2639 ND2 ASN B 59 -20.050 23.332 2.352 1.00 0.00 N ATOM 0 H ASN B 59 -17.286 20.870 1.715 1.00 0.00 H new ATOM 0 HA ASN B 59 -16.024 22.342 2.814 1.00 0.00 H new ATOM 0 HB2 ASN B 59 -17.107 24.533 3.133 1.00 0.00 H new ATOM 0 HB3 ASN B 59 -17.636 23.794 1.635 1.00 0.00 H new ATOM 0 HD21 ASN B 59 -21.038 23.393 2.597 1.00 0.00 H new ATOM 0 HD22 ASN B 59 -19.767 22.878 1.484 1.00 0.00 H new ATOM 2646 N LYS B 60 -16.345 21.269 5.195 1.00 0.00 N ATOM 2647 CA LYS B 60 -16.249 21.070 6.637 1.00 0.00 C ATOM 2648 C LYS B 60 -15.318 19.903 6.980 1.00 0.00 C ATOM 2649 O LYS B 60 -15.754 18.752 7.014 1.00 0.00 O ATOM 2650 CB LYS B 60 -17.638 20.815 7.230 1.00 0.00 C ATOM 2651 CG LYS B 60 -17.697 20.995 8.738 1.00 0.00 C ATOM 2652 CD LYS B 60 -18.999 20.459 9.312 1.00 0.00 C ATOM 2653 CE LYS B 60 -18.778 19.782 10.656 1.00 0.00 C ATOM 2654 NZ LYS B 60 -18.251 20.730 11.676 1.00 0.00 N ATOM 0 H LYS B 60 -15.840 20.580 4.638 1.00 0.00 H new ATOM 0 HA LYS B 60 -15.830 21.979 7.070 1.00 0.00 H new ATOM 0 HB2 LYS B 60 -18.353 21.492 6.763 1.00 0.00 H new ATOM 0 HB3 LYS B 60 -17.950 19.801 6.981 1.00 0.00 H new ATOM 0 HG2 LYS B 60 -16.855 20.480 9.200 1.00 0.00 H new ATOM 0 HG3 LYS B 60 -17.598 22.052 8.984 1.00 0.00 H new ATOM 0 HD2 LYS B 60 -19.711 21.276 9.428 1.00 0.00 H new ATOM 0 HD3 LYS B 60 -19.441 19.748 8.614 1.00 0.00 H new ATOM 0 HE2 LYS B 60 -19.718 19.357 11.007 1.00 0.00 H new ATOM 0 HE3 LYS B 60 -18.079 18.954 10.535 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 -18.194 20.252 12.598 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 -17.303 21.052 11.394 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 -18.887 21.549 11.750 1.00 0.00 H new ATOM 2668 N PRO B 61 -14.017 20.172 7.245 1.00 0.00 N ATOM 2669 CA PRO B 61 -13.433 21.525 7.223 1.00 0.00 C ATOM 2670 C PRO B 61 -13.232 22.049 5.802 1.00 0.00 C ATOM 2671 O PRO B 61 -13.745 21.474 4.841 1.00 0.00 O ATOM 2672 CB PRO B 61 -12.088 21.332 7.913 1.00 0.00 C ATOM 2673 CG PRO B 61 -11.717 19.922 7.612 1.00 0.00 C ATOM 2674 CD PRO B 61 -13.009 19.151 7.591 1.00 0.00 C ATOM 0 HA PRO B 61 -14.079 22.258 7.706 1.00 0.00 H new ATOM 0 HB2 PRO B 61 -11.342 22.029 7.532 1.00 0.00 H new ATOM 0 HB3 PRO B 61 -12.164 21.502 8.987 1.00 0.00 H new ATOM 0 HG2 PRO B 61 -11.203 19.849 6.653 1.00 0.00 H new ATOM 0 HG3 PRO B 61 -11.039 19.527 8.368 1.00 0.00 H new ATOM 0 HD2 PRO B 61 -12.984 18.347 6.856 1.00 0.00 H new ATOM 0 HD3 PRO B 61 -13.218 18.693 8.558 1.00 0.00 H new ATOM 2682 N PHE B 62 -12.486 23.143 5.676 1.00 0.00 N ATOM 2683 CA PHE B 62 -12.221 23.744 4.373 1.00 0.00 C ATOM 2684 C PHE B 62 -10.927 23.201 3.769 1.00 0.00 C ATOM 2685 O PHE B 62 -10.938 22.591 2.701 1.00 0.00 O ATOM 2686 CB PHE B 62 -12.138 25.266 4.499 1.00 0.00 C ATOM 2687 CG PHE B 62 -13.481 25.936 4.584 1.00 0.00 C ATOM 2688 CD1 PHE B 62 -14.261 25.809 5.722 1.00 0.00 C ATOM 2689 CD2 PHE B 62 -13.961 26.693 3.527 1.00 0.00 C ATOM 2690 CE1 PHE B 62 -15.496 26.425 5.804 1.00 0.00 C ATOM 2691 CE2 PHE B 62 -15.195 27.309 3.603 1.00 0.00 C ATOM 2692 CZ PHE B 62 -15.964 27.176 4.743 1.00 0.00 C ATOM 0 H PHE B 62 -12.054 23.631 6.461 1.00 0.00 H new ATOM 0 HA PHE B 62 -13.045 23.483 3.709 1.00 0.00 H new ATOM 0 HB2 PHE B 62 -11.559 25.518 5.387 1.00 0.00 H new ATOM 0 HB3 PHE B 62 -11.596 25.664 3.641 1.00 0.00 H new ATOM 0 HD1 PHE B 62 -13.900 25.222 6.554 1.00 0.00 H new ATOM 0 HD2 PHE B 62 -13.364 26.802 2.634 1.00 0.00 H new ATOM 0 HE1 PHE B 62 -16.094 26.319 6.697 1.00 0.00 H new ATOM 0 HE2 PHE B 62 -15.559 27.894 2.771 1.00 0.00 H new ATOM 0 HZ PHE B 62 -16.929 27.658 4.805 1.00 0.00 H new ATOM 2702 N LYS B 63 -9.812 23.431 4.460 1.00 0.00 N ATOM 2703 CA LYS B 63 -8.507 22.966 3.993 1.00 0.00 C ATOM 2704 C LYS B 63 -8.509 21.454 3.772 1.00 0.00 C ATOM 2705 O LYS B 63 -8.286 20.680 4.703 1.00 0.00 O ATOM 2706 CB LYS B 63 -7.421 23.343 5.003 1.00 0.00 C ATOM 2707 CG LYS B 63 -6.955 24.785 4.885 1.00 0.00 C ATOM 2708 CD LYS B 63 -5.496 24.935 5.287 1.00 0.00 C ATOM 2709 CE LYS B 63 -4.945 26.295 4.887 1.00 0.00 C ATOM 2710 NZ LYS B 63 -5.868 27.401 5.267 1.00 0.00 N ATOM 0 H LYS B 63 -9.786 23.937 5.345 1.00 0.00 H new ATOM 0 HA LYS B 63 -8.297 23.451 3.040 1.00 0.00 H new ATOM 0 HB2 LYS B 63 -7.799 23.173 6.011 1.00 0.00 H new ATOM 0 HB3 LYS B 63 -6.565 22.681 4.868 1.00 0.00 H new ATOM 0 HG2 LYS B 63 -7.088 25.128 3.859 1.00 0.00 H new ATOM 0 HG3 LYS B 63 -7.575 25.421 5.517 1.00 0.00 H new ATOM 0 HD2 LYS B 63 -5.399 24.805 6.365 1.00 0.00 H new ATOM 0 HD3 LYS B 63 -4.905 24.149 4.817 1.00 0.00 H new ATOM 0 HE2 LYS B 63 -3.977 26.449 5.364 1.00 0.00 H new ATOM 0 HE3 LYS B 63 -4.777 26.316 3.810 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 -5.407 28.316 5.086 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 -6.739 27.335 4.703 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 -6.103 27.326 6.277 1.00 0.00 H new ATOM 2724 N TYR B 64 -8.773 21.040 2.535 1.00 0.00 N ATOM 2725 CA TYR B 64 -8.815 19.623 2.201 1.00 0.00 C ATOM 2726 C TYR B 64 -7.824 19.278 1.091 1.00 0.00 C ATOM 2727 O TYR B 64 -7.874 19.850 0.004 1.00 0.00 O ATOM 2728 CB TYR B 64 -10.233 19.236 1.762 1.00 0.00 C ATOM 2729 CG TYR B 64 -11.019 18.489 2.816 1.00 0.00 C ATOM 2730 CD1 TYR B 64 -10.637 17.218 3.223 1.00 0.00 C ATOM 2731 CD2 TYR B 64 -12.144 19.056 3.399 1.00 0.00 C ATOM 2732 CE1 TYR B 64 -11.356 16.531 4.183 1.00 0.00 C ATOM 2733 CE2 TYR B 64 -12.868 18.377 4.358 1.00 0.00 C ATOM 2734 CZ TYR B 64 -12.470 17.116 4.747 1.00 0.00 C ATOM 2735 OH TYR B 64 -13.190 16.437 5.703 1.00 0.00 O ATOM 0 H TYR B 64 -8.960 21.665 1.751 1.00 0.00 H new ATOM 0 HA TYR B 64 -8.535 19.061 3.092 1.00 0.00 H new ATOM 0 HB2 TYR B 64 -10.778 20.140 1.489 1.00 0.00 H new ATOM 0 HB3 TYR B 64 -10.170 18.620 0.865 1.00 0.00 H new ATOM 0 HD1 TYR B 64 -9.764 16.759 2.783 1.00 0.00 H new ATOM 0 HD2 TYR B 64 -12.458 20.044 3.097 1.00 0.00 H new ATOM 0 HE1 TYR B 64 -11.047 15.542 4.489 1.00 0.00 H new ATOM 0 HE2 TYR B 64 -13.742 18.831 4.801 1.00 0.00 H new ATOM 0 HH TYR B 64 -14.135 16.410 5.443 1.00 0.00 H new ATOM 2745 N VAL B 65 -6.958 18.305 1.352 1.00 0.00 N ATOM 2746 CA VAL B 65 -5.997 17.854 0.349 1.00 0.00 C ATOM 2747 C VAL B 65 -6.409 16.475 -0.127 1.00 0.00 C ATOM 2748 O VAL B 65 -6.943 15.683 0.647 1.00 0.00 O ATOM 2749 CB VAL B 65 -4.520 17.777 0.836 1.00 0.00 C ATOM 2750 CG1 VAL B 65 -3.585 18.396 -0.189 1.00 0.00 C ATOM 2751 CG2 VAL B 65 -4.312 18.415 2.194 1.00 0.00 C ATOM 0 H VAL B 65 -6.901 17.815 2.245 1.00 0.00 H new ATOM 0 HA VAL B 65 -6.019 18.604 -0.442 1.00 0.00 H new ATOM 0 HB VAL B 65 -4.284 16.719 0.946 1.00 0.00 H new ATOM 0 HG11 VAL B 65 -2.558 18.332 0.170 1.00 0.00 H new ATOM 0 HG12 VAL B 65 -3.673 17.859 -1.133 1.00 0.00 H new ATOM 0 HG13 VAL B 65 -3.852 19.442 -0.340 1.00 0.00 H new ATOM 0 HG21 VAL B 65 -3.263 18.330 2.479 1.00 0.00 H new ATOM 0 HG22 VAL B 65 -4.591 19.468 2.148 1.00 0.00 H new ATOM 0 HG23 VAL B 65 -4.931 17.907 2.933 1.00 0.00 H new ATOM 2761 N VAL B 66 -6.177 16.187 -1.394 1.00 0.00 N ATOM 2762 CA VAL B 66 -6.548 14.889 -1.934 1.00 0.00 C ATOM 2763 C VAL B 66 -5.422 14.273 -2.743 1.00 0.00 C ATOM 2764 O VAL B 66 -5.174 14.676 -3.871 1.00 0.00 O ATOM 2765 CB VAL B 66 -7.812 14.958 -2.824 1.00 0.00 C ATOM 2766 CG1 VAL B 66 -8.555 13.637 -2.763 1.00 0.00 C ATOM 2767 CG2 VAL B 66 -8.734 16.104 -2.416 1.00 0.00 C ATOM 0 H VAL B 66 -5.740 16.823 -2.061 1.00 0.00 H new ATOM 0 HA VAL B 66 -6.760 14.264 -1.067 1.00 0.00 H new ATOM 0 HB VAL B 66 -7.491 15.149 -3.848 1.00 0.00 H new ATOM 0 HG11 VAL B 66 -9.444 13.690 -3.391 1.00 0.00 H new ATOM 0 HG12 VAL B 66 -7.906 12.838 -3.120 1.00 0.00 H new ATOM 0 HG13 VAL B 66 -8.850 13.432 -1.734 1.00 0.00 H new ATOM 0 HG21 VAL B 66 -9.609 16.116 -3.066 1.00 0.00 H new ATOM 0 HG22 VAL B 66 -9.052 15.965 -1.383 1.00 0.00 H new ATOM 0 HG23 VAL B 66 -8.201 17.050 -2.507 1.00 0.00 H new ATOM 2777 N THR B 67 -4.748 13.284 -2.175 1.00 0.00 N ATOM 2778 CA THR B 67 -3.665 12.609 -2.894 1.00 0.00 C ATOM 2779 C THR B 67 -3.885 11.110 -2.930 1.00 0.00 C ATOM 2780 O THR B 67 -4.553 10.549 -2.068 1.00 0.00 O ATOM 2781 CB THR B 67 -2.303 12.920 -2.291 1.00 0.00 C ATOM 2782 OG1 THR B 67 -1.293 12.141 -2.909 1.00 0.00 O ATOM 2783 CG2 THR B 67 -2.243 12.654 -0.814 1.00 0.00 C ATOM 0 H THR B 67 -4.924 12.932 -1.234 1.00 0.00 H new ATOM 0 HA THR B 67 -3.677 12.992 -3.914 1.00 0.00 H new ATOM 0 HB THR B 67 -2.140 13.984 -2.464 1.00 0.00 H new ATOM 0 HG1 THR B 67 -1.387 12.197 -3.883 1.00 0.00 H new ATOM 0 HG21 THR B 67 -1.247 12.894 -0.441 1.00 0.00 H new ATOM 0 HG22 THR B 67 -2.981 13.272 -0.303 1.00 0.00 H new ATOM 0 HG23 THR B 67 -2.457 11.602 -0.625 1.00 0.00 H new ATOM 2791 N CYS B 68 -3.330 10.472 -3.949 1.00 0.00 N ATOM 2792 CA CYS B 68 -3.470 9.037 -4.124 1.00 0.00 C ATOM 2793 C CYS B 68 -2.282 8.460 -4.882 1.00 0.00 C ATOM 2794 O CYS B 68 -1.622 9.154 -5.651 1.00 0.00 O ATOM 2795 CB CYS B 68 -4.764 8.717 -4.872 1.00 0.00 C ATOM 2796 SG CYS B 68 -5.058 9.760 -6.310 1.00 0.00 S ATOM 0 H CYS B 68 -2.775 10.931 -4.671 1.00 0.00 H new ATOM 0 HA CYS B 68 -3.504 8.581 -3.135 1.00 0.00 H new ATOM 0 HB2 CYS B 68 -4.739 7.675 -5.191 1.00 0.00 H new ATOM 0 HB3 CYS B 68 -5.604 8.819 -4.184 1.00 0.00 H new ATOM 0 HG CYS B 68 -6.195 9.440 -6.853 1.00 0.00 H new ATOM 2802 N ILE B 69 -2.024 7.183 -4.658 1.00 0.00 N ATOM 2803 CA ILE B 69 -0.928 6.486 -5.310 1.00 0.00 C ATOM 2804 C ILE B 69 -1.433 5.173 -5.912 1.00 0.00 C ATOM 2805 O ILE B 69 -2.266 4.490 -5.320 1.00 0.00 O ATOM 2806 CB ILE B 69 0.216 6.213 -4.302 1.00 0.00 C ATOM 2807 CG1 ILE B 69 0.801 7.536 -3.805 1.00 0.00 C ATOM 2808 CG2 ILE B 69 1.311 5.345 -4.910 1.00 0.00 C ATOM 2809 CD1 ILE B 69 0.086 8.097 -2.596 1.00 0.00 C ATOM 0 H ILE B 69 -2.567 6.601 -4.020 1.00 0.00 H new ATOM 0 HA ILE B 69 -0.536 7.115 -6.110 1.00 0.00 H new ATOM 0 HB ILE B 69 -0.205 5.665 -3.459 1.00 0.00 H new ATOM 0 HG12 ILE B 69 1.853 7.389 -3.559 1.00 0.00 H new ATOM 0 HG13 ILE B 69 0.761 8.267 -4.612 1.00 0.00 H new ATOM 0 HG21 ILE B 69 2.094 5.177 -4.171 1.00 0.00 H new ATOM 0 HG22 ILE B 69 0.889 4.388 -5.215 1.00 0.00 H new ATOM 0 HG23 ILE B 69 1.734 5.849 -5.779 1.00 0.00 H new ATOM 0 HD11 ILE B 69 0.555 9.035 -2.299 1.00 0.00 H new ATOM 0 HD12 ILE B 69 -0.960 8.276 -2.843 1.00 0.00 H new ATOM 0 HD13 ILE B 69 0.148 7.384 -1.774 1.00 0.00 H new ATOM 2821 N ILE B 70 -0.933 4.828 -7.094 1.00 0.00 N ATOM 2822 CA ILE B 70 -1.351 3.600 -7.761 1.00 0.00 C ATOM 2823 C ILE B 70 -0.277 2.522 -7.669 1.00 0.00 C ATOM 2824 O ILE B 70 0.906 2.784 -7.884 1.00 0.00 O ATOM 2825 CB ILE B 70 -1.697 3.849 -9.240 1.00 0.00 C ATOM 2826 CG1 ILE B 70 -0.492 4.422 -9.988 1.00 0.00 C ATOM 2827 CG2 ILE B 70 -2.890 4.786 -9.353 1.00 0.00 C ATOM 2828 CD1 ILE B 70 -0.698 4.504 -11.485 1.00 0.00 C ATOM 0 H ILE B 70 -0.243 5.377 -7.607 1.00 0.00 H new ATOM 0 HA ILE B 70 -2.246 3.254 -7.243 1.00 0.00 H new ATOM 0 HB ILE B 70 -1.960 2.895 -9.698 1.00 0.00 H new ATOM 0 HG12 ILE B 70 -0.275 5.419 -9.603 1.00 0.00 H new ATOM 0 HG13 ILE B 70 0.382 3.804 -9.782 1.00 0.00 H new ATOM 0 HG21 ILE B 70 -3.123 4.953 -10.405 1.00 0.00 H new ATOM 0 HG22 ILE B 70 -3.752 4.339 -8.857 1.00 0.00 H new ATOM 0 HG23 ILE B 70 -2.651 5.738 -8.879 1.00 0.00 H new ATOM 0 HD11 ILE B 70 0.195 4.919 -11.953 1.00 0.00 H new ATOM 0 HD12 ILE B 70 -0.885 3.506 -11.882 1.00 0.00 H new ATOM 0 HD13 ILE B 70 -1.552 5.146 -11.700 1.00 0.00 H new ATOM 2840 N MET B 71 -0.703 1.304 -7.347 1.00 0.00 N ATOM 2841 CA MET B 71 0.213 0.176 -7.227 1.00 0.00 C ATOM 2842 C MET B 71 -0.134 -0.908 -8.244 1.00 0.00 C ATOM 2843 O MET B 71 -1.135 -1.612 -8.099 1.00 0.00 O ATOM 2844 CB MET B 71 0.164 -0.398 -5.810 1.00 0.00 C ATOM 2845 CG MET B 71 1.465 -1.055 -5.373 1.00 0.00 C ATOM 2846 SD MET B 71 1.221 -2.693 -4.657 1.00 0.00 S ATOM 2847 CE MET B 71 0.291 -3.494 -5.961 1.00 0.00 C ATOM 0 H MET B 71 -1.680 1.073 -7.164 1.00 0.00 H new ATOM 0 HA MET B 71 1.224 0.531 -7.429 1.00 0.00 H new ATOM 0 HB2 MET B 71 -0.082 0.402 -5.111 1.00 0.00 H new ATOM 0 HB3 MET B 71 -0.641 -1.131 -5.752 1.00 0.00 H new ATOM 0 HG2 MET B 71 2.131 -1.135 -6.232 1.00 0.00 H new ATOM 0 HG3 MET B 71 1.961 -0.416 -4.643 1.00 0.00 H new ATOM 0 HE1 MET B 71 0.306 -4.573 -5.808 1.00 0.00 H new ATOM 0 HE2 MET B 71 -0.739 -3.139 -5.944 1.00 0.00 H new ATOM 0 HE3 MET B 71 0.740 -3.258 -6.926 1.00 0.00 H new ATOM 2857 N GLN B 72 0.695 -1.030 -9.275 1.00 0.00 N ATOM 2858 CA GLN B 72 0.474 -2.020 -10.324 1.00 0.00 C ATOM 2859 C GLN B 72 1.076 -3.371 -9.947 1.00 0.00 C ATOM 2860 O GLN B 72 2.050 -3.442 -9.199 1.00 0.00 O ATOM 2861 CB GLN B 72 1.073 -1.534 -11.644 1.00 0.00 C ATOM 2862 CG GLN B 72 0.246 -1.909 -12.862 1.00 0.00 C ATOM 2863 CD GLN B 72 -0.650 -0.778 -13.328 1.00 0.00 C ATOM 2864 OE1 GLN B 72 -1.855 -0.957 -13.504 1.00 0.00 O ATOM 2865 NE2 GLN B 72 -0.063 0.397 -13.531 1.00 0.00 N ATOM 0 H GLN B 72 1.527 -0.455 -9.407 1.00 0.00 H new ATOM 0 HA GLN B 72 -0.602 -2.148 -10.442 1.00 0.00 H new ATOM 0 HB2 GLN B 72 1.180 -0.450 -11.608 1.00 0.00 H new ATOM 0 HB3 GLN B 72 2.075 -1.949 -11.754 1.00 0.00 H new ATOM 0 HG2 GLN B 72 0.913 -2.198 -13.674 1.00 0.00 H new ATOM 0 HG3 GLN B 72 -0.366 -2.780 -12.627 1.00 0.00 H new ATOM 0 HE21 GLN B 72 0.939 0.501 -13.373 1.00 0.00 H new ATOM 0 HE22 GLN B 72 -0.615 1.195 -13.845 1.00 0.00 H new ATOM 2874 N LYS B 73 0.487 -4.439 -10.478 1.00 0.00 N ATOM 2875 CA LYS B 73 0.957 -5.794 -10.209 1.00 0.00 C ATOM 2876 C LYS B 73 0.828 -6.137 -8.729 1.00 0.00 C ATOM 2877 O LYS B 73 1.081 -5.301 -7.863 1.00 0.00 O ATOM 2878 CB LYS B 73 2.411 -5.954 -10.656 1.00 0.00 C ATOM 2879 CG LYS B 73 2.749 -7.357 -11.136 1.00 0.00 C ATOM 2880 CD LYS B 73 3.230 -8.235 -9.993 1.00 0.00 C ATOM 2881 CE LYS B 73 3.420 -9.676 -10.438 1.00 0.00 C ATOM 2882 NZ LYS B 73 4.847 -9.984 -10.731 1.00 0.00 N ATOM 0 H LYS B 73 -0.320 -4.391 -11.100 1.00 0.00 H new ATOM 0 HA LYS B 73 0.332 -6.483 -10.777 1.00 0.00 H new ATOM 0 HB2 LYS B 73 2.616 -5.245 -11.458 1.00 0.00 H new ATOM 0 HB3 LYS B 73 3.068 -5.695 -9.826 1.00 0.00 H new ATOM 0 HG2 LYS B 73 1.870 -7.807 -11.597 1.00 0.00 H new ATOM 0 HG3 LYS B 73 3.520 -7.304 -11.905 1.00 0.00 H new ATOM 0 HD2 LYS B 73 4.172 -7.846 -9.605 1.00 0.00 H new ATOM 0 HD3 LYS B 73 2.509 -8.198 -9.176 1.00 0.00 H new ATOM 0 HE2 LYS B 73 3.056 -10.347 -9.660 1.00 0.00 H new ATOM 0 HE3 LYS B 73 2.818 -9.863 -11.327 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 4.934 -10.976 -11.031 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 5.188 -9.361 -11.491 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 5.418 -9.830 -9.876 1.00 0.00 H new ATOM 2896 N ASN B 74 0.434 -7.375 -8.446 1.00 0.00 N ATOM 2897 CA ASN B 74 0.271 -7.831 -7.071 1.00 0.00 C ATOM 2898 C ASN B 74 1.559 -8.455 -6.547 1.00 0.00 C ATOM 2899 O ASN B 74 1.876 -9.604 -6.858 1.00 0.00 O ATOM 2900 CB ASN B 74 -0.872 -8.844 -6.978 1.00 0.00 C ATOM 2901 CG ASN B 74 -0.740 -9.959 -7.997 1.00 0.00 C ATOM 2902 OD1 ASN B 74 0.213 -9.995 -8.776 1.00 0.00 O ATOM 2903 ND2 ASN B 74 -1.698 -10.878 -7.996 1.00 0.00 N ATOM 0 H ASN B 74 0.222 -8.080 -9.152 1.00 0.00 H new ATOM 0 HA ASN B 74 0.031 -6.964 -6.455 1.00 0.00 H new ATOM 0 HB2 ASN B 74 -0.894 -9.272 -5.976 1.00 0.00 H new ATOM 0 HB3 ASN B 74 -1.822 -8.331 -7.126 1.00 0.00 H new ATOM 0 HD21 ASN B 74 -1.662 -11.653 -8.658 1.00 0.00 H new ATOM 0 HD22 ASN B 74 -2.470 -10.809 -7.333 1.00 0.00 H new ATOM 2910 N GLY B 75 2.300 -7.692 -5.750 1.00 0.00 N ATOM 2911 CA GLY B 75 3.545 -8.189 -5.194 1.00 0.00 C ATOM 2912 C GLY B 75 4.547 -7.083 -4.934 1.00 0.00 C ATOM 2913 O GLY B 75 5.389 -7.196 -4.044 1.00 0.00 O ATOM 0 H GLY B 75 2.060 -6.738 -5.479 1.00 0.00 H new ATOM 0 HA2 GLY B 75 3.339 -8.714 -4.262 1.00 0.00 H new ATOM 0 HA3 GLY B 75 3.981 -8.916 -5.880 1.00 0.00 H new ATOM 2917 N ALA B 76 4.458 -6.010 -5.713 1.00 0.00 N ATOM 2918 CA ALA B 76 5.364 -4.879 -5.563 1.00 0.00 C ATOM 2919 C ALA B 76 5.097 -4.132 -4.261 1.00 0.00 C ATOM 2920 O ALA B 76 3.988 -3.653 -4.025 1.00 0.00 O ATOM 2921 CB ALA B 76 5.234 -3.938 -6.750 1.00 0.00 C ATOM 0 H ALA B 76 3.767 -5.901 -6.455 1.00 0.00 H new ATOM 0 HA ALA B 76 6.383 -5.263 -5.529 1.00 0.00 H new ATOM 0 HB1 ALA B 76 5.917 -3.098 -6.625 1.00 0.00 H new ATOM 0 HB2 ALA B 76 5.481 -4.473 -7.667 1.00 0.00 H new ATOM 0 HB3 ALA B 76 4.210 -3.568 -6.811 1.00 0.00 H new ATOM 2927 N GLY B 77 6.121 -4.035 -3.419 1.00 0.00 N ATOM 2928 CA GLY B 77 5.976 -3.343 -2.152 1.00 0.00 C ATOM 2929 C GLY B 77 5.822 -1.844 -2.328 1.00 0.00 C ATOM 2930 O GLY B 77 6.404 -1.257 -3.240 1.00 0.00 O ATOM 0 H GLY B 77 7.048 -4.423 -3.592 1.00 0.00 H new ATOM 0 HA2 GLY B 77 5.107 -3.736 -1.624 1.00 0.00 H new ATOM 0 HA3 GLY B 77 6.847 -3.546 -1.528 1.00 0.00 H new ATOM 2934 N LEU B 78 5.034 -1.225 -1.456 1.00 0.00 N ATOM 2935 CA LEU B 78 4.806 0.213 -1.524 1.00 0.00 C ATOM 2936 C LEU B 78 4.823 0.837 -0.133 1.00 0.00 C ATOM 2937 O LEU B 78 4.227 0.306 0.805 1.00 0.00 O ATOM 2938 CB LEU B 78 3.470 0.505 -2.210 1.00 0.00 C ATOM 2939 CG LEU B 78 3.124 1.989 -2.352 1.00 0.00 C ATOM 2940 CD1 LEU B 78 3.713 2.554 -3.634 1.00 0.00 C ATOM 2941 CD2 LEU B 78 1.616 2.188 -2.323 1.00 0.00 C ATOM 0 H LEU B 78 4.543 -1.695 -0.695 1.00 0.00 H new ATOM 0 HA LEU B 78 5.613 0.655 -2.108 1.00 0.00 H new ATOM 0 HB2 LEU B 78 3.483 0.054 -3.202 1.00 0.00 H new ATOM 0 HB3 LEU B 78 2.676 0.015 -1.647 1.00 0.00 H new ATOM 0 HG LEU B 78 3.559 2.527 -1.509 1.00 0.00 H new ATOM 0 HD11 LEU B 78 3.457 3.610 -3.718 1.00 0.00 H new ATOM 0 HD12 LEU B 78 4.797 2.444 -3.616 1.00 0.00 H new ATOM 0 HD13 LEU B 78 3.308 2.013 -4.490 1.00 0.00 H new ATOM 0 HD21 LEU B 78 1.387 3.249 -2.425 1.00 0.00 H new ATOM 0 HD22 LEU B 78 1.160 1.638 -3.146 1.00 0.00 H new ATOM 0 HD23 LEU B 78 1.219 1.820 -1.377 1.00 0.00 H new ATOM 2953 N HIS B 79 5.507 1.968 -0.007 1.00 0.00 N ATOM 2954 CA HIS B 79 5.603 2.670 1.269 1.00 0.00 C ATOM 2955 C HIS B 79 5.750 4.173 1.049 1.00 0.00 C ATOM 2956 O HIS B 79 6.450 4.610 0.136 1.00 0.00 O ATOM 2957 CB HIS B 79 6.784 2.133 2.081 1.00 0.00 C ATOM 2958 CG HIS B 79 6.385 1.153 3.139 1.00 0.00 C ATOM 2959 ND1 HIS B 79 6.971 -0.089 3.276 1.00 0.00 N ATOM 2960 CD2 HIS B 79 5.451 1.235 4.117 1.00 0.00 C ATOM 2961 CE1 HIS B 79 6.415 -0.726 4.291 1.00 0.00 C ATOM 2962 NE2 HIS B 79 5.491 0.055 4.818 1.00 0.00 N ATOM 0 H HIS B 79 6.005 2.420 -0.774 1.00 0.00 H new ATOM 0 HA HIS B 79 4.684 2.495 1.828 1.00 0.00 H new ATOM 0 HB2 HIS B 79 7.493 1.656 1.404 1.00 0.00 H new ATOM 0 HB3 HIS B 79 7.303 2.969 2.549 1.00 0.00 H new ATOM 0 HD2 HIS B 79 4.797 2.073 4.309 1.00 0.00 H new ATOM 0 HE1 HIS B 79 6.673 -1.718 4.632 1.00 0.00 H new ATOM 0 HE2 HIS B 79 4.902 -0.180 5.617 1.00 0.00 H new ATOM 2971 N THR B 80 5.083 4.957 1.888 1.00 0.00 N ATOM 2972 CA THR B 80 5.134 6.411 1.783 1.00 0.00 C ATOM 2973 C THR B 80 5.545 7.044 3.110 1.00 0.00 C ATOM 2974 O THR B 80 5.306 6.480 4.179 1.00 0.00 O ATOM 2975 CB THR B 80 3.769 6.953 1.350 1.00 0.00 C ATOM 2976 OG1 THR B 80 3.232 6.175 0.295 1.00 0.00 O ATOM 2977 CG2 THR B 80 3.811 8.392 0.882 1.00 0.00 C ATOM 0 H THR B 80 4.500 4.610 2.649 1.00 0.00 H new ATOM 0 HA THR B 80 5.882 6.671 1.034 1.00 0.00 H new ATOM 0 HB THR B 80 3.144 6.898 2.242 1.00 0.00 H new ATOM 0 HG1 THR B 80 2.359 6.536 0.034 1.00 0.00 H new ATOM 0 HG21 THR B 80 2.810 8.709 0.591 1.00 0.00 H new ATOM 0 HG22 THR B 80 4.172 9.027 1.691 1.00 0.00 H new ATOM 0 HG23 THR B 80 4.481 8.477 0.027 1.00 0.00 H new ATOM 2985 N ALA B 81 6.150 8.224 3.034 1.00 0.00 N ATOM 2986 CA ALA B 81 6.581 8.946 4.225 1.00 0.00 C ATOM 2987 C ALA B 81 6.299 10.427 4.048 1.00 0.00 C ATOM 2988 O ALA B 81 6.420 10.953 2.943 1.00 0.00 O ATOM 2989 CB ALA B 81 8.060 8.717 4.502 1.00 0.00 C ATOM 0 H ALA B 81 6.354 8.702 2.156 1.00 0.00 H new ATOM 0 HA ALA B 81 6.022 8.570 5.082 1.00 0.00 H new ATOM 0 HB1 ALA B 81 8.352 9.268 5.396 1.00 0.00 H new ATOM 0 HB2 ALA B 81 8.241 7.653 4.656 1.00 0.00 H new ATOM 0 HB3 ALA B 81 8.647 9.066 3.653 1.00 0.00 H new ATOM 2995 N ALA B 82 5.905 11.099 5.120 1.00 0.00 N ATOM 2996 CA ALA B 82 5.597 12.514 5.023 1.00 0.00 C ATOM 2997 C ALA B 82 5.659 13.228 6.362 1.00 0.00 C ATOM 2998 O ALA B 82 5.022 12.826 7.335 1.00 0.00 O ATOM 2999 CB ALA B 82 4.236 12.698 4.392 1.00 0.00 C ATOM 0 H ALA B 82 5.793 10.695 6.050 1.00 0.00 H new ATOM 0 HA ALA B 82 6.363 12.967 4.394 1.00 0.00 H new ATOM 0 HB1 ALA B 82 4.009 13.762 4.321 1.00 0.00 H new ATOM 0 HB2 ALA B 82 4.235 12.259 3.394 1.00 0.00 H new ATOM 0 HB3 ALA B 82 3.481 12.206 5.005 1.00 0.00 H new ATOM 3005 N SER B 83 6.413 14.317 6.378 1.00 0.00 N ATOM 3006 CA SER B 83 6.556 15.142 7.559 1.00 0.00 C ATOM 3007 C SER B 83 5.900 16.491 7.294 1.00 0.00 C ATOM 3008 O SER B 83 6.323 17.231 6.407 1.00 0.00 O ATOM 3009 CB SER B 83 8.037 15.326 7.895 1.00 0.00 C ATOM 3010 OG SER B 83 8.203 15.941 9.161 1.00 0.00 O ATOM 0 H SER B 83 6.941 14.650 5.571 1.00 0.00 H new ATOM 0 HA SER B 83 6.072 14.661 8.409 1.00 0.00 H new ATOM 0 HB2 SER B 83 8.537 14.357 7.890 1.00 0.00 H new ATOM 0 HB3 SER B 83 8.514 15.935 7.127 1.00 0.00 H new ATOM 0 HG SER B 83 9.159 16.045 9.351 1.00 0.00 H new ATOM 3016 N CYS B 84 4.856 16.799 8.049 1.00 0.00 N ATOM 3017 CA CYS B 84 4.139 18.052 7.869 1.00 0.00 C ATOM 3018 C CYS B 84 4.595 19.095 8.877 1.00 0.00 C ATOM 3019 O CYS B 84 4.873 18.776 10.034 1.00 0.00 O ATOM 3020 CB CYS B 84 2.631 17.819 7.987 1.00 0.00 C ATOM 3021 SG CYS B 84 1.707 18.204 6.481 1.00 0.00 S ATOM 0 H CYS B 84 4.488 16.201 8.789 1.00 0.00 H new ATOM 0 HA CYS B 84 4.361 18.430 6.871 1.00 0.00 H new ATOM 0 HB2 CYS B 84 2.455 16.777 8.253 1.00 0.00 H new ATOM 0 HB3 CYS B 84 2.243 18.427 8.804 1.00 0.00 H new ATOM 0 HG CYS B 84 1.461 19.480 6.437 1.00 0.00 H new ATOM 3027 N TRP B 85 4.674 20.343 8.433 1.00 0.00 N ATOM 3028 CA TRP B 85 5.104 21.427 9.309 1.00 0.00 C ATOM 3029 C TRP B 85 3.999 21.846 10.288 1.00 0.00 C ATOM 3030 O TRP B 85 4.219 22.706 11.141 1.00 0.00 O ATOM 3031 CB TRP B 85 5.541 22.636 8.482 1.00 0.00 C ATOM 3032 CG TRP B 85 6.770 23.291 9.020 1.00 0.00 C ATOM 3033 CD1 TRP B 85 7.943 22.675 9.335 1.00 0.00 C ATOM 3034 CD2 TRP B 85 6.951 24.680 9.314 1.00 0.00 C ATOM 3035 NE1 TRP B 85 8.847 23.592 9.806 1.00 0.00 N ATOM 3036 CE2 TRP B 85 8.262 24.833 9.803 1.00 0.00 C ATOM 3037 CE3 TRP B 85 6.135 25.809 9.210 1.00 0.00 C ATOM 3038 CZ2 TRP B 85 8.774 26.069 10.188 1.00 0.00 C ATOM 3039 CZ3 TRP B 85 6.644 27.036 9.591 1.00 0.00 C ATOM 3040 CH2 TRP B 85 7.953 27.158 10.075 1.00 0.00 C ATOM 0 H TRP B 85 4.448 20.629 7.480 1.00 0.00 H new ATOM 0 HA TRP B 85 5.947 21.056 9.892 1.00 0.00 H new ATOM 0 HB2 TRP B 85 5.723 22.321 7.454 1.00 0.00 H new ATOM 0 HB3 TRP B 85 4.730 23.363 8.454 1.00 0.00 H new ATOM 0 HD1 TRP B 85 8.134 21.617 9.229 1.00 0.00 H new ATOM 0 HE1 TRP B 85 9.799 23.385 10.109 1.00 0.00 H new ATOM 0 HE3 TRP B 85 5.124 25.724 8.838 1.00 0.00 H new ATOM 0 HZ2 TRP B 85 9.783 26.165 10.562 1.00 0.00 H new ATOM 0 HZ3 TRP B 85 6.022 27.916 9.514 1.00 0.00 H new ATOM 0 HH2 TRP B 85 8.322 28.131 10.365 1.00 0.00 H new ATOM 3051 N TRP B 86 2.814 21.244 10.168 1.00 0.00 N ATOM 3052 CA TRP B 86 1.698 21.576 11.053 1.00 0.00 C ATOM 3053 C TRP B 86 1.099 20.310 11.657 1.00 0.00 C ATOM 3054 O TRP B 86 1.489 19.198 11.299 1.00 0.00 O ATOM 3055 CB TRP B 86 0.613 22.355 10.294 1.00 0.00 C ATOM 3056 CG TRP B 86 1.153 23.236 9.208 1.00 0.00 C ATOM 3057 CD1 TRP B 86 1.583 24.524 9.333 1.00 0.00 C ATOM 3058 CD2 TRP B 86 1.331 22.883 7.832 1.00 0.00 C ATOM 3059 NE1 TRP B 86 2.020 24.993 8.120 1.00 0.00 N ATOM 3060 CE2 TRP B 86 1.874 24.005 7.182 1.00 0.00 C ATOM 3061 CE3 TRP B 86 1.085 21.726 7.088 1.00 0.00 C ATOM 3062 CZ2 TRP B 86 2.175 24.004 5.822 1.00 0.00 C ATOM 3063 CZ3 TRP B 86 1.384 21.727 5.738 1.00 0.00 C ATOM 3064 CH2 TRP B 86 1.925 22.859 5.118 1.00 0.00 C ATOM 0 H TRP B 86 2.604 20.529 9.471 1.00 0.00 H new ATOM 0 HA TRP B 86 2.082 22.204 11.857 1.00 0.00 H new ATOM 0 HB2 TRP B 86 -0.093 21.647 9.859 1.00 0.00 H new ATOM 0 HB3 TRP B 86 0.055 22.967 11.002 1.00 0.00 H new ATOM 0 HD1 TRP B 86 1.580 25.092 10.252 1.00 0.00 H new ATOM 0 HE1 TRP B 86 2.393 25.926 7.945 1.00 0.00 H new ATOM 0 HE3 TRP B 86 0.669 20.847 7.559 1.00 0.00 H new ATOM 0 HZ2 TRP B 86 2.591 24.877 5.341 1.00 0.00 H new ATOM 0 HZ3 TRP B 86 1.197 20.839 5.152 1.00 0.00 H new ATOM 0 HH2 TRP B 86 2.150 22.827 4.062 1.00 0.00 H new ATOM 3075 N ASP B 87 0.153 20.482 12.575 1.00 0.00 N ATOM 3076 CA ASP B 87 -0.491 19.345 13.223 1.00 0.00 C ATOM 3077 C ASP B 87 -1.712 19.783 14.027 1.00 0.00 C ATOM 3078 O ASP B 87 -2.756 19.130 13.991 1.00 0.00 O ATOM 3079 CB ASP B 87 0.501 18.627 14.140 1.00 0.00 C ATOM 3080 CG ASP B 87 0.298 17.124 14.147 1.00 0.00 C ATOM 3081 OD1 ASP B 87 -0.494 16.636 14.980 1.00 0.00 O ATOM 3082 OD2 ASP B 87 0.932 16.436 13.321 1.00 0.00 O ATOM 0 H ASP B 87 -0.183 21.393 12.886 1.00 0.00 H new ATOM 0 HA ASP B 87 -0.823 18.661 12.442 1.00 0.00 H new ATOM 0 HB2 ASP B 87 1.518 18.852 13.818 1.00 0.00 H new ATOM 0 HB3 ASP B 87 0.396 19.010 15.155 1.00 0.00 H new ATOM 3087 N SER B 88 -1.576 20.886 14.755 1.00 0.00 N ATOM 3088 CA SER B 88 -2.671 21.400 15.570 1.00 0.00 C ATOM 3089 C SER B 88 -3.884 21.742 14.710 1.00 0.00 C ATOM 3090 O SER B 88 -5.025 21.635 15.159 1.00 0.00 O ATOM 3091 CB SER B 88 -2.217 22.639 16.345 1.00 0.00 C ATOM 3092 OG SER B 88 -3.163 22.994 17.340 1.00 0.00 O ATOM 0 H SER B 88 -0.721 21.440 14.798 1.00 0.00 H new ATOM 0 HA SER B 88 -2.960 20.620 16.275 1.00 0.00 H new ATOM 0 HB2 SER B 88 -1.250 22.447 16.810 1.00 0.00 H new ATOM 0 HB3 SER B 88 -2.079 23.472 15.656 1.00 0.00 H new ATOM 0 HG SER B 88 -2.849 23.787 17.822 1.00 0.00 H new ATOM 3098 N THR B 89 -3.631 22.148 13.470 1.00 0.00 N ATOM 3099 CA THR B 89 -4.702 22.498 12.546 1.00 0.00 C ATOM 3100 C THR B 89 -4.848 21.436 11.463 1.00 0.00 C ATOM 3101 O THR B 89 -5.955 21.018 11.133 1.00 0.00 O ATOM 3102 CB THR B 89 -4.438 23.866 11.911 1.00 0.00 C ATOM 3103 OG1 THR B 89 -5.316 24.089 10.821 1.00 0.00 O ATOM 3104 CG2 THR B 89 -3.022 24.031 11.398 1.00 0.00 C ATOM 0 H THR B 89 -2.692 22.243 13.082 1.00 0.00 H new ATOM 0 HA THR B 89 -5.633 22.548 13.110 1.00 0.00 H new ATOM 0 HB THR B 89 -4.603 24.589 12.710 1.00 0.00 H new ATOM 0 HG1 THR B 89 -6.242 23.963 11.116 1.00 0.00 H new ATOM 0 HG21 THR B 89 -2.906 25.023 10.961 1.00 0.00 H new ATOM 0 HG22 THR B 89 -2.320 23.914 12.224 1.00 0.00 H new ATOM 0 HG23 THR B 89 -2.819 23.275 10.639 1.00 0.00 H new ATOM 3112 N THR B 90 -3.717 21.006 10.915 1.00 0.00 N ATOM 3113 CA THR B 90 -3.705 19.995 9.866 1.00 0.00 C ATOM 3114 C THR B 90 -3.915 18.604 10.449 1.00 0.00 C ATOM 3115 O THR B 90 -2.962 17.846 10.632 1.00 0.00 O ATOM 3116 CB THR B 90 -2.382 20.045 9.100 1.00 0.00 C ATOM 3117 OG1 THR B 90 -1.288 19.748 9.952 1.00 0.00 O ATOM 3118 CG2 THR B 90 -2.122 21.391 8.460 1.00 0.00 C ATOM 0 H THR B 90 -2.793 21.344 11.182 1.00 0.00 H new ATOM 0 HA THR B 90 -4.524 20.208 9.180 1.00 0.00 H new ATOM 0 HB THR B 90 -2.473 19.295 8.314 1.00 0.00 H new ATOM 0 HG1 THR B 90 -1.469 18.917 10.440 1.00 0.00 H new ATOM 0 HG21 THR B 90 -1.169 21.365 7.931 1.00 0.00 H new ATOM 0 HG22 THR B 90 -2.922 21.619 7.755 1.00 0.00 H new ATOM 0 HG23 THR B 90 -2.087 22.160 9.232 1.00 0.00 H new ATOM 3126 N ASP B 91 -5.169 18.271 10.742 1.00 0.00 N ATOM 3127 CA ASP B 91 -5.494 16.967 11.307 1.00 0.00 C ATOM 3128 C ASP B 91 -6.637 16.293 10.554 1.00 0.00 C ATOM 3129 O ASP B 91 -7.793 16.355 10.974 1.00 0.00 O ATOM 3130 CB ASP B 91 -5.852 17.105 12.787 1.00 0.00 C ATOM 3131 CG ASP B 91 -5.994 15.761 13.475 1.00 0.00 C ATOM 3132 OD1 ASP B 91 -7.024 15.088 13.257 1.00 0.00 O ATOM 3133 OD2 ASP B 91 -5.076 15.381 14.231 1.00 0.00 O ATOM 0 H ASP B 91 -5.972 18.883 10.598 1.00 0.00 H new ATOM 0 HA ASP B 91 -4.611 16.336 11.206 1.00 0.00 H new ATOM 0 HB2 ASP B 91 -5.082 17.689 13.291 1.00 0.00 H new ATOM 0 HB3 ASP B 91 -6.786 17.659 12.882 1.00 0.00 H new ATOM 3138 N GLY B 92 -6.303 15.648 9.441 1.00 0.00 N ATOM 3139 CA GLY B 92 -7.317 14.966 8.648 1.00 0.00 C ATOM 3140 C GLY B 92 -6.789 13.785 7.840 1.00 0.00 C ATOM 3141 O GLY B 92 -7.539 12.849 7.558 1.00 0.00 O ATOM 0 H GLY B 92 -5.354 15.584 9.073 1.00 0.00 H new ATOM 0 HA2 GLY B 92 -8.106 14.613 9.313 1.00 0.00 H new ATOM 0 HA3 GLY B 92 -7.772 15.684 7.966 1.00 0.00 H new ATOM 3145 N SER B 93 -5.507 13.838 7.450 1.00 0.00 N ATOM 3146 CA SER B 93 -4.858 12.786 6.650 1.00 0.00 C ATOM 3147 C SER B 93 -5.368 11.373 6.954 1.00 0.00 C ATOM 3148 O SER B 93 -5.131 10.829 8.031 1.00 0.00 O ATOM 3149 CB SER B 93 -3.347 12.833 6.871 1.00 0.00 C ATOM 3150 OG SER B 93 -3.023 12.592 8.229 1.00 0.00 O ATOM 0 H SER B 93 -4.888 14.615 7.681 1.00 0.00 H new ATOM 0 HA SER B 93 -5.111 12.993 5.610 1.00 0.00 H new ATOM 0 HB2 SER B 93 -2.861 12.089 6.240 1.00 0.00 H new ATOM 0 HB3 SER B 93 -2.962 13.807 6.569 1.00 0.00 H new ATOM 0 HG SER B 93 -3.602 11.885 8.583 1.00 0.00 H new ATOM 3156 N ARG B 94 -6.052 10.785 5.974 1.00 0.00 N ATOM 3157 CA ARG B 94 -6.584 9.433 6.100 1.00 0.00 C ATOM 3158 C ARG B 94 -6.488 8.714 4.755 1.00 0.00 C ATOM 3159 O ARG B 94 -7.103 9.134 3.774 1.00 0.00 O ATOM 3160 CB ARG B 94 -8.034 9.467 6.594 1.00 0.00 C ATOM 3161 CG ARG B 94 -8.200 8.947 8.013 1.00 0.00 C ATOM 3162 CD ARG B 94 -8.003 10.051 9.039 1.00 0.00 C ATOM 3163 NE ARG B 94 -7.287 9.577 10.223 1.00 0.00 N ATOM 3164 CZ ARG B 94 -6.812 10.375 11.178 1.00 0.00 C ATOM 3165 NH1 ARG B 94 -6.972 11.692 11.103 1.00 0.00 N ATOM 3166 NH2 ARG B 94 -6.173 9.853 12.217 1.00 0.00 N ATOM 0 H ARG B 94 -6.251 11.230 5.078 1.00 0.00 H new ATOM 0 HA ARG B 94 -5.992 8.887 6.835 1.00 0.00 H new ATOM 0 HB2 ARG B 94 -8.403 10.491 6.545 1.00 0.00 H new ATOM 0 HB3 ARG B 94 -8.653 8.872 5.922 1.00 0.00 H new ATOM 0 HG2 ARG B 94 -9.194 8.515 8.129 1.00 0.00 H new ATOM 0 HG3 ARG B 94 -7.481 8.148 8.195 1.00 0.00 H new ATOM 0 HD2 ARG B 94 -7.449 10.873 8.585 1.00 0.00 H new ATOM 0 HD3 ARG B 94 -8.974 10.447 9.337 1.00 0.00 H new ATOM 0 HE ARG B 94 -7.142 8.572 10.324 1.00 0.00 H new ATOM 0 HH11 ARG B 94 -7.463 12.102 10.308 1.00 0.00 H new ATOM 0 HH12 ARG B 94 -6.604 12.293 11.840 1.00 0.00 H new ATOM 0 HH21 ARG B 94 -6.046 8.843 12.283 1.00 0.00 H new ATOM 0 HH22 ARG B 94 -5.808 10.462 12.950 1.00 0.00 H new ATOM 3180 N THR B 95 -5.691 7.649 4.707 1.00 0.00 N ATOM 3181 CA THR B 95 -5.494 6.899 3.471 1.00 0.00 C ATOM 3182 C THR B 95 -6.479 5.742 3.323 1.00 0.00 C ATOM 3183 O THR B 95 -6.915 5.146 4.307 1.00 0.00 O ATOM 3184 CB THR B 95 -4.065 6.375 3.397 1.00 0.00 C ATOM 3185 OG1 THR B 95 -3.852 5.667 2.190 1.00 0.00 O ATOM 3186 CG2 THR B 95 -3.716 5.456 4.537 1.00 0.00 C ATOM 0 H THR B 95 -5.173 7.287 5.508 1.00 0.00 H new ATOM 0 HA THR B 95 -5.679 7.589 2.648 1.00 0.00 H new ATOM 0 HB THR B 95 -3.426 7.257 3.451 1.00 0.00 H new ATOM 0 HG1 THR B 95 -4.042 6.254 1.429 1.00 0.00 H new ATOM 0 HG21 THR B 95 -2.686 5.116 4.428 1.00 0.00 H new ATOM 0 HG22 THR B 95 -3.824 5.990 5.481 1.00 0.00 H new ATOM 0 HG23 THR B 95 -4.385 4.595 4.528 1.00 0.00 H new ATOM 3194 N VAL B 96 -6.806 5.429 2.071 1.00 0.00 N ATOM 3195 CA VAL B 96 -7.721 4.339 1.748 1.00 0.00 C ATOM 3196 C VAL B 96 -7.064 3.385 0.762 1.00 0.00 C ATOM 3197 O VAL B 96 -6.285 3.811 -0.087 1.00 0.00 O ATOM 3198 CB VAL B 96 -9.034 4.854 1.129 1.00 0.00 C ATOM 3199 CG1 VAL B 96 -10.055 3.732 1.029 1.00 0.00 C ATOM 3200 CG2 VAL B 96 -9.591 6.017 1.932 1.00 0.00 C ATOM 0 H VAL B 96 -6.445 5.923 1.255 1.00 0.00 H new ATOM 0 HA VAL B 96 -7.954 3.827 2.682 1.00 0.00 H new ATOM 0 HB VAL B 96 -8.818 5.211 0.122 1.00 0.00 H new ATOM 0 HG11 VAL B 96 -10.976 4.116 0.589 1.00 0.00 H new ATOM 0 HG12 VAL B 96 -9.658 2.934 0.401 1.00 0.00 H new ATOM 0 HG13 VAL B 96 -10.264 3.341 2.025 1.00 0.00 H new ATOM 0 HG21 VAL B 96 -10.518 6.363 1.475 1.00 0.00 H new ATOM 0 HG22 VAL B 96 -9.789 5.692 2.954 1.00 0.00 H new ATOM 0 HG23 VAL B 96 -8.866 6.831 1.944 1.00 0.00 H new ATOM 3210 N ARG B 97 -7.365 2.097 0.875 1.00 0.00 N ATOM 3211 CA ARG B 97 -6.776 1.107 -0.021 1.00 0.00 C ATOM 3212 C ARG B 97 -7.843 0.308 -0.767 1.00 0.00 C ATOM 3213 O ARG B 97 -8.543 -0.518 -0.181 1.00 0.00 O ATOM 3214 CB ARG B 97 -5.871 0.157 0.763 1.00 0.00 C ATOM 3215 CG ARG B 97 -4.875 0.871 1.665 1.00 0.00 C ATOM 3216 CD ARG B 97 -3.489 0.924 1.040 1.00 0.00 C ATOM 3217 NE ARG B 97 -2.464 1.301 2.012 1.00 0.00 N ATOM 3218 CZ ARG B 97 -1.152 1.205 1.790 1.00 0.00 C ATOM 3219 NH1 ARG B 97 -0.694 0.743 0.631 1.00 0.00 N ATOM 3220 NH2 ARG B 97 -0.295 1.572 2.733 1.00 0.00 N ATOM 0 H ARG B 97 -8.006 1.715 1.570 1.00 0.00 H new ATOM 0 HA ARG B 97 -6.185 1.647 -0.761 1.00 0.00 H new ATOM 0 HB2 ARG B 97 -6.490 -0.503 1.370 1.00 0.00 H new ATOM 0 HB3 ARG B 97 -5.326 -0.474 0.061 1.00 0.00 H new ATOM 0 HG2 ARG B 97 -5.224 1.884 1.863 1.00 0.00 H new ATOM 0 HG3 ARG B 97 -4.822 0.359 2.626 1.00 0.00 H new ATOM 0 HD2 ARG B 97 -3.245 -0.050 0.615 1.00 0.00 H new ATOM 0 HD3 ARG B 97 -3.489 1.639 0.218 1.00 0.00 H new ATOM 0 HE ARG B 97 -2.771 1.660 2.916 1.00 0.00 H new ATOM 0 HH11 ARG B 97 -1.347 0.458 -0.098 1.00 0.00 H new ATOM 0 HH12 ARG B 97 0.311 0.673 0.471 1.00 0.00 H new ATOM 0 HH21 ARG B 97 -0.639 1.927 3.625 1.00 0.00 H new ATOM 0 HH22 ARG B 97 0.709 1.500 2.566 1.00 0.00 H new ATOM 3234 N TRP B 98 -7.939 0.548 -2.071 1.00 0.00 N ATOM 3235 CA TRP B 98 -8.892 -0.158 -2.924 1.00 0.00 C ATOM 3236 C TRP B 98 -8.178 -1.316 -3.625 1.00 0.00 C ATOM 3237 O TRP B 98 -7.045 -1.168 -4.084 1.00 0.00 O ATOM 3238 CB TRP B 98 -9.459 0.809 -3.980 1.00 0.00 C ATOM 3239 CG TRP B 98 -10.865 1.285 -3.742 1.00 0.00 C ATOM 3240 CD1 TRP B 98 -11.312 2.566 -3.882 1.00 0.00 C ATOM 3241 CD2 TRP B 98 -12.009 0.508 -3.353 1.00 0.00 C ATOM 3242 NE1 TRP B 98 -12.657 2.629 -3.620 1.00 0.00 N ATOM 3243 CE2 TRP B 98 -13.104 1.390 -3.280 1.00 0.00 C ATOM 3244 CE3 TRP B 98 -12.219 -0.838 -3.058 1.00 0.00 C ATOM 3245 CZ2 TRP B 98 -14.381 0.975 -2.926 1.00 0.00 C ATOM 3246 CZ3 TRP B 98 -13.491 -1.254 -2.706 1.00 0.00 C ATOM 3247 CH2 TRP B 98 -14.558 -0.349 -2.641 1.00 0.00 C ATOM 0 H TRP B 98 -7.364 1.231 -2.564 1.00 0.00 H new ATOM 0 HA TRP B 98 -9.709 -0.544 -2.315 1.00 0.00 H new ATOM 0 HB2 TRP B 98 -8.805 1.679 -4.037 1.00 0.00 H new ATOM 0 HB3 TRP B 98 -9.421 0.318 -4.953 1.00 0.00 H new ATOM 0 HD1 TRP B 98 -10.696 3.409 -4.159 1.00 0.00 H new ATOM 0 HE1 TRP B 98 -13.231 3.471 -3.672 1.00 0.00 H new ATOM 0 HE3 TRP B 98 -11.403 -1.544 -3.103 1.00 0.00 H new ATOM 0 HZ2 TRP B 98 -15.204 1.673 -2.878 1.00 0.00 H new ATOM 0 HZ3 TRP B 98 -13.664 -2.295 -2.477 1.00 0.00 H new ATOM 0 HH2 TRP B 98 -15.538 -0.705 -2.360 1.00 0.00 H new ATOM 3258 N GLU B 99 -8.841 -2.461 -3.707 1.00 0.00 N ATOM 3259 CA GLU B 99 -8.262 -3.632 -4.353 1.00 0.00 C ATOM 3260 C GLU B 99 -9.340 -4.437 -5.074 1.00 0.00 C ATOM 3261 O GLU B 99 -10.487 -4.489 -4.632 1.00 0.00 O ATOM 3262 CB GLU B 99 -7.549 -4.506 -3.316 1.00 0.00 C ATOM 3263 CG GLU B 99 -6.040 -4.318 -3.300 1.00 0.00 C ATOM 3264 CD GLU B 99 -5.498 -4.015 -1.917 1.00 0.00 C ATOM 3265 OE1 GLU B 99 -5.821 -4.768 -0.975 1.00 0.00 O ATOM 3266 OE2 GLU B 99 -4.751 -3.024 -1.776 1.00 0.00 O ATOM 0 H GLU B 99 -9.780 -2.605 -3.335 1.00 0.00 H new ATOM 0 HA GLU B 99 -7.534 -3.296 -5.092 1.00 0.00 H new ATOM 0 HB2 GLU B 99 -7.946 -4.279 -2.327 1.00 0.00 H new ATOM 0 HB3 GLU B 99 -7.775 -5.553 -3.518 1.00 0.00 H new ATOM 0 HG2 GLU B 99 -5.562 -5.220 -3.682 1.00 0.00 H new ATOM 0 HG3 GLU B 99 -5.773 -3.505 -3.976 1.00 0.00 H new ATOM 3273 N ASN B 100 -8.964 -5.057 -6.188 1.00 0.00 N ATOM 3274 CA ASN B 100 -9.903 -5.856 -6.969 1.00 0.00 C ATOM 3275 C ASN B 100 -9.367 -7.263 -7.205 1.00 0.00 C ATOM 3276 O ASN B 100 -10.047 -8.251 -6.924 1.00 0.00 O ATOM 3277 CB ASN B 100 -10.199 -5.176 -8.309 1.00 0.00 C ATOM 3278 CG ASN B 100 -8.943 -4.688 -9.006 1.00 0.00 C ATOM 3279 OD1 ASN B 100 -8.106 -4.018 -8.403 1.00 0.00 O ATOM 3280 ND2 ASN B 100 -8.809 -5.021 -10.285 1.00 0.00 N ATOM 0 H ASN B 100 -8.019 -5.022 -6.570 1.00 0.00 H new ATOM 0 HA ASN B 100 -10.828 -5.935 -6.398 1.00 0.00 H new ATOM 0 HB2 ASN B 100 -10.722 -5.876 -8.960 1.00 0.00 H new ATOM 0 HB3 ASN B 100 -10.869 -4.333 -8.144 1.00 0.00 H new ATOM 0 HD21 ASN B 100 -7.986 -4.719 -10.807 1.00 0.00 H new ATOM 0 HD22 ASN B 100 -9.529 -5.578 -10.745 1.00 0.00 H new ATOM 3287 N LYS B 101 -8.146 -7.351 -7.722 1.00 0.00 N ATOM 3288 CA LYS B 101 -7.529 -8.643 -7.995 1.00 0.00 C ATOM 3289 C LYS B 101 -6.007 -8.542 -7.986 1.00 0.00 C ATOM 3290 O LYS B 101 -5.324 -9.384 -7.403 1.00 0.00 O ATOM 3291 CB LYS B 101 -8.004 -9.182 -9.345 1.00 0.00 C ATOM 3292 CG LYS B 101 -7.897 -8.171 -10.474 1.00 0.00 C ATOM 3293 CD LYS B 101 -6.611 -8.353 -11.266 1.00 0.00 C ATOM 3294 CE LYS B 101 -6.824 -9.240 -12.483 1.00 0.00 C ATOM 3295 NZ LYS B 101 -6.063 -8.751 -13.667 1.00 0.00 N ATOM 0 H LYS B 101 -7.566 -6.546 -7.959 1.00 0.00 H new ATOM 0 HA LYS B 101 -7.831 -9.331 -7.205 1.00 0.00 H new ATOM 0 HB2 LYS B 101 -7.418 -10.064 -9.601 1.00 0.00 H new ATOM 0 HB3 LYS B 101 -9.041 -9.504 -9.254 1.00 0.00 H new ATOM 0 HG2 LYS B 101 -8.753 -8.276 -11.140 1.00 0.00 H new ATOM 0 HG3 LYS B 101 -7.933 -7.162 -10.064 1.00 0.00 H new ATOM 0 HD2 LYS B 101 -6.239 -7.380 -11.585 1.00 0.00 H new ATOM 0 HD3 LYS B 101 -5.847 -8.792 -10.624 1.00 0.00 H new ATOM 0 HE2 LYS B 101 -6.515 -10.259 -12.248 1.00 0.00 H new ATOM 0 HE3 LYS B 101 -7.886 -9.277 -12.724 1.00 0.00 H new ATOM 0 HZ1 LYS B 101 -6.235 -9.383 -14.475 1.00 0.00 H new ATOM 0 HZ2 LYS B 101 -6.375 -7.789 -13.907 1.00 0.00 H new ATOM 0 HZ3 LYS B 101 -5.047 -8.740 -13.446 1.00 0.00 H new ATOM 3309 N SER B 102 -5.481 -7.511 -8.637 1.00 0.00 N ATOM 3310 CA SER B 102 -4.038 -7.309 -8.704 1.00 0.00 C ATOM 3311 C SER B 102 -3.680 -5.828 -8.639 1.00 0.00 C ATOM 3312 O SER B 102 -2.771 -5.431 -7.910 1.00 0.00 O ATOM 3313 CB SER B 102 -3.477 -7.923 -9.988 1.00 0.00 C ATOM 3314 OG SER B 102 -2.059 -7.898 -9.989 1.00 0.00 O ATOM 0 H SER B 102 -6.030 -6.803 -9.125 1.00 0.00 H new ATOM 0 HA SER B 102 -3.592 -7.805 -7.841 1.00 0.00 H new ATOM 0 HB2 SER B 102 -3.826 -8.951 -10.086 1.00 0.00 H new ATOM 0 HB3 SER B 102 -3.854 -7.375 -10.852 1.00 0.00 H new ATOM 0 HG SER B 102 -1.725 -8.297 -10.819 1.00 0.00 H new ATOM 3320 N MET B 103 -4.398 -5.014 -9.405 1.00 0.00 N ATOM 3321 CA MET B 103 -4.150 -3.577 -9.432 1.00 0.00 C ATOM 3322 C MET B 103 -4.728 -2.902 -8.193 1.00 0.00 C ATOM 3323 O MET B 103 -5.943 -2.850 -8.012 1.00 0.00 O ATOM 3324 CB MET B 103 -4.753 -2.957 -10.693 1.00 0.00 C ATOM 3325 CG MET B 103 -3.996 -1.738 -11.193 1.00 0.00 C ATOM 3326 SD MET B 103 -4.151 -0.325 -10.085 1.00 0.00 S ATOM 3327 CE MET B 103 -2.442 0.198 -9.967 1.00 0.00 C ATOM 0 H MET B 103 -5.155 -5.324 -10.014 1.00 0.00 H new ATOM 0 HA MET B 103 -3.071 -3.420 -9.439 1.00 0.00 H new ATOM 0 HB2 MET B 103 -4.776 -3.709 -11.482 1.00 0.00 H new ATOM 0 HB3 MET B 103 -5.786 -2.675 -10.491 1.00 0.00 H new ATOM 0 HG2 MET B 103 -2.942 -1.991 -11.308 1.00 0.00 H new ATOM 0 HG3 MET B 103 -4.368 -1.464 -12.180 1.00 0.00 H new ATOM 0 HE1 MET B 103 -2.191 0.388 -8.924 1.00 0.00 H new ATOM 0 HE2 MET B 103 -1.794 -0.586 -10.359 1.00 0.00 H new ATOM 0 HE3 MET B 103 -2.300 1.110 -10.547 1.00 0.00 H new ATOM 3337 N TYR B 104 -3.848 -2.383 -7.341 1.00 0.00 N ATOM 3338 CA TYR B 104 -4.277 -1.711 -6.119 1.00 0.00 C ATOM 3339 C TYR B 104 -4.202 -0.196 -6.279 1.00 0.00 C ATOM 3340 O TYR B 104 -3.310 0.323 -6.950 1.00 0.00 O ATOM 3341 CB TYR B 104 -3.416 -2.156 -4.931 1.00 0.00 C ATOM 3342 CG TYR B 104 -3.160 -3.653 -4.856 1.00 0.00 C ATOM 3343 CD1 TYR B 104 -4.002 -4.570 -5.483 1.00 0.00 C ATOM 3344 CD2 TYR B 104 -2.071 -4.147 -4.148 1.00 0.00 C ATOM 3345 CE1 TYR B 104 -3.763 -5.930 -5.403 1.00 0.00 C ATOM 3346 CE2 TYR B 104 -1.826 -5.505 -4.067 1.00 0.00 C ATOM 3347 CZ TYR B 104 -2.675 -6.391 -4.696 1.00 0.00 C ATOM 3348 OH TYR B 104 -2.434 -7.743 -4.616 1.00 0.00 O ATOM 0 H TYR B 104 -2.837 -2.415 -7.474 1.00 0.00 H new ATOM 0 HA TYR B 104 -5.313 -1.989 -5.927 1.00 0.00 H new ATOM 0 HB2 TYR B 104 -2.457 -1.640 -4.981 1.00 0.00 H new ATOM 0 HB3 TYR B 104 -3.902 -1.838 -4.009 1.00 0.00 H new ATOM 0 HD1 TYR B 104 -4.855 -4.213 -6.041 1.00 0.00 H new ATOM 0 HD2 TYR B 104 -1.404 -3.457 -3.652 1.00 0.00 H new ATOM 0 HE1 TYR B 104 -4.427 -6.627 -5.893 1.00 0.00 H new ATOM 0 HE2 TYR B 104 -0.974 -5.870 -3.514 1.00 0.00 H new ATOM 0 HH TYR B 104 -1.628 -7.900 -4.082 1.00 0.00 H new ATOM 3358 N CYS B 105 -5.143 0.506 -5.658 1.00 0.00 N ATOM 3359 CA CYS B 105 -5.183 1.963 -5.733 1.00 0.00 C ATOM 3360 C CYS B 105 -5.392 2.575 -4.351 1.00 0.00 C ATOM 3361 O CYS B 105 -6.436 2.381 -3.727 1.00 0.00 O ATOM 3362 CB CYS B 105 -6.297 2.415 -6.678 1.00 0.00 C ATOM 3363 SG CYS B 105 -6.140 1.774 -8.361 1.00 0.00 S ATOM 0 H CYS B 105 -5.888 0.091 -5.098 1.00 0.00 H new ATOM 0 HA CYS B 105 -4.225 2.308 -6.121 1.00 0.00 H new ATOM 0 HB2 CYS B 105 -7.257 2.100 -6.268 1.00 0.00 H new ATOM 0 HB3 CYS B 105 -6.308 3.504 -6.715 1.00 0.00 H new ATOM 0 HG CYS B 105 -5.129 0.960 -8.423 1.00 0.00 H new ATOM 3369 N ILE B 106 -4.394 3.316 -3.880 1.00 0.00 N ATOM 3370 CA ILE B 106 -4.469 3.958 -2.574 1.00 0.00 C ATOM 3371 C ILE B 106 -4.783 5.447 -2.723 1.00 0.00 C ATOM 3372 O ILE B 106 -4.204 6.133 -3.561 1.00 0.00 O ATOM 3373 CB ILE B 106 -3.151 3.757 -1.778 1.00 0.00 C ATOM 3374 CG1 ILE B 106 -3.125 4.593 -0.490 1.00 0.00 C ATOM 3375 CG2 ILE B 106 -1.947 4.090 -2.640 1.00 0.00 C ATOM 3376 CD1 ILE B 106 -2.455 3.880 0.660 1.00 0.00 C ATOM 0 H ILE B 106 -3.524 3.486 -4.384 1.00 0.00 H new ATOM 0 HA ILE B 106 -5.278 3.488 -2.014 1.00 0.00 H new ATOM 0 HB ILE B 106 -3.106 2.706 -1.493 1.00 0.00 H new ATOM 0 HG12 ILE B 106 -2.604 5.531 -0.682 1.00 0.00 H new ATOM 0 HG13 ILE B 106 -4.146 4.848 -0.207 1.00 0.00 H new ATOM 0 HG21 ILE B 106 -1.034 3.942 -2.063 1.00 0.00 H new ATOM 0 HG22 ILE B 106 -1.933 3.438 -3.513 1.00 0.00 H new ATOM 0 HG23 ILE B 106 -2.007 5.129 -2.964 1.00 0.00 H new ATOM 0 HD11 ILE B 106 -2.467 4.520 1.542 1.00 0.00 H new ATOM 0 HD12 ILE B 106 -2.990 2.955 0.876 1.00 0.00 H new ATOM 0 HD13 ILE B 106 -1.424 3.649 0.394 1.00 0.00 H new ATOM 3388 N CYS B 107 -5.705 5.938 -1.902 1.00 0.00 N ATOM 3389 CA CYS B 107 -6.092 7.342 -1.941 1.00 0.00 C ATOM 3390 C CYS B 107 -6.277 7.895 -0.534 1.00 0.00 C ATOM 3391 O CYS B 107 -7.085 7.383 0.242 1.00 0.00 O ATOM 3392 CB CYS B 107 -7.378 7.522 -2.744 1.00 0.00 C ATOM 3393 SG CYS B 107 -7.912 9.242 -2.907 1.00 0.00 S ATOM 0 H CYS B 107 -6.198 5.384 -1.202 1.00 0.00 H new ATOM 0 HA CYS B 107 -5.290 7.896 -2.429 1.00 0.00 H new ATOM 0 HB2 CYS B 107 -7.234 7.102 -3.739 1.00 0.00 H new ATOM 0 HB3 CYS B 107 -8.174 6.949 -2.268 1.00 0.00 H new ATOM 0 HG CYS B 107 -9.008 9.292 -3.605 1.00 0.00 H new ATOM 3399 N THR B 108 -5.532 8.945 -0.211 1.00 0.00 N ATOM 3400 CA THR B 108 -5.622 9.568 1.103 1.00 0.00 C ATOM 3401 C THR B 108 -6.239 10.959 1.019 1.00 0.00 C ATOM 3402 O THR B 108 -5.919 11.747 0.123 1.00 0.00 O ATOM 3403 CB THR B 108 -4.239 9.630 1.782 1.00 0.00 C ATOM 3404 OG1 THR B 108 -4.380 9.731 3.187 1.00 0.00 O ATOM 3405 CG2 THR B 108 -3.360 10.788 1.331 1.00 0.00 C ATOM 0 H THR B 108 -4.859 9.382 -0.841 1.00 0.00 H new ATOM 0 HA THR B 108 -6.277 8.947 1.714 1.00 0.00 H new ATOM 0 HB THR B 108 -3.749 8.704 1.483 1.00 0.00 H new ATOM 0 HG1 THR B 108 -3.493 9.768 3.603 1.00 0.00 H new ATOM 0 HG21 THR B 108 -2.408 10.751 1.861 1.00 0.00 H new ATOM 0 HG22 THR B 108 -3.181 10.713 0.258 1.00 0.00 H new ATOM 0 HG23 THR B 108 -3.860 11.731 1.550 1.00 0.00 H new ATOM 3413 N VAL B 109 -7.102 11.255 1.979 1.00 0.00 N ATOM 3414 CA VAL B 109 -7.749 12.554 2.048 1.00 0.00 C ATOM 3415 C VAL B 109 -7.245 13.294 3.270 1.00 0.00 C ATOM 3416 O VAL B 109 -7.318 12.786 4.390 1.00 0.00 O ATOM 3417 CB VAL B 109 -9.298 12.471 2.120 1.00 0.00 C ATOM 3418 CG1 VAL B 109 -9.922 13.547 1.245 1.00 0.00 C ATOM 3419 CG2 VAL B 109 -9.810 11.096 1.724 1.00 0.00 C ATOM 0 H VAL B 109 -7.370 10.610 2.723 1.00 0.00 H new ATOM 0 HA VAL B 109 -7.498 13.079 1.126 1.00 0.00 H new ATOM 0 HB VAL B 109 -9.592 12.640 3.156 1.00 0.00 H new ATOM 0 HG11 VAL B 109 -11.008 13.479 1.304 1.00 0.00 H new ATOM 0 HG12 VAL B 109 -9.601 14.529 1.591 1.00 0.00 H new ATOM 0 HG13 VAL B 109 -9.605 13.405 0.212 1.00 0.00 H new ATOM 0 HG21 VAL B 109 -10.898 11.081 1.788 1.00 0.00 H new ATOM 0 HG22 VAL B 109 -9.503 10.874 0.702 1.00 0.00 H new ATOM 0 HG23 VAL B 109 -9.396 10.346 2.398 1.00 0.00 H new ATOM 3429 N PHE B 110 -6.723 14.484 3.055 1.00 0.00 N ATOM 3430 CA PHE B 110 -6.201 15.278 4.144 1.00 0.00 C ATOM 3431 C PHE B 110 -7.205 16.353 4.550 1.00 0.00 C ATOM 3432 O PHE B 110 -7.303 17.406 3.921 1.00 0.00 O ATOM 3433 CB PHE B 110 -4.876 15.903 3.713 1.00 0.00 C ATOM 3434 CG PHE B 110 -3.673 15.055 4.017 1.00 0.00 C ATOM 3435 CD1 PHE B 110 -3.650 13.713 3.674 1.00 0.00 C ATOM 3436 CD2 PHE B 110 -2.563 15.605 4.638 1.00 0.00 C ATOM 3437 CE1 PHE B 110 -2.541 12.934 3.946 1.00 0.00 C ATOM 3438 CE2 PHE B 110 -1.450 14.830 4.911 1.00 0.00 C ATOM 3439 CZ PHE B 110 -1.440 13.493 4.566 1.00 0.00 C ATOM 0 H PHE B 110 -6.650 14.921 2.136 1.00 0.00 H new ATOM 0 HA PHE B 110 -6.030 14.641 5.012 1.00 0.00 H new ATOM 0 HB2 PHE B 110 -4.909 16.097 2.641 1.00 0.00 H new ATOM 0 HB3 PHE B 110 -4.763 16.867 4.208 1.00 0.00 H new ATOM 0 HD1 PHE B 110 -4.508 13.271 3.189 1.00 0.00 H new ATOM 0 HD2 PHE B 110 -2.567 16.650 4.912 1.00 0.00 H new ATOM 0 HE1 PHE B 110 -2.535 11.889 3.674 1.00 0.00 H new ATOM 0 HE2 PHE B 110 -0.590 15.270 5.393 1.00 0.00 H new ATOM 0 HZ PHE B 110 -0.573 12.885 4.780 1.00 0.00 H new ATOM 3449 N GLY B 111 -7.945 16.069 5.617 1.00 0.00 N ATOM 3450 CA GLY B 111 -8.938 17.005 6.122 1.00 0.00 C ATOM 3451 C GLY B 111 -8.345 17.940 7.150 1.00 0.00 C ATOM 3452 O GLY B 111 -8.492 17.734 8.355 1.00 0.00 O ATOM 0 H GLY B 111 -7.875 15.200 6.146 1.00 0.00 H new ATOM 0 HA2 GLY B 111 -9.347 17.585 5.295 1.00 0.00 H new ATOM 0 HA3 GLY B 111 -9.767 16.454 6.565 1.00 0.00 H new ATOM 3456 N LEU B 112 -7.649 18.952 6.667 1.00 0.00 N ATOM 3457 CA LEU B 112 -6.990 19.915 7.532 1.00 0.00 C ATOM 3458 C LEU B 112 -7.980 20.945 8.068 1.00 0.00 C ATOM 3459 O LEU B 112 -8.754 21.532 7.313 1.00 0.00 O ATOM 3460 CB LEU B 112 -5.865 20.606 6.751 1.00 0.00 C ATOM 3461 CG LEU B 112 -4.645 19.733 6.380 1.00 0.00 C ATOM 3462 CD1 LEU B 112 -5.011 18.272 6.159 1.00 0.00 C ATOM 3463 CD2 LEU B 112 -3.978 20.268 5.131 1.00 0.00 C ATOM 0 H LEU B 112 -7.524 19.130 5.670 1.00 0.00 H new ATOM 0 HA LEU B 112 -6.570 19.389 8.389 1.00 0.00 H new ATOM 0 HB2 LEU B 112 -6.287 21.011 5.831 1.00 0.00 H new ATOM 0 HB3 LEU B 112 -5.512 21.453 7.339 1.00 0.00 H new ATOM 0 HG LEU B 112 -3.961 19.781 7.227 1.00 0.00 H new ATOM 0 HD11 LEU B 112 -4.115 17.707 5.901 1.00 0.00 H new ATOM 0 HD12 LEU B 112 -5.447 17.864 7.071 1.00 0.00 H new ATOM 0 HD13 LEU B 112 -5.733 18.197 5.346 1.00 0.00 H new ATOM 0 HD21 LEU B 112 -3.120 19.644 4.881 1.00 0.00 H new ATOM 0 HD22 LEU B 112 -4.689 20.255 4.305 1.00 0.00 H new ATOM 0 HD23 LEU B 112 -3.644 21.291 5.307 1.00 0.00 H new ATOM 3475 N ALA B 113 -7.945 21.154 9.378 1.00 0.00 N ATOM 3476 CA ALA B 113 -8.835 22.107 10.030 1.00 0.00 C ATOM 3477 C ALA B 113 -8.486 23.543 9.648 1.00 0.00 C ATOM 3478 O ALA B 113 -7.860 24.266 10.423 1.00 0.00 O ATOM 3479 CB ALA B 113 -8.767 21.933 11.539 1.00 0.00 C ATOM 0 H ALA B 113 -7.307 20.674 10.013 1.00 0.00 H new ATOM 0 HA ALA B 113 -9.852 21.908 9.691 1.00 0.00 H new ATOM 0 HB1 ALA B 113 -9.435 22.649 12.018 1.00 0.00 H new ATOM 0 HB2 ALA B 113 -9.071 20.920 11.803 1.00 0.00 H new ATOM 0 HB3 ALA B 113 -7.746 22.105 11.879 1.00 0.00 H new ATOM 3485 N ILE B 114 -8.898 23.950 8.451 1.00 0.00 N ATOM 3486 CA ILE B 114 -8.631 25.303 7.969 1.00 0.00 C ATOM 3487 C ILE B 114 -7.137 25.614 7.979 1.00 0.00 C ATOM 3488 O ILE B 114 -6.356 24.731 8.392 1.00 0.00 O ATOM 3489 CB ILE B 114 -9.367 26.357 8.818 1.00 0.00 C ATOM 3490 CG1 ILE B 114 -10.835 25.967 8.998 1.00 0.00 C ATOM 3491 CG2 ILE B 114 -9.253 27.730 8.174 1.00 0.00 C ATOM 3492 CD1 ILE B 114 -11.554 26.787 10.048 1.00 0.00 C ATOM 0 H ILE B 114 -9.417 23.364 7.797 1.00 0.00 H new ATOM 0 HA ILE B 114 -8.999 25.347 6.944 1.00 0.00 H new ATOM 0 HB ILE B 114 -8.900 26.399 9.802 1.00 0.00 H new ATOM 0 HG12 ILE B 114 -11.352 26.079 8.045 1.00 0.00 H new ATOM 0 HG13 ILE B 114 -10.892 24.913 9.270 1.00 0.00 H new ATOM 0 HG21 ILE B 114 -9.778 28.464 8.786 1.00 0.00 H new ATOM 0 HG22 ILE B 114 -8.202 28.009 8.095 1.00 0.00 H new ATOM 0 HG23 ILE B 114 -9.697 27.703 7.179 1.00 0.00 H new ATOM 0 HD11 ILE B 114 -12.590 26.456 10.122 1.00 0.00 H new ATOM 0 HD12 ILE B 114 -11.062 26.656 11.012 1.00 0.00 H new ATOM 0 HD13 ILE B 114 -11.529 27.840 9.768 1.00 0.00 H new TER 3504 ILE B 114