USER MOD reduce.3.24.130724 H: found=0, std=0, add=1706, rem=0, adj=63 USER MOD reduce.3.24.130724 removed 1707 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 25 GLN : amide:sc= -6.25! C(o=-13!,f=-20!) USER MOD Set 1.2: A 26 SER OG : rot 55:sc= 0.496 USER MOD Set 1.3: B 72 MET CE :methyl -140:sc= -7.06! (180deg=-5.8!) USER MOD Set 2.1: B 25 GLN : amide:sc= -2.62! K(o=-2.2!,f=-3.2) USER MOD Set 2.2: B 26 SER OG : rot 88:sc= 0.434 USER MOD Set 3.1: B 18 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: B 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 4.1: B 5 THR OG1 : rot 145:sc= 1.85 USER MOD Set 4.2: B 7 TYR OH : rot -33:sc= 0.956 USER MOD Set 5.1: A 70 GLN : amide:sc= 0.593 K(o=1.6,f=-5.4!) USER MOD Set 5.2: B 34 THR OG1 : rot -73:sc= 1.03 USER MOD Set 6.1: A 9 ASN : amide:sc= -12.4! C(o=-13!,f=-21!) USER MOD Set 6.2: A 14 SER OG : rot 75:sc= -0.573 USER MOD Set 7.1: A 5 THR OG1 : rot 134:sc= 2.06 USER MOD Set 7.2: A 7 TYR OH : rot -30:sc= 0.833 USER MOD Set 8.1: A 2 SER OG : rot 179:sc= -1.35 USER MOD Set 8.2: A 31 ASN :FLIP amide:sc= -6.94! C(o=-9.7!,f=-8.3!) USER MOD Single : A 3 GLN :FLIP amide:sc= 0.231 F(o=-0.54,f=0.23) USER MOD Single : A 8 LYS NZ :NH3+ -111:sc= -0.142 (180deg=-2.84!) USER MOD Single : A 10 LYS NZ :NH3+ -149:sc= -0.188 (180deg=-0.782) USER MOD Single : A 12 LYS NZ :NH3+ -151:sc= -0.214 (180deg=-0.92) USER MOD Single : A 13 SER OG : rot 108:sc=0.000994 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 87:sc= -1.21! USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 THR OG1 : rot -149:sc= -1.45 USER MOD Single : A 41 THR OG1 : rot 180:sc= -3.43! USER MOD Single : A 48 LYS NZ :NH3+ 159:sc= -0.0482 (180deg=-0.346) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot 180:sc= 0.0127 USER MOD Single : A 53 HIS : no HD1:sc= -0.27 X(o=-0.27,f=-0.68) USER MOD Single : A 55 CYS SG : rot -40:sc= -2.03 USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 HIS :FLIP no HD1:sc= -0.271 F(o=-1.4,f=-0.27) USER MOD Single : A 67 MET CE :methyl -144:sc= -11.7! (180deg=-18.8!) USER MOD Single : A 69 THR OG1 : rot 180:sc= -3.32! USER MOD Single : A 71 GLN : amide:sc= -0.213 K(o=-0.21,f=-1.6) USER MOD Single : A 72 MET CE :methyl 147:sc= -5.67! (180deg=-7.72!) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 77:sc= 0.941 USER MOD Single : A 78 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0481) USER MOD Single : A 81 SER OG : rot -62:sc= -4.34! USER MOD Single : A 85 ASN : amide:sc= -0.788 X(o=-0.79,f=-0.79) USER MOD Single : A 88 SER OG : rot -27:sc= 0.403 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 ASN :FLIP amide:sc= -1.46 F(o=-2.8!,f=-1.5) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl 143:sc= -0.0579 (180deg=-2.14!) USER MOD Single : B 1 MET N :NH3+ -118:sc= 0.0347 (180deg=0) USER MOD Single : B 2 SER OG : rot -58:sc= -0.871! USER MOD Single : B 3 GLN : amide:sc= -1.21 X(o=-1.2,f=-0.75!) USER MOD Single : B 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 ASN :FLIP amide:sc= -21.1! C(o=-25!,f=-21!) USER MOD Single : B 10 LYS NZ :NH3+ -106:sc= -1.14 (180deg=-3.06!) USER MOD Single : B 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 13 SER OG : rot 180:sc= 0 USER MOD Single : B 14 SER OG : rot 79:sc= -0.717! USER MOD Single : B 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 17 THR OG1 : rot 180:sc= 0 USER MOD Single : B 20 TYR OH : rot 83:sc= -2.28! USER MOD Single : B 31 ASN :FLIP amide:sc= -0.0787 F(o=-2.7,f=-0.079) USER MOD Single : B 33 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 41 THR OG1 : rot 180:sc= -3.74! USER MOD Single : B 48 LYS NZ :NH3+ 158:sc= -0.304 (180deg=-1.04) USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 52 SER OG : rot 180:sc= 0 USER MOD Single : B 53 HIS :FLIP no HD1:sc= -0.749 F(o=-1.9,f=-0.75) USER MOD Single : B 55 CYS SG : rot 42:sc= -0.514 USER MOD Single : B 57 THR OG1 : rot -61:sc= -10.2! USER MOD Single : B 59 HIS :FLIP no HD1:sc= -3.91! F(o=-5.2,f=-3.9!) USER MOD Single : B 67 MET CE :methyl -135:sc= -14.3! (180deg=-21.2!) USER MOD Single : B 69 THR OG1 : rot 180:sc= -1.64 USER MOD Single : B 70 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 73 THR OG1 : rot 180:sc= 0 USER MOD Single : B 74 SER OG : rot 113:sc= 1.1 USER MOD Single : B 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 81 SER OG : rot -148:sc= -3.81! USER MOD Single : B 85 ASN : amide:sc= -0.302 X(o=-0.3,f=-0.27) USER MOD Single : B 88 SER OG : rot 180:sc= 0.118 USER MOD Single : B 89 THR OG1 : rot 180:sc= 0 USER MOD Single : B 92 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 103 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 20 N SER A 2 2.848 7.501 14.874 1.00 0.00 N ATOM 21 CA SER A 2 3.192 7.442 13.458 1.00 0.00 C ATOM 22 C SER A 2 2.062 8.010 12.599 1.00 0.00 C ATOM 23 O SER A 2 1.153 7.280 12.209 1.00 0.00 O ATOM 24 CB SER A 2 3.490 5.991 13.041 1.00 0.00 C ATOM 25 OG SER A 2 4.849 5.843 12.671 1.00 0.00 O ATOM 0 HA SER A 2 4.084 8.048 13.300 1.00 0.00 H new ATOM 0 HB2 SER A 2 3.257 5.316 13.865 1.00 0.00 H new ATOM 0 HB3 SER A 2 2.848 5.709 12.206 1.00 0.00 H new ATOM 0 HG SER A 2 5.021 4.910 12.424 1.00 0.00 H new ATOM 31 N GLN A 3 2.114 9.312 12.300 1.00 0.00 N ATOM 32 CA GLN A 3 1.071 9.934 11.480 1.00 0.00 C ATOM 33 C GLN A 3 1.248 11.449 11.334 1.00 0.00 C ATOM 34 O GLN A 3 1.667 12.139 12.263 1.00 0.00 O ATOM 35 CB GLN A 3 -0.314 9.649 12.078 1.00 0.00 C ATOM 36 CG GLN A 3 -1.453 10.353 11.355 1.00 0.00 C ATOM 37 CD GLN A 3 -2.792 9.681 11.585 1.00 0.00 C ATOM 38 OE1 GLN A 3 -3.513 9.414 10.502 1.00 0.00 O flip ATOM 39 NE2 GLN A 3 -3.175 9.405 12.722 1.00 0.00 N flip ATOM 0 H GLN A 3 2.853 9.945 12.607 1.00 0.00 H new ATOM 0 HA GLN A 3 1.158 9.494 10.487 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -0.493 8.574 12.059 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -0.317 9.954 13.124 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -1.507 11.388 11.692 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -1.241 10.376 10.286 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -2.588 9.628 13.526 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -4.079 8.953 12.860 1.00 0.00 H new ATOM 48 N PHE A 4 0.862 11.947 10.160 1.00 0.00 N ATOM 49 CA PHE A 4 0.893 13.376 9.843 1.00 0.00 C ATOM 50 C PHE A 4 2.294 13.981 9.791 1.00 0.00 C ATOM 51 O PHE A 4 2.479 15.148 10.138 1.00 0.00 O ATOM 52 CB PHE A 4 0.022 14.146 10.835 1.00 0.00 C ATOM 53 CG PHE A 4 -1.455 13.983 10.588 1.00 0.00 C ATOM 54 CD1 PHE A 4 -1.930 13.007 9.721 1.00 0.00 C ATOM 55 CD2 PHE A 4 -2.369 14.807 11.224 1.00 0.00 C ATOM 56 CE1 PHE A 4 -3.283 12.856 9.496 1.00 0.00 C ATOM 57 CE2 PHE A 4 -3.726 14.661 11.002 1.00 0.00 C ATOM 58 CZ PHE A 4 -4.183 13.684 10.138 1.00 0.00 C ATOM 0 H PHE A 4 0.516 11.367 9.396 1.00 0.00 H new ATOM 0 HA PHE A 4 0.496 13.468 8.832 1.00 0.00 H new ATOM 0 HB2 PHE A 4 0.253 13.810 11.846 1.00 0.00 H new ATOM 0 HB3 PHE A 4 0.276 15.205 10.785 1.00 0.00 H new ATOM 0 HD1 PHE A 4 -1.231 12.357 9.216 1.00 0.00 H new ATOM 0 HD2 PHE A 4 -2.018 15.572 11.901 1.00 0.00 H new ATOM 0 HE1 PHE A 4 -3.637 12.092 8.820 1.00 0.00 H new ATOM 0 HE2 PHE A 4 -4.428 15.310 11.504 1.00 0.00 H new ATOM 0 HZ PHE A 4 -5.243 13.568 9.965 1.00 0.00 H new ATOM 68 N THR A 5 3.268 13.217 9.319 1.00 0.00 N ATOM 69 CA THR A 5 4.622 13.722 9.184 1.00 0.00 C ATOM 70 C THR A 5 5.044 13.644 7.726 1.00 0.00 C ATOM 71 O THR A 5 4.513 12.842 6.959 1.00 0.00 O ATOM 72 CB THR A 5 5.597 12.915 10.036 1.00 0.00 C ATOM 73 OG1 THR A 5 4.947 12.359 11.166 1.00 0.00 O ATOM 74 CG2 THR A 5 6.775 13.725 10.534 1.00 0.00 C ATOM 0 H THR A 5 3.145 12.248 9.024 1.00 0.00 H new ATOM 0 HA THR A 5 4.640 14.756 9.527 1.00 0.00 H new ATOM 0 HB THR A 5 5.969 12.133 9.375 1.00 0.00 H new ATOM 0 HG1 THR A 5 5.206 11.419 11.263 1.00 0.00 H new ATOM 0 HG21 THR A 5 7.427 13.089 11.133 1.00 0.00 H new ATOM 0 HG22 THR A 5 7.332 14.118 9.683 1.00 0.00 H new ATOM 0 HG23 THR A 5 6.415 14.553 11.145 1.00 0.00 H new ATOM 82 N LEU A 6 6.014 14.457 7.353 1.00 0.00 N ATOM 83 CA LEU A 6 6.522 14.449 5.993 1.00 0.00 C ATOM 84 C LEU A 6 7.722 13.533 5.934 1.00 0.00 C ATOM 85 O LEU A 6 8.865 13.989 5.975 1.00 0.00 O ATOM 86 CB LEU A 6 6.916 15.854 5.553 1.00 0.00 C ATOM 87 CG LEU A 6 6.850 16.097 4.048 1.00 0.00 C ATOM 88 CD1 LEU A 6 7.207 17.537 3.732 1.00 0.00 C ATOM 89 CD2 LEU A 6 7.778 15.141 3.313 1.00 0.00 C ATOM 0 H LEU A 6 6.466 15.131 7.971 1.00 0.00 H new ATOM 0 HA LEU A 6 5.743 14.093 5.318 1.00 0.00 H new ATOM 0 HB2 LEU A 6 6.264 16.571 6.051 1.00 0.00 H new ATOM 0 HB3 LEU A 6 7.931 16.055 5.895 1.00 0.00 H new ATOM 0 HG LEU A 6 5.831 15.911 3.710 1.00 0.00 H new ATOM 0 HD11 LEU A 6 7.156 17.697 2.655 1.00 0.00 H new ATOM 0 HD12 LEU A 6 6.504 18.204 4.231 1.00 0.00 H new ATOM 0 HD13 LEU A 6 8.218 17.747 4.082 1.00 0.00 H new ATOM 0 HD21 LEU A 6 7.718 15.328 2.241 1.00 0.00 H new ATOM 0 HD22 LEU A 6 8.802 15.296 3.652 1.00 0.00 H new ATOM 0 HD23 LEU A 6 7.479 14.113 3.519 1.00 0.00 H new ATOM 101 N TYR A 7 7.466 12.234 5.886 1.00 0.00 N ATOM 102 CA TYR A 7 8.553 11.279 5.879 1.00 0.00 C ATOM 103 C TYR A 7 9.183 11.119 4.508 1.00 0.00 C ATOM 104 O TYR A 7 8.565 10.612 3.573 1.00 0.00 O ATOM 105 CB TYR A 7 8.086 9.915 6.426 1.00 0.00 C ATOM 106 CG TYR A 7 7.100 9.968 7.580 1.00 0.00 C ATOM 107 CD1 TYR A 7 5.814 10.495 7.433 1.00 0.00 C ATOM 108 CD2 TYR A 7 7.449 9.440 8.818 1.00 0.00 C ATOM 109 CE1 TYR A 7 4.922 10.492 8.487 1.00 0.00 C ATOM 110 CE2 TYR A 7 6.557 9.430 9.872 1.00 0.00 C ATOM 111 CZ TYR A 7 5.297 9.955 9.703 1.00 0.00 C ATOM 112 OH TYR A 7 4.406 9.948 10.752 1.00 0.00 O ATOM 0 H TYR A 7 6.531 11.827 5.852 1.00 0.00 H new ATOM 0 HA TYR A 7 9.325 11.678 6.537 1.00 0.00 H new ATOM 0 HB2 TYR A 7 7.631 9.354 5.610 1.00 0.00 H new ATOM 0 HB3 TYR A 7 8.963 9.354 6.748 1.00 0.00 H new ATOM 0 HD1 TYR A 7 5.514 10.910 6.482 1.00 0.00 H new ATOM 0 HD2 TYR A 7 8.438 9.029 8.958 1.00 0.00 H new ATOM 0 HE1 TYR A 7 3.934 10.909 8.361 1.00 0.00 H new ATOM 0 HE2 TYR A 7 6.847 9.012 10.825 1.00 0.00 H new ATOM 0 HH TYR A 7 3.803 10.716 10.674 1.00 0.00 H new ATOM 122 N LYS A 8 10.453 11.527 4.431 1.00 0.00 N ATOM 123 CA LYS A 8 11.242 11.418 3.215 1.00 0.00 C ATOM 124 C LYS A 8 11.366 9.951 2.813 1.00 0.00 C ATOM 125 O LYS A 8 10.375 9.300 2.508 1.00 0.00 O ATOM 126 CB LYS A 8 12.623 12.046 3.436 1.00 0.00 C ATOM 127 CG LYS A 8 13.428 12.244 2.161 1.00 0.00 C ATOM 128 CD LYS A 8 12.840 13.339 1.288 1.00 0.00 C ATOM 129 CE LYS A 8 13.916 14.040 0.474 1.00 0.00 C ATOM 130 NZ LYS A 8 14.835 14.835 1.335 1.00 0.00 N ATOM 0 H LYS A 8 10.957 11.942 5.215 1.00 0.00 H new ATOM 0 HA LYS A 8 10.747 11.955 2.406 1.00 0.00 H new ATOM 0 HB2 LYS A 8 12.497 13.011 3.926 1.00 0.00 H new ATOM 0 HB3 LYS A 8 13.192 11.414 4.118 1.00 0.00 H new ATOM 0 HG2 LYS A 8 14.457 12.496 2.416 1.00 0.00 H new ATOM 0 HG3 LYS A 8 13.458 11.309 1.601 1.00 0.00 H new ATOM 0 HD2 LYS A 8 12.096 12.910 0.617 1.00 0.00 H new ATOM 0 HD3 LYS A 8 12.323 14.067 1.914 1.00 0.00 H new ATOM 0 HE2 LYS A 8 14.490 13.299 -0.083 1.00 0.00 H new ATOM 0 HE3 LYS A 8 13.447 14.696 -0.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 14.685 15.849 1.159 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 14.642 14.625 2.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 15.820 14.587 1.113 1.00 0.00 H new ATOM 144 N ASN A 9 12.578 9.436 2.822 1.00 0.00 N ATOM 145 CA ASN A 9 12.831 8.054 2.474 1.00 0.00 C ATOM 146 C ASN A 9 13.963 7.549 3.353 1.00 0.00 C ATOM 147 O ASN A 9 15.071 8.074 3.270 1.00 0.00 O ATOM 148 CB ASN A 9 13.224 7.949 0.994 1.00 0.00 C ATOM 149 CG ASN A 9 12.424 6.909 0.233 1.00 0.00 C ATOM 150 OD1 ASN A 9 12.682 5.712 0.336 1.00 0.00 O ATOM 151 ND2 ASN A 9 11.457 7.365 -0.552 1.00 0.00 N ATOM 0 H ASN A 9 13.415 9.964 3.071 1.00 0.00 H new ATOM 0 HA ASN A 9 11.935 7.453 2.632 1.00 0.00 H new ATOM 0 HB2 ASN A 9 13.088 8.921 0.519 1.00 0.00 H new ATOM 0 HB3 ASN A 9 14.284 7.705 0.923 1.00 0.00 H new ATOM 0 HD21 ASN A 9 10.895 6.713 -1.099 1.00 0.00 H new ATOM 0 HD22 ASN A 9 11.276 8.367 -0.608 1.00 0.00 H new ATOM 158 N LYS A 10 13.680 6.549 4.202 1.00 0.00 N ATOM 159 CA LYS A 10 14.682 5.973 5.115 1.00 0.00 C ATOM 160 C LYS A 10 16.044 6.585 4.872 1.00 0.00 C ATOM 161 O LYS A 10 16.613 7.276 5.717 1.00 0.00 O ATOM 162 CB LYS A 10 14.777 4.474 4.903 1.00 0.00 C ATOM 163 CG LYS A 10 13.800 3.981 3.870 1.00 0.00 C ATOM 164 CD LYS A 10 13.990 4.705 2.550 1.00 0.00 C ATOM 165 CE LYS A 10 14.192 3.734 1.397 1.00 0.00 C ATOM 166 NZ LYS A 10 15.318 2.795 1.653 1.00 0.00 N ATOM 0 H LYS A 10 12.758 6.119 4.276 1.00 0.00 H new ATOM 0 HA LYS A 10 14.368 6.187 6.137 1.00 0.00 H new ATOM 0 HB2 LYS A 10 15.790 4.216 4.594 1.00 0.00 H new ATOM 0 HB3 LYS A 10 14.592 3.963 5.848 1.00 0.00 H new ATOM 0 HG2 LYS A 10 13.932 2.909 3.723 1.00 0.00 H new ATOM 0 HG3 LYS A 10 12.781 4.131 4.227 1.00 0.00 H new ATOM 0 HD2 LYS A 10 13.120 5.331 2.350 1.00 0.00 H new ATOM 0 HD3 LYS A 10 14.851 5.370 2.621 1.00 0.00 H new ATOM 0 HE2 LYS A 10 13.276 3.166 1.236 1.00 0.00 H new ATOM 0 HE3 LYS A 10 14.386 4.293 0.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 15.766 2.535 0.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 16.020 3.254 2.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 14.957 1.938 2.119 1.00 0.00 H new ATOM 180 N ASP A 11 16.526 6.329 3.671 1.00 0.00 N ATOM 181 CA ASP A 11 17.780 6.834 3.209 1.00 0.00 C ATOM 182 C ASP A 11 17.508 7.842 2.088 1.00 0.00 C ATOM 183 O ASP A 11 17.045 7.472 1.011 1.00 0.00 O ATOM 184 CB ASP A 11 18.637 5.662 2.734 1.00 0.00 C ATOM 185 CG ASP A 11 20.106 5.846 3.061 1.00 0.00 C ATOM 186 OD1 ASP A 11 20.487 5.623 4.229 1.00 0.00 O ATOM 187 OD2 ASP A 11 20.876 6.214 2.148 1.00 0.00 O ATOM 0 H ASP A 11 16.039 5.752 2.985 1.00 0.00 H new ATOM 0 HA ASP A 11 18.325 7.345 4.003 1.00 0.00 H new ATOM 0 HB2 ASP A 11 18.278 4.743 3.196 1.00 0.00 H new ATOM 0 HB3 ASP A 11 18.520 5.544 1.657 1.00 0.00 H new ATOM 192 N LYS A 12 17.752 9.125 2.368 1.00 0.00 N ATOM 193 CA LYS A 12 17.485 10.201 1.405 1.00 0.00 C ATOM 194 C LYS A 12 17.997 9.882 -0.004 1.00 0.00 C ATOM 195 O LYS A 12 17.582 10.522 -0.971 1.00 0.00 O ATOM 196 CB LYS A 12 18.080 11.523 1.906 1.00 0.00 C ATOM 197 CG LYS A 12 17.357 12.101 3.123 1.00 0.00 C ATOM 198 CD LYS A 12 18.188 11.950 4.387 1.00 0.00 C ATOM 199 CE LYS A 12 18.062 13.169 5.285 1.00 0.00 C ATOM 200 NZ LYS A 12 18.494 14.416 4.595 1.00 0.00 N ATOM 0 H LYS A 12 18.135 9.446 3.257 1.00 0.00 H new ATOM 0 HA LYS A 12 16.402 10.296 1.329 1.00 0.00 H new ATOM 0 HB2 LYS A 12 19.129 11.367 2.158 1.00 0.00 H new ATOM 0 HB3 LYS A 12 18.052 12.253 1.097 1.00 0.00 H new ATOM 0 HG2 LYS A 12 17.141 13.156 2.952 1.00 0.00 H new ATOM 0 HG3 LYS A 12 16.400 11.596 3.253 1.00 0.00 H new ATOM 0 HD2 LYS A 12 17.867 11.061 4.931 1.00 0.00 H new ATOM 0 HD3 LYS A 12 19.234 11.800 4.120 1.00 0.00 H new ATOM 0 HE2 LYS A 12 17.027 13.274 5.610 1.00 0.00 H new ATOM 0 HE3 LYS A 12 18.665 13.023 6.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 18.862 15.091 5.296 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 19.240 14.191 3.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 17.682 14.838 4.101 1.00 0.00 H new ATOM 214 N SER A 13 18.871 8.887 -0.135 1.00 0.00 N ATOM 215 CA SER A 13 19.384 8.506 -1.449 1.00 0.00 C ATOM 216 C SER A 13 18.233 8.060 -2.353 1.00 0.00 C ATOM 217 O SER A 13 18.273 8.244 -3.570 1.00 0.00 O ATOM 218 CB SER A 13 20.413 7.381 -1.315 1.00 0.00 C ATOM 219 OG SER A 13 21.581 7.834 -0.653 1.00 0.00 O ATOM 0 H SER A 13 19.235 8.336 0.642 1.00 0.00 H new ATOM 0 HA SER A 13 19.871 9.372 -1.897 1.00 0.00 H new ATOM 0 HB2 SER A 13 19.977 6.549 -0.762 1.00 0.00 H new ATOM 0 HB3 SER A 13 20.675 7.004 -2.304 1.00 0.00 H new ATOM 0 HG SER A 13 21.613 7.456 0.250 1.00 0.00 H new ATOM 225 N SER A 14 17.201 7.488 -1.735 1.00 0.00 N ATOM 226 CA SER A 14 16.012 7.023 -2.452 1.00 0.00 C ATOM 227 C SER A 14 15.399 8.129 -3.271 1.00 0.00 C ATOM 228 O SER A 14 14.828 7.893 -4.332 1.00 0.00 O ATOM 229 CB SER A 14 14.954 6.560 -1.455 1.00 0.00 C ATOM 230 OG SER A 14 15.548 6.025 -0.285 1.00 0.00 O ATOM 0 H SER A 14 17.164 7.334 -0.727 1.00 0.00 H new ATOM 0 HA SER A 14 16.326 6.208 -3.105 1.00 0.00 H new ATOM 0 HB2 SER A 14 14.311 7.399 -1.188 1.00 0.00 H new ATOM 0 HB3 SER A 14 14.318 5.806 -1.920 1.00 0.00 H new ATOM 0 HG SER A 14 15.905 6.754 0.264 1.00 0.00 H new ATOM 236 N ALA A 15 15.470 9.330 -2.736 1.00 0.00 N ATOM 237 CA ALA A 15 14.864 10.474 -3.373 1.00 0.00 C ATOM 238 C ALA A 15 15.241 10.604 -4.841 1.00 0.00 C ATOM 239 O ALA A 15 14.509 11.232 -5.608 1.00 0.00 O ATOM 240 CB ALA A 15 15.205 11.741 -2.604 1.00 0.00 C ATOM 0 H ALA A 15 15.944 9.537 -1.857 1.00 0.00 H new ATOM 0 HA ALA A 15 13.785 10.322 -3.351 1.00 0.00 H new ATOM 0 HB1 ALA A 15 14.743 12.599 -3.093 1.00 0.00 H new ATOM 0 HB2 ALA A 15 14.830 11.659 -1.584 1.00 0.00 H new ATOM 0 HB3 ALA A 15 16.287 11.874 -2.584 1.00 0.00 H new ATOM 246 N LYS A 16 16.351 9.996 -5.256 1.00 0.00 N ATOM 247 CA LYS A 16 16.730 10.058 -6.661 1.00 0.00 C ATOM 248 C LYS A 16 15.531 9.621 -7.491 1.00 0.00 C ATOM 249 O LYS A 16 15.139 10.282 -8.452 1.00 0.00 O ATOM 250 CB LYS A 16 17.933 9.153 -6.939 1.00 0.00 C ATOM 251 CG LYS A 16 19.266 9.881 -6.888 1.00 0.00 C ATOM 252 CD LYS A 16 20.433 8.915 -7.020 1.00 0.00 C ATOM 253 CE LYS A 16 20.652 8.128 -5.738 1.00 0.00 C ATOM 254 NZ LYS A 16 21.835 7.230 -5.832 1.00 0.00 N ATOM 0 H LYS A 16 16.986 9.469 -4.657 1.00 0.00 H new ATOM 0 HA LYS A 16 17.019 11.075 -6.924 1.00 0.00 H new ATOM 0 HB2 LYS A 16 17.943 8.342 -6.211 1.00 0.00 H new ATOM 0 HB3 LYS A 16 17.815 8.697 -7.922 1.00 0.00 H new ATOM 0 HG2 LYS A 16 19.310 10.618 -7.689 1.00 0.00 H new ATOM 0 HG3 LYS A 16 19.348 10.427 -5.948 1.00 0.00 H new ATOM 0 HD2 LYS A 16 20.245 8.226 -7.844 1.00 0.00 H new ATOM 0 HD3 LYS A 16 21.339 9.469 -7.268 1.00 0.00 H new ATOM 0 HE2 LYS A 16 20.787 8.820 -4.906 1.00 0.00 H new ATOM 0 HE3 LYS A 16 19.763 7.536 -5.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 21.949 6.712 -4.938 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 21.696 6.553 -6.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 22.688 7.797 -6.015 1.00 0.00 H new ATOM 268 N THR A 17 14.922 8.521 -7.057 1.00 0.00 N ATOM 269 CA THR A 17 13.723 7.995 -7.688 1.00 0.00 C ATOM 270 C THR A 17 12.504 8.289 -6.816 1.00 0.00 C ATOM 271 O THR A 17 11.466 8.737 -7.303 1.00 0.00 O ATOM 272 CB THR A 17 13.844 6.489 -7.925 1.00 0.00 C ATOM 273 OG1 THR A 17 14.930 6.201 -8.788 1.00 0.00 O ATOM 274 CG2 THR A 17 12.597 5.882 -8.534 1.00 0.00 C ATOM 0 H THR A 17 15.247 7.973 -6.260 1.00 0.00 H new ATOM 0 HA THR A 17 13.603 8.484 -8.655 1.00 0.00 H new ATOM 0 HB THR A 17 14.000 6.051 -6.939 1.00 0.00 H new ATOM 0 HG1 THR A 17 14.991 5.233 -8.925 1.00 0.00 H new ATOM 0 HG21 THR A 17 12.746 4.812 -8.677 1.00 0.00 H new ATOM 0 HG22 THR A 17 11.750 6.044 -7.867 1.00 0.00 H new ATOM 0 HG23 THR A 17 12.396 6.353 -9.496 1.00 0.00 H new ATOM 282 N TYR A 18 12.642 8.009 -5.516 1.00 0.00 N ATOM 283 CA TYR A 18 11.559 8.215 -4.554 1.00 0.00 C ATOM 284 C TYR A 18 12.041 8.955 -3.319 1.00 0.00 C ATOM 285 O TYR A 18 12.841 8.420 -2.553 1.00 0.00 O ATOM 286 CB TYR A 18 11.039 6.881 -4.085 1.00 0.00 C ATOM 287 CG TYR A 18 10.650 5.936 -5.201 1.00 0.00 C ATOM 288 CD1 TYR A 18 9.694 6.298 -6.142 1.00 0.00 C ATOM 289 CD2 TYR A 18 11.239 4.683 -5.313 1.00 0.00 C ATOM 290 CE1 TYR A 18 9.336 5.438 -7.162 1.00 0.00 C ATOM 291 CE2 TYR A 18 10.886 3.817 -6.330 1.00 0.00 C ATOM 292 CZ TYR A 18 9.934 4.199 -7.252 1.00 0.00 C ATOM 293 OH TYR A 18 9.581 3.340 -8.267 1.00 0.00 O ATOM 0 H TYR A 18 13.499 7.637 -5.106 1.00 0.00 H new ATOM 0 HA TYR A 18 10.789 8.798 -5.059 1.00 0.00 H new ATOM 0 HB2 TYR A 18 11.801 6.403 -3.470 1.00 0.00 H new ATOM 0 HB3 TYR A 18 10.171 7.047 -3.446 1.00 0.00 H new ATOM 0 HD1 TYR A 18 9.223 7.268 -6.075 1.00 0.00 H new ATOM 0 HD2 TYR A 18 11.985 4.381 -4.593 1.00 0.00 H new ATOM 0 HE1 TYR A 18 8.591 5.735 -7.886 1.00 0.00 H new ATOM 0 HE2 TYR A 18 11.353 2.846 -6.403 1.00 0.00 H new ATOM 0 HH TYR A 18 10.096 2.510 -8.187 1.00 0.00 H new ATOM 303 N PRO A 19 11.594 10.194 -3.098 1.00 0.00 N ATOM 304 CA PRO A 19 12.029 10.968 -1.956 1.00 0.00 C ATOM 305 C PRO A 19 11.212 10.762 -0.680 1.00 0.00 C ATOM 306 O PRO A 19 11.793 10.730 0.399 1.00 0.00 O ATOM 307 CB PRO A 19 11.915 12.415 -2.434 1.00 0.00 C ATOM 308 CG PRO A 19 11.182 12.370 -3.740 1.00 0.00 C ATOM 309 CD PRO A 19 10.685 10.961 -3.938 1.00 0.00 C ATOM 0 HA PRO A 19 13.033 10.662 -1.661 1.00 0.00 H new ATOM 0 HB2 PRO A 19 11.377 13.023 -1.707 1.00 0.00 H new ATOM 0 HB3 PRO A 19 12.901 12.863 -2.557 1.00 0.00 H new ATOM 0 HG2 PRO A 19 10.349 13.072 -3.735 1.00 0.00 H new ATOM 0 HG3 PRO A 19 11.840 12.662 -4.558 1.00 0.00 H new ATOM 0 HD2 PRO A 19 9.647 10.847 -3.625 1.00 0.00 H new ATOM 0 HD3 PRO A 19 10.738 10.653 -4.982 1.00 0.00 H new ATOM 317 N TYR A 20 9.878 10.654 -0.761 1.00 0.00 N ATOM 318 CA TYR A 20 9.103 10.496 0.480 1.00 0.00 C ATOM 319 C TYR A 20 7.794 9.755 0.361 1.00 0.00 C ATOM 320 O TYR A 20 7.354 9.329 -0.705 1.00 0.00 O ATOM 321 CB TYR A 20 8.768 11.839 1.142 1.00 0.00 C ATOM 322 CG TYR A 20 9.266 13.034 0.416 1.00 0.00 C ATOM 323 CD1 TYR A 20 9.053 13.166 -0.943 1.00 0.00 C ATOM 324 CD2 TYR A 20 9.950 14.020 1.095 1.00 0.00 C ATOM 325 CE1 TYR A 20 9.508 14.255 -1.634 1.00 0.00 C ATOM 326 CE2 TYR A 20 10.422 15.130 0.418 1.00 0.00 C ATOM 327 CZ TYR A 20 10.200 15.243 -0.949 1.00 0.00 C ATOM 328 OH TYR A 20 10.675 16.337 -1.623 1.00 0.00 O ATOM 0 H TYR A 20 9.335 10.671 -1.624 1.00 0.00 H new ATOM 0 HA TYR A 20 9.787 9.895 1.080 1.00 0.00 H new ATOM 0 HB2 TYR A 20 7.686 11.918 1.243 1.00 0.00 H new ATOM 0 HB3 TYR A 20 9.183 11.845 2.150 1.00 0.00 H new ATOM 0 HD1 TYR A 20 8.515 12.392 -1.471 1.00 0.00 H new ATOM 0 HD2 TYR A 20 10.118 13.925 2.158 1.00 0.00 H new ATOM 0 HE1 TYR A 20 9.331 14.344 -2.696 1.00 0.00 H new ATOM 0 HE2 TYR A 20 10.959 15.903 0.948 1.00 0.00 H new ATOM 0 HH TYR A 20 9.976 17.022 -1.669 1.00 0.00 H new ATOM 338 N PHE A 21 7.180 9.682 1.539 1.00 0.00 N ATOM 339 CA PHE A 21 5.888 9.092 1.767 1.00 0.00 C ATOM 340 C PHE A 21 5.317 9.723 3.018 1.00 0.00 C ATOM 341 O PHE A 21 6.029 10.407 3.753 1.00 0.00 O ATOM 342 CB PHE A 21 5.955 7.585 1.974 1.00 0.00 C ATOM 343 CG PHE A 21 7.273 6.938 1.613 1.00 0.00 C ATOM 344 CD1 PHE A 21 7.620 6.778 0.285 1.00 0.00 C ATOM 345 CD2 PHE A 21 8.152 6.469 2.591 1.00 0.00 C ATOM 346 CE1 PHE A 21 8.808 6.174 -0.071 1.00 0.00 C ATOM 347 CE2 PHE A 21 9.340 5.860 2.236 1.00 0.00 C ATOM 348 CZ PHE A 21 9.668 5.713 0.904 1.00 0.00 C ATOM 0 H PHE A 21 7.599 10.053 2.392 1.00 0.00 H new ATOM 0 HA PHE A 21 5.270 9.270 0.887 1.00 0.00 H new ATOM 0 HB2 PHE A 21 5.738 7.369 3.020 1.00 0.00 H new ATOM 0 HB3 PHE A 21 5.167 7.119 1.383 1.00 0.00 H new ATOM 0 HD1 PHE A 21 6.951 7.131 -0.486 1.00 0.00 H new ATOM 0 HD2 PHE A 21 7.901 6.583 3.635 1.00 0.00 H new ATOM 0 HE1 PHE A 21 9.065 6.062 -1.114 1.00 0.00 H new ATOM 0 HE2 PHE A 21 10.012 5.499 3.001 1.00 0.00 H new ATOM 0 HZ PHE A 21 10.597 5.238 0.625 1.00 0.00 H new ATOM 358 N VAL A 22 4.050 9.494 3.270 1.00 0.00 N ATOM 359 CA VAL A 22 3.425 10.047 4.448 1.00 0.00 C ATOM 360 C VAL A 22 2.666 8.980 5.206 1.00 0.00 C ATOM 361 O VAL A 22 1.694 8.419 4.709 1.00 0.00 O ATOM 362 CB VAL A 22 2.481 11.189 4.089 1.00 0.00 C ATOM 363 CG1 VAL A 22 1.909 11.814 5.353 1.00 0.00 C ATOM 364 CG2 VAL A 22 3.201 12.230 3.246 1.00 0.00 C ATOM 0 H VAL A 22 3.435 8.933 2.680 1.00 0.00 H new ATOM 0 HA VAL A 22 4.219 10.439 5.084 1.00 0.00 H new ATOM 0 HB VAL A 22 1.655 10.790 3.499 1.00 0.00 H new ATOM 0 HG11 VAL A 22 1.236 12.628 5.084 1.00 0.00 H new ATOM 0 HG12 VAL A 22 1.359 11.059 5.915 1.00 0.00 H new ATOM 0 HG13 VAL A 22 2.722 12.202 5.967 1.00 0.00 H new ATOM 0 HG21 VAL A 22 2.512 13.038 2.999 1.00 0.00 H new ATOM 0 HG22 VAL A 22 4.045 12.632 3.807 1.00 0.00 H new ATOM 0 HG23 VAL A 22 3.562 11.768 2.327 1.00 0.00 H new ATOM 374 N ASP A 23 3.126 8.699 6.412 1.00 0.00 N ATOM 375 CA ASP A 23 2.489 7.678 7.246 1.00 0.00 C ATOM 376 C ASP A 23 1.012 8.000 7.475 1.00 0.00 C ATOM 377 O ASP A 23 0.680 8.972 8.154 1.00 0.00 O ATOM 378 CB ASP A 23 3.208 7.565 8.587 1.00 0.00 C ATOM 379 CG ASP A 23 4.411 6.645 8.524 1.00 0.00 C ATOM 380 OD1 ASP A 23 4.880 6.357 7.403 1.00 0.00 O ATOM 381 OD2 ASP A 23 4.884 6.213 9.596 1.00 0.00 O ATOM 0 H ASP A 23 3.932 9.156 6.839 1.00 0.00 H new ATOM 0 HA ASP A 23 2.557 6.725 6.721 1.00 0.00 H new ATOM 0 HB2 ASP A 23 3.529 8.556 8.908 1.00 0.00 H new ATOM 0 HB3 ASP A 23 2.511 7.196 9.339 1.00 0.00 H new ATOM 386 N VAL A 24 0.126 7.183 6.900 1.00 0.00 N ATOM 387 CA VAL A 24 -1.312 7.401 7.046 1.00 0.00 C ATOM 388 C VAL A 24 -2.123 6.128 6.832 1.00 0.00 C ATOM 389 O VAL A 24 -2.248 5.636 5.712 1.00 0.00 O ATOM 390 CB VAL A 24 -1.799 8.507 6.087 1.00 0.00 C ATOM 391 CG1 VAL A 24 -1.189 8.336 4.704 1.00 0.00 C ATOM 392 CG2 VAL A 24 -3.321 8.551 6.014 1.00 0.00 C ATOM 0 H VAL A 24 0.377 6.372 6.334 1.00 0.00 H new ATOM 0 HA VAL A 24 -1.475 7.720 8.075 1.00 0.00 H new ATOM 0 HB VAL A 24 -1.462 9.463 6.488 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -1.548 9.128 4.047 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -0.103 8.390 4.776 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -1.478 7.367 4.296 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -3.630 9.341 5.330 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -3.696 7.593 5.654 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -3.727 8.751 7.006 1.00 0.00 H new ATOM 402 N GLN A 25 -2.700 5.631 7.927 1.00 0.00 N ATOM 403 CA GLN A 25 -3.543 4.438 7.904 1.00 0.00 C ATOM 404 C GLN A 25 -3.780 3.902 9.318 1.00 0.00 C ATOM 405 O GLN A 25 -4.664 4.381 10.028 1.00 0.00 O ATOM 406 CB GLN A 25 -2.949 3.350 6.999 1.00 0.00 C ATOM 407 CG GLN A 25 -3.645 1.998 7.100 1.00 0.00 C ATOM 408 CD GLN A 25 -2.665 0.846 7.197 1.00 0.00 C ATOM 409 OE1 GLN A 25 -1.952 0.704 8.190 1.00 0.00 O ATOM 410 NE2 GLN A 25 -2.623 0.017 6.161 1.00 0.00 N ATOM 0 H GLN A 25 -2.595 6.045 8.853 1.00 0.00 H new ATOM 0 HA GLN A 25 -4.508 4.727 7.487 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -2.993 3.691 5.965 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -1.896 3.222 7.248 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -4.295 1.992 7.975 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -4.283 1.855 6.228 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -3.233 0.173 5.358 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -1.981 -0.776 6.168 1.00 0.00 H new ATOM 419 N SER A 26 -3.001 2.901 9.719 1.00 0.00 N ATOM 420 CA SER A 26 -3.155 2.303 11.047 1.00 0.00 C ATOM 421 C SER A 26 -2.883 3.292 12.159 1.00 0.00 C ATOM 422 O SER A 26 -1.729 3.511 12.525 1.00 0.00 O ATOM 423 CB SER A 26 -2.219 1.125 11.253 1.00 0.00 C ATOM 424 OG SER A 26 -2.613 0.009 10.475 1.00 0.00 O ATOM 0 H SER A 26 -2.262 2.488 9.151 1.00 0.00 H new ATOM 0 HA SER A 26 -4.193 1.973 11.089 1.00 0.00 H new ATOM 0 HB2 SER A 26 -1.203 1.415 10.987 1.00 0.00 H new ATOM 0 HB3 SER A 26 -2.206 0.849 12.307 1.00 0.00 H new ATOM 0 HG SER A 26 -2.686 0.275 9.535 1.00 0.00 H new ATOM 430 N ASP A 27 -3.934 3.843 12.742 1.00 0.00 N ATOM 431 CA ASP A 27 -3.755 4.747 13.862 1.00 0.00 C ATOM 432 C ASP A 27 -3.166 3.949 15.019 1.00 0.00 C ATOM 433 O ASP A 27 -2.404 4.470 15.833 1.00 0.00 O ATOM 434 CB ASP A 27 -5.084 5.387 14.268 1.00 0.00 C ATOM 435 CG ASP A 27 -5.271 6.765 13.664 1.00 0.00 C ATOM 436 OD1 ASP A 27 -4.636 7.049 12.627 1.00 0.00 O ATOM 437 OD2 ASP A 27 -6.052 7.559 14.229 1.00 0.00 O ATOM 0 H ASP A 27 -4.902 3.684 12.464 1.00 0.00 H new ATOM 0 HA ASP A 27 -3.082 5.557 13.581 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -5.905 4.742 13.955 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -5.132 5.460 15.354 1.00 0.00 H new ATOM 442 N LEU A 28 -3.515 2.660 15.056 1.00 0.00 N ATOM 443 CA LEU A 28 -3.016 1.753 16.076 1.00 0.00 C ATOM 444 C LEU A 28 -1.675 1.184 15.652 1.00 0.00 C ATOM 445 O LEU A 28 -0.671 1.319 16.352 1.00 0.00 O ATOM 446 CB LEU A 28 -4.011 0.618 16.332 1.00 0.00 C ATOM 447 CG LEU A 28 -5.356 1.049 16.917 1.00 0.00 C ATOM 448 CD1 LEU A 28 -6.015 2.088 16.026 1.00 0.00 C ATOM 449 CD2 LEU A 28 -6.266 -0.156 17.097 1.00 0.00 C ATOM 0 H LEU A 28 -4.146 2.225 14.383 1.00 0.00 H new ATOM 0 HA LEU A 28 -2.891 2.313 17.003 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -4.192 0.097 15.392 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -3.551 -0.100 17.011 1.00 0.00 H new ATOM 0 HG LEU A 28 -5.181 1.498 17.895 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -6.971 2.383 16.458 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -5.368 2.961 15.946 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -6.179 1.666 15.035 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -7.220 0.167 17.514 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -6.435 -0.632 16.131 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -5.796 -0.869 17.775 1.00 0.00 H new ATOM 461 N LEU A 29 -1.675 0.567 14.484 1.00 0.00 N ATOM 462 CA LEU A 29 -0.472 -0.016 13.913 1.00 0.00 C ATOM 463 C LEU A 29 0.290 1.040 13.120 1.00 0.00 C ATOM 464 O LEU A 29 0.816 0.764 12.042 1.00 0.00 O ATOM 465 CB LEU A 29 -0.851 -1.173 12.995 1.00 0.00 C ATOM 466 CG LEU A 29 -1.646 -2.292 13.664 1.00 0.00 C ATOM 467 CD1 LEU A 29 -2.453 -3.064 12.632 1.00 0.00 C ATOM 468 CD2 LEU A 29 -0.719 -3.225 14.432 1.00 0.00 C ATOM 0 H LEU A 29 -2.507 0.456 13.905 1.00 0.00 H new ATOM 0 HA LEU A 29 0.164 -0.385 14.718 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -1.435 -0.781 12.162 1.00 0.00 H new ATOM 0 HB3 LEU A 29 0.061 -1.597 12.574 1.00 0.00 H new ATOM 0 HG LEU A 29 -2.340 -1.843 14.374 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -3.013 -3.857 13.127 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -3.147 -2.388 12.132 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -1.779 -3.501 11.896 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -1.305 -4.015 14.901 1.00 0.00 H new ATOM 0 HD22 LEU A 29 0.002 -3.667 13.745 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -0.190 -2.661 15.200 1.00 0.00 H new ATOM 480 N ASP A 30 0.316 2.257 13.650 1.00 0.00 N ATOM 481 CA ASP A 30 0.979 3.365 12.981 1.00 0.00 C ATOM 482 C ASP A 30 2.499 3.176 12.931 1.00 0.00 C ATOM 483 O ASP A 30 3.077 3.092 11.852 1.00 0.00 O ATOM 484 CB ASP A 30 0.616 4.683 13.679 1.00 0.00 C ATOM 485 CG ASP A 30 0.783 4.619 15.186 1.00 0.00 C ATOM 486 OD1 ASP A 30 1.184 3.551 15.696 1.00 0.00 O ATOM 487 OD2 ASP A 30 0.512 5.637 15.856 1.00 0.00 O ATOM 0 H ASP A 30 -0.115 2.500 14.542 1.00 0.00 H new ATOM 0 HA ASP A 30 0.629 3.396 11.949 1.00 0.00 H new ATOM 0 HB2 ASP A 30 1.242 5.482 13.283 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -0.417 4.940 13.444 1.00 0.00 H new ATOM 492 N ASN A 31 3.144 3.071 14.085 1.00 0.00 N ATOM 493 CA ASN A 31 4.592 2.854 14.119 1.00 0.00 C ATOM 494 C ASN A 31 4.909 1.583 14.863 1.00 0.00 C ATOM 495 O ASN A 31 6.070 1.288 15.149 1.00 0.00 O ATOM 496 CB ASN A 31 5.332 4.024 14.776 1.00 0.00 C ATOM 497 CG ASN A 31 6.714 4.244 14.188 1.00 0.00 C ATOM 498 OD1 ASN A 31 6.802 4.264 12.863 1.00 0.00 O flip ATOM 499 ND2 ASN A 31 7.693 4.398 14.918 1.00 0.00 N flip ATOM 0 H ASN A 31 2.699 3.131 15.001 1.00 0.00 H new ATOM 0 HA ASN A 31 4.931 2.776 13.086 1.00 0.00 H new ATOM 0 HB2 ASN A 31 4.743 4.933 14.659 1.00 0.00 H new ATOM 0 HB3 ASN A 31 5.422 3.837 15.846 1.00 0.00 H new ATOM 0 HD21 ASN A 31 7.582 4.376 15.932 1.00 0.00 H new ATOM 0 HD22 ASN A 31 8.615 4.548 14.509 1.00 0.00 H new ATOM 506 N LEU A 32 3.873 0.821 15.152 1.00 0.00 N ATOM 507 CA LEU A 32 4.048 -0.449 15.842 1.00 0.00 C ATOM 508 C LEU A 32 5.133 -1.224 15.145 1.00 0.00 C ATOM 509 O LEU A 32 6.162 -1.574 15.724 1.00 0.00 O ATOM 510 CB LEU A 32 2.778 -1.281 15.791 1.00 0.00 C ATOM 511 CG LEU A 32 2.223 -1.710 17.151 1.00 0.00 C ATOM 512 CD1 LEU A 32 0.703 -1.674 17.145 1.00 0.00 C ATOM 513 CD2 LEU A 32 2.725 -3.099 17.516 1.00 0.00 C ATOM 0 H LEU A 32 2.906 1.053 14.923 1.00 0.00 H new ATOM 0 HA LEU A 32 4.300 -0.245 16.883 1.00 0.00 H new ATOM 0 HB2 LEU A 32 2.011 -0.711 15.267 1.00 0.00 H new ATOM 0 HB3 LEU A 32 2.972 -2.175 15.198 1.00 0.00 H new ATOM 0 HG LEU A 32 2.578 -1.007 17.905 1.00 0.00 H new ATOM 0 HD11 LEU A 32 0.328 -1.982 18.121 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.364 -0.661 16.930 1.00 0.00 H new ATOM 0 HD13 LEU A 32 0.326 -2.353 16.380 1.00 0.00 H new ATOM 0 HD21 LEU A 32 2.321 -3.389 18.486 1.00 0.00 H new ATOM 0 HD22 LEU A 32 2.400 -3.814 16.760 1.00 0.00 H new ATOM 0 HD23 LEU A 32 3.814 -3.091 17.564 1.00 0.00 H new ATOM 525 N ASN A 33 4.874 -1.476 13.875 1.00 0.00 N ATOM 526 CA ASN A 33 5.798 -2.196 13.045 1.00 0.00 C ATOM 527 C ASN A 33 5.930 -1.545 11.666 1.00 0.00 C ATOM 528 O ASN A 33 6.937 -1.731 10.983 1.00 0.00 O ATOM 529 CB ASN A 33 5.348 -3.651 12.893 1.00 0.00 C ATOM 530 CG ASN A 33 5.939 -4.553 13.958 1.00 0.00 C ATOM 531 OD1 ASN A 33 7.071 -5.021 13.834 1.00 0.00 O ATOM 532 ND2 ASN A 33 5.173 -4.803 15.014 1.00 0.00 N ATOM 0 H ASN A 33 4.019 -1.185 13.400 1.00 0.00 H new ATOM 0 HA ASN A 33 6.774 -2.169 13.529 1.00 0.00 H new ATOM 0 HB2 ASN A 33 4.260 -3.699 12.943 1.00 0.00 H new ATOM 0 HB3 ASN A 33 5.639 -4.017 11.908 1.00 0.00 H new ATOM 0 HD21 ASN A 33 5.517 -5.404 15.763 1.00 0.00 H new ATOM 0 HD22 ASN A 33 4.241 -4.394 15.076 1.00 0.00 H new ATOM 539 N THR A 34 4.905 -0.787 11.252 1.00 0.00 N ATOM 540 CA THR A 34 4.917 -0.124 9.943 1.00 0.00 C ATOM 541 C THR A 34 3.736 0.832 9.808 1.00 0.00 C ATOM 542 O THR A 34 2.884 0.915 10.692 1.00 0.00 O ATOM 543 CB THR A 34 4.875 -1.145 8.783 1.00 0.00 C ATOM 544 OG1 THR A 34 3.687 -0.999 8.023 1.00 0.00 O ATOM 545 CG2 THR A 34 4.948 -2.597 9.214 1.00 0.00 C ATOM 0 H THR A 34 4.062 -0.619 11.802 1.00 0.00 H new ATOM 0 HA THR A 34 5.850 0.436 9.882 1.00 0.00 H new ATOM 0 HB THR A 34 5.767 -0.918 8.200 1.00 0.00 H new ATOM 0 HG1 THR A 34 3.424 -1.869 7.656 1.00 0.00 H new ATOM 0 HG21 THR A 34 4.912 -3.240 8.334 1.00 0.00 H new ATOM 0 HG22 THR A 34 5.880 -2.770 9.752 1.00 0.00 H new ATOM 0 HG23 THR A 34 4.105 -2.826 9.865 1.00 0.00 H new ATOM 553 N ARG A 35 3.673 1.519 8.670 1.00 0.00 N ATOM 554 CA ARG A 35 2.573 2.433 8.386 1.00 0.00 C ATOM 555 C ARG A 35 2.342 2.554 6.889 1.00 0.00 C ATOM 556 O ARG A 35 3.278 2.446 6.100 1.00 0.00 O ATOM 557 CB ARG A 35 2.838 3.822 8.964 1.00 0.00 C ATOM 558 CG ARG A 35 1.603 4.715 8.977 1.00 0.00 C ATOM 559 CD ARG A 35 1.317 5.251 10.368 1.00 0.00 C ATOM 560 NE ARG A 35 -0.115 5.318 10.661 1.00 0.00 N ATOM 561 CZ ARG A 35 -0.848 6.424 10.548 1.00 0.00 C ATOM 562 NH1 ARG A 35 -0.309 7.544 10.083 1.00 0.00 N ATOM 563 NH2 ARG A 35 -2.127 6.409 10.897 1.00 0.00 N ATOM 0 H ARG A 35 4.372 1.459 7.930 1.00 0.00 H new ATOM 0 HA ARG A 35 1.683 2.018 8.859 1.00 0.00 H new ATOM 0 HB2 ARG A 35 3.214 3.719 9.982 1.00 0.00 H new ATOM 0 HB3 ARG A 35 3.622 4.307 8.382 1.00 0.00 H new ATOM 0 HG2 ARG A 35 1.748 5.547 8.288 1.00 0.00 H new ATOM 0 HG3 ARG A 35 0.742 4.151 8.619 1.00 0.00 H new ATOM 0 HD2 ARG A 35 1.806 4.615 11.106 1.00 0.00 H new ATOM 0 HD3 ARG A 35 1.751 6.246 10.467 1.00 0.00 H new ATOM 0 HE ARG A 35 -0.580 4.465 10.971 1.00 0.00 H new ATOM 0 HH11 ARG A 35 0.673 7.562 9.809 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -0.877 8.387 9.999 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -2.549 5.551 11.252 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -2.689 7.256 10.811 1.00 0.00 H new ATOM 577 N LEU A 36 1.101 2.823 6.506 1.00 0.00 N ATOM 578 CA LEU A 36 0.767 3.004 5.103 1.00 0.00 C ATOM 579 C LEU A 36 1.206 4.395 4.684 1.00 0.00 C ATOM 580 O LEU A 36 1.365 5.272 5.534 1.00 0.00 O ATOM 581 CB LEU A 36 -0.734 2.843 4.885 1.00 0.00 C ATOM 582 CG LEU A 36 -1.164 2.629 3.432 1.00 0.00 C ATOM 583 CD1 LEU A 36 -0.332 1.535 2.780 1.00 0.00 C ATOM 584 CD2 LEU A 36 -2.645 2.289 3.360 1.00 0.00 C ATOM 0 H LEU A 36 0.313 2.920 7.146 1.00 0.00 H new ATOM 0 HA LEU A 36 1.278 2.250 4.503 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.082 1.997 5.478 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -1.238 3.730 5.269 1.00 0.00 H new ATOM 0 HG LEU A 36 -0.996 3.557 2.885 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.654 1.399 1.748 1.00 0.00 H new ATOM 0 HD12 LEU A 36 0.720 1.819 2.797 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -0.465 0.602 3.327 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -2.934 2.140 2.320 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -2.837 1.376 3.924 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -3.227 3.107 3.785 1.00 0.00 H new ATOM 596 N VAL A 37 1.436 4.608 3.397 1.00 0.00 N ATOM 597 CA VAL A 37 1.893 5.916 2.955 1.00 0.00 C ATOM 598 C VAL A 37 1.520 6.250 1.529 1.00 0.00 C ATOM 599 O VAL A 37 1.398 5.379 0.669 1.00 0.00 O ATOM 600 CB VAL A 37 3.425 6.019 3.038 1.00 0.00 C ATOM 601 CG1 VAL A 37 3.898 5.926 4.481 1.00 0.00 C ATOM 602 CG2 VAL A 37 4.065 4.933 2.185 1.00 0.00 C ATOM 0 H VAL A 37 1.318 3.914 2.659 1.00 0.00 H new ATOM 0 HA VAL A 37 1.395 6.616 3.626 1.00 0.00 H new ATOM 0 HB VAL A 37 3.731 6.991 2.652 1.00 0.00 H new ATOM 0 HG11 VAL A 37 4.985 6.001 4.513 1.00 0.00 H new ATOM 0 HG12 VAL A 37 3.461 6.739 5.060 1.00 0.00 H new ATOM 0 HG13 VAL A 37 3.588 4.971 4.905 1.00 0.00 H new ATOM 0 HG21 VAL A 37 5.150 5.012 2.249 1.00 0.00 H new ATOM 0 HG22 VAL A 37 3.751 3.954 2.547 1.00 0.00 H new ATOM 0 HG23 VAL A 37 3.753 5.054 1.148 1.00 0.00 H new ATOM 612 N ILE A 38 1.449 7.547 1.282 1.00 0.00 N ATOM 613 CA ILE A 38 1.217 8.060 -0.043 1.00 0.00 C ATOM 614 C ILE A 38 2.547 8.678 -0.469 1.00 0.00 C ATOM 615 O ILE A 38 2.841 9.834 -0.167 1.00 0.00 O ATOM 616 CB ILE A 38 0.081 9.103 -0.044 1.00 0.00 C ATOM 617 CG1 ILE A 38 -0.098 9.708 -1.436 1.00 0.00 C ATOM 618 CG2 ILE A 38 0.345 10.183 1.000 1.00 0.00 C ATOM 619 CD1 ILE A 38 -1.134 10.812 -1.483 1.00 0.00 C ATOM 0 H ILE A 38 1.551 8.267 1.998 1.00 0.00 H new ATOM 0 HA ILE A 38 0.899 7.279 -0.734 1.00 0.00 H new ATOM 0 HB ILE A 38 -0.849 8.601 0.221 1.00 0.00 H new ATOM 0 HG12 ILE A 38 0.859 10.103 -1.778 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -0.385 8.920 -2.132 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -0.467 10.910 0.985 1.00 0.00 H new ATOM 0 HG22 ILE A 38 0.405 9.727 1.988 1.00 0.00 H new ATOM 0 HG23 ILE A 38 1.286 10.685 0.774 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -1.210 11.197 -2.500 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -2.101 10.417 -1.171 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -0.838 11.618 -0.812 1.00 0.00 H new ATOM 631 N PRO A 39 3.408 7.859 -1.098 1.00 0.00 N ATOM 632 CA PRO A 39 4.765 8.251 -1.484 1.00 0.00 C ATOM 633 C PRO A 39 4.888 9.600 -2.193 1.00 0.00 C ATOM 634 O PRO A 39 4.589 9.719 -3.375 1.00 0.00 O ATOM 635 CB PRO A 39 5.232 7.124 -2.418 1.00 0.00 C ATOM 636 CG PRO A 39 4.093 6.160 -2.534 1.00 0.00 C ATOM 637 CD PRO A 39 3.163 6.441 -1.392 1.00 0.00 C ATOM 0 HA PRO A 39 5.368 8.383 -0.586 1.00 0.00 H new ATOM 0 HB2 PRO A 39 5.504 7.520 -3.396 1.00 0.00 H new ATOM 0 HB3 PRO A 39 6.117 6.631 -2.016 1.00 0.00 H new ATOM 0 HG2 PRO A 39 3.580 6.282 -3.488 1.00 0.00 H new ATOM 0 HG3 PRO A 39 4.452 5.132 -2.495 1.00 0.00 H new ATOM 0 HD2 PRO A 39 2.124 6.261 -1.666 1.00 0.00 H new ATOM 0 HD3 PRO A 39 3.380 5.808 -0.531 1.00 0.00 H new ATOM 645 N LEU A 40 5.393 10.597 -1.472 1.00 0.00 N ATOM 646 CA LEU A 40 5.626 11.926 -2.032 1.00 0.00 C ATOM 647 C LEU A 40 6.788 11.881 -2.993 1.00 0.00 C ATOM 648 O LEU A 40 7.670 11.032 -2.874 1.00 0.00 O ATOM 649 CB LEU A 40 5.940 12.917 -0.918 1.00 0.00 C ATOM 650 CG LEU A 40 4.728 13.495 -0.220 1.00 0.00 C ATOM 651 CD1 LEU A 40 5.036 13.768 1.244 1.00 0.00 C ATOM 652 CD2 LEU A 40 4.275 14.764 -0.919 1.00 0.00 C ATOM 0 H LEU A 40 5.651 10.508 -0.489 1.00 0.00 H new ATOM 0 HA LEU A 40 4.726 12.245 -2.558 1.00 0.00 H new ATOM 0 HB2 LEU A 40 6.566 12.421 -0.176 1.00 0.00 H new ATOM 0 HB3 LEU A 40 6.526 13.736 -1.335 1.00 0.00 H new ATOM 0 HG LEU A 40 3.918 12.767 -0.267 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.153 14.183 1.730 1.00 0.00 H new ATOM 0 HD12 LEU A 40 5.317 12.837 1.736 1.00 0.00 H new ATOM 0 HD13 LEU A 40 5.859 14.480 1.316 1.00 0.00 H new ATOM 0 HD21 LEU A 40 3.402 15.170 -0.407 1.00 0.00 H new ATOM 0 HD22 LEU A 40 5.081 15.498 -0.899 1.00 0.00 H new ATOM 0 HD23 LEU A 40 4.016 14.537 -1.953 1.00 0.00 H new ATOM 664 N THR A 41 6.791 12.792 -3.947 1.00 0.00 N ATOM 665 CA THR A 41 7.861 12.839 -4.916 1.00 0.00 C ATOM 666 C THR A 41 7.957 14.203 -5.583 1.00 0.00 C ATOM 667 O THR A 41 7.041 15.015 -5.492 1.00 0.00 O ATOM 668 CB THR A 41 7.702 11.709 -5.926 1.00 0.00 C ATOM 669 OG1 THR A 41 8.171 12.079 -7.211 1.00 0.00 O ATOM 670 CG2 THR A 41 6.282 11.201 -6.090 1.00 0.00 C ATOM 0 H THR A 41 6.070 13.503 -4.069 1.00 0.00 H new ATOM 0 HA THR A 41 8.807 12.691 -4.395 1.00 0.00 H new ATOM 0 HB THR A 41 8.305 10.906 -5.502 1.00 0.00 H new ATOM 0 HG1 THR A 41 8.054 11.329 -7.830 1.00 0.00 H new ATOM 0 HG21 THR A 41 6.265 10.399 -6.828 1.00 0.00 H new ATOM 0 HG22 THR A 41 5.918 10.823 -5.135 1.00 0.00 H new ATOM 0 HG23 THR A 41 5.641 12.016 -6.426 1.00 0.00 H new ATOM 678 N PRO A 42 9.081 14.486 -6.250 1.00 0.00 N ATOM 679 CA PRO A 42 9.295 15.771 -6.912 1.00 0.00 C ATOM 680 C PRO A 42 8.364 15.979 -8.097 1.00 0.00 C ATOM 681 O PRO A 42 8.457 15.292 -9.113 1.00 0.00 O ATOM 682 CB PRO A 42 10.761 15.676 -7.342 1.00 0.00 C ATOM 683 CG PRO A 42 10.958 14.228 -7.565 1.00 0.00 C ATOM 684 CD PRO A 42 10.251 13.600 -6.409 1.00 0.00 C ATOM 0 HA PRO A 42 9.084 16.625 -6.268 1.00 0.00 H new ATOM 0 HB2 PRO A 42 10.953 16.252 -8.247 1.00 0.00 H new ATOM 0 HB3 PRO A 42 11.431 16.059 -6.573 1.00 0.00 H new ATOM 0 HG2 PRO A 42 10.535 13.907 -8.517 1.00 0.00 H new ATOM 0 HG3 PRO A 42 12.015 13.964 -7.581 1.00 0.00 H new ATOM 0 HD2 PRO A 42 9.959 12.571 -6.619 1.00 0.00 H new ATOM 0 HD3 PRO A 42 10.872 13.578 -5.513 1.00 0.00 H new ATOM 692 N ILE A 43 7.462 16.943 -7.940 1.00 0.00 N ATOM 693 CA ILE A 43 6.484 17.289 -8.967 1.00 0.00 C ATOM 694 C ILE A 43 7.116 17.322 -10.352 1.00 0.00 C ATOM 695 O ILE A 43 6.464 17.049 -11.360 1.00 0.00 O ATOM 696 CB ILE A 43 5.871 18.673 -8.667 1.00 0.00 C ATOM 697 CG1 ILE A 43 4.966 18.591 -7.446 1.00 0.00 C ATOM 698 CG2 ILE A 43 5.139 19.224 -9.879 1.00 0.00 C ATOM 699 CD1 ILE A 43 5.091 19.791 -6.536 1.00 0.00 C ATOM 0 H ILE A 43 7.388 17.508 -7.094 1.00 0.00 H new ATOM 0 HA ILE A 43 5.710 16.522 -8.954 1.00 0.00 H new ATOM 0 HB ILE A 43 6.677 19.371 -8.442 1.00 0.00 H new ATOM 0 HG12 ILE A 43 3.931 18.497 -7.774 1.00 0.00 H new ATOM 0 HG13 ILE A 43 5.205 17.689 -6.883 1.00 0.00 H new ATOM 0 HG21 ILE A 43 4.718 20.200 -9.637 1.00 0.00 H new ATOM 0 HG22 ILE A 43 5.837 19.326 -10.710 1.00 0.00 H new ATOM 0 HG23 ILE A 43 4.336 18.542 -10.160 1.00 0.00 H new ATOM 0 HD11 ILE A 43 4.421 19.673 -5.684 1.00 0.00 H new ATOM 0 HD12 ILE A 43 6.118 19.873 -6.181 1.00 0.00 H new ATOM 0 HD13 ILE A 43 4.824 20.694 -7.085 1.00 0.00 H new ATOM 711 N GLU A 44 8.381 17.689 -10.383 1.00 0.00 N ATOM 712 CA GLU A 44 9.126 17.806 -11.622 1.00 0.00 C ATOM 713 C GLU A 44 9.420 16.450 -12.261 1.00 0.00 C ATOM 714 O GLU A 44 9.565 16.355 -13.480 1.00 0.00 O ATOM 715 CB GLU A 44 10.413 18.558 -11.333 1.00 0.00 C ATOM 716 CG GLU A 44 11.218 18.898 -12.575 1.00 0.00 C ATOM 717 CD GLU A 44 12.599 19.431 -12.247 1.00 0.00 C ATOM 718 OE1 GLU A 44 13.107 19.128 -11.147 1.00 0.00 O ATOM 719 OE2 GLU A 44 13.173 20.152 -13.090 1.00 0.00 O ATOM 0 H GLU A 44 8.923 17.915 -9.549 1.00 0.00 H new ATOM 0 HA GLU A 44 8.519 18.352 -12.344 1.00 0.00 H new ATOM 0 HB2 GLU A 44 10.173 19.480 -10.804 1.00 0.00 H new ATOM 0 HB3 GLU A 44 11.031 17.958 -10.664 1.00 0.00 H new ATOM 0 HG2 GLU A 44 11.314 18.007 -13.196 1.00 0.00 H new ATOM 0 HG3 GLU A 44 10.677 19.639 -13.163 1.00 0.00 H new ATOM 726 N LEU A 45 9.505 15.404 -11.448 1.00 0.00 N ATOM 727 CA LEU A 45 9.779 14.068 -11.967 1.00 0.00 C ATOM 728 C LEU A 45 8.659 13.607 -12.894 1.00 0.00 C ATOM 729 O LEU A 45 8.884 12.820 -13.812 1.00 0.00 O ATOM 730 CB LEU A 45 9.948 13.068 -10.821 1.00 0.00 C ATOM 731 CG LEU A 45 11.398 12.760 -10.442 1.00 0.00 C ATOM 732 CD1 LEU A 45 11.450 11.724 -9.330 1.00 0.00 C ATOM 733 CD2 LEU A 45 12.175 12.279 -11.658 1.00 0.00 C ATOM 0 H LEU A 45 9.390 15.453 -10.436 1.00 0.00 H new ATOM 0 HA LEU A 45 10.708 14.114 -12.535 1.00 0.00 H new ATOM 0 HB2 LEU A 45 9.433 13.455 -9.942 1.00 0.00 H new ATOM 0 HB3 LEU A 45 9.454 12.136 -11.096 1.00 0.00 H new ATOM 0 HG LEU A 45 11.862 13.677 -10.078 1.00 0.00 H new ATOM 0 HD11 LEU A 45 12.489 11.517 -9.074 1.00 0.00 H new ATOM 0 HD12 LEU A 45 10.929 12.106 -8.452 1.00 0.00 H new ATOM 0 HD13 LEU A 45 10.970 10.805 -9.666 1.00 0.00 H new ATOM 0 HD21 LEU A 45 13.204 12.064 -11.371 1.00 0.00 H new ATOM 0 HD22 LEU A 45 11.712 11.374 -12.051 1.00 0.00 H new ATOM 0 HD23 LEU A 45 12.166 13.053 -12.425 1.00 0.00 H new ATOM 745 N LEU A 46 7.450 14.102 -12.644 1.00 0.00 N ATOM 746 CA LEU A 46 6.295 13.739 -13.455 1.00 0.00 C ATOM 747 C LEU A 46 5.843 14.910 -14.323 1.00 0.00 C ATOM 748 O LEU A 46 4.667 15.015 -14.675 1.00 0.00 O ATOM 749 CB LEU A 46 5.144 13.279 -12.557 1.00 0.00 C ATOM 750 CG LEU A 46 4.139 12.338 -13.223 1.00 0.00 C ATOM 751 CD1 LEU A 46 4.763 10.970 -13.456 1.00 0.00 C ATOM 752 CD2 LEU A 46 2.883 12.215 -12.375 1.00 0.00 C ATOM 0 H LEU A 46 7.246 14.755 -11.887 1.00 0.00 H new ATOM 0 HA LEU A 46 6.587 12.920 -14.112 1.00 0.00 H new ATOM 0 HB2 LEU A 46 5.562 12.779 -11.683 1.00 0.00 H new ATOM 0 HB3 LEU A 46 4.611 14.159 -12.196 1.00 0.00 H new ATOM 0 HG LEU A 46 3.861 12.758 -14.190 1.00 0.00 H new ATOM 0 HD11 LEU A 46 4.034 10.313 -13.931 1.00 0.00 H new ATOM 0 HD12 LEU A 46 5.634 11.073 -14.103 1.00 0.00 H new ATOM 0 HD13 LEU A 46 5.069 10.542 -12.501 1.00 0.00 H new ATOM 0 HD21 LEU A 46 2.179 11.542 -12.864 1.00 0.00 H new ATOM 0 HD22 LEU A 46 3.144 11.818 -11.394 1.00 0.00 H new ATOM 0 HD23 LEU A 46 2.425 13.197 -12.259 1.00 0.00 H new ATOM 764 N ASP A 47 6.781 15.789 -14.668 1.00 0.00 N ATOM 765 CA ASP A 47 6.474 16.951 -15.496 1.00 0.00 C ATOM 766 C ASP A 47 5.640 17.950 -14.744 1.00 0.00 C ATOM 767 O ASP A 47 4.504 17.686 -14.349 1.00 0.00 O ATOM 768 CB ASP A 47 5.757 16.547 -16.781 1.00 0.00 C ATOM 769 CG ASP A 47 6.246 15.223 -17.337 1.00 0.00 C ATOM 770 OD1 ASP A 47 7.232 15.229 -18.103 1.00 0.00 O ATOM 771 OD2 ASP A 47 5.642 14.181 -17.007 1.00 0.00 O ATOM 0 H ASP A 47 7.759 15.718 -14.387 1.00 0.00 H new ATOM 0 HA ASP A 47 7.425 17.414 -15.759 1.00 0.00 H new ATOM 0 HB2 ASP A 47 4.686 16.482 -16.589 1.00 0.00 H new ATOM 0 HB3 ASP A 47 5.899 17.325 -17.531 1.00 0.00 H new ATOM 776 N LYS A 48 6.232 19.107 -14.565 1.00 0.00 N ATOM 777 CA LYS A 48 5.595 20.197 -13.877 1.00 0.00 C ATOM 778 C LYS A 48 4.399 20.705 -14.674 1.00 0.00 C ATOM 779 O LYS A 48 3.402 21.156 -14.112 1.00 0.00 O ATOM 780 CB LYS A 48 6.615 21.303 -13.679 1.00 0.00 C ATOM 781 CG LYS A 48 6.711 21.791 -12.244 1.00 0.00 C ATOM 782 CD LYS A 48 7.888 21.157 -11.529 1.00 0.00 C ATOM 783 CE LYS A 48 9.183 21.893 -11.834 1.00 0.00 C ATOM 784 NZ LYS A 48 9.207 23.252 -11.226 1.00 0.00 N ATOM 0 H LYS A 48 7.174 19.317 -14.895 1.00 0.00 H new ATOM 0 HA LYS A 48 5.227 19.859 -12.908 1.00 0.00 H new ATOM 0 HB2 LYS A 48 7.594 20.945 -13.999 1.00 0.00 H new ATOM 0 HB3 LYS A 48 6.357 22.143 -14.323 1.00 0.00 H new ATOM 0 HG2 LYS A 48 6.816 22.876 -12.232 1.00 0.00 H new ATOM 0 HG3 LYS A 48 5.789 21.554 -11.714 1.00 0.00 H new ATOM 0 HD2 LYS A 48 7.709 21.163 -10.454 1.00 0.00 H new ATOM 0 HD3 LYS A 48 7.981 20.114 -11.831 1.00 0.00 H new ATOM 0 HE2 LYS A 48 10.027 21.313 -11.460 1.00 0.00 H new ATOM 0 HE3 LYS A 48 9.307 21.976 -12.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 10.191 23.577 -11.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 8.675 23.912 -11.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 8.771 23.218 -10.282 1.00 0.00 H new ATOM 798 N LYS A 49 4.520 20.624 -15.995 1.00 0.00 N ATOM 799 CA LYS A 49 3.467 21.068 -16.899 1.00 0.00 C ATOM 800 C LYS A 49 2.269 20.124 -16.854 1.00 0.00 C ATOM 801 O LYS A 49 1.127 20.562 -16.719 1.00 0.00 O ATOM 802 CB LYS A 49 4.008 21.152 -18.328 1.00 0.00 C ATOM 803 CG LYS A 49 4.650 19.861 -18.817 1.00 0.00 C ATOM 804 CD LYS A 49 5.361 20.062 -20.145 1.00 0.00 C ATOM 805 CE LYS A 49 6.723 20.711 -19.955 1.00 0.00 C ATOM 806 NZ LYS A 49 7.822 19.705 -19.956 1.00 0.00 N ATOM 0 H LYS A 49 5.345 20.251 -16.466 1.00 0.00 H new ATOM 0 HA LYS A 49 3.136 22.055 -16.576 1.00 0.00 H new ATOM 0 HB2 LYS A 49 3.193 21.419 -19.000 1.00 0.00 H new ATOM 0 HB3 LYS A 49 4.742 21.956 -18.382 1.00 0.00 H new ATOM 0 HG2 LYS A 49 5.361 19.502 -18.073 1.00 0.00 H new ATOM 0 HG3 LYS A 49 3.886 19.091 -18.925 1.00 0.00 H new ATOM 0 HD2 LYS A 49 5.481 19.100 -20.644 1.00 0.00 H new ATOM 0 HD3 LYS A 49 4.748 20.684 -20.797 1.00 0.00 H new ATOM 0 HE2 LYS A 49 6.894 21.436 -20.751 1.00 0.00 H new ATOM 0 HE3 LYS A 49 6.735 21.261 -19.014 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 8.734 20.187 -19.824 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 7.673 19.027 -19.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 7.827 19.197 -20.864 1.00 0.00 H new ATOM 820 N ALA A 50 2.538 18.828 -16.973 1.00 0.00 N ATOM 821 CA ALA A 50 1.482 17.822 -16.951 1.00 0.00 C ATOM 822 C ALA A 50 0.877 17.686 -15.554 1.00 0.00 C ATOM 823 O ALA A 50 1.544 17.231 -14.625 1.00 0.00 O ATOM 824 CB ALA A 50 2.025 16.482 -17.423 1.00 0.00 C ATOM 0 H ALA A 50 3.478 18.449 -17.086 1.00 0.00 H new ATOM 0 HA ALA A 50 0.692 18.145 -17.629 1.00 0.00 H new ATOM 0 HB1 ALA A 50 1.228 15.739 -17.402 1.00 0.00 H new ATOM 0 HB2 ALA A 50 2.403 16.581 -18.441 1.00 0.00 H new ATOM 0 HB3 ALA A 50 2.834 16.165 -16.765 1.00 0.00 H new ATOM 830 N PRO A 51 -0.401 18.074 -15.385 1.00 0.00 N ATOM 831 CA PRO A 51 -1.084 17.985 -14.090 1.00 0.00 C ATOM 832 C PRO A 51 -1.014 16.581 -13.500 1.00 0.00 C ATOM 833 O PRO A 51 -1.355 15.601 -14.163 1.00 0.00 O ATOM 834 CB PRO A 51 -2.532 18.355 -14.419 1.00 0.00 C ATOM 835 CG PRO A 51 -2.443 19.176 -15.658 1.00 0.00 C ATOM 836 CD PRO A 51 -1.279 18.626 -16.434 1.00 0.00 C ATOM 0 HA PRO A 51 -0.627 18.635 -13.343 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -3.141 17.465 -14.577 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -2.992 18.916 -13.605 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -3.364 19.111 -16.237 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -2.291 20.229 -15.419 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -1.594 17.858 -17.140 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -0.777 19.403 -17.011 1.00 0.00 H new ATOM 844 N SER A 52 -0.569 16.489 -12.252 1.00 0.00 N ATOM 845 CA SER A 52 -0.452 15.203 -11.575 1.00 0.00 C ATOM 846 C SER A 52 -1.765 14.822 -10.897 1.00 0.00 C ATOM 847 O SER A 52 -2.052 15.266 -9.785 1.00 0.00 O ATOM 848 CB SER A 52 0.677 15.246 -10.543 1.00 0.00 C ATOM 849 OG SER A 52 1.549 16.336 -10.785 1.00 0.00 O ATOM 0 H SER A 52 -0.283 17.290 -11.688 1.00 0.00 H new ATOM 0 HA SER A 52 -0.220 14.446 -12.325 1.00 0.00 H new ATOM 0 HB2 SER A 52 0.255 15.329 -9.541 1.00 0.00 H new ATOM 0 HB3 SER A 52 1.239 14.313 -10.575 1.00 0.00 H new ATOM 0 HG SER A 52 2.260 16.342 -10.111 1.00 0.00 H new ATOM 855 N HIS A 53 -2.556 13.994 -11.573 1.00 0.00 N ATOM 856 CA HIS A 53 -3.837 13.551 -11.033 1.00 0.00 C ATOM 857 C HIS A 53 -3.639 12.813 -9.713 1.00 0.00 C ATOM 858 O HIS A 53 -2.605 12.183 -9.494 1.00 0.00 O ATOM 859 CB HIS A 53 -4.553 12.647 -12.040 1.00 0.00 C ATOM 860 CG HIS A 53 -5.951 13.085 -12.349 1.00 0.00 C ATOM 861 ND1 HIS A 53 -6.702 13.864 -11.494 1.00 0.00 N ATOM 862 CD2 HIS A 53 -6.735 12.849 -13.427 1.00 0.00 C ATOM 863 CE1 HIS A 53 -7.888 14.087 -12.033 1.00 0.00 C ATOM 864 NE2 HIS A 53 -7.933 13.483 -13.206 1.00 0.00 N ATOM 0 H HIS A 53 -2.333 13.617 -12.494 1.00 0.00 H new ATOM 0 HA HIS A 53 -4.453 14.431 -10.848 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -3.977 12.619 -12.965 1.00 0.00 H new ATOM 0 HB3 HIS A 53 -4.578 11.630 -11.649 1.00 0.00 H new ATOM 0 HD2 HIS A 53 -6.468 12.270 -14.299 1.00 0.00 H new ATOM 0 HE1 HIS A 53 -8.685 14.665 -11.589 1.00 0.00 H new ATOM 0 HE2 HIS A 53 -8.728 13.487 -13.845 1.00 0.00 H new ATOM 873 N LEU A 54 -4.637 12.897 -8.836 1.00 0.00 N ATOM 874 CA LEU A 54 -4.573 12.239 -7.534 1.00 0.00 C ATOM 875 C LEU A 54 -3.468 12.846 -6.674 1.00 0.00 C ATOM 876 O LEU A 54 -3.739 13.603 -5.743 1.00 0.00 O ATOM 877 CB LEU A 54 -4.341 10.734 -7.704 1.00 0.00 C ATOM 878 CG LEU A 54 -5.601 9.872 -7.610 1.00 0.00 C ATOM 879 CD1 LEU A 54 -6.332 9.848 -8.943 1.00 0.00 C ATOM 880 CD2 LEU A 54 -5.247 8.459 -7.169 1.00 0.00 C ATOM 0 H LEU A 54 -5.500 13.415 -9.004 1.00 0.00 H new ATOM 0 HA LEU A 54 -5.527 12.393 -7.030 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -3.872 10.561 -8.672 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -3.634 10.402 -6.943 1.00 0.00 H new ATOM 0 HG LEU A 54 -6.264 10.310 -6.864 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -7.226 9.230 -8.857 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -6.618 10.863 -9.219 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -5.677 9.434 -9.710 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -6.155 7.859 -7.107 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -4.565 8.012 -7.893 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -4.767 8.493 -6.191 1.00 0.00 H new ATOM 892 N CYS A 55 -2.222 12.511 -6.995 1.00 0.00 N ATOM 893 CA CYS A 55 -1.076 13.025 -6.253 1.00 0.00 C ATOM 894 C CYS A 55 -1.033 14.551 -6.309 1.00 0.00 C ATOM 895 O CYS A 55 -0.749 15.132 -7.356 1.00 0.00 O ATOM 896 CB CYS A 55 0.222 12.445 -6.817 1.00 0.00 C ATOM 897 SG CYS A 55 0.460 12.749 -8.583 1.00 0.00 S ATOM 0 H CYS A 55 -1.980 11.886 -7.764 1.00 0.00 H new ATOM 0 HA CYS A 55 -1.180 12.720 -5.212 1.00 0.00 H new ATOM 0 HB2 CYS A 55 1.064 12.868 -6.270 1.00 0.00 H new ATOM 0 HB3 CYS A 55 0.234 11.370 -6.639 1.00 0.00 H new ATOM 0 HG CYS A 55 -0.672 12.601 -9.205 1.00 0.00 H new ATOM 903 N PRO A 56 -1.327 15.226 -5.181 1.00 0.00 N ATOM 904 CA PRO A 56 -1.333 16.678 -5.105 1.00 0.00 C ATOM 905 C PRO A 56 -0.017 17.249 -4.583 1.00 0.00 C ATOM 906 O PRO A 56 0.620 16.663 -3.708 1.00 0.00 O ATOM 907 CB PRO A 56 -2.457 16.931 -4.105 1.00 0.00 C ATOM 908 CG PRO A 56 -2.425 15.753 -3.175 1.00 0.00 C ATOM 909 CD PRO A 56 -1.693 14.633 -3.885 1.00 0.00 C ATOM 0 HA PRO A 56 -1.466 17.150 -6.078 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -2.301 17.865 -3.564 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -3.421 17.011 -4.607 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -1.919 16.012 -2.245 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -3.437 15.444 -2.912 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -0.813 14.313 -3.328 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -2.327 13.756 -4.010 1.00 0.00 H new ATOM 917 N THR A 57 0.378 18.403 -5.116 1.00 0.00 N ATOM 918 CA THR A 57 1.612 19.056 -4.690 1.00 0.00 C ATOM 919 C THR A 57 1.474 19.638 -3.321 1.00 0.00 C ATOM 920 O THR A 57 0.367 19.841 -2.822 1.00 0.00 O ATOM 921 CB THR A 57 2.016 20.218 -5.584 1.00 0.00 C ATOM 922 OG1 THR A 57 1.269 21.376 -5.228 1.00 0.00 O ATOM 923 CG2 THR A 57 1.862 19.958 -7.069 1.00 0.00 C ATOM 0 H THR A 57 -0.137 18.903 -5.841 1.00 0.00 H new ATOM 0 HA THR A 57 2.363 18.267 -4.731 1.00 0.00 H new ATOM 0 HB THR A 57 3.083 20.364 -5.414 1.00 0.00 H new ATOM 0 HG1 THR A 57 1.532 22.124 -5.804 1.00 0.00 H new ATOM 0 HG21 THR A 57 2.174 20.841 -7.627 1.00 0.00 H new ATOM 0 HG22 THR A 57 2.483 19.109 -7.356 1.00 0.00 H new ATOM 0 HG23 THR A 57 0.819 19.736 -7.293 1.00 0.00 H new ATOM 931 N ILE A 58 2.609 19.975 -2.741 1.00 0.00 N ATOM 932 CA ILE A 58 2.595 20.609 -1.470 1.00 0.00 C ATOM 933 C ILE A 58 3.512 21.815 -1.441 1.00 0.00 C ATOM 934 O ILE A 58 4.236 22.088 -2.398 1.00 0.00 O ATOM 935 CB ILE A 58 3.024 19.679 -0.335 1.00 0.00 C ATOM 936 CG1 ILE A 58 4.464 19.237 -0.574 1.00 0.00 C ATOM 937 CG2 ILE A 58 2.076 18.491 -0.221 1.00 0.00 C ATOM 938 CD1 ILE A 58 4.542 18.052 -1.485 1.00 0.00 C ATOM 0 H ILE A 58 3.535 19.816 -3.137 1.00 0.00 H new ATOM 0 HA ILE A 58 1.558 20.909 -1.316 1.00 0.00 H new ATOM 0 HB ILE A 58 2.976 20.210 0.615 1.00 0.00 H new ATOM 0 HG12 ILE A 58 5.030 20.063 -1.004 1.00 0.00 H new ATOM 0 HG13 ILE A 58 4.931 18.993 0.380 1.00 0.00 H new ATOM 0 HG21 ILE A 58 2.401 17.843 0.593 1.00 0.00 H new ATOM 0 HG22 ILE A 58 1.067 18.849 -0.019 1.00 0.00 H new ATOM 0 HG23 ILE A 58 2.082 17.930 -1.156 1.00 0.00 H new ATOM 0 HD11 ILE A 58 5.585 17.771 -1.628 1.00 0.00 H new ATOM 0 HD12 ILE A 58 3.998 17.217 -1.043 1.00 0.00 H new ATOM 0 HD13 ILE A 58 4.099 18.304 -2.448 1.00 0.00 H new ATOM 950 N HIS A 59 3.519 22.493 -0.307 1.00 0.00 N ATOM 951 CA HIS A 59 4.399 23.623 -0.115 1.00 0.00 C ATOM 952 C HIS A 59 5.103 23.492 1.217 1.00 0.00 C ATOM 953 O HIS A 59 4.679 24.059 2.224 1.00 0.00 O ATOM 954 CB HIS A 59 3.643 24.936 -0.163 1.00 0.00 C ATOM 955 CG HIS A 59 2.597 24.998 -1.233 1.00 0.00 C ATOM 956 ND1 HIS A 59 1.478 24.260 -1.423 1.00 0.00 N flip ATOM 957 CD2 HIS A 59 2.636 25.904 -2.272 1.00 0.00 C flip ATOM 958 CE1 HIS A 59 0.869 24.729 -2.560 1.00 0.00 C flip ATOM 959 NE2 HIS A 59 1.586 25.721 -3.053 1.00 0.00 N flip ATOM 0 H HIS A 59 2.924 22.278 0.493 1.00 0.00 H new ATOM 0 HA HIS A 59 5.127 23.626 -0.927 1.00 0.00 H new ATOM 0 HB2 HIS A 59 3.170 25.106 0.804 1.00 0.00 H new ATOM 0 HB3 HIS A 59 4.354 25.748 -0.317 1.00 0.00 H new ATOM 0 HD2 HIS A 59 3.405 26.647 -2.424 1.00 0.00 H new ATOM 0 HE1 HIS A 59 -0.049 24.348 -2.983 1.00 0.00 H new ATOM 0 HE2 HIS A 59 1.367 26.255 -3.894 1.00 0.00 H new ATOM 968 N ILE A 60 6.175 22.734 1.210 1.00 0.00 N ATOM 969 CA ILE A 60 6.956 22.504 2.413 1.00 0.00 C ATOM 970 C ILE A 60 8.332 23.163 2.318 1.00 0.00 C ATOM 971 O ILE A 60 8.635 23.850 1.343 1.00 0.00 O ATOM 972 CB ILE A 60 7.101 20.997 2.691 1.00 0.00 C ATOM 973 CG1 ILE A 60 7.954 20.327 1.609 1.00 0.00 C ATOM 974 CG2 ILE A 60 5.720 20.354 2.758 1.00 0.00 C ATOM 975 CD1 ILE A 60 9.091 19.499 2.165 1.00 0.00 C ATOM 0 H ILE A 60 6.532 22.261 0.380 1.00 0.00 H new ATOM 0 HA ILE A 60 6.420 22.961 3.245 1.00 0.00 H new ATOM 0 HB ILE A 60 7.604 20.861 3.648 1.00 0.00 H new ATOM 0 HG12 ILE A 60 7.316 19.689 0.997 1.00 0.00 H new ATOM 0 HG13 ILE A 60 8.362 21.095 0.951 1.00 0.00 H new ATOM 0 HG21 ILE A 60 5.825 19.287 2.955 1.00 0.00 H new ATOM 0 HG22 ILE A 60 5.142 20.816 3.559 1.00 0.00 H new ATOM 0 HG23 ILE A 60 5.205 20.499 1.808 1.00 0.00 H new ATOM 0 HD11 ILE A 60 9.653 19.054 1.344 1.00 0.00 H new ATOM 0 HD12 ILE A 60 9.751 20.136 2.753 1.00 0.00 H new ATOM 0 HD13 ILE A 60 8.689 18.709 2.800 1.00 0.00 H new ATOM 987 N ASP A 61 9.151 22.967 3.346 1.00 0.00 N ATOM 988 CA ASP A 61 10.486 23.560 3.392 1.00 0.00 C ATOM 989 C ASP A 61 11.314 23.212 2.160 1.00 0.00 C ATOM 990 O ASP A 61 11.854 24.097 1.497 1.00 0.00 O ATOM 991 CB ASP A 61 11.222 23.112 4.656 1.00 0.00 C ATOM 992 CG ASP A 61 12.069 24.218 5.255 1.00 0.00 C ATOM 993 OD1 ASP A 61 11.517 25.047 6.009 1.00 0.00 O ATOM 994 OD2 ASP A 61 13.284 24.256 4.969 1.00 0.00 O ATOM 0 H ASP A 61 8.914 22.401 4.161 1.00 0.00 H new ATOM 0 HA ASP A 61 10.357 24.642 3.407 1.00 0.00 H new ATOM 0 HB2 ASP A 61 10.496 22.773 5.395 1.00 0.00 H new ATOM 0 HB3 ASP A 61 11.858 22.259 4.420 1.00 0.00 H new ATOM 999 N GLU A 62 11.419 21.924 1.857 1.00 0.00 N ATOM 1000 CA GLU A 62 12.193 21.478 0.704 1.00 0.00 C ATOM 1001 C GLU A 62 11.561 21.935 -0.612 1.00 0.00 C ATOM 1002 O GLU A 62 12.141 21.746 -1.681 1.00 0.00 O ATOM 1003 CB GLU A 62 12.342 19.955 0.712 1.00 0.00 C ATOM 1004 CG GLU A 62 12.756 19.389 2.061 1.00 0.00 C ATOM 1005 CD GLU A 62 14.231 19.045 2.120 1.00 0.00 C ATOM 1006 OE1 GLU A 62 14.782 18.612 1.086 1.00 0.00 O ATOM 1007 OE2 GLU A 62 14.836 19.209 3.200 1.00 0.00 O ATOM 0 H GLU A 62 10.981 21.173 2.390 1.00 0.00 H new ATOM 0 HA GLU A 62 13.180 21.934 0.779 1.00 0.00 H new ATOM 0 HB2 GLU A 62 11.395 19.505 0.414 1.00 0.00 H new ATOM 0 HB3 GLU A 62 13.081 19.667 -0.035 1.00 0.00 H new ATOM 0 HG2 GLU A 62 12.524 20.113 2.842 1.00 0.00 H new ATOM 0 HG3 GLU A 62 12.169 18.495 2.271 1.00 0.00 H new ATOM 1014 N GLY A 63 10.376 22.543 -0.535 1.00 0.00 N ATOM 1015 CA GLY A 63 9.712 23.013 -1.739 1.00 0.00 C ATOM 1016 C GLY A 63 8.411 22.285 -2.020 1.00 0.00 C ATOM 1017 O GLY A 63 7.659 21.966 -1.099 1.00 0.00 O ATOM 0 H GLY A 63 9.869 22.716 0.333 1.00 0.00 H new ATOM 0 HA2 GLY A 63 9.512 24.080 -1.644 1.00 0.00 H new ATOM 0 HA3 GLY A 63 10.383 22.889 -2.589 1.00 0.00 H new ATOM 1021 N ASP A 64 8.144 22.030 -3.298 1.00 0.00 N ATOM 1022 CA ASP A 64 6.921 21.342 -3.703 1.00 0.00 C ATOM 1023 C ASP A 64 7.216 19.925 -4.189 1.00 0.00 C ATOM 1024 O ASP A 64 8.242 19.667 -4.818 1.00 0.00 O ATOM 1025 CB ASP A 64 6.210 22.130 -4.804 1.00 0.00 C ATOM 1026 CG ASP A 64 6.068 23.600 -4.465 1.00 0.00 C ATOM 1027 OD1 ASP A 64 7.097 24.309 -4.455 1.00 0.00 O ATOM 1028 OD2 ASP A 64 4.929 24.044 -4.209 1.00 0.00 O ATOM 0 H ASP A 64 8.757 22.289 -4.071 1.00 0.00 H new ATOM 0 HA ASP A 64 6.272 21.275 -2.830 1.00 0.00 H new ATOM 0 HB2 ASP A 64 6.765 22.027 -5.736 1.00 0.00 H new ATOM 0 HB3 ASP A 64 5.222 21.702 -4.973 1.00 0.00 H new ATOM 1033 N PHE A 65 6.294 19.022 -3.887 1.00 0.00 N ATOM 1034 CA PHE A 65 6.400 17.615 -4.267 1.00 0.00 C ATOM 1035 C PHE A 65 4.991 17.057 -4.446 1.00 0.00 C ATOM 1036 O PHE A 65 4.037 17.823 -4.394 1.00 0.00 O ATOM 1037 CB PHE A 65 7.203 16.843 -3.215 1.00 0.00 C ATOM 1038 CG PHE A 65 8.423 17.600 -2.771 1.00 0.00 C ATOM 1039 CD1 PHE A 65 9.535 17.689 -3.594 1.00 0.00 C ATOM 1040 CD2 PHE A 65 8.449 18.245 -1.546 1.00 0.00 C ATOM 1041 CE1 PHE A 65 10.652 18.402 -3.202 1.00 0.00 C ATOM 1042 CE2 PHE A 65 9.561 18.962 -1.150 1.00 0.00 C ATOM 1043 CZ PHE A 65 10.664 19.040 -1.978 1.00 0.00 C ATOM 0 H PHE A 65 5.444 19.244 -3.368 1.00 0.00 H new ATOM 0 HA PHE A 65 6.936 17.509 -5.210 1.00 0.00 H new ATOM 0 HB2 PHE A 65 6.569 16.639 -2.352 1.00 0.00 H new ATOM 0 HB3 PHE A 65 7.504 15.879 -3.624 1.00 0.00 H new ATOM 0 HD1 PHE A 65 9.528 17.195 -4.554 1.00 0.00 H new ATOM 0 HD2 PHE A 65 7.591 18.187 -0.893 1.00 0.00 H new ATOM 0 HE1 PHE A 65 11.513 18.460 -3.851 1.00 0.00 H new ATOM 0 HE2 PHE A 65 9.568 19.462 -0.193 1.00 0.00 H new ATOM 0 HZ PHE A 65 11.534 19.599 -1.668 1.00 0.00 H new ATOM 1053 N ILE A 66 4.829 15.754 -4.672 1.00 0.00 N ATOM 1054 CA ILE A 66 3.488 15.215 -4.867 1.00 0.00 C ATOM 1055 C ILE A 66 3.317 13.850 -4.233 1.00 0.00 C ATOM 1056 O ILE A 66 4.055 12.913 -4.526 1.00 0.00 O ATOM 1057 CB ILE A 66 3.092 15.135 -6.363 1.00 0.00 C ATOM 1058 CG1 ILE A 66 4.322 15.003 -7.257 1.00 0.00 C ATOM 1059 CG2 ILE A 66 2.279 16.357 -6.762 1.00 0.00 C ATOM 1060 CD1 ILE A 66 5.158 13.799 -6.928 1.00 0.00 C ATOM 0 H ILE A 66 5.585 15.072 -4.723 1.00 0.00 H new ATOM 0 HA ILE A 66 2.822 15.919 -4.368 1.00 0.00 H new ATOM 0 HB ILE A 66 2.480 14.243 -6.499 1.00 0.00 H new ATOM 0 HG12 ILE A 66 4.004 14.944 -8.298 1.00 0.00 H new ATOM 0 HG13 ILE A 66 4.933 15.901 -7.161 1.00 0.00 H new ATOM 0 HG21 ILE A 66 2.009 16.286 -7.816 1.00 0.00 H new ATOM 0 HG22 ILE A 66 1.373 16.405 -6.157 1.00 0.00 H new ATOM 0 HG23 ILE A 66 2.872 17.257 -6.600 1.00 0.00 H new ATOM 0 HD11 ILE A 66 6.018 13.759 -7.597 1.00 0.00 H new ATOM 0 HD12 ILE A 66 5.504 13.867 -5.896 1.00 0.00 H new ATOM 0 HD13 ILE A 66 4.560 12.896 -7.052 1.00 0.00 H new ATOM 1072 N MET A 67 2.321 13.739 -3.369 1.00 0.00 N ATOM 1073 CA MET A 67 2.048 12.482 -2.708 1.00 0.00 C ATOM 1074 C MET A 67 1.494 11.488 -3.716 1.00 0.00 C ATOM 1075 O MET A 67 0.382 11.643 -4.217 1.00 0.00 O ATOM 1076 CB MET A 67 1.072 12.695 -1.557 1.00 0.00 C ATOM 1077 CG MET A 67 1.466 13.834 -0.637 1.00 0.00 C ATOM 1078 SD MET A 67 0.107 14.388 0.404 1.00 0.00 S ATOM 1079 CE MET A 67 0.478 13.504 1.914 1.00 0.00 C ATOM 0 H MET A 67 1.694 14.502 -3.113 1.00 0.00 H new ATOM 0 HA MET A 67 2.973 12.080 -2.294 1.00 0.00 H new ATOM 0 HB2 MET A 67 0.080 12.892 -1.963 1.00 0.00 H new ATOM 0 HB3 MET A 67 1.001 11.776 -0.975 1.00 0.00 H new ATOM 0 HG2 MET A 67 2.295 13.515 -0.006 1.00 0.00 H new ATOM 0 HG3 MET A 67 1.825 14.671 -1.235 1.00 0.00 H new ATOM 0 HE1 MET A 67 -0.451 13.194 2.392 1.00 0.00 H new ATOM 0 HE2 MET A 67 1.078 12.624 1.682 1.00 0.00 H new ATOM 0 HE3 MET A 67 1.034 14.155 2.589 1.00 0.00 H new ATOM 1089 N LEU A 68 2.292 10.478 -4.018 1.00 0.00 N ATOM 1090 CA LEU A 68 1.909 9.456 -4.984 1.00 0.00 C ATOM 1091 C LEU A 68 0.888 8.489 -4.384 1.00 0.00 C ATOM 1092 O LEU A 68 1.251 7.514 -3.727 1.00 0.00 O ATOM 1093 CB LEU A 68 3.152 8.697 -5.474 1.00 0.00 C ATOM 1094 CG LEU A 68 3.179 8.397 -6.976 1.00 0.00 C ATOM 1095 CD1 LEU A 68 4.347 9.113 -7.642 1.00 0.00 C ATOM 1096 CD2 LEU A 68 3.262 6.898 -7.222 1.00 0.00 C ATOM 0 H LEU A 68 3.215 10.341 -3.607 1.00 0.00 H new ATOM 0 HA LEU A 68 1.441 9.948 -5.837 1.00 0.00 H new ATOM 0 HB2 LEU A 68 4.038 9.279 -5.219 1.00 0.00 H new ATOM 0 HB3 LEU A 68 3.222 7.755 -4.930 1.00 0.00 H new ATOM 0 HG LEU A 68 2.252 8.765 -7.416 1.00 0.00 H new ATOM 0 HD11 LEU A 68 4.351 8.889 -8.709 1.00 0.00 H new ATOM 0 HD12 LEU A 68 4.244 10.189 -7.498 1.00 0.00 H new ATOM 0 HD13 LEU A 68 5.283 8.775 -7.197 1.00 0.00 H new ATOM 0 HD21 LEU A 68 3.280 6.706 -8.295 1.00 0.00 H new ATOM 0 HD22 LEU A 68 4.171 6.504 -6.767 1.00 0.00 H new ATOM 0 HD23 LEU A 68 2.394 6.408 -6.780 1.00 0.00 H new ATOM 1108 N THR A 69 -0.393 8.773 -4.620 1.00 0.00 N ATOM 1109 CA THR A 69 -1.479 7.936 -4.110 1.00 0.00 C ATOM 1110 C THR A 69 -1.887 6.882 -5.137 1.00 0.00 C ATOM 1111 O THR A 69 -3.005 6.367 -5.097 1.00 0.00 O ATOM 1112 CB THR A 69 -2.694 8.802 -3.744 1.00 0.00 C ATOM 1113 OG1 THR A 69 -2.364 10.179 -3.794 1.00 0.00 O ATOM 1114 CG2 THR A 69 -3.254 8.509 -2.364 1.00 0.00 C ATOM 0 H THR A 69 -0.704 9.579 -5.163 1.00 0.00 H new ATOM 0 HA THR A 69 -1.119 7.427 -3.216 1.00 0.00 H new ATOM 0 HB THR A 69 -3.455 8.552 -4.483 1.00 0.00 H new ATOM 0 HG1 THR A 69 -3.152 10.713 -3.559 1.00 0.00 H new ATOM 0 HG21 THR A 69 -4.109 9.157 -2.173 1.00 0.00 H new ATOM 0 HG22 THR A 69 -3.570 7.467 -2.313 1.00 0.00 H new ATOM 0 HG23 THR A 69 -2.486 8.692 -1.613 1.00 0.00 H new ATOM 1122 N GLN A 70 -0.981 6.566 -6.060 1.00 0.00 N ATOM 1123 CA GLN A 70 -1.259 5.576 -7.095 1.00 0.00 C ATOM 1124 C GLN A 70 -0.429 4.308 -6.896 1.00 0.00 C ATOM 1125 O GLN A 70 -0.508 3.378 -7.699 1.00 0.00 O ATOM 1126 CB GLN A 70 -0.980 6.167 -8.478 1.00 0.00 C ATOM 1127 CG GLN A 70 -1.960 5.706 -9.545 1.00 0.00 C ATOM 1128 CD GLN A 70 -1.486 4.463 -10.273 1.00 0.00 C ATOM 1129 OE1 GLN A 70 -2.205 3.468 -10.357 1.00 0.00 O ATOM 1130 NE2 GLN A 70 -0.270 4.515 -10.804 1.00 0.00 N ATOM 0 H GLN A 70 -0.051 6.981 -6.111 1.00 0.00 H new ATOM 0 HA GLN A 70 -2.312 5.305 -7.021 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -1.012 7.255 -8.412 1.00 0.00 H new ATOM 0 HB3 GLN A 70 0.031 5.896 -8.783 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -2.927 5.506 -9.083 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -2.111 6.509 -10.266 1.00 0.00 H new ATOM 0 HE21 GLN A 70 0.292 5.361 -10.710 1.00 0.00 H new ATOM 0 HE22 GLN A 70 0.102 3.709 -11.306 1.00 0.00 H new ATOM 1139 N GLN A 71 0.363 4.269 -5.827 1.00 0.00 N ATOM 1140 CA GLN A 71 1.196 3.107 -5.541 1.00 0.00 C ATOM 1141 C GLN A 71 1.034 2.675 -4.088 1.00 0.00 C ATOM 1142 O GLN A 71 0.614 1.555 -3.807 1.00 0.00 O ATOM 1143 CB GLN A 71 2.664 3.418 -5.834 1.00 0.00 C ATOM 1144 CG GLN A 71 3.435 2.238 -6.402 1.00 0.00 C ATOM 1145 CD GLN A 71 2.935 1.820 -7.771 1.00 0.00 C ATOM 1146 OE1 GLN A 71 2.126 2.513 -8.387 1.00 0.00 O ATOM 1147 NE2 GLN A 71 3.417 0.680 -8.254 1.00 0.00 N ATOM 0 H GLN A 71 0.444 5.026 -5.148 1.00 0.00 H new ATOM 0 HA GLN A 71 0.874 2.289 -6.186 1.00 0.00 H new ATOM 0 HB2 GLN A 71 2.717 4.249 -6.538 1.00 0.00 H new ATOM 0 HB3 GLN A 71 3.147 3.748 -4.914 1.00 0.00 H new ATOM 0 HG2 GLN A 71 4.492 2.497 -6.469 1.00 0.00 H new ATOM 0 HG3 GLN A 71 3.356 1.394 -5.717 1.00 0.00 H new ATOM 0 HE21 GLN A 71 4.086 0.137 -7.708 1.00 0.00 H new ATOM 0 HE22 GLN A 71 3.118 0.347 -9.171 1.00 0.00 H new ATOM 1156 N MET A 72 1.366 3.572 -3.167 1.00 0.00 N ATOM 1157 CA MET A 72 1.249 3.278 -1.744 1.00 0.00 C ATOM 1158 C MET A 72 2.131 2.093 -1.359 1.00 0.00 C ATOM 1159 O MET A 72 2.335 1.173 -2.150 1.00 0.00 O ATOM 1160 CB MET A 72 -0.210 2.990 -1.389 1.00 0.00 C ATOM 1161 CG MET A 72 -0.671 3.665 -0.108 1.00 0.00 C ATOM 1162 SD MET A 72 -2.397 3.318 0.279 1.00 0.00 S ATOM 1163 CE MET A 72 -2.464 1.554 -0.021 1.00 0.00 C ATOM 0 H MET A 72 1.717 4.506 -3.379 1.00 0.00 H new ATOM 0 HA MET A 72 1.587 4.149 -1.183 1.00 0.00 H new ATOM 0 HB2 MET A 72 -0.846 3.317 -2.211 1.00 0.00 H new ATOM 0 HB3 MET A 72 -0.345 1.913 -1.291 1.00 0.00 H new ATOM 0 HG2 MET A 72 -0.044 3.333 0.719 1.00 0.00 H new ATOM 0 HG3 MET A 72 -0.533 4.742 -0.200 1.00 0.00 H new ATOM 0 HE1 MET A 72 -3.173 1.094 0.668 1.00 0.00 H new ATOM 0 HE2 MET A 72 -2.784 1.371 -1.047 1.00 0.00 H new ATOM 0 HE3 MET A 72 -1.476 1.121 0.133 1.00 0.00 H new ATOM 1173 N THR A 73 2.658 2.125 -0.141 1.00 0.00 N ATOM 1174 CA THR A 73 3.525 1.057 0.344 1.00 0.00 C ATOM 1175 C THR A 73 3.837 1.245 1.825 1.00 0.00 C ATOM 1176 O THR A 73 4.332 2.293 2.229 1.00 0.00 O ATOM 1177 CB THR A 73 4.824 1.031 -0.468 1.00 0.00 C ATOM 1178 OG1 THR A 73 5.830 0.306 0.217 1.00 0.00 O ATOM 1179 CG2 THR A 73 5.376 2.413 -0.765 1.00 0.00 C ATOM 0 H THR A 73 2.501 2.878 0.529 1.00 0.00 H new ATOM 0 HA THR A 73 3.006 0.107 0.221 1.00 0.00 H new ATOM 0 HB THR A 73 4.563 0.551 -1.411 1.00 0.00 H new ATOM 0 HG1 THR A 73 6.651 0.300 -0.318 1.00 0.00 H new ATOM 0 HG21 THR A 73 6.296 2.321 -1.343 1.00 0.00 H new ATOM 0 HG22 THR A 73 4.644 2.982 -1.337 1.00 0.00 H new ATOM 0 HG23 THR A 73 5.586 2.930 0.171 1.00 0.00 H new ATOM 1187 N SER A 74 3.556 0.232 2.639 1.00 0.00 N ATOM 1188 CA SER A 74 3.823 0.334 4.069 1.00 0.00 C ATOM 1189 C SER A 74 5.322 0.329 4.330 1.00 0.00 C ATOM 1190 O SER A 74 6.024 -0.625 3.998 1.00 0.00 O ATOM 1191 CB SER A 74 3.141 -0.796 4.844 1.00 0.00 C ATOM 1192 OG SER A 74 1.801 -0.973 4.417 1.00 0.00 O ATOM 0 H SER A 74 3.150 -0.655 2.340 1.00 0.00 H new ATOM 0 HA SER A 74 3.408 1.278 4.421 1.00 0.00 H new ATOM 0 HB2 SER A 74 3.696 -1.724 4.704 1.00 0.00 H new ATOM 0 HB3 SER A 74 3.159 -0.572 5.911 1.00 0.00 H new ATOM 0 HG SER A 74 1.791 -1.447 3.559 1.00 0.00 H new ATOM 1198 N VAL A 75 5.799 1.424 4.910 1.00 0.00 N ATOM 1199 CA VAL A 75 7.217 1.592 5.212 1.00 0.00 C ATOM 1200 C VAL A 75 7.507 1.273 6.678 1.00 0.00 C ATOM 1201 O VAL A 75 7.254 2.091 7.562 1.00 0.00 O ATOM 1202 CB VAL A 75 7.685 3.035 4.869 1.00 0.00 C ATOM 1203 CG1 VAL A 75 6.604 4.051 5.200 1.00 0.00 C ATOM 1204 CG2 VAL A 75 8.982 3.413 5.571 1.00 0.00 C ATOM 0 H VAL A 75 5.218 2.217 5.183 1.00 0.00 H new ATOM 0 HA VAL A 75 7.776 0.890 4.594 1.00 0.00 H new ATOM 0 HB VAL A 75 7.876 3.048 3.796 1.00 0.00 H new ATOM 0 HG11 VAL A 75 6.957 5.052 4.951 1.00 0.00 H new ATOM 0 HG12 VAL A 75 5.706 3.828 4.623 1.00 0.00 H new ATOM 0 HG13 VAL A 75 6.373 4.002 6.264 1.00 0.00 H new ATOM 0 HG21 VAL A 75 9.262 4.430 5.296 1.00 0.00 H new ATOM 0 HG22 VAL A 75 8.842 3.355 6.650 1.00 0.00 H new ATOM 0 HG23 VAL A 75 9.772 2.725 5.270 1.00 0.00 H new ATOM 1214 N PRO A 76 8.051 0.072 6.950 1.00 0.00 N ATOM 1215 CA PRO A 76 8.387 -0.358 8.308 1.00 0.00 C ATOM 1216 C PRO A 76 9.019 0.757 9.136 1.00 0.00 C ATOM 1217 O PRO A 76 9.825 1.540 8.633 1.00 0.00 O ATOM 1218 CB PRO A 76 9.390 -1.482 8.066 1.00 0.00 C ATOM 1219 CG PRO A 76 8.975 -2.081 6.767 1.00 0.00 C ATOM 1220 CD PRO A 76 8.385 -0.962 5.949 1.00 0.00 C ATOM 0 HA PRO A 76 7.507 -0.659 8.876 1.00 0.00 H new ATOM 0 HB2 PRO A 76 10.410 -1.100 8.019 1.00 0.00 H new ATOM 0 HB3 PRO A 76 9.362 -2.218 8.869 1.00 0.00 H new ATOM 0 HG2 PRO A 76 9.828 -2.527 6.256 1.00 0.00 H new ATOM 0 HG3 PRO A 76 8.245 -2.875 6.922 1.00 0.00 H new ATOM 0 HD2 PRO A 76 9.095 -0.589 5.211 1.00 0.00 H new ATOM 0 HD3 PRO A 76 7.501 -1.290 5.403 1.00 0.00 H new ATOM 1228 N VAL A 77 8.641 0.820 10.408 1.00 0.00 N ATOM 1229 CA VAL A 77 9.155 1.835 11.328 1.00 0.00 C ATOM 1230 C VAL A 77 10.660 2.051 11.161 1.00 0.00 C ATOM 1231 O VAL A 77 11.138 3.185 11.155 1.00 0.00 O ATOM 1232 CB VAL A 77 8.871 1.444 12.791 1.00 0.00 C ATOM 1233 CG1 VAL A 77 9.518 0.107 13.118 1.00 0.00 C ATOM 1234 CG2 VAL A 77 9.356 2.526 13.746 1.00 0.00 C ATOM 0 H VAL A 77 7.974 0.175 10.831 1.00 0.00 H new ATOM 0 HA VAL A 77 8.639 2.764 11.084 1.00 0.00 H new ATOM 0 HB VAL A 77 7.793 1.345 12.916 1.00 0.00 H new ATOM 0 HG11 VAL A 77 9.308 -0.155 14.155 1.00 0.00 H new ATOM 0 HG12 VAL A 77 9.114 -0.663 12.460 1.00 0.00 H new ATOM 0 HG13 VAL A 77 10.596 0.179 12.973 1.00 0.00 H new ATOM 0 HG21 VAL A 77 9.144 2.227 14.773 1.00 0.00 H new ATOM 0 HG22 VAL A 77 10.430 2.665 13.623 1.00 0.00 H new ATOM 0 HG23 VAL A 77 8.841 3.462 13.527 1.00 0.00 H new ATOM 1244 N LYS A 78 11.400 0.953 11.046 1.00 0.00 N ATOM 1245 CA LYS A 78 12.859 1.016 10.899 1.00 0.00 C ATOM 1246 C LYS A 78 13.284 2.066 9.892 1.00 0.00 C ATOM 1247 O LYS A 78 14.054 2.977 10.198 1.00 0.00 O ATOM 1248 CB LYS A 78 13.451 -0.311 10.429 1.00 0.00 C ATOM 1249 CG LYS A 78 12.423 -1.293 9.928 1.00 0.00 C ATOM 1250 CD LYS A 78 11.829 -2.078 11.082 1.00 0.00 C ATOM 1251 CE LYS A 78 12.509 -3.427 11.251 1.00 0.00 C ATOM 1252 NZ LYS A 78 13.567 -3.388 12.298 1.00 0.00 N ATOM 0 H LYS A 78 11.018 0.007 11.051 1.00 0.00 H new ATOM 0 HA LYS A 78 13.231 1.266 11.893 1.00 0.00 H new ATOM 0 HB2 LYS A 78 14.171 -0.116 9.634 1.00 0.00 H new ATOM 0 HB3 LYS A 78 14.002 -0.765 11.253 1.00 0.00 H new ATOM 0 HG2 LYS A 78 11.633 -0.762 9.397 1.00 0.00 H new ATOM 0 HG3 LYS A 78 12.883 -1.977 9.214 1.00 0.00 H new ATOM 0 HD2 LYS A 78 11.927 -1.503 12.003 1.00 0.00 H new ATOM 0 HD3 LYS A 78 10.763 -2.226 10.911 1.00 0.00 H new ATOM 0 HE2 LYS A 78 11.765 -4.178 11.515 1.00 0.00 H new ATOM 0 HE3 LYS A 78 12.949 -3.733 10.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 13.936 -4.348 12.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 14.340 -2.766 11.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 13.165 -3.023 13.185 1.00 0.00 H new ATOM 1266 N ILE A 79 12.805 1.889 8.671 1.00 0.00 N ATOM 1267 CA ILE A 79 13.159 2.774 7.579 1.00 0.00 C ATOM 1268 C ILE A 79 12.105 3.857 7.339 1.00 0.00 C ATOM 1269 O ILE A 79 12.012 4.393 6.238 1.00 0.00 O ATOM 1270 CB ILE A 79 13.397 1.998 6.256 1.00 0.00 C ATOM 1271 CG1 ILE A 79 12.467 0.781 6.145 1.00 0.00 C ATOM 1272 CG2 ILE A 79 14.863 1.579 6.125 1.00 0.00 C ATOM 1273 CD1 ILE A 79 11.007 1.162 6.003 1.00 0.00 C ATOM 0 H ILE A 79 12.167 1.136 8.413 1.00 0.00 H new ATOM 0 HA ILE A 79 14.089 3.254 7.884 1.00 0.00 H new ATOM 0 HB ILE A 79 13.161 2.670 5.431 1.00 0.00 H new ATOM 0 HG12 ILE A 79 12.765 0.180 5.286 1.00 0.00 H new ATOM 0 HG13 ILE A 79 12.589 0.156 7.029 1.00 0.00 H new ATOM 0 HG21 ILE A 79 15.004 1.037 5.190 1.00 0.00 H new ATOM 0 HG22 ILE A 79 15.497 2.466 6.130 1.00 0.00 H new ATOM 0 HG23 ILE A 79 15.134 0.935 6.962 1.00 0.00 H new ATOM 0 HD11 ILE A 79 10.401 0.259 5.929 1.00 0.00 H new ATOM 0 HD12 ILE A 79 10.695 1.738 6.874 1.00 0.00 H new ATOM 0 HD13 ILE A 79 10.874 1.763 5.104 1.00 0.00 H new ATOM 1285 N LEU A 80 11.309 4.173 8.362 1.00 0.00 N ATOM 1286 CA LEU A 80 10.263 5.195 8.230 1.00 0.00 C ATOM 1287 C LEU A 80 10.793 6.475 7.627 1.00 0.00 C ATOM 1288 O LEU A 80 11.153 7.414 8.335 1.00 0.00 O ATOM 1289 CB LEU A 80 9.594 5.489 9.571 1.00 0.00 C ATOM 1290 CG LEU A 80 8.091 5.780 9.480 1.00 0.00 C ATOM 1291 CD1 LEU A 80 7.764 6.560 8.209 1.00 0.00 C ATOM 1292 CD2 LEU A 80 7.298 4.483 9.526 1.00 0.00 C ATOM 0 H LEU A 80 11.365 3.742 9.285 1.00 0.00 H new ATOM 0 HA LEU A 80 9.516 4.784 7.550 1.00 0.00 H new ATOM 0 HB2 LEU A 80 9.747 4.637 10.234 1.00 0.00 H new ATOM 0 HB3 LEU A 80 10.090 6.344 10.031 1.00 0.00 H new ATOM 0 HG LEU A 80 7.809 6.393 10.336 1.00 0.00 H new ATOM 0 HD11 LEU A 80 6.692 6.754 8.167 1.00 0.00 H new ATOM 0 HD12 LEU A 80 8.305 7.507 8.214 1.00 0.00 H new ATOM 0 HD13 LEU A 80 8.061 5.977 7.338 1.00 0.00 H new ATOM 0 HD21 LEU A 80 6.233 4.705 9.461 1.00 0.00 H new ATOM 0 HD22 LEU A 80 7.589 3.849 8.688 1.00 0.00 H new ATOM 0 HD23 LEU A 80 7.503 3.964 10.462 1.00 0.00 H new ATOM 1304 N SER A 81 10.783 6.492 6.299 1.00 0.00 N ATOM 1305 CA SER A 81 11.200 7.632 5.499 1.00 0.00 C ATOM 1306 C SER A 81 11.896 8.713 6.322 1.00 0.00 C ATOM 1307 O SER A 81 11.248 9.450 7.065 1.00 0.00 O ATOM 1308 CB SER A 81 9.970 8.193 4.805 1.00 0.00 C ATOM 1309 OG SER A 81 8.782 7.645 5.352 1.00 0.00 O ATOM 0 H SER A 81 10.478 5.696 5.739 1.00 0.00 H new ATOM 0 HA SER A 81 11.937 7.294 4.771 1.00 0.00 H new ATOM 0 HB2 SER A 81 9.954 9.278 4.907 1.00 0.00 H new ATOM 0 HB3 SER A 81 10.018 7.973 3.738 1.00 0.00 H new ATOM 0 HG SER A 81 8.773 6.675 5.210 1.00 0.00 H new ATOM 1315 N GLU A 82 13.220 8.795 6.185 1.00 0.00 N ATOM 1316 CA GLU A 82 14.012 9.784 6.926 1.00 0.00 C ATOM 1317 C GLU A 82 13.303 11.141 6.984 1.00 0.00 C ATOM 1318 O GLU A 82 13.347 11.913 6.031 1.00 0.00 O ATOM 1319 CB GLU A 82 15.395 9.944 6.291 1.00 0.00 C ATOM 1320 CG GLU A 82 16.531 9.860 7.298 1.00 0.00 C ATOM 1321 CD GLU A 82 17.350 11.135 7.365 1.00 0.00 C ATOM 1322 OE1 GLU A 82 16.751 12.216 7.547 1.00 0.00 O ATOM 1323 OE2 GLU A 82 18.589 11.052 7.236 1.00 0.00 O ATOM 0 H GLU A 82 13.767 8.192 5.571 1.00 0.00 H new ATOM 0 HA GLU A 82 14.126 9.418 7.946 1.00 0.00 H new ATOM 0 HB2 GLU A 82 15.531 9.172 5.534 1.00 0.00 H new ATOM 0 HB3 GLU A 82 15.443 10.905 5.778 1.00 0.00 H new ATOM 0 HG2 GLU A 82 16.121 9.644 8.285 1.00 0.00 H new ATOM 0 HG3 GLU A 82 17.183 9.027 7.035 1.00 0.00 H new ATOM 1330 N PRO A 83 12.633 11.446 8.111 1.00 0.00 N ATOM 1331 CA PRO A 83 11.905 12.706 8.288 1.00 0.00 C ATOM 1332 C PRO A 83 12.638 13.922 7.727 1.00 0.00 C ATOM 1333 O PRO A 83 13.469 14.527 8.405 1.00 0.00 O ATOM 1334 CB PRO A 83 11.781 12.809 9.805 1.00 0.00 C ATOM 1335 CG PRO A 83 11.681 11.395 10.260 1.00 0.00 C ATOM 1336 CD PRO A 83 12.527 10.584 9.308 1.00 0.00 C ATOM 0 HA PRO A 83 10.956 12.701 7.752 1.00 0.00 H new ATOM 0 HB2 PRO A 83 12.646 13.308 10.242 1.00 0.00 H new ATOM 0 HB3 PRO A 83 10.901 13.384 10.095 1.00 0.00 H new ATOM 0 HG2 PRO A 83 12.038 11.290 11.284 1.00 0.00 H new ATOM 0 HG3 PRO A 83 10.646 11.054 10.247 1.00 0.00 H new ATOM 0 HD2 PRO A 83 13.507 10.364 9.731 1.00 0.00 H new ATOM 0 HD3 PRO A 83 12.060 9.628 9.073 1.00 0.00 H new ATOM 1344 N VAL A 84 12.305 14.288 6.491 1.00 0.00 N ATOM 1345 CA VAL A 84 12.911 15.448 5.847 1.00 0.00 C ATOM 1346 C VAL A 84 12.248 16.730 6.355 1.00 0.00 C ATOM 1347 O VAL A 84 12.895 17.768 6.497 1.00 0.00 O ATOM 1348 CB VAL A 84 12.763 15.388 4.313 1.00 0.00 C ATOM 1349 CG1 VAL A 84 11.305 15.197 3.922 1.00 0.00 C ATOM 1350 CG2 VAL A 84 13.335 16.642 3.666 1.00 0.00 C ATOM 0 H VAL A 84 11.619 13.798 5.917 1.00 0.00 H new ATOM 0 HA VAL A 84 13.972 15.444 6.095 1.00 0.00 H new ATOM 0 HB VAL A 84 13.329 14.531 3.949 1.00 0.00 H new ATOM 0 HG11 VAL A 84 11.222 15.157 2.836 1.00 0.00 H new ATOM 0 HG12 VAL A 84 10.933 14.266 4.349 1.00 0.00 H new ATOM 0 HG13 VAL A 84 10.714 16.031 4.301 1.00 0.00 H new ATOM 0 HG21 VAL A 84 13.220 16.578 2.584 1.00 0.00 H new ATOM 0 HG22 VAL A 84 12.802 17.518 4.036 1.00 0.00 H new ATOM 0 HG23 VAL A 84 14.393 16.729 3.914 1.00 0.00 H new ATOM 1360 N ASN A 85 10.943 16.637 6.619 1.00 0.00 N ATOM 1361 CA ASN A 85 10.158 17.771 7.104 1.00 0.00 C ATOM 1362 C ASN A 85 8.874 17.284 7.781 1.00 0.00 C ATOM 1363 O ASN A 85 8.821 16.161 8.284 1.00 0.00 O ATOM 1364 CB ASN A 85 9.826 18.711 5.941 1.00 0.00 C ATOM 1365 CG ASN A 85 9.917 20.173 6.335 1.00 0.00 C ATOM 1366 OD1 ASN A 85 8.903 20.864 6.438 1.00 0.00 O ATOM 1367 ND2 ASN A 85 11.135 20.651 6.559 1.00 0.00 N ATOM 0 H ASN A 85 10.405 15.778 6.503 1.00 0.00 H new ATOM 0 HA ASN A 85 10.747 18.317 7.841 1.00 0.00 H new ATOM 0 HB2 ASN A 85 10.509 18.517 5.114 1.00 0.00 H new ATOM 0 HB3 ASN A 85 8.820 18.497 5.580 1.00 0.00 H new ATOM 0 HD21 ASN A 85 11.258 21.627 6.828 1.00 0.00 H new ATOM 0 HD22 ASN A 85 11.948 20.042 6.462 1.00 0.00 H new ATOM 1374 N GLU A 86 7.838 18.124 7.789 1.00 0.00 N ATOM 1375 CA GLU A 86 6.565 17.767 8.398 1.00 0.00 C ATOM 1376 C GLU A 86 5.454 18.606 7.793 1.00 0.00 C ATOM 1377 O GLU A 86 5.581 19.826 7.687 1.00 0.00 O ATOM 1378 CB GLU A 86 6.615 17.976 9.913 1.00 0.00 C ATOM 1379 CG GLU A 86 7.826 17.342 10.578 1.00 0.00 C ATOM 1380 CD GLU A 86 7.786 17.452 12.089 1.00 0.00 C ATOM 1381 OE1 GLU A 86 7.352 18.508 12.596 1.00 0.00 O ATOM 1382 OE2 GLU A 86 8.189 16.483 12.766 1.00 0.00 O ATOM 0 H GLU A 86 7.860 19.057 7.378 1.00 0.00 H new ATOM 0 HA GLU A 86 6.367 16.713 8.203 1.00 0.00 H new ATOM 0 HB2 GLU A 86 6.614 19.045 10.123 1.00 0.00 H new ATOM 0 HB3 GLU A 86 5.710 17.563 10.358 1.00 0.00 H new ATOM 0 HG2 GLU A 86 7.882 16.291 10.295 1.00 0.00 H new ATOM 0 HG3 GLU A 86 8.732 17.821 10.206 1.00 0.00 H new ATOM 1389 N LEU A 87 4.365 17.961 7.387 1.00 0.00 N ATOM 1390 CA LEU A 87 3.259 18.697 6.787 1.00 0.00 C ATOM 1391 C LEU A 87 1.904 18.339 7.393 1.00 0.00 C ATOM 1392 O LEU A 87 1.008 17.825 6.722 1.00 0.00 O ATOM 1393 CB LEU A 87 3.209 18.518 5.286 1.00 0.00 C ATOM 1394 CG LEU A 87 3.937 17.305 4.735 1.00 0.00 C ATOM 1395 CD1 LEU A 87 3.456 16.051 5.457 1.00 0.00 C ATOM 1396 CD2 LEU A 87 3.716 17.217 3.228 1.00 0.00 C ATOM 0 H LEU A 87 4.226 16.953 7.460 1.00 0.00 H new ATOM 0 HA LEU A 87 3.457 19.745 7.012 1.00 0.00 H new ATOM 0 HB2 LEU A 87 2.164 18.459 4.982 1.00 0.00 H new ATOM 0 HB3 LEU A 87 3.627 19.410 4.820 1.00 0.00 H new ATOM 0 HG LEU A 87 5.009 17.398 4.908 1.00 0.00 H new ATOM 0 HD11 LEU A 87 3.979 15.180 5.061 1.00 0.00 H new ATOM 0 HD12 LEU A 87 3.661 16.144 6.523 1.00 0.00 H new ATOM 0 HD13 LEU A 87 2.384 15.931 5.303 1.00 0.00 H new ATOM 0 HD21 LEU A 87 4.239 16.346 2.834 1.00 0.00 H new ATOM 0 HD22 LEU A 87 2.650 17.124 3.021 1.00 0.00 H new ATOM 0 HD23 LEU A 87 4.101 18.118 2.751 1.00 0.00 H new ATOM 1408 N SER A 88 1.772 18.664 8.653 1.00 0.00 N ATOM 1409 CA SER A 88 0.535 18.451 9.409 1.00 0.00 C ATOM 1410 C SER A 88 -0.530 19.405 8.933 1.00 0.00 C ATOM 1411 O SER A 88 -1.694 19.040 8.843 1.00 0.00 O ATOM 1412 CB SER A 88 0.765 18.635 10.905 1.00 0.00 C ATOM 1413 OG SER A 88 1.789 17.777 11.377 1.00 0.00 O ATOM 0 H SER A 88 2.520 19.089 9.201 1.00 0.00 H new ATOM 0 HA SER A 88 0.206 17.426 9.239 1.00 0.00 H new ATOM 0 HB2 SER A 88 1.033 19.672 11.109 1.00 0.00 H new ATOM 0 HB3 SER A 88 -0.160 18.433 11.445 1.00 0.00 H new ATOM 0 HG SER A 88 1.840 16.983 10.805 1.00 0.00 H new ATOM 1419 N THR A 89 -0.134 20.622 8.592 1.00 0.00 N ATOM 1420 CA THR A 89 -1.090 21.587 8.082 1.00 0.00 C ATOM 1421 C THR A 89 -1.771 20.988 6.860 1.00 0.00 C ATOM 1422 O THR A 89 -2.909 21.320 6.527 1.00 0.00 O ATOM 1423 CB THR A 89 -0.398 22.896 7.712 1.00 0.00 C ATOM 1424 OG1 THR A 89 -1.356 23.927 7.543 1.00 0.00 O ATOM 1425 CG2 THR A 89 0.421 22.803 6.439 1.00 0.00 C ATOM 0 H THR A 89 0.826 20.959 8.658 1.00 0.00 H new ATOM 0 HA THR A 89 -1.828 21.810 8.852 1.00 0.00 H new ATOM 0 HB THR A 89 0.280 23.117 8.536 1.00 0.00 H new ATOM 0 HG1 THR A 89 -0.900 24.762 7.307 1.00 0.00 H new ATOM 0 HG21 THR A 89 0.886 23.767 6.234 1.00 0.00 H new ATOM 0 HG22 THR A 89 1.195 22.045 6.559 1.00 0.00 H new ATOM 0 HG23 THR A 89 -0.229 22.529 5.608 1.00 0.00 H new ATOM 1433 N PHE A 90 -1.048 20.076 6.215 1.00 0.00 N ATOM 1434 CA PHE A 90 -1.540 19.375 5.042 1.00 0.00 C ATOM 1435 C PHE A 90 -2.110 18.019 5.451 1.00 0.00 C ATOM 1436 O PHE A 90 -2.349 17.149 4.616 1.00 0.00 O ATOM 1437 CB PHE A 90 -0.399 19.199 4.045 1.00 0.00 C ATOM 1438 CG PHE A 90 -0.054 20.448 3.280 1.00 0.00 C ATOM 1439 CD1 PHE A 90 -0.442 21.700 3.735 1.00 0.00 C ATOM 1440 CD2 PHE A 90 0.665 20.367 2.102 1.00 0.00 C ATOM 1441 CE1 PHE A 90 -0.115 22.841 3.028 1.00 0.00 C ATOM 1442 CE2 PHE A 90 0.992 21.497 1.397 1.00 0.00 C ATOM 1443 CZ PHE A 90 0.606 22.737 1.856 1.00 0.00 C ATOM 0 H PHE A 90 -0.105 19.805 6.494 1.00 0.00 H new ATOM 0 HA PHE A 90 -2.334 19.955 4.572 1.00 0.00 H new ATOM 0 HB2 PHE A 90 0.487 18.857 4.580 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -0.667 18.415 3.337 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -1.006 21.784 4.652 1.00 0.00 H new ATOM 0 HD2 PHE A 90 0.973 19.400 1.732 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -0.422 23.811 3.391 1.00 0.00 H new ATOM 0 HE2 PHE A 90 1.554 21.414 0.479 1.00 0.00 H new ATOM 0 HZ PHE A 90 0.867 23.625 1.300 1.00 0.00 H new ATOM 1453 N ARG A 91 -2.323 17.860 6.758 1.00 0.00 N ATOM 1454 CA ARG A 91 -2.863 16.631 7.328 1.00 0.00 C ATOM 1455 C ARG A 91 -3.999 16.074 6.483 1.00 0.00 C ATOM 1456 O ARG A 91 -4.048 14.874 6.221 1.00 0.00 O ATOM 1457 CB ARG A 91 -3.366 16.886 8.740 1.00 0.00 C ATOM 1458 CG ARG A 91 -4.137 18.166 8.805 1.00 0.00 C ATOM 1459 CD ARG A 91 -4.028 18.860 10.154 1.00 0.00 C ATOM 1460 NE ARG A 91 -5.332 19.022 10.796 1.00 0.00 N ATOM 1461 CZ ARG A 91 -5.742 18.317 11.850 1.00 0.00 C ATOM 1462 NH1 ARG A 91 -4.962 17.388 12.389 1.00 0.00 N ATOM 1463 NH2 ARG A 91 -6.942 18.542 12.367 1.00 0.00 N ATOM 0 H ARG A 91 -2.125 18.583 7.450 1.00 0.00 H new ATOM 0 HA ARG A 91 -2.057 15.897 7.348 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -3.999 16.058 9.061 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -2.523 16.928 9.429 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -3.778 18.839 8.027 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -5.186 17.962 8.591 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -3.372 18.283 10.806 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -3.565 19.838 10.022 1.00 0.00 H new ATOM 0 HE ARG A 91 -5.969 19.720 10.412 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -4.038 17.207 11.997 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -5.287 16.855 13.196 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -7.548 19.253 11.958 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -7.259 18.004 13.174 1.00 0.00 H new ATOM 1477 N ASN A 92 -4.914 16.940 6.045 1.00 0.00 N ATOM 1478 CA ASN A 92 -6.019 16.472 5.224 1.00 0.00 C ATOM 1479 C ASN A 92 -5.474 15.841 3.957 1.00 0.00 C ATOM 1480 O ASN A 92 -5.889 14.754 3.570 1.00 0.00 O ATOM 1481 CB ASN A 92 -7.004 17.583 4.868 1.00 0.00 C ATOM 1482 CG ASN A 92 -6.510 18.479 3.748 1.00 0.00 C ATOM 1483 OD1 ASN A 92 -6.633 17.995 2.516 1.00 0.00 O flip ATOM 1484 ND2 ASN A 92 -6.027 19.586 3.985 1.00 0.00 N flip ATOM 0 H ASN A 92 -4.910 17.941 6.241 1.00 0.00 H new ATOM 0 HA ASN A 92 -6.570 15.736 5.809 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -7.955 17.138 4.576 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -7.194 18.189 5.754 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -5.953 19.915 4.948 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -5.700 20.175 3.219 1.00 0.00 H new ATOM 1491 N GLU A 93 -4.511 16.520 3.328 1.00 0.00 N ATOM 1492 CA GLU A 93 -3.881 15.996 2.123 1.00 0.00 C ATOM 1493 C GLU A 93 -3.578 14.537 2.340 1.00 0.00 C ATOM 1494 O GLU A 93 -3.833 13.683 1.492 1.00 0.00 O ATOM 1495 CB GLU A 93 -2.562 16.708 1.849 1.00 0.00 C ATOM 1496 CG GLU A 93 -2.408 17.185 0.414 1.00 0.00 C ATOM 1497 CD GLU A 93 -2.695 18.665 0.258 1.00 0.00 C ATOM 1498 OE1 GLU A 93 -3.529 19.192 1.024 1.00 0.00 O ATOM 1499 OE2 GLU A 93 -2.086 19.298 -0.630 1.00 0.00 O ATOM 0 H GLU A 93 -4.156 17.426 3.633 1.00 0.00 H new ATOM 0 HA GLU A 93 -4.556 16.147 1.281 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -2.477 17.565 2.518 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -1.740 16.034 2.088 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -1.394 16.977 0.073 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -3.082 16.618 -0.228 1.00 0.00 H new ATOM 1506 N ILE A 94 -3.023 14.280 3.512 1.00 0.00 N ATOM 1507 CA ILE A 94 -2.665 12.948 3.901 1.00 0.00 C ATOM 1508 C ILE A 94 -3.927 12.103 4.059 1.00 0.00 C ATOM 1509 O ILE A 94 -3.984 10.958 3.613 1.00 0.00 O ATOM 1510 CB ILE A 94 -1.855 12.961 5.218 1.00 0.00 C ATOM 1511 CG1 ILE A 94 -0.435 13.462 4.958 1.00 0.00 C ATOM 1512 CG2 ILE A 94 -1.815 11.584 5.862 1.00 0.00 C ATOM 1513 CD1 ILE A 94 -0.375 14.878 4.426 1.00 0.00 C ATOM 0 H ILE A 94 -2.813 14.993 4.210 1.00 0.00 H new ATOM 0 HA ILE A 94 -2.037 12.511 3.124 1.00 0.00 H new ATOM 0 HB ILE A 94 -2.354 13.639 5.910 1.00 0.00 H new ATOM 0 HG12 ILE A 94 0.135 13.408 5.885 1.00 0.00 H new ATOM 0 HG13 ILE A 94 0.051 12.795 4.246 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -1.237 11.631 6.785 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -2.831 11.257 6.085 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -1.348 10.876 5.178 1.00 0.00 H new ATOM 0 HD11 ILE A 94 0.665 15.163 4.266 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -0.916 14.935 3.482 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -0.831 15.557 5.147 1.00 0.00 H new ATOM 1525 N ILE A 95 -4.943 12.693 4.689 1.00 0.00 N ATOM 1526 CA ILE A 95 -6.215 12.014 4.897 1.00 0.00 C ATOM 1527 C ILE A 95 -6.916 11.789 3.564 1.00 0.00 C ATOM 1528 O ILE A 95 -7.106 10.647 3.146 1.00 0.00 O ATOM 1529 CB ILE A 95 -7.141 12.814 5.837 1.00 0.00 C ATOM 1530 CG1 ILE A 95 -6.426 13.117 7.155 1.00 0.00 C ATOM 1531 CG2 ILE A 95 -8.433 12.049 6.095 1.00 0.00 C ATOM 1532 CD1 ILE A 95 -6.933 14.364 7.845 1.00 0.00 C ATOM 0 H ILE A 95 -4.906 13.641 5.063 1.00 0.00 H new ATOM 0 HA ILE A 95 -6.000 11.054 5.366 1.00 0.00 H new ATOM 0 HB ILE A 95 -7.393 13.758 5.353 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -6.544 12.267 7.827 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -5.359 13.226 6.963 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -9.073 12.629 6.760 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -8.950 11.879 5.151 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -8.202 11.090 6.559 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -6.381 14.517 8.772 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -6.790 15.225 7.192 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -7.994 14.250 8.069 1.00 0.00 H new ATOM 1544 N ALA A 96 -7.287 12.883 2.886 1.00 0.00 N ATOM 1545 CA ALA A 96 -7.948 12.785 1.583 1.00 0.00 C ATOM 1546 C ALA A 96 -7.300 11.693 0.730 1.00 0.00 C ATOM 1547 O ALA A 96 -7.972 11.022 -0.048 1.00 0.00 O ATOM 1548 CB ALA A 96 -7.910 14.128 0.864 1.00 0.00 C ATOM 0 H ALA A 96 -7.141 13.837 3.216 1.00 0.00 H new ATOM 0 HA ALA A 96 -8.991 12.513 1.745 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -8.406 14.037 -0.103 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -8.423 14.878 1.466 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -6.874 14.431 0.714 1.00 0.00 H new ATOM 1554 N ALA A 97 -5.996 11.494 0.920 1.00 0.00 N ATOM 1555 CA ALA A 97 -5.262 10.447 0.210 1.00 0.00 C ATOM 1556 C ALA A 97 -6.001 9.138 0.336 1.00 0.00 C ATOM 1557 O ALA A 97 -6.620 8.654 -0.603 1.00 0.00 O ATOM 1558 CB ALA A 97 -3.871 10.300 0.807 1.00 0.00 C ATOM 0 H ALA A 97 -5.425 12.045 1.561 1.00 0.00 H new ATOM 0 HA ALA A 97 -5.178 10.719 -0.842 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -3.328 9.519 0.275 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -3.334 11.244 0.714 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -3.954 10.032 1.860 1.00 0.00 H new ATOM 1564 N ILE A 98 -5.944 8.596 1.528 1.00 0.00 N ATOM 1565 CA ILE A 98 -6.597 7.361 1.853 1.00 0.00 C ATOM 1566 C ILE A 98 -8.084 7.445 1.538 1.00 0.00 C ATOM 1567 O ILE A 98 -8.677 6.555 0.936 1.00 0.00 O ATOM 1568 CB ILE A 98 -6.440 7.133 3.366 1.00 0.00 C ATOM 1569 CG1 ILE A 98 -5.087 6.506 3.698 1.00 0.00 C ATOM 1570 CG2 ILE A 98 -7.574 6.281 3.931 1.00 0.00 C ATOM 1571 CD1 ILE A 98 -3.913 7.342 3.257 1.00 0.00 C ATOM 0 H ILE A 98 -5.434 9.010 2.308 1.00 0.00 H new ATOM 0 HA ILE A 98 -6.155 6.551 1.273 1.00 0.00 H new ATOM 0 HB ILE A 98 -6.489 8.113 3.840 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -5.024 6.345 4.774 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -5.023 5.526 3.225 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -7.426 6.143 5.002 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -8.527 6.782 3.757 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -7.580 5.309 3.437 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -2.985 6.836 3.525 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -3.951 7.482 2.177 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -3.952 8.313 3.750 1.00 0.00 H new ATOM 1583 N ASP A 99 -8.663 8.523 2.023 1.00 0.00 N ATOM 1584 CA ASP A 99 -10.080 8.795 1.900 1.00 0.00 C ATOM 1585 C ASP A 99 -10.561 8.949 0.454 1.00 0.00 C ATOM 1586 O ASP A 99 -11.740 8.744 0.168 1.00 0.00 O ATOM 1587 CB ASP A 99 -10.375 10.046 2.713 1.00 0.00 C ATOM 1588 CG ASP A 99 -11.710 9.978 3.428 1.00 0.00 C ATOM 1589 OD1 ASP A 99 -12.211 8.855 3.644 1.00 0.00 O ATOM 1590 OD2 ASP A 99 -12.254 11.048 3.772 1.00 0.00 O ATOM 0 H ASP A 99 -8.152 9.250 2.524 1.00 0.00 H new ATOM 0 HA ASP A 99 -10.631 7.934 2.280 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -9.582 10.193 3.446 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -10.365 10.914 2.053 1.00 0.00 H new ATOM 1595 N PHE A 100 -9.665 9.301 -0.455 1.00 0.00 N ATOM 1596 CA PHE A 100 -10.032 9.462 -1.859 1.00 0.00 C ATOM 1597 C PHE A 100 -9.537 8.272 -2.659 1.00 0.00 C ATOM 1598 O PHE A 100 -10.218 7.750 -3.541 1.00 0.00 O ATOM 1599 CB PHE A 100 -9.445 10.762 -2.418 1.00 0.00 C ATOM 1600 CG PHE A 100 -9.662 10.941 -3.894 1.00 0.00 C ATOM 1601 CD1 PHE A 100 -10.936 10.865 -4.435 1.00 0.00 C ATOM 1602 CD2 PHE A 100 -8.592 11.184 -4.740 1.00 0.00 C ATOM 1603 CE1 PHE A 100 -11.138 11.029 -5.793 1.00 0.00 C ATOM 1604 CE2 PHE A 100 -8.788 11.349 -6.098 1.00 0.00 C ATOM 1605 CZ PHE A 100 -10.062 11.271 -6.625 1.00 0.00 C ATOM 0 H PHE A 100 -8.682 9.481 -0.250 1.00 0.00 H new ATOM 0 HA PHE A 100 -11.118 9.514 -1.937 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -9.889 11.606 -1.890 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -8.375 10.784 -2.212 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -11.780 10.676 -3.789 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -7.593 11.245 -4.333 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -12.135 10.968 -6.203 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -7.946 11.539 -6.747 1.00 0.00 H new ATOM 0 HZ PHE A 100 -10.217 11.399 -7.686 1.00 0.00 H new ATOM 1615 N LEU A 101 -8.327 7.872 -2.327 1.00 0.00 N ATOM 1616 CA LEU A 101 -7.652 6.762 -2.967 1.00 0.00 C ATOM 1617 C LEU A 101 -8.225 5.435 -2.504 1.00 0.00 C ATOM 1618 O LEU A 101 -8.425 4.515 -3.297 1.00 0.00 O ATOM 1619 CB LEU A 101 -6.164 6.860 -2.616 1.00 0.00 C ATOM 1620 CG LEU A 101 -5.543 5.662 -1.883 1.00 0.00 C ATOM 1621 CD1 LEU A 101 -4.817 4.739 -2.848 1.00 0.00 C ATOM 1622 CD2 LEU A 101 -4.612 6.136 -0.765 1.00 0.00 C ATOM 0 H LEU A 101 -7.776 8.316 -1.593 1.00 0.00 H new ATOM 0 HA LEU A 101 -7.793 6.811 -4.047 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -5.607 7.018 -3.540 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -6.018 7.747 -2.000 1.00 0.00 H new ATOM 0 HG LEU A 101 -6.352 5.089 -1.430 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -4.389 3.901 -2.298 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -5.520 4.363 -3.591 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -4.020 5.290 -3.348 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -4.182 5.272 -0.258 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -3.812 6.742 -1.190 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -5.177 6.732 -0.049 1.00 0.00 H new ATOM 1634 N ILE A 102 -8.455 5.338 -1.204 1.00 0.00 N ATOM 1635 CA ILE A 102 -8.967 4.120 -0.614 1.00 0.00 C ATOM 1636 C ILE A 102 -10.479 4.180 -0.424 1.00 0.00 C ATOM 1637 O ILE A 102 -11.137 3.143 -0.328 1.00 0.00 O ATOM 1638 CB ILE A 102 -8.294 3.836 0.744 1.00 0.00 C ATOM 1639 CG1 ILE A 102 -6.789 4.131 0.668 1.00 0.00 C ATOM 1640 CG2 ILE A 102 -8.538 2.392 1.158 1.00 0.00 C ATOM 1641 CD1 ILE A 102 -6.042 3.812 1.945 1.00 0.00 C ATOM 0 H ILE A 102 -8.293 6.094 -0.538 1.00 0.00 H new ATOM 0 HA ILE A 102 -8.734 3.312 -1.307 1.00 0.00 H new ATOM 0 HB ILE A 102 -8.733 4.491 1.497 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -6.356 3.555 -0.150 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -6.646 5.184 0.427 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -8.058 2.203 2.118 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -9.610 2.215 1.247 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -8.121 1.722 0.406 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -4.985 4.046 1.816 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -6.448 4.407 2.763 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -6.154 2.753 2.177 1.00 0.00 H new ATOM 1653 N THR A 103 -11.034 5.392 -0.362 1.00 0.00 N ATOM 1654 CA THR A 103 -12.475 5.547 -0.176 1.00 0.00 C ATOM 1655 C THR A 103 -13.109 6.282 -1.352 1.00 0.00 C ATOM 1656 O THR A 103 -14.187 5.910 -1.817 1.00 0.00 O ATOM 1657 CB THR A 103 -12.764 6.271 1.147 1.00 0.00 C ATOM 1658 OG1 THR A 103 -12.768 5.352 2.224 1.00 0.00 O ATOM 1659 CG2 THR A 103 -14.091 7.005 1.173 1.00 0.00 C ATOM 0 H THR A 103 -10.516 6.267 -0.437 1.00 0.00 H new ATOM 0 HA THR A 103 -12.923 4.554 -0.133 1.00 0.00 H new ATOM 0 HB THR A 103 -11.966 7.007 1.244 1.00 0.00 H new ATOM 0 HG1 THR A 103 -12.952 5.829 3.060 1.00 0.00 H new ATOM 0 HG21 THR A 103 -14.220 7.490 2.141 1.00 0.00 H new ATOM 0 HG22 THR A 103 -14.106 7.758 0.385 1.00 0.00 H new ATOM 0 HG23 THR A 103 -14.903 6.295 1.012 1.00 0.00 H new ATOM 1667 N GLY A 104 -12.442 7.321 -1.831 1.00 0.00 N ATOM 1668 CA GLY A 104 -12.970 8.076 -2.948 1.00 0.00 C ATOM 1669 C GLY A 104 -14.157 8.934 -2.559 1.00 0.00 C ATOM 1670 O GLY A 104 -15.303 8.586 -2.846 1.00 0.00 O ATOM 0 H GLY A 104 -11.549 7.654 -1.468 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -12.184 8.712 -3.356 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -13.267 7.388 -3.740 1.00 0.00 H new ATOM 1674 N ILE A 105 -13.886 10.059 -1.905 1.00 0.00 N ATOM 1675 CA ILE A 105 -14.942 10.967 -1.477 1.00 0.00 C ATOM 1676 C ILE A 105 -14.969 12.225 -2.338 1.00 0.00 C ATOM 1677 O ILE A 105 -14.462 12.171 -3.479 1.00 0.00 O ATOM 1678 CB ILE A 105 -14.780 11.373 0.003 1.00 0.00 C ATOM 1679 CG1 ILE A 105 -13.308 11.628 0.340 1.00 0.00 C ATOM 1680 CG2 ILE A 105 -15.358 10.299 0.913 1.00 0.00 C ATOM 1681 CD1 ILE A 105 -12.661 12.689 -0.523 1.00 0.00 C ATOM 1682 OXT ILE A 105 -15.497 13.254 -1.866 1.00 0.00 O ATOM 0 H ILE A 105 -12.944 10.363 -1.660 1.00 0.00 H new ATOM 0 HA ILE A 105 -15.882 10.428 -1.593 1.00 0.00 H new ATOM 0 HB ILE A 105 -15.330 12.300 0.166 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -13.230 11.926 1.386 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -12.753 10.696 0.232 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -15.236 10.600 1.954 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -16.418 10.169 0.695 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -14.834 9.358 0.744 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -11.620 12.814 -0.226 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -12.706 12.385 -1.569 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -13.191 13.633 -0.397 1.00 0.00 H new ATOM 1695 N MET B 1 -10.865 -7.001 -15.145 1.00 0.00 N ATOM 1696 CA MET B 1 -11.186 -6.391 -13.828 1.00 0.00 C ATOM 1697 C MET B 1 -10.034 -6.566 -12.844 1.00 0.00 C ATOM 1698 O MET B 1 -9.227 -7.487 -12.975 1.00 0.00 O ATOM 1699 CB MET B 1 -12.452 -7.052 -13.281 1.00 0.00 C ATOM 1700 CG MET B 1 -13.219 -6.180 -12.301 1.00 0.00 C ATOM 1701 SD MET B 1 -14.286 -4.982 -13.124 1.00 0.00 S ATOM 1702 CE MET B 1 -14.793 -3.970 -11.737 1.00 0.00 C ATOM 0 H1 MET B 1 -10.861 -6.263 -15.878 1.00 0.00 H new ATOM 0 H2 MET B 1 -9.928 -7.450 -15.101 1.00 0.00 H new ATOM 0 H3 MET B 1 -11.581 -7.718 -15.379 1.00 0.00 H new ATOM 0 HA MET B 1 -11.346 -5.321 -13.959 1.00 0.00 H new ATOM 0 HB2 MET B 1 -13.106 -7.310 -14.114 1.00 0.00 H new ATOM 0 HB3 MET B 1 -12.180 -7.986 -12.788 1.00 0.00 H new ATOM 0 HG2 MET B 1 -13.824 -6.814 -11.653 1.00 0.00 H new ATOM 0 HG3 MET B 1 -12.512 -5.652 -11.661 1.00 0.00 H new ATOM 0 HE1 MET B 1 -14.859 -2.928 -12.051 1.00 0.00 H new ATOM 0 HE2 MET B 1 -15.767 -4.304 -11.380 1.00 0.00 H new ATOM 0 HE3 MET B 1 -14.062 -4.061 -10.934 1.00 0.00 H new ATOM 1714 N SER B 2 -9.962 -5.677 -11.860 1.00 0.00 N ATOM 1715 CA SER B 2 -8.908 -5.733 -10.853 1.00 0.00 C ATOM 1716 C SER B 2 -9.500 -5.702 -9.444 1.00 0.00 C ATOM 1717 O SER B 2 -9.357 -4.711 -8.728 1.00 0.00 O ATOM 1718 CB SER B 2 -7.931 -4.560 -11.040 1.00 0.00 C ATOM 1719 OG SER B 2 -6.699 -5.008 -11.582 1.00 0.00 O ATOM 0 H SER B 2 -10.621 -4.908 -11.738 1.00 0.00 H new ATOM 0 HA SER B 2 -8.366 -6.671 -10.978 1.00 0.00 H new ATOM 0 HB2 SER B 2 -8.374 -3.815 -11.701 1.00 0.00 H new ATOM 0 HB3 SER B 2 -7.755 -4.072 -10.081 1.00 0.00 H new ATOM 0 HG SER B 2 -6.309 -5.685 -10.991 1.00 0.00 H new ATOM 1725 N GLN B 3 -10.170 -6.783 -9.039 1.00 0.00 N ATOM 1726 CA GLN B 3 -10.769 -6.820 -7.708 1.00 0.00 C ATOM 1727 C GLN B 3 -11.376 -8.179 -7.349 1.00 0.00 C ATOM 1728 O GLN B 3 -12.097 -8.789 -8.138 1.00 0.00 O ATOM 1729 CB GLN B 3 -11.852 -5.745 -7.605 1.00 0.00 C ATOM 1730 CG GLN B 3 -13.014 -5.959 -8.561 1.00 0.00 C ATOM 1731 CD GLN B 3 -14.237 -6.533 -7.872 1.00 0.00 C ATOM 1732 OE1 GLN B 3 -14.423 -7.749 -7.822 1.00 0.00 O ATOM 1733 NE2 GLN B 3 -15.079 -5.657 -7.336 1.00 0.00 N ATOM 0 H GLN B 3 -10.308 -7.624 -9.599 1.00 0.00 H new ATOM 0 HA GLN B 3 -9.962 -6.635 -6.999 1.00 0.00 H new ATOM 0 HB2 GLN B 3 -12.232 -5.721 -6.584 1.00 0.00 H new ATOM 0 HB3 GLN B 3 -11.405 -4.771 -7.802 1.00 0.00 H new ATOM 0 HG2 GLN B 3 -13.276 -5.009 -9.027 1.00 0.00 H new ATOM 0 HG3 GLN B 3 -12.703 -6.631 -9.361 1.00 0.00 H new ATOM 0 HE21 GLN B 3 -14.885 -4.658 -7.401 1.00 0.00 H new ATOM 0 HE22 GLN B 3 -15.920 -5.983 -6.859 1.00 0.00 H new ATOM 1742 N PHE B 4 -11.110 -8.601 -6.113 1.00 0.00 N ATOM 1743 CA PHE B 4 -11.649 -9.842 -5.553 1.00 0.00 C ATOM 1744 C PHE B 4 -11.141 -11.116 -6.228 1.00 0.00 C ATOM 1745 O PHE B 4 -11.880 -12.094 -6.340 1.00 0.00 O ATOM 1746 CB PHE B 4 -13.177 -9.806 -5.586 1.00 0.00 C ATOM 1747 CG PHE B 4 -13.779 -8.947 -4.507 1.00 0.00 C ATOM 1748 CD1 PHE B 4 -13.040 -7.937 -3.905 1.00 0.00 C ATOM 1749 CD2 PHE B 4 -15.085 -9.149 -4.095 1.00 0.00 C ATOM 1750 CE1 PHE B 4 -13.591 -7.147 -2.918 1.00 0.00 C ATOM 1751 CE2 PHE B 4 -15.644 -8.361 -3.105 1.00 0.00 C ATOM 1752 CZ PHE B 4 -14.896 -7.358 -2.516 1.00 0.00 C ATOM 0 H PHE B 4 -10.510 -8.088 -5.467 1.00 0.00 H new ATOM 0 HA PHE B 4 -11.286 -9.888 -4.526 1.00 0.00 H new ATOM 0 HB2 PHE B 4 -13.503 -9.437 -6.558 1.00 0.00 H new ATOM 0 HB3 PHE B 4 -13.559 -10.822 -5.486 1.00 0.00 H new ATOM 0 HD1 PHE B 4 -12.019 -7.768 -4.214 1.00 0.00 H new ATOM 0 HD2 PHE B 4 -15.674 -9.931 -4.552 1.00 0.00 H new ATOM 0 HE1 PHE B 4 -13.004 -6.365 -2.460 1.00 0.00 H new ATOM 0 HE2 PHE B 4 -16.664 -8.529 -2.792 1.00 0.00 H new ATOM 0 HZ PHE B 4 -15.331 -6.741 -1.744 1.00 0.00 H new ATOM 1762 N THR B 5 -9.880 -11.129 -6.633 1.00 0.00 N ATOM 1763 CA THR B 5 -9.298 -12.313 -7.238 1.00 0.00 C ATOM 1764 C THR B 5 -8.114 -12.774 -6.405 1.00 0.00 C ATOM 1765 O THR B 5 -7.485 -11.976 -5.711 1.00 0.00 O ATOM 1766 CB THR B 5 -8.828 -12.030 -8.660 1.00 0.00 C ATOM 1767 OG1 THR B 5 -9.593 -10.995 -9.253 1.00 0.00 O ATOM 1768 CG2 THR B 5 -8.902 -13.238 -9.571 1.00 0.00 C ATOM 0 H THR B 5 -9.244 -10.336 -6.553 1.00 0.00 H new ATOM 0 HA THR B 5 -10.062 -13.090 -7.274 1.00 0.00 H new ATOM 0 HB THR B 5 -7.783 -11.736 -8.559 1.00 0.00 H new ATOM 0 HG1 THR B 5 -9.017 -10.453 -9.832 1.00 0.00 H new ATOM 0 HG21 THR B 5 -8.553 -12.965 -10.567 1.00 0.00 H new ATOM 0 HG22 THR B 5 -8.273 -14.034 -9.172 1.00 0.00 H new ATOM 0 HG23 THR B 5 -9.933 -13.586 -9.631 1.00 0.00 H new ATOM 1776 N LEU B 6 -7.795 -14.051 -6.495 1.00 0.00 N ATOM 1777 CA LEU B 6 -6.661 -14.592 -5.770 1.00 0.00 C ATOM 1778 C LEU B 6 -5.439 -14.517 -6.654 1.00 0.00 C ATOM 1779 O LEU B 6 -5.048 -15.506 -7.274 1.00 0.00 O ATOM 1780 CB LEU B 6 -6.915 -16.038 -5.351 1.00 0.00 C ATOM 1781 CG LEU B 6 -6.087 -16.508 -4.157 1.00 0.00 C ATOM 1782 CD1 LEU B 6 -6.485 -17.917 -3.760 1.00 0.00 C ATOM 1783 CD2 LEU B 6 -4.602 -16.441 -4.479 1.00 0.00 C ATOM 0 H LEU B 6 -8.303 -14.731 -7.061 1.00 0.00 H new ATOM 0 HA LEU B 6 -6.506 -14.006 -4.864 1.00 0.00 H new ATOM 0 HB2 LEU B 6 -7.972 -16.153 -5.111 1.00 0.00 H new ATOM 0 HB3 LEU B 6 -6.708 -16.690 -6.199 1.00 0.00 H new ATOM 0 HG LEU B 6 -6.285 -15.844 -3.315 1.00 0.00 H new ATOM 0 HD11 LEU B 6 -5.886 -18.238 -2.908 1.00 0.00 H new ATOM 0 HD12 LEU B 6 -7.541 -17.934 -3.489 1.00 0.00 H new ATOM 0 HD13 LEU B 6 -6.315 -18.593 -4.598 1.00 0.00 H new ATOM 0 HD21 LEU B 6 -4.027 -16.779 -3.617 1.00 0.00 H new ATOM 0 HD22 LEU B 6 -4.386 -17.082 -5.334 1.00 0.00 H new ATOM 0 HD23 LEU B 6 -4.327 -15.413 -4.717 1.00 0.00 H new ATOM 1795 N TYR B 7 -4.855 -13.331 -6.749 1.00 0.00 N ATOM 1796 CA TYR B 7 -3.703 -13.153 -7.607 1.00 0.00 C ATOM 1797 C TYR B 7 -2.428 -13.654 -6.955 1.00 0.00 C ATOM 1798 O TYR B 7 -1.998 -13.151 -5.920 1.00 0.00 O ATOM 1799 CB TYR B 7 -3.562 -11.674 -8.029 1.00 0.00 C ATOM 1800 CG TYR B 7 -4.853 -10.963 -8.385 1.00 0.00 C ATOM 1801 CD1 TYR B 7 -5.812 -10.653 -7.418 1.00 0.00 C ATOM 1802 CD2 TYR B 7 -5.084 -10.546 -9.690 1.00 0.00 C ATOM 1803 CE1 TYR B 7 -6.954 -9.952 -7.754 1.00 0.00 C ATOM 1804 CE2 TYR B 7 -6.229 -9.855 -10.031 1.00 0.00 C ATOM 1805 CZ TYR B 7 -7.159 -9.557 -9.061 1.00 0.00 C ATOM 1806 OH TYR B 7 -8.297 -8.859 -9.397 1.00 0.00 O ATOM 0 H TYR B 7 -5.156 -12.494 -6.250 1.00 0.00 H new ATOM 0 HA TYR B 7 -3.865 -13.755 -8.501 1.00 0.00 H new ATOM 0 HB2 TYR B 7 -3.081 -11.129 -7.217 1.00 0.00 H new ATOM 0 HB3 TYR B 7 -2.893 -11.623 -8.888 1.00 0.00 H new ATOM 0 HD1 TYR B 7 -5.659 -10.965 -6.395 1.00 0.00 H new ATOM 0 HD2 TYR B 7 -4.353 -10.767 -10.453 1.00 0.00 H new ATOM 0 HE1 TYR B 7 -7.685 -9.713 -6.996 1.00 0.00 H new ATOM 0 HE2 TYR B 7 -6.394 -9.550 -11.054 1.00 0.00 H new ATOM 0 HH TYR B 7 -9.042 -9.156 -8.833 1.00 0.00 H new ATOM 1816 N LYS B 8 -1.823 -14.651 -7.607 1.00 0.00 N ATOM 1817 CA LYS B 8 -0.582 -15.248 -7.138 1.00 0.00 C ATOM 1818 C LYS B 8 0.615 -14.704 -7.886 1.00 0.00 C ATOM 1819 O LYS B 8 0.799 -14.978 -9.070 1.00 0.00 O ATOM 1820 CB LYS B 8 -0.610 -16.765 -7.288 1.00 0.00 C ATOM 1821 CG LYS B 8 0.772 -17.405 -7.280 1.00 0.00 C ATOM 1822 CD LYS B 8 0.893 -18.464 -6.198 1.00 0.00 C ATOM 1823 CE LYS B 8 0.722 -19.865 -6.764 1.00 0.00 C ATOM 1824 NZ LYS B 8 2.029 -20.553 -6.947 1.00 0.00 N ATOM 0 H LYS B 8 -2.182 -15.061 -8.469 1.00 0.00 H new ATOM 0 HA LYS B 8 -0.490 -14.989 -6.083 1.00 0.00 H new ATOM 0 HB2 LYS B 8 -1.203 -17.191 -6.478 1.00 0.00 H new ATOM 0 HB3 LYS B 8 -1.114 -17.020 -8.220 1.00 0.00 H new ATOM 0 HG2 LYS B 8 0.971 -17.854 -8.253 1.00 0.00 H new ATOM 0 HG3 LYS B 8 1.528 -16.636 -7.123 1.00 0.00 H new ATOM 0 HD2 LYS B 8 1.867 -18.382 -5.716 1.00 0.00 H new ATOM 0 HD3 LYS B 8 0.141 -18.287 -5.429 1.00 0.00 H new ATOM 0 HE2 LYS B 8 0.093 -20.452 -6.095 1.00 0.00 H new ATOM 0 HE3 LYS B 8 0.204 -19.809 -7.721 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 1.869 -21.505 -7.334 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 2.620 -20.006 -7.605 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 2.512 -20.630 -6.029 1.00 0.00 H new ATOM 1838 N ASN B 9 1.444 -13.984 -7.154 1.00 0.00 N ATOM 1839 CA ASN B 9 2.674 -13.417 -7.666 1.00 0.00 C ATOM 1840 C ASN B 9 2.721 -13.355 -9.184 1.00 0.00 C ATOM 1841 O ASN B 9 3.027 -14.343 -9.848 1.00 0.00 O ATOM 1842 CB ASN B 9 3.851 -14.240 -7.171 1.00 0.00 C ATOM 1843 CG ASN B 9 3.667 -15.707 -7.487 1.00 0.00 C ATOM 1844 OD1 ASN B 9 4.296 -16.562 -6.705 1.00 0.00 O flip ATOM 1845 ND2 ASN B 9 2.951 -16.067 -8.420 1.00 0.00 N flip ATOM 0 H ASN B 9 1.277 -13.774 -6.170 1.00 0.00 H new ATOM 0 HA ASN B 9 2.724 -12.392 -7.299 1.00 0.00 H new ATOM 0 HB2 ASN B 9 4.770 -13.879 -7.633 1.00 0.00 H new ATOM 0 HB3 ASN B 9 3.962 -14.109 -6.095 1.00 0.00 H new ATOM 0 HD21 ASN B 9 2.482 -15.372 -9.001 1.00 0.00 H new ATOM 0 HD22 ASN B 9 2.826 -17.061 -8.613 1.00 0.00 H new ATOM 1852 N LYS B 10 2.441 -12.174 -9.712 1.00 0.00 N ATOM 1853 CA LYS B 10 2.470 -11.906 -11.163 1.00 0.00 C ATOM 1854 C LYS B 10 3.382 -12.892 -11.853 1.00 0.00 C ATOM 1855 O LYS B 10 3.059 -13.476 -12.887 1.00 0.00 O ATOM 1856 CB LYS B 10 2.989 -10.507 -11.415 1.00 0.00 C ATOM 1857 CG LYS B 10 3.346 -9.800 -10.135 1.00 0.00 C ATOM 1858 CD LYS B 10 4.479 -10.518 -9.427 1.00 0.00 C ATOM 1859 CE LYS B 10 5.193 -9.612 -8.436 1.00 0.00 C ATOM 1860 NZ LYS B 10 6.466 -9.074 -8.990 1.00 0.00 N ATOM 0 H LYS B 10 2.184 -11.361 -9.152 1.00 0.00 H new ATOM 0 HA LYS B 10 1.458 -12.004 -11.556 1.00 0.00 H new ATOM 0 HB2 LYS B 10 3.867 -10.556 -12.059 1.00 0.00 H new ATOM 0 HB3 LYS B 10 2.234 -9.931 -11.949 1.00 0.00 H new ATOM 0 HG2 LYS B 10 3.638 -8.772 -10.350 1.00 0.00 H new ATOM 0 HG3 LYS B 10 2.474 -9.754 -9.483 1.00 0.00 H new ATOM 0 HD2 LYS B 10 4.086 -11.390 -8.904 1.00 0.00 H new ATOM 0 HD3 LYS B 10 5.194 -10.884 -10.164 1.00 0.00 H new ATOM 0 HE2 LYS B 10 4.538 -8.785 -8.164 1.00 0.00 H new ATOM 0 HE3 LYS B 10 5.402 -10.168 -7.522 1.00 0.00 H new ATOM 0 HZ1 LYS B 10 7.271 -9.558 -8.544 1.00 0.00 H new ATOM 0 HZ2 LYS B 10 6.492 -9.234 -10.017 1.00 0.00 H new ATOM 0 HZ3 LYS B 10 6.525 -8.054 -8.797 1.00 0.00 H new ATOM 1874 N ASP B 11 4.524 -13.069 -11.220 1.00 0.00 N ATOM 1875 CA ASP B 11 5.534 -13.973 -11.669 1.00 0.00 C ATOM 1876 C ASP B 11 5.683 -15.078 -10.613 1.00 0.00 C ATOM 1877 O ASP B 11 6.251 -14.853 -9.545 1.00 0.00 O ATOM 1878 CB ASP B 11 6.830 -13.184 -11.889 1.00 0.00 C ATOM 1879 CG ASP B 11 7.695 -13.782 -12.982 1.00 0.00 C ATOM 1880 OD1 ASP B 11 7.148 -14.494 -13.850 1.00 0.00 O ATOM 1881 OD2 ASP B 11 8.920 -13.539 -12.968 1.00 0.00 O ATOM 0 H ASP B 11 4.770 -12.573 -10.363 1.00 0.00 H new ATOM 0 HA ASP B 11 5.275 -14.445 -12.616 1.00 0.00 H new ATOM 0 HB2 ASP B 11 6.585 -12.154 -12.147 1.00 0.00 H new ATOM 0 HB3 ASP B 11 7.396 -13.154 -10.958 1.00 0.00 H new ATOM 1886 N LYS B 12 5.112 -16.255 -10.901 1.00 0.00 N ATOM 1887 CA LYS B 12 5.112 -17.391 -9.962 1.00 0.00 C ATOM 1888 C LYS B 12 6.480 -17.661 -9.321 1.00 0.00 C ATOM 1889 O LYS B 12 6.565 -18.416 -8.353 1.00 0.00 O ATOM 1890 CB LYS B 12 4.571 -18.654 -10.651 1.00 0.00 C ATOM 1891 CG LYS B 12 3.059 -18.617 -10.920 1.00 0.00 C ATOM 1892 CD LYS B 12 2.743 -19.014 -12.354 1.00 0.00 C ATOM 1893 CE LYS B 12 2.517 -20.512 -12.480 1.00 0.00 C ATOM 1894 NZ LYS B 12 2.752 -20.994 -13.869 1.00 0.00 N ATOM 0 H LYS B 12 4.640 -16.449 -11.784 1.00 0.00 H new ATOM 0 HA LYS B 12 4.450 -17.112 -9.142 1.00 0.00 H new ATOM 0 HB2 LYS B 12 5.095 -18.793 -11.597 1.00 0.00 H new ATOM 0 HB3 LYS B 12 4.799 -19.521 -10.030 1.00 0.00 H new ATOM 0 HG2 LYS B 12 2.549 -19.292 -10.233 1.00 0.00 H new ATOM 0 HG3 LYS B 12 2.677 -17.615 -10.725 1.00 0.00 H new ATOM 0 HD2 LYS B 12 1.855 -18.481 -12.693 1.00 0.00 H new ATOM 0 HD3 LYS B 12 3.563 -18.713 -13.005 1.00 0.00 H new ATOM 0 HE2 LYS B 12 3.182 -21.038 -11.796 1.00 0.00 H new ATOM 0 HE3 LYS B 12 1.497 -20.752 -12.180 1.00 0.00 H new ATOM 0 HZ1 LYS B 12 2.588 -22.020 -13.913 1.00 0.00 H new ATOM 0 HZ2 LYS B 12 2.100 -20.511 -14.519 1.00 0.00 H new ATOM 0 HZ3 LYS B 12 3.733 -20.788 -14.146 1.00 0.00 H new ATOM 1908 N SER B 13 7.541 -17.036 -9.824 1.00 0.00 N ATOM 1909 CA SER B 13 8.869 -17.221 -9.242 1.00 0.00 C ATOM 1910 C SER B 13 8.945 -16.564 -7.858 1.00 0.00 C ATOM 1911 O SER B 13 9.719 -16.984 -6.998 1.00 0.00 O ATOM 1912 CB SER B 13 9.941 -16.631 -10.161 1.00 0.00 C ATOM 1913 OG SER B 13 9.854 -15.217 -10.204 1.00 0.00 O ATOM 0 H SER B 13 7.510 -16.404 -10.624 1.00 0.00 H new ATOM 0 HA SER B 13 9.049 -18.290 -9.132 1.00 0.00 H new ATOM 0 HB2 SER B 13 10.929 -16.927 -9.809 1.00 0.00 H new ATOM 0 HB3 SER B 13 9.826 -17.036 -11.166 1.00 0.00 H new ATOM 0 HG SER B 13 10.550 -14.864 -10.797 1.00 0.00 H new ATOM 1919 N SER B 14 8.128 -15.530 -7.662 1.00 0.00 N ATOM 1920 CA SER B 14 8.069 -14.789 -6.396 1.00 0.00 C ATOM 1921 C SER B 14 7.675 -15.670 -5.237 1.00 0.00 C ATOM 1922 O SER B 14 8.040 -15.411 -4.094 1.00 0.00 O ATOM 1923 CB SER B 14 7.010 -13.694 -6.490 1.00 0.00 C ATOM 1924 OG SER B 14 6.882 -13.214 -7.818 1.00 0.00 O ATOM 0 H SER B 14 7.487 -15.180 -8.374 1.00 0.00 H new ATOM 0 HA SER B 14 9.067 -14.384 -6.226 1.00 0.00 H new ATOM 0 HB2 SER B 14 6.051 -14.082 -6.147 1.00 0.00 H new ATOM 0 HB3 SER B 14 7.276 -12.870 -5.827 1.00 0.00 H new ATOM 0 HG SER B 14 6.339 -13.840 -8.341 1.00 0.00 H new ATOM 1930 N ALA B 15 6.861 -16.659 -5.528 1.00 0.00 N ATOM 1931 CA ALA B 15 6.329 -17.522 -4.498 1.00 0.00 C ATOM 1932 C ALA B 15 7.401 -18.073 -3.569 1.00 0.00 C ATOM 1933 O ALA B 15 7.095 -18.449 -2.437 1.00 0.00 O ATOM 1934 CB ALA B 15 5.514 -18.643 -5.126 1.00 0.00 C ATOM 0 H ALA B 15 6.552 -16.886 -6.473 1.00 0.00 H new ATOM 0 HA ALA B 15 5.677 -16.913 -3.872 1.00 0.00 H new ATOM 0 HB1 ALA B 15 5.117 -19.288 -4.342 1.00 0.00 H new ATOM 0 HB2 ALA B 15 4.689 -18.217 -5.697 1.00 0.00 H new ATOM 0 HB3 ALA B 15 6.151 -19.228 -5.789 1.00 0.00 H new ATOM 1940 N LYS B 16 8.657 -18.096 -4.010 1.00 0.00 N ATOM 1941 CA LYS B 16 9.721 -18.578 -3.140 1.00 0.00 C ATOM 1942 C LYS B 16 9.639 -17.813 -1.825 1.00 0.00 C ATOM 1943 O LYS B 16 9.658 -18.397 -0.741 1.00 0.00 O ATOM 1944 CB LYS B 16 11.091 -18.373 -3.792 1.00 0.00 C ATOM 1945 CG LYS B 16 11.596 -19.594 -4.542 1.00 0.00 C ATOM 1946 CD LYS B 16 12.414 -19.200 -5.761 1.00 0.00 C ATOM 1947 CE LYS B 16 12.397 -20.292 -6.819 1.00 0.00 C ATOM 1948 NZ LYS B 16 13.306 -21.418 -6.470 1.00 0.00 N ATOM 0 H LYS B 16 8.955 -17.795 -4.938 1.00 0.00 H new ATOM 0 HA LYS B 16 9.599 -19.647 -2.963 1.00 0.00 H new ATOM 0 HB2 LYS B 16 11.033 -17.531 -4.482 1.00 0.00 H new ATOM 0 HB3 LYS B 16 11.814 -18.105 -3.022 1.00 0.00 H new ATOM 0 HG2 LYS B 16 12.205 -20.205 -3.876 1.00 0.00 H new ATOM 0 HG3 LYS B 16 10.750 -20.207 -4.853 1.00 0.00 H new ATOM 0 HD2 LYS B 16 12.018 -18.276 -6.183 1.00 0.00 H new ATOM 0 HD3 LYS B 16 13.442 -18.998 -5.461 1.00 0.00 H new ATOM 0 HE2 LYS B 16 11.381 -20.669 -6.935 1.00 0.00 H new ATOM 0 HE3 LYS B 16 12.693 -19.871 -7.780 1.00 0.00 H new ATOM 0 HZ1 LYS B 16 13.265 -22.141 -7.216 1.00 0.00 H new ATOM 0 HZ2 LYS B 16 14.280 -21.064 -6.384 1.00 0.00 H new ATOM 0 HZ3 LYS B 16 13.009 -21.837 -5.566 1.00 0.00 H new ATOM 1962 N THR B 17 9.487 -16.498 -1.950 1.00 0.00 N ATOM 1963 CA THR B 17 9.328 -15.620 -0.801 1.00 0.00 C ATOM 1964 C THR B 17 7.873 -15.167 -0.686 1.00 0.00 C ATOM 1965 O THR B 17 7.285 -15.187 0.395 1.00 0.00 O ATOM 1966 CB THR B 17 10.247 -14.402 -0.913 1.00 0.00 C ATOM 1967 OG1 THR B 17 11.607 -14.797 -0.912 1.00 0.00 O ATOM 1968 CG2 THR B 17 10.055 -13.406 0.213 1.00 0.00 C ATOM 0 H THR B 17 9.471 -16.015 -2.848 1.00 0.00 H new ATOM 0 HA THR B 17 9.603 -16.176 0.095 1.00 0.00 H new ATOM 0 HB THR B 17 9.979 -13.921 -1.854 1.00 0.00 H new ATOM 0 HG1 THR B 17 12.178 -14.004 -0.986 1.00 0.00 H new ATOM 0 HG21 THR B 17 10.736 -12.566 0.076 1.00 0.00 H new ATOM 0 HG22 THR B 17 9.027 -13.045 0.208 1.00 0.00 H new ATOM 0 HG23 THR B 17 10.264 -13.890 1.167 1.00 0.00 H new ATOM 1976 N TYR B 18 7.313 -14.733 -1.818 1.00 0.00 N ATOM 1977 CA TYR B 18 5.936 -14.240 -1.867 1.00 0.00 C ATOM 1978 C TYR B 18 5.143 -14.890 -2.987 1.00 0.00 C ATOM 1979 O TYR B 18 5.469 -14.707 -4.157 1.00 0.00 O ATOM 1980 CB TYR B 18 5.943 -12.762 -2.150 1.00 0.00 C ATOM 1981 CG TYR B 18 6.843 -11.957 -1.239 1.00 0.00 C ATOM 1982 CD1 TYR B 18 6.713 -12.034 0.142 1.00 0.00 C ATOM 1983 CD2 TYR B 18 7.822 -11.121 -1.760 1.00 0.00 C ATOM 1984 CE1 TYR B 18 7.533 -11.300 0.978 1.00 0.00 C ATOM 1985 CE2 TYR B 18 8.646 -10.384 -0.931 1.00 0.00 C ATOM 1986 CZ TYR B 18 8.497 -10.477 0.437 1.00 0.00 C ATOM 1987 OH TYR B 18 9.316 -9.744 1.266 1.00 0.00 O ATOM 0 H TYR B 18 7.796 -14.714 -2.716 1.00 0.00 H new ATOM 0 HA TYR B 18 5.480 -14.474 -0.905 1.00 0.00 H new ATOM 0 HB2 TYR B 18 6.255 -12.603 -3.182 1.00 0.00 H new ATOM 0 HB3 TYR B 18 4.925 -12.383 -2.063 1.00 0.00 H new ATOM 0 HD1 TYR B 18 5.959 -12.678 0.569 1.00 0.00 H new ATOM 0 HD2 TYR B 18 7.941 -11.046 -2.831 1.00 0.00 H new ATOM 0 HE1 TYR B 18 7.419 -11.371 2.050 1.00 0.00 H new ATOM 0 HE2 TYR B 18 9.403 -9.739 -1.352 1.00 0.00 H new ATOM 0 HH TYR B 18 9.941 -9.217 0.726 1.00 0.00 H new ATOM 1997 N PRO B 19 4.101 -15.662 -2.673 1.00 0.00 N ATOM 1998 CA PRO B 19 3.313 -16.325 -3.689 1.00 0.00 C ATOM 1999 C PRO B 19 2.157 -15.494 -4.256 1.00 0.00 C ATOM 2000 O PRO B 19 1.906 -15.557 -5.452 1.00 0.00 O ATOM 2001 CB PRO B 19 2.774 -17.566 -2.978 1.00 0.00 C ATOM 2002 CG PRO B 19 3.113 -17.396 -1.530 1.00 0.00 C ATOM 2003 CD PRO B 19 3.622 -15.993 -1.340 1.00 0.00 C ATOM 0 HA PRO B 19 3.930 -16.532 -4.564 1.00 0.00 H new ATOM 0 HB2 PRO B 19 1.697 -17.658 -3.118 1.00 0.00 H new ATOM 0 HB3 PRO B 19 3.226 -18.473 -3.380 1.00 0.00 H new ATOM 0 HG2 PRO B 19 2.235 -17.571 -0.909 1.00 0.00 H new ATOM 0 HG3 PRO B 19 3.868 -18.121 -1.227 1.00 0.00 H new ATOM 0 HD2 PRO B 19 2.835 -15.315 -1.009 1.00 0.00 H new ATOM 0 HD3 PRO B 19 4.418 -15.945 -0.597 1.00 0.00 H new ATOM 2011 N TYR B 20 1.426 -14.741 -3.426 1.00 0.00 N ATOM 2012 CA TYR B 20 0.293 -13.964 -3.960 1.00 0.00 C ATOM 2013 C TYR B 20 0.043 -12.649 -3.274 1.00 0.00 C ATOM 2014 O TYR B 20 0.676 -12.281 -2.288 1.00 0.00 O ATOM 2015 CB TYR B 20 -1.043 -14.721 -3.884 1.00 0.00 C ATOM 2016 CG TYR B 20 -0.955 -16.111 -3.375 1.00 0.00 C ATOM 2017 CD1 TYR B 20 -0.258 -16.399 -2.214 1.00 0.00 C ATOM 2018 CD2 TYR B 20 -1.571 -17.130 -4.067 1.00 0.00 C ATOM 2019 CE1 TYR B 20 -0.161 -17.678 -1.741 1.00 0.00 C ATOM 2020 CE2 TYR B 20 -1.491 -18.430 -3.607 1.00 0.00 C ATOM 2021 CZ TYR B 20 -0.781 -18.703 -2.443 1.00 0.00 C ATOM 2022 OH TYR B 20 -0.688 -19.994 -1.992 1.00 0.00 O ATOM 0 H TYR B 20 1.585 -14.651 -2.422 1.00 0.00 H new ATOM 0 HA TYR B 20 0.609 -13.792 -4.989 1.00 0.00 H new ATOM 0 HB2 TYR B 20 -1.724 -14.160 -3.244 1.00 0.00 H new ATOM 0 HB3 TYR B 20 -1.486 -14.743 -4.880 1.00 0.00 H new ATOM 0 HD1 TYR B 20 0.219 -15.597 -1.671 1.00 0.00 H new ATOM 0 HD2 TYR B 20 -2.118 -16.912 -4.972 1.00 0.00 H new ATOM 0 HE1 TYR B 20 0.389 -17.888 -0.836 1.00 0.00 H new ATOM 0 HE2 TYR B 20 -1.977 -19.229 -4.148 1.00 0.00 H new ATOM 0 HH TYR B 20 -1.363 -20.148 -1.299 1.00 0.00 H new ATOM 2032 N PHE B 21 -0.978 -12.004 -3.826 1.00 0.00 N ATOM 2033 CA PHE B 21 -1.522 -10.753 -3.365 1.00 0.00 C ATOM 2034 C PHE B 21 -2.964 -10.708 -3.830 1.00 0.00 C ATOM 2035 O PHE B 21 -3.381 -11.539 -4.637 1.00 0.00 O ATOM 2036 CB PHE B 21 -0.769 -9.534 -3.906 1.00 0.00 C ATOM 2037 CG PHE B 21 0.581 -9.814 -4.541 1.00 0.00 C ATOM 2038 CD1 PHE B 21 1.636 -10.301 -3.786 1.00 0.00 C ATOM 2039 CD2 PHE B 21 0.798 -9.578 -5.895 1.00 0.00 C ATOM 2040 CE1 PHE B 21 2.868 -10.549 -4.358 1.00 0.00 C ATOM 2041 CE2 PHE B 21 2.030 -9.823 -6.470 1.00 0.00 C ATOM 2042 CZ PHE B 21 3.065 -10.310 -5.701 1.00 0.00 C ATOM 0 H PHE B 21 -1.465 -12.365 -4.646 1.00 0.00 H new ATOM 0 HA PHE B 21 -1.431 -10.705 -2.280 1.00 0.00 H new ATOM 0 HB2 PHE B 21 -1.400 -9.040 -4.645 1.00 0.00 H new ATOM 0 HB3 PHE B 21 -0.624 -8.829 -3.088 1.00 0.00 H new ATOM 0 HD1 PHE B 21 1.492 -10.490 -2.732 1.00 0.00 H new ATOM 0 HD2 PHE B 21 -0.008 -9.198 -6.505 1.00 0.00 H new ATOM 0 HE1 PHE B 21 3.677 -10.930 -3.753 1.00 0.00 H new ATOM 0 HE2 PHE B 21 2.182 -9.633 -7.522 1.00 0.00 H new ATOM 0 HZ PHE B 21 4.028 -10.504 -6.150 1.00 0.00 H new ATOM 2052 N VAL B 22 -3.730 -9.769 -3.326 1.00 0.00 N ATOM 2053 CA VAL B 22 -5.123 -9.679 -3.711 1.00 0.00 C ATOM 2054 C VAL B 22 -5.537 -8.255 -4.015 1.00 0.00 C ATOM 2055 O VAL B 22 -5.454 -7.376 -3.166 1.00 0.00 O ATOM 2056 CB VAL B 22 -6.023 -10.252 -2.617 1.00 0.00 C ATOM 2057 CG1 VAL B 22 -7.485 -10.144 -3.023 1.00 0.00 C ATOM 2058 CG2 VAL B 22 -5.652 -11.701 -2.314 1.00 0.00 C ATOM 0 H VAL B 22 -3.420 -9.064 -2.657 1.00 0.00 H new ATOM 0 HA VAL B 22 -5.239 -10.266 -4.622 1.00 0.00 H new ATOM 0 HB VAL B 22 -5.873 -9.669 -1.708 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -8.113 -10.556 -2.233 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -7.742 -9.097 -3.182 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -7.649 -10.702 -3.945 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -6.306 -12.088 -1.532 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -5.769 -12.303 -3.215 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -4.616 -11.749 -1.977 1.00 0.00 H new ATOM 2068 N ASP B 23 -5.990 -8.044 -5.240 1.00 0.00 N ATOM 2069 CA ASP B 23 -6.429 -6.715 -5.672 1.00 0.00 C ATOM 2070 C ASP B 23 -7.549 -6.191 -4.769 1.00 0.00 C ATOM 2071 O ASP B 23 -8.649 -6.744 -4.753 1.00 0.00 O ATOM 2072 CB ASP B 23 -6.908 -6.762 -7.125 1.00 0.00 C ATOM 2073 CG ASP B 23 -5.760 -6.776 -8.114 1.00 0.00 C ATOM 2074 OD1 ASP B 23 -4.618 -6.479 -7.703 1.00 0.00 O ATOM 2075 OD2 ASP B 23 -6.001 -7.084 -9.300 1.00 0.00 O ATOM 0 H ASP B 23 -6.066 -8.768 -5.954 1.00 0.00 H new ATOM 0 HA ASP B 23 -5.580 -6.036 -5.598 1.00 0.00 H new ATOM 0 HB2 ASP B 23 -7.522 -7.650 -7.273 1.00 0.00 H new ATOM 0 HB3 ASP B 23 -7.543 -5.899 -7.323 1.00 0.00 H new ATOM 2080 N VAL B 24 -7.265 -5.128 -4.010 1.00 0.00 N ATOM 2081 CA VAL B 24 -8.259 -4.554 -3.102 1.00 0.00 C ATOM 2082 C VAL B 24 -7.979 -3.094 -2.764 1.00 0.00 C ATOM 2083 O VAL B 24 -7.002 -2.779 -2.089 1.00 0.00 O ATOM 2084 CB VAL B 24 -8.352 -5.381 -1.810 1.00 0.00 C ATOM 2085 CG1 VAL B 24 -6.965 -5.697 -1.272 1.00 0.00 C ATOM 2086 CG2 VAL B 24 -9.200 -4.671 -0.762 1.00 0.00 C ATOM 0 H VAL B 24 -6.363 -4.652 -4.007 1.00 0.00 H new ATOM 0 HA VAL B 24 -9.213 -4.587 -3.628 1.00 0.00 H new ATOM 0 HB VAL B 24 -8.844 -6.324 -2.048 1.00 0.00 H new ATOM 0 HG11 VAL B 24 -7.054 -6.283 -0.357 1.00 0.00 H new ATOM 0 HG12 VAL B 24 -6.408 -6.267 -2.015 1.00 0.00 H new ATOM 0 HG13 VAL B 24 -6.438 -4.768 -1.057 1.00 0.00 H new ATOM 0 HG21 VAL B 24 -9.248 -5.280 0.141 1.00 0.00 H new ATOM 0 HG22 VAL B 24 -8.753 -3.705 -0.525 1.00 0.00 H new ATOM 0 HG23 VAL B 24 -10.207 -4.519 -1.151 1.00 0.00 H new ATOM 2096 N GLN B 25 -8.884 -2.221 -3.212 1.00 0.00 N ATOM 2097 CA GLN B 25 -8.803 -0.784 -2.954 1.00 0.00 C ATOM 2098 C GLN B 25 -9.670 -0.003 -3.942 1.00 0.00 C ATOM 2099 O GLN B 25 -10.861 0.200 -3.708 1.00 0.00 O ATOM 2100 CB GLN B 25 -7.355 -0.277 -2.995 1.00 0.00 C ATOM 2101 CG GLN B 25 -7.218 1.239 -2.941 1.00 0.00 C ATOM 2102 CD GLN B 25 -6.094 1.750 -3.819 1.00 0.00 C ATOM 2103 OE1 GLN B 25 -6.295 2.046 -4.996 1.00 0.00 O ATOM 2104 NE2 GLN B 25 -4.899 1.857 -3.248 1.00 0.00 N ATOM 0 H GLN B 25 -9.696 -2.493 -3.766 1.00 0.00 H new ATOM 0 HA GLN B 25 -9.184 -0.616 -1.947 1.00 0.00 H new ATOM 0 HB2 GLN B 25 -6.808 -0.709 -2.157 1.00 0.00 H new ATOM 0 HB3 GLN B 25 -6.881 -0.640 -3.907 1.00 0.00 H new ATOM 0 HG2 GLN B 25 -8.156 1.697 -3.254 1.00 0.00 H new ATOM 0 HG3 GLN B 25 -7.040 1.548 -1.911 1.00 0.00 H new ATOM 0 HE21 GLN B 25 -4.777 1.600 -2.268 1.00 0.00 H new ATOM 0 HE22 GLN B 25 -4.104 2.196 -3.789 1.00 0.00 H new ATOM 2113 N SER B 26 -9.064 0.445 -5.036 1.00 0.00 N ATOM 2114 CA SER B 26 -9.791 1.219 -6.045 1.00 0.00 C ATOM 2115 C SER B 26 -10.749 0.366 -6.849 1.00 0.00 C ATOM 2116 O SER B 26 -10.351 -0.260 -7.829 1.00 0.00 O ATOM 2117 CB SER B 26 -8.852 1.894 -7.031 1.00 0.00 C ATOM 2118 OG SER B 26 -8.125 2.944 -6.418 1.00 0.00 O ATOM 0 H SER B 26 -8.079 0.289 -5.249 1.00 0.00 H new ATOM 0 HA SER B 26 -10.346 1.966 -5.478 1.00 0.00 H new ATOM 0 HB2 SER B 26 -8.158 1.158 -7.437 1.00 0.00 H new ATOM 0 HB3 SER B 26 -9.425 2.288 -7.870 1.00 0.00 H new ATOM 0 HG SER B 26 -7.304 2.585 -6.021 1.00 0.00 H new ATOM 2124 N ASP B 27 -12.020 0.384 -6.484 1.00 0.00 N ATOM 2125 CA ASP B 27 -13.006 -0.354 -7.250 1.00 0.00 C ATOM 2126 C ASP B 27 -13.096 0.285 -8.630 1.00 0.00 C ATOM 2127 O ASP B 27 -13.371 -0.380 -9.628 1.00 0.00 O ATOM 2128 CB ASP B 27 -14.369 -0.334 -6.556 1.00 0.00 C ATOM 2129 CG ASP B 27 -14.862 1.075 -6.289 1.00 0.00 C ATOM 2130 OD1 ASP B 27 -14.335 1.722 -5.359 1.00 0.00 O ATOM 2131 OD2 ASP B 27 -15.773 1.532 -7.010 1.00 0.00 O ATOM 0 H ASP B 27 -12.387 0.891 -5.679 1.00 0.00 H new ATOM 0 HA ASP B 27 -12.706 -1.399 -7.334 1.00 0.00 H new ATOM 0 HB2 ASP B 27 -15.096 -0.859 -7.175 1.00 0.00 H new ATOM 0 HB3 ASP B 27 -14.302 -0.877 -5.613 1.00 0.00 H new ATOM 2136 N LEU B 28 -12.823 1.593 -8.667 1.00 0.00 N ATOM 2137 CA LEU B 28 -12.829 2.351 -9.907 1.00 0.00 C ATOM 2138 C LEU B 28 -11.480 2.243 -10.592 1.00 0.00 C ATOM 2139 O LEU B 28 -11.378 1.813 -11.741 1.00 0.00 O ATOM 2140 CB LEU B 28 -13.168 3.818 -9.641 1.00 0.00 C ATOM 2141 CG LEU B 28 -14.245 4.054 -8.580 1.00 0.00 C ATOM 2142 CD1 LEU B 28 -13.859 5.215 -7.676 1.00 0.00 C ATOM 2143 CD2 LEU B 28 -15.591 4.310 -9.239 1.00 0.00 C ATOM 0 H LEU B 28 -12.594 2.146 -7.841 1.00 0.00 H new ATOM 0 HA LEU B 28 -13.594 1.934 -10.562 1.00 0.00 H new ATOM 0 HB2 LEU B 28 -12.259 4.335 -9.334 1.00 0.00 H new ATOM 0 HB3 LEU B 28 -13.495 4.274 -10.575 1.00 0.00 H new ATOM 0 HG LEU B 28 -14.328 3.157 -7.966 1.00 0.00 H new ATOM 0 HD11 LEU B 28 -14.637 5.368 -6.928 1.00 0.00 H new ATOM 0 HD12 LEU B 28 -12.916 4.990 -7.178 1.00 0.00 H new ATOM 0 HD13 LEU B 28 -13.747 6.120 -8.273 1.00 0.00 H new ATOM 0 HD21 LEU B 28 -16.346 4.476 -8.471 1.00 0.00 H new ATOM 0 HD22 LEU B 28 -15.522 5.191 -9.877 1.00 0.00 H new ATOM 0 HD23 LEU B 28 -15.871 3.446 -9.842 1.00 0.00 H new ATOM 2155 N LEU B 29 -10.446 2.620 -9.859 1.00 0.00 N ATOM 2156 CA LEU B 29 -9.081 2.558 -10.355 1.00 0.00 C ATOM 2157 C LEU B 29 -8.494 1.174 -10.104 1.00 0.00 C ATOM 2158 O LEU B 29 -7.302 1.032 -9.832 1.00 0.00 O ATOM 2159 CB LEU B 29 -8.231 3.615 -9.654 1.00 0.00 C ATOM 2160 CG LEU B 29 -8.704 5.052 -9.854 1.00 0.00 C ATOM 2161 CD1 LEU B 29 -8.148 5.954 -8.763 1.00 0.00 C ATOM 2162 CD2 LEU B 29 -8.302 5.562 -11.232 1.00 0.00 C ATOM 0 H LEU B 29 -10.528 2.976 -8.907 1.00 0.00 H new ATOM 0 HA LEU B 29 -9.084 2.750 -11.428 1.00 0.00 H new ATOM 0 HB2 LEU B 29 -8.215 3.398 -8.586 1.00 0.00 H new ATOM 0 HB3 LEU B 29 -7.205 3.532 -10.012 1.00 0.00 H new ATOM 0 HG LEU B 29 -9.792 5.068 -9.789 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -8.496 6.975 -8.922 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -8.490 5.602 -7.790 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -7.059 5.933 -8.794 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -8.648 6.588 -11.355 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -7.217 5.531 -11.329 1.00 0.00 H new ATOM 0 HD23 LEU B 29 -8.753 4.932 -11.999 1.00 0.00 H new ATOM 2174 N ASP B 30 -9.349 0.157 -10.171 1.00 0.00 N ATOM 2175 CA ASP B 30 -8.928 -1.214 -9.922 1.00 0.00 C ATOM 2176 C ASP B 30 -7.840 -1.660 -10.900 1.00 0.00 C ATOM 2177 O ASP B 30 -6.730 -1.995 -10.492 1.00 0.00 O ATOM 2178 CB ASP B 30 -10.136 -2.157 -10.003 1.00 0.00 C ATOM 2179 CG ASP B 30 -11.060 -1.835 -11.163 1.00 0.00 C ATOM 2180 OD1 ASP B 30 -10.654 -1.050 -12.046 1.00 0.00 O ATOM 2181 OD2 ASP B 30 -12.189 -2.369 -11.188 1.00 0.00 O ATOM 0 H ASP B 30 -10.339 0.259 -10.396 1.00 0.00 H new ATOM 0 HA ASP B 30 -8.504 -1.256 -8.919 1.00 0.00 H new ATOM 0 HB2 ASP B 30 -9.783 -3.184 -10.100 1.00 0.00 H new ATOM 0 HB3 ASP B 30 -10.698 -2.100 -9.071 1.00 0.00 H new ATOM 2186 N ASN B 31 -8.144 -1.642 -12.192 1.00 0.00 N ATOM 2187 CA ASN B 31 -7.162 -2.032 -13.204 1.00 0.00 C ATOM 2188 C ASN B 31 -6.928 -0.897 -14.166 1.00 0.00 C ATOM 2189 O ASN B 31 -6.359 -1.083 -15.242 1.00 0.00 O ATOM 2190 CB ASN B 31 -7.612 -3.271 -13.986 1.00 0.00 C ATOM 2191 CG ASN B 31 -8.994 -3.106 -14.589 1.00 0.00 C ATOM 2192 OD1 ASN B 31 -10.019 -3.130 -13.745 1.00 0.00 O flip ATOM 2193 ND2 ASN B 31 -9.139 -2.957 -15.802 1.00 0.00 N flip ATOM 0 H ASN B 31 -9.052 -1.365 -12.564 1.00 0.00 H new ATOM 0 HA ASN B 31 -6.237 -2.274 -12.681 1.00 0.00 H new ATOM 0 HB2 ASN B 31 -6.894 -3.476 -14.780 1.00 0.00 H new ATOM 0 HB3 ASN B 31 -7.609 -4.136 -13.323 1.00 0.00 H new ATOM 0 HD21 ASN B 31 -8.324 -2.944 -16.415 1.00 0.00 H new ATOM 0 HD22 ASN B 31 -10.074 -2.846 -16.194 1.00 0.00 H new ATOM 2200 N LEU B 32 -7.345 0.284 -13.759 1.00 0.00 N ATOM 2201 CA LEU B 32 -7.148 1.468 -14.583 1.00 0.00 C ATOM 2202 C LEU B 32 -5.701 1.519 -14.994 1.00 0.00 C ATOM 2203 O LEU B 32 -5.354 1.487 -16.174 1.00 0.00 O ATOM 2204 CB LEU B 32 -7.454 2.738 -13.805 1.00 0.00 C ATOM 2205 CG LEU B 32 -8.537 3.632 -14.413 1.00 0.00 C ATOM 2206 CD1 LEU B 32 -9.891 3.326 -13.792 1.00 0.00 C ATOM 2207 CD2 LEU B 32 -8.181 5.102 -14.235 1.00 0.00 C ATOM 0 H LEU B 32 -7.819 0.454 -12.872 1.00 0.00 H new ATOM 0 HA LEU B 32 -7.816 1.408 -15.443 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -7.759 2.462 -12.796 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -6.536 3.318 -13.713 1.00 0.00 H new ATOM 0 HG LEU B 32 -8.596 3.424 -15.481 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -10.649 3.971 -14.236 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -10.149 2.283 -13.976 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -9.847 3.504 -12.718 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -8.963 5.721 -14.674 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -8.092 5.329 -13.173 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -7.233 5.309 -14.731 1.00 0.00 H new ATOM 2219 N ASN B 33 -4.865 1.586 -13.974 1.00 0.00 N ATOM 2220 CA ASN B 33 -3.443 1.628 -14.161 1.00 0.00 C ATOM 2221 C ASN B 33 -2.738 0.674 -13.194 1.00 0.00 C ATOM 2222 O ASN B 33 -1.647 0.187 -13.485 1.00 0.00 O ATOM 2223 CB ASN B 33 -2.922 3.052 -13.962 1.00 0.00 C ATOM 2224 CG ASN B 33 -3.022 3.887 -15.224 1.00 0.00 C ATOM 2225 OD1 ASN B 33 -3.907 4.733 -15.353 1.00 0.00 O ATOM 2226 ND2 ASN B 33 -2.114 3.651 -16.163 1.00 0.00 N ATOM 0 H ASN B 33 -5.161 1.612 -12.998 1.00 0.00 H new ATOM 0 HA ASN B 33 -3.226 1.310 -15.181 1.00 0.00 H new ATOM 0 HB2 ASN B 33 -3.487 3.535 -13.165 1.00 0.00 H new ATOM 0 HB3 ASN B 33 -1.882 3.013 -13.637 1.00 0.00 H new ATOM 0 HD21 ASN B 33 -2.132 4.181 -17.034 1.00 0.00 H new ATOM 0 HD22 ASN B 33 -1.398 2.940 -16.013 1.00 0.00 H new ATOM 2233 N THR B 34 -3.380 0.409 -12.045 1.00 0.00 N ATOM 2234 CA THR B 34 -2.833 -0.481 -11.012 1.00 0.00 C ATOM 2235 C THR B 34 -3.884 -0.740 -9.941 1.00 0.00 C ATOM 2236 O THR B 34 -4.975 -0.170 -9.978 1.00 0.00 O ATOM 2237 CB THR B 34 -1.599 0.126 -10.318 1.00 0.00 C ATOM 2238 OG1 THR B 34 -1.989 1.162 -9.436 1.00 0.00 O ATOM 2239 CG2 THR B 34 -0.552 0.702 -11.249 1.00 0.00 C ATOM 0 H THR B 34 -4.290 0.805 -11.808 1.00 0.00 H new ATOM 0 HA THR B 34 -2.542 -1.404 -11.513 1.00 0.00 H new ATOM 0 HB THR B 34 -1.146 -0.718 -9.798 1.00 0.00 H new ATOM 0 HG1 THR B 34 -2.264 1.947 -9.955 1.00 0.00 H new ATOM 0 HG21 THR B 34 0.275 1.104 -10.663 1.00 0.00 H new ATOM 0 HG22 THR B 34 -0.181 -0.082 -11.909 1.00 0.00 H new ATOM 0 HG23 THR B 34 -0.995 1.499 -11.846 1.00 0.00 H new ATOM 2247 N ARG B 35 -3.536 -1.568 -8.962 1.00 0.00 N ATOM 2248 CA ARG B 35 -4.441 -1.852 -7.857 1.00 0.00 C ATOM 2249 C ARG B 35 -3.679 -2.217 -6.593 1.00 0.00 C ATOM 2250 O ARG B 35 -2.554 -2.714 -6.646 1.00 0.00 O ATOM 2251 CB ARG B 35 -5.427 -2.966 -8.209 1.00 0.00 C ATOM 2252 CG ARG B 35 -6.872 -2.583 -7.928 1.00 0.00 C ATOM 2253 CD ARG B 35 -7.355 -3.100 -6.584 1.00 0.00 C ATOM 2254 NE ARG B 35 -8.653 -2.526 -6.221 1.00 0.00 N ATOM 2255 CZ ARG B 35 -9.742 -3.245 -5.945 1.00 0.00 C ATOM 2256 NH1 ARG B 35 -9.715 -4.566 -6.018 1.00 0.00 N ATOM 2257 NH2 ARG B 35 -10.869 -2.637 -5.602 1.00 0.00 N ATOM 0 H ARG B 35 -2.639 -2.051 -8.912 1.00 0.00 H new ATOM 0 HA ARG B 35 -5.005 -0.938 -7.671 1.00 0.00 H new ATOM 0 HB2 ARG B 35 -5.321 -3.219 -9.264 1.00 0.00 H new ATOM 0 HB3 ARG B 35 -5.176 -3.861 -7.640 1.00 0.00 H new ATOM 0 HG2 ARG B 35 -6.969 -1.498 -7.953 1.00 0.00 H new ATOM 0 HG3 ARG B 35 -7.511 -2.979 -8.718 1.00 0.00 H new ATOM 0 HD2 ARG B 35 -7.434 -4.187 -6.618 1.00 0.00 H new ATOM 0 HD3 ARG B 35 -6.621 -2.858 -5.815 1.00 0.00 H new ATOM 0 HE ARG B 35 -8.729 -1.510 -6.176 1.00 0.00 H new ATOM 0 HH11 ARG B 35 -8.855 -5.044 -6.288 1.00 0.00 H new ATOM 0 HH12 ARG B 35 -10.554 -5.106 -5.805 1.00 0.00 H new ATOM 0 HH21 ARG B 35 -10.904 -1.619 -5.549 1.00 0.00 H new ATOM 0 HH22 ARG B 35 -11.702 -3.187 -5.391 1.00 0.00 H new ATOM 2271 N LEU B 36 -4.320 -1.986 -5.458 1.00 0.00 N ATOM 2272 CA LEU B 36 -3.741 -2.304 -4.164 1.00 0.00 C ATOM 2273 C LEU B 36 -3.880 -3.795 -3.910 1.00 0.00 C ATOM 2274 O LEU B 36 -4.852 -4.406 -4.346 1.00 0.00 O ATOM 2275 CB LEU B 36 -4.483 -1.527 -3.077 1.00 0.00 C ATOM 2276 CG LEU B 36 -3.954 -1.687 -1.646 1.00 0.00 C ATOM 2277 CD1 LEU B 36 -4.233 -3.080 -1.104 1.00 0.00 C ATOM 2278 CD2 LEU B 36 -2.466 -1.373 -1.590 1.00 0.00 C ATOM 0 H LEU B 36 -5.252 -1.575 -5.408 1.00 0.00 H new ATOM 0 HA LEU B 36 -2.686 -2.029 -4.151 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -4.457 -0.468 -3.335 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -5.529 -1.833 -3.091 1.00 0.00 H new ATOM 0 HG LEU B 36 -4.482 -0.975 -1.012 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -3.845 -3.160 -0.088 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -5.308 -3.259 -1.097 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -3.746 -3.821 -1.737 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -2.107 -1.492 -0.568 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -1.925 -2.055 -2.246 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -2.298 -0.347 -1.917 1.00 0.00 H new ATOM 2290 N VAL B 37 -2.929 -4.387 -3.201 1.00 0.00 N ATOM 2291 CA VAL B 37 -3.017 -5.809 -2.912 1.00 0.00 C ATOM 2292 C VAL B 37 -2.543 -6.160 -1.524 1.00 0.00 C ATOM 2293 O VAL B 37 -1.656 -5.518 -0.961 1.00 0.00 O ATOM 2294 CB VAL B 37 -2.198 -6.680 -3.884 1.00 0.00 C ATOM 2295 CG1 VAL B 37 -2.803 -6.668 -5.277 1.00 0.00 C ATOM 2296 CG2 VAL B 37 -0.744 -6.237 -3.921 1.00 0.00 C ATOM 0 H VAL B 37 -2.106 -3.917 -2.823 1.00 0.00 H new ATOM 0 HA VAL B 37 -4.081 -6.020 -3.019 1.00 0.00 H new ATOM 0 HB VAL B 37 -2.229 -7.705 -3.516 1.00 0.00 H new ATOM 0 HG11 VAL B 37 -2.203 -7.291 -5.940 1.00 0.00 H new ATOM 0 HG12 VAL B 37 -3.820 -7.057 -5.235 1.00 0.00 H new ATOM 0 HG13 VAL B 37 -2.821 -5.647 -5.657 1.00 0.00 H new ATOM 0 HG21 VAL B 37 -0.189 -6.868 -4.615 1.00 0.00 H new ATOM 0 HG22 VAL B 37 -0.688 -5.199 -4.250 1.00 0.00 H new ATOM 0 HG23 VAL B 37 -0.311 -6.325 -2.924 1.00 0.00 H new ATOM 2306 N ILE B 38 -3.092 -7.251 -1.024 1.00 0.00 N ATOM 2307 CA ILE B 38 -2.690 -7.789 0.249 1.00 0.00 C ATOM 2308 C ILE B 38 -1.912 -9.048 -0.075 1.00 0.00 C ATOM 2309 O ILE B 38 -2.486 -10.122 -0.253 1.00 0.00 O ATOM 2310 CB ILE B 38 -3.892 -8.132 1.143 1.00 0.00 C ATOM 2311 CG1 ILE B 38 -4.979 -7.064 1.000 1.00 0.00 C ATOM 2312 CG2 ILE B 38 -3.440 -8.256 2.585 1.00 0.00 C ATOM 2313 CD1 ILE B 38 -6.184 -7.298 1.883 1.00 0.00 C ATOM 0 H ILE B 38 -3.826 -7.783 -1.492 1.00 0.00 H new ATOM 0 HA ILE B 38 -2.102 -7.058 0.804 1.00 0.00 H new ATOM 0 HB ILE B 38 -4.313 -9.087 0.829 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -4.551 -6.090 1.236 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -5.304 -7.026 -0.040 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -4.296 -8.499 3.215 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -2.694 -9.046 2.666 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -3.005 -7.312 2.912 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -6.910 -6.501 1.726 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -6.638 -8.257 1.633 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -5.874 -7.305 2.928 1.00 0.00 H new ATOM 2325 N PRO B 39 -0.592 -8.907 -0.238 1.00 0.00 N ATOM 2326 CA PRO B 39 0.268 -10.008 -0.636 1.00 0.00 C ATOM 2327 C PRO B 39 0.080 -11.278 0.192 1.00 0.00 C ATOM 2328 O PRO B 39 0.638 -11.412 1.276 1.00 0.00 O ATOM 2329 CB PRO B 39 1.690 -9.459 -0.476 1.00 0.00 C ATOM 2330 CG PRO B 39 1.555 -8.105 0.146 1.00 0.00 C ATOM 2331 CD PRO B 39 0.155 -7.646 -0.129 1.00 0.00 C ATOM 0 HA PRO B 39 0.033 -10.323 -1.653 1.00 0.00 H new ATOM 0 HB2 PRO B 39 2.291 -10.116 0.152 1.00 0.00 H new ATOM 0 HB3 PRO B 39 2.192 -9.394 -1.441 1.00 0.00 H new ATOM 0 HG2 PRO B 39 1.744 -8.151 1.218 1.00 0.00 H new ATOM 0 HG3 PRO B 39 2.281 -7.410 -0.277 1.00 0.00 H new ATOM 0 HD2 PRO B 39 -0.229 -7.018 0.675 1.00 0.00 H new ATOM 0 HD3 PRO B 39 0.095 -7.061 -1.047 1.00 0.00 H new ATOM 2339 N LEU B 40 -0.688 -12.218 -0.349 1.00 0.00 N ATOM 2340 CA LEU B 40 -0.934 -13.495 0.308 1.00 0.00 C ATOM 2341 C LEU B 40 0.330 -14.319 0.364 1.00 0.00 C ATOM 2342 O LEU B 40 1.264 -14.096 -0.403 1.00 0.00 O ATOM 2343 CB LEU B 40 -2.006 -14.273 -0.448 1.00 0.00 C ATOM 2344 CG LEU B 40 -3.403 -14.137 0.117 1.00 0.00 C ATOM 2345 CD1 LEU B 40 -4.442 -14.515 -0.928 1.00 0.00 C ATOM 2346 CD2 LEU B 40 -3.556 -14.991 1.366 1.00 0.00 C ATOM 0 H LEU B 40 -1.155 -12.116 -1.250 1.00 0.00 H new ATOM 0 HA LEU B 40 -1.273 -13.295 1.324 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -2.014 -13.939 -1.486 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -1.733 -15.328 -0.455 1.00 0.00 H new ATOM 0 HG LEU B 40 -3.565 -13.095 0.394 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -5.440 -14.411 -0.503 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -4.345 -13.857 -1.792 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -4.286 -15.548 -1.239 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -4.566 -14.882 1.760 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -3.375 -16.036 1.116 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -2.836 -14.668 2.118 1.00 0.00 H new ATOM 2358 N THR B 41 0.349 -15.274 1.275 1.00 0.00 N ATOM 2359 CA THR B 41 1.499 -16.137 1.425 1.00 0.00 C ATOM 2360 C THR B 41 1.125 -17.433 2.133 1.00 0.00 C ATOM 2361 O THR B 41 0.000 -17.584 2.603 1.00 0.00 O ATOM 2362 CB THR B 41 2.620 -15.388 2.135 1.00 0.00 C ATOM 2363 OG1 THR B 41 3.228 -16.172 3.145 1.00 0.00 O ATOM 2364 CG2 THR B 41 2.187 -14.085 2.775 1.00 0.00 C ATOM 0 H THR B 41 -0.418 -15.469 1.919 1.00 0.00 H new ATOM 0 HA THR B 41 1.864 -16.421 0.438 1.00 0.00 H new ATOM 0 HB THR B 41 3.327 -15.167 1.335 1.00 0.00 H new ATOM 0 HG1 THR B 41 3.942 -15.656 3.574 1.00 0.00 H new ATOM 0 HG21 THR B 41 3.043 -13.615 3.259 1.00 0.00 H new ATOM 0 HG22 THR B 41 1.791 -13.418 2.010 1.00 0.00 H new ATOM 0 HG23 THR B 41 1.415 -14.284 3.518 1.00 0.00 H new ATOM 2372 N PRO B 42 2.049 -18.405 2.193 1.00 0.00 N ATOM 2373 CA PRO B 42 1.783 -19.693 2.815 1.00 0.00 C ATOM 2374 C PRO B 42 2.074 -19.712 4.301 1.00 0.00 C ATOM 2375 O PRO B 42 3.208 -19.521 4.740 1.00 0.00 O ATOM 2376 CB PRO B 42 2.731 -20.602 2.043 1.00 0.00 C ATOM 2377 CG PRO B 42 3.936 -19.756 1.846 1.00 0.00 C ATOM 2378 CD PRO B 42 3.419 -18.355 1.633 1.00 0.00 C ATOM 0 HA PRO B 42 0.734 -19.984 2.766 1.00 0.00 H new ATOM 0 HB2 PRO B 42 2.963 -21.508 2.603 1.00 0.00 H new ATOM 0 HB3 PRO B 42 2.301 -20.916 1.092 1.00 0.00 H new ATOM 0 HG2 PRO B 42 4.594 -19.803 2.714 1.00 0.00 H new ATOM 0 HG3 PRO B 42 4.516 -20.094 0.987 1.00 0.00 H new ATOM 0 HD2 PRO B 42 4.036 -17.617 2.146 1.00 0.00 H new ATOM 0 HD3 PRO B 42 3.412 -18.086 0.577 1.00 0.00 H new ATOM 2386 N ILE B 43 1.020 -19.963 5.063 1.00 0.00 N ATOM 2387 CA ILE B 43 1.096 -20.039 6.509 1.00 0.00 C ATOM 2388 C ILE B 43 2.307 -20.855 6.953 1.00 0.00 C ATOM 2389 O ILE B 43 2.881 -20.616 8.016 1.00 0.00 O ATOM 2390 CB ILE B 43 -0.195 -20.678 7.061 1.00 0.00 C ATOM 2391 CG1 ILE B 43 -1.291 -19.631 7.164 1.00 0.00 C ATOM 2392 CG2 ILE B 43 0.053 -21.361 8.401 1.00 0.00 C ATOM 2393 CD1 ILE B 43 -2.552 -20.161 7.809 1.00 0.00 C ATOM 0 H ILE B 43 0.084 -20.120 4.690 1.00 0.00 H new ATOM 0 HA ILE B 43 1.204 -19.028 6.902 1.00 0.00 H new ATOM 0 HB ILE B 43 -0.523 -21.451 6.366 1.00 0.00 H new ATOM 0 HG12 ILE B 43 -0.923 -18.782 7.741 1.00 0.00 H new ATOM 0 HG13 ILE B 43 -1.527 -19.260 6.167 1.00 0.00 H new ATOM 0 HG21 ILE B 43 -0.876 -21.801 8.763 1.00 0.00 H new ATOM 0 HG22 ILE B 43 0.801 -22.144 8.277 1.00 0.00 H new ATOM 0 HG23 ILE B 43 0.412 -20.627 9.123 1.00 0.00 H new ATOM 0 HD11 ILE B 43 -3.298 -19.368 7.855 1.00 0.00 H new ATOM 0 HD12 ILE B 43 -2.941 -20.991 7.220 1.00 0.00 H new ATOM 0 HD13 ILE B 43 -2.327 -20.506 8.818 1.00 0.00 H new ATOM 2405 N GLU B 44 2.673 -21.826 6.132 1.00 0.00 N ATOM 2406 CA GLU B 44 3.798 -22.701 6.420 1.00 0.00 C ATOM 2407 C GLU B 44 5.126 -21.951 6.376 1.00 0.00 C ATOM 2408 O GLU B 44 5.843 -21.890 7.375 1.00 0.00 O ATOM 2409 CB GLU B 44 3.802 -23.855 5.426 1.00 0.00 C ATOM 2410 CG GLU B 44 4.694 -25.011 5.840 1.00 0.00 C ATOM 2411 CD GLU B 44 4.655 -26.162 4.854 1.00 0.00 C ATOM 2412 OE1 GLU B 44 3.639 -26.888 4.829 1.00 0.00 O ATOM 2413 OE2 GLU B 44 5.640 -26.337 4.106 1.00 0.00 O ATOM 0 H GLU B 44 2.201 -22.029 5.251 1.00 0.00 H new ATOM 0 HA GLU B 44 3.684 -23.087 7.433 1.00 0.00 H new ATOM 0 HB2 GLU B 44 2.782 -24.220 5.302 1.00 0.00 H new ATOM 0 HB3 GLU B 44 4.129 -23.485 4.454 1.00 0.00 H new ATOM 0 HG2 GLU B 44 5.720 -24.656 5.938 1.00 0.00 H new ATOM 0 HG3 GLU B 44 4.386 -25.369 6.822 1.00 0.00 H new ATOM 2420 N LEU B 45 5.453 -21.382 5.222 1.00 0.00 N ATOM 2421 CA LEU B 45 6.702 -20.642 5.072 1.00 0.00 C ATOM 2422 C LEU B 45 6.731 -19.426 5.995 1.00 0.00 C ATOM 2423 O LEU B 45 7.795 -18.873 6.273 1.00 0.00 O ATOM 2424 CB LEU B 45 6.897 -20.200 3.620 1.00 0.00 C ATOM 2425 CG LEU B 45 6.586 -21.267 2.569 1.00 0.00 C ATOM 2426 CD1 LEU B 45 6.886 -20.744 1.173 1.00 0.00 C ATOM 2427 CD2 LEU B 45 7.379 -22.535 2.847 1.00 0.00 C ATOM 0 H LEU B 45 4.876 -21.418 4.382 1.00 0.00 H new ATOM 0 HA LEU B 45 7.519 -21.308 5.350 1.00 0.00 H new ATOM 0 HB2 LEU B 45 6.264 -19.332 3.433 1.00 0.00 H new ATOM 0 HB3 LEU B 45 7.929 -19.875 3.491 1.00 0.00 H new ATOM 0 HG LEU B 45 5.524 -21.506 2.625 1.00 0.00 H new ATOM 0 HD11 LEU B 45 6.659 -21.517 0.438 1.00 0.00 H new ATOM 0 HD12 LEU B 45 6.274 -19.864 0.975 1.00 0.00 H new ATOM 0 HD13 LEU B 45 7.940 -20.476 1.104 1.00 0.00 H new ATOM 0 HD21 LEU B 45 7.146 -23.283 2.090 1.00 0.00 H new ATOM 0 HD22 LEU B 45 8.445 -22.311 2.819 1.00 0.00 H new ATOM 0 HD23 LEU B 45 7.115 -22.921 3.832 1.00 0.00 H new ATOM 2439 N LEU B 46 5.558 -19.014 6.470 1.00 0.00 N ATOM 2440 CA LEU B 46 5.456 -17.867 7.363 1.00 0.00 C ATOM 2441 C LEU B 46 5.108 -18.307 8.782 1.00 0.00 C ATOM 2442 O LEU B 46 4.519 -17.546 9.550 1.00 0.00 O ATOM 2443 CB LEU B 46 4.401 -16.886 6.848 1.00 0.00 C ATOM 2444 CG LEU B 46 4.580 -15.440 7.313 1.00 0.00 C ATOM 2445 CD1 LEU B 46 5.974 -14.938 6.973 1.00 0.00 C ATOM 2446 CD2 LEU B 46 3.521 -14.545 6.686 1.00 0.00 C ATOM 0 H LEU B 46 4.666 -19.458 6.250 1.00 0.00 H new ATOM 0 HA LEU B 46 6.426 -17.370 7.385 1.00 0.00 H new ATOM 0 HB2 LEU B 46 4.410 -16.905 5.758 1.00 0.00 H new ATOM 0 HB3 LEU B 46 3.418 -17.234 7.164 1.00 0.00 H new ATOM 0 HG LEU B 46 4.460 -15.409 8.396 1.00 0.00 H new ATOM 0 HD11 LEU B 46 6.082 -13.908 7.312 1.00 0.00 H new ATOM 0 HD12 LEU B 46 6.717 -15.563 7.469 1.00 0.00 H new ATOM 0 HD13 LEU B 46 6.124 -14.983 5.894 1.00 0.00 H new ATOM 0 HD21 LEU B 46 3.663 -13.520 7.027 1.00 0.00 H new ATOM 0 HD22 LEU B 46 3.610 -14.582 5.600 1.00 0.00 H new ATOM 0 HD23 LEU B 46 2.531 -14.892 6.981 1.00 0.00 H new ATOM 2458 N ASP B 47 5.475 -19.540 9.127 1.00 0.00 N ATOM 2459 CA ASP B 47 5.201 -20.081 10.455 1.00 0.00 C ATOM 2460 C ASP B 47 3.750 -20.455 10.605 1.00 0.00 C ATOM 2461 O ASP B 47 2.849 -19.622 10.511 1.00 0.00 O ATOM 2462 CB ASP B 47 5.608 -19.098 11.553 1.00 0.00 C ATOM 2463 CG ASP B 47 6.869 -18.326 11.211 1.00 0.00 C ATOM 2464 OD1 ASP B 47 7.941 -18.958 11.106 1.00 0.00 O ATOM 2465 OD2 ASP B 47 6.784 -17.091 11.048 1.00 0.00 O ATOM 0 H ASP B 47 5.963 -20.183 8.504 1.00 0.00 H new ATOM 0 HA ASP B 47 5.802 -20.984 10.563 1.00 0.00 H new ATOM 0 HB2 ASP B 47 4.793 -18.396 11.726 1.00 0.00 H new ATOM 0 HB3 ASP B 47 5.762 -19.643 12.484 1.00 0.00 H new ATOM 2470 N LYS B 48 3.553 -21.733 10.840 1.00 0.00 N ATOM 2471 CA LYS B 48 2.238 -22.297 11.015 1.00 0.00 C ATOM 2472 C LYS B 48 1.713 -22.013 12.419 1.00 0.00 C ATOM 2473 O LYS B 48 1.382 -22.931 13.169 1.00 0.00 O ATOM 2474 CB LYS B 48 2.328 -23.794 10.767 1.00 0.00 C ATOM 2475 CG LYS B 48 1.178 -24.346 9.940 1.00 0.00 C ATOM 2476 CD LYS B 48 1.593 -24.577 8.499 1.00 0.00 C ATOM 2477 CE LYS B 48 2.477 -25.806 8.363 1.00 0.00 C ATOM 2478 NZ LYS B 48 1.922 -26.974 9.101 1.00 0.00 N ATOM 0 H LYS B 48 4.309 -22.414 10.915 1.00 0.00 H new ATOM 0 HA LYS B 48 1.541 -21.845 10.309 1.00 0.00 H new ATOM 0 HB2 LYS B 48 3.267 -24.014 10.259 1.00 0.00 H new ATOM 0 HB3 LYS B 48 2.356 -24.311 11.726 1.00 0.00 H new ATOM 0 HG2 LYS B 48 0.832 -25.284 10.375 1.00 0.00 H new ATOM 0 HG3 LYS B 48 0.339 -23.651 9.972 1.00 0.00 H new ATOM 0 HD2 LYS B 48 0.705 -24.696 7.878 1.00 0.00 H new ATOM 0 HD3 LYS B 48 2.126 -23.702 8.128 1.00 0.00 H new ATOM 0 HE2 LYS B 48 2.585 -26.061 7.309 1.00 0.00 H new ATOM 0 HE3 LYS B 48 3.474 -25.579 8.740 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 2.312 -27.853 8.704 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 2.179 -26.904 10.106 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 0.886 -26.983 9.009 1.00 0.00 H new ATOM 2492 N LYS B 49 1.655 -20.733 12.773 1.00 0.00 N ATOM 2493 CA LYS B 49 1.188 -20.328 14.092 1.00 0.00 C ATOM 2494 C LYS B 49 1.002 -18.816 14.165 1.00 0.00 C ATOM 2495 O LYS B 49 1.227 -18.203 15.209 1.00 0.00 O ATOM 2496 CB LYS B 49 2.188 -20.781 15.159 1.00 0.00 C ATOM 2497 CG LYS B 49 3.643 -20.560 14.767 1.00 0.00 C ATOM 2498 CD LYS B 49 4.082 -19.130 15.042 1.00 0.00 C ATOM 2499 CE LYS B 49 5.558 -19.059 15.396 1.00 0.00 C ATOM 2500 NZ LYS B 49 5.830 -18.035 16.442 1.00 0.00 N ATOM 0 H LYS B 49 1.925 -19.960 12.165 1.00 0.00 H new ATOM 0 HA LYS B 49 0.223 -20.801 14.274 1.00 0.00 H new ATOM 0 HB2 LYS B 49 1.985 -20.244 16.086 1.00 0.00 H new ATOM 0 HB3 LYS B 49 2.033 -21.840 15.363 1.00 0.00 H new ATOM 0 HG2 LYS B 49 4.279 -21.250 15.321 1.00 0.00 H new ATOM 0 HG3 LYS B 49 3.774 -20.785 13.709 1.00 0.00 H new ATOM 0 HD2 LYS B 49 3.887 -18.513 14.165 1.00 0.00 H new ATOM 0 HD3 LYS B 49 3.490 -18.717 15.859 1.00 0.00 H new ATOM 0 HE2 LYS B 49 5.894 -20.035 15.747 1.00 0.00 H new ATOM 0 HE3 LYS B 49 6.135 -18.826 14.501 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 6.848 -18.018 16.655 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 5.533 -17.100 16.098 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 5.300 -18.271 17.305 1.00 0.00 H new ATOM 2514 N ALA B 50 0.594 -18.219 13.050 1.00 0.00 N ATOM 2515 CA ALA B 50 0.382 -16.778 12.990 1.00 0.00 C ATOM 2516 C ALA B 50 -0.882 -16.375 13.747 1.00 0.00 C ATOM 2517 O ALA B 50 -1.864 -17.118 13.771 1.00 0.00 O ATOM 2518 CB ALA B 50 0.304 -16.318 11.542 1.00 0.00 C ATOM 0 H ALA B 50 0.404 -18.710 12.177 1.00 0.00 H new ATOM 0 HA ALA B 50 1.230 -16.290 13.470 1.00 0.00 H new ATOM 0 HB1 ALA B 50 0.145 -15.240 11.511 1.00 0.00 H new ATOM 0 HB2 ALA B 50 1.236 -16.563 11.032 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -0.525 -16.821 11.045 1.00 0.00 H new ATOM 2524 N PRO B 51 -0.874 -15.188 14.379 1.00 0.00 N ATOM 2525 CA PRO B 51 -2.024 -14.690 15.140 1.00 0.00 C ATOM 2526 C PRO B 51 -3.164 -14.231 14.237 1.00 0.00 C ATOM 2527 O PRO B 51 -3.013 -14.159 13.017 1.00 0.00 O ATOM 2528 CB PRO B 51 -1.446 -13.506 15.915 1.00 0.00 C ATOM 2529 CG PRO B 51 -0.319 -13.020 15.073 1.00 0.00 C ATOM 2530 CD PRO B 51 0.257 -14.239 14.403 1.00 0.00 C ATOM 0 HA PRO B 51 -2.459 -15.462 15.774 1.00 0.00 H new ATOM 0 HB2 PRO B 51 -2.194 -12.727 16.064 1.00 0.00 H new ATOM 0 HB3 PRO B 51 -1.100 -13.810 16.903 1.00 0.00 H new ATOM 0 HG2 PRO B 51 -0.667 -12.297 14.335 1.00 0.00 H new ATOM 0 HG3 PRO B 51 0.433 -12.517 15.681 1.00 0.00 H new ATOM 0 HD2 PRO B 51 0.613 -14.014 13.398 1.00 0.00 H new ATOM 0 HD3 PRO B 51 1.105 -14.639 14.959 1.00 0.00 H new ATOM 2538 N SER B 52 -4.304 -13.919 14.845 1.00 0.00 N ATOM 2539 CA SER B 52 -5.471 -13.465 14.096 1.00 0.00 C ATOM 2540 C SER B 52 -5.682 -11.965 14.275 1.00 0.00 C ATOM 2541 O SER B 52 -6.350 -11.529 15.212 1.00 0.00 O ATOM 2542 CB SER B 52 -6.719 -14.225 14.547 1.00 0.00 C ATOM 2543 OG SER B 52 -6.868 -15.436 13.826 1.00 0.00 O ATOM 0 H SER B 52 -4.445 -13.972 15.854 1.00 0.00 H new ATOM 0 HA SER B 52 -5.294 -13.665 13.039 1.00 0.00 H new ATOM 0 HB2 SER B 52 -6.652 -14.439 15.614 1.00 0.00 H new ATOM 0 HB3 SER B 52 -7.601 -13.601 14.402 1.00 0.00 H new ATOM 0 HG SER B 52 -7.672 -15.904 14.134 1.00 0.00 H new ATOM 2549 N HIS B 53 -5.109 -11.181 13.368 1.00 0.00 N ATOM 2550 CA HIS B 53 -5.233 -9.728 13.423 1.00 0.00 C ATOM 2551 C HIS B 53 -4.541 -9.080 12.229 1.00 0.00 C ATOM 2552 O HIS B 53 -3.366 -9.338 11.966 1.00 0.00 O ATOM 2553 CB HIS B 53 -4.638 -9.193 14.726 1.00 0.00 C ATOM 2554 CG HIS B 53 -5.354 -7.993 15.263 1.00 0.00 C ATOM 2555 ND1 HIS B 53 -5.931 -7.771 16.468 1.00 0.00 N flip ATOM 2556 CD2 HIS B 53 -5.542 -6.839 14.532 1.00 0.00 C flip ATOM 2557 CE1 HIS B 53 -6.451 -6.500 16.442 1.00 0.00 C flip ATOM 2558 NE2 HIS B 53 -6.203 -5.959 15.264 1.00 0.00 N flip ATOM 0 H HIS B 53 -4.554 -11.527 12.585 1.00 0.00 H new ATOM 0 HA HIS B 53 -6.293 -9.476 13.387 1.00 0.00 H new ATOM 0 HB2 HIS B 53 -4.658 -9.983 15.476 1.00 0.00 H new ATOM 0 HB3 HIS B 53 -3.592 -8.937 14.560 1.00 0.00 H new ATOM 0 HD2 HIS B 53 -5.202 -6.679 13.519 1.00 0.00 H new ATOM 0 HE1 HIS B 53 -6.978 -6.021 17.254 1.00 0.00 H new ATOM 0 HE2 HIS B 53 -6.475 -5.021 14.969 1.00 0.00 H new ATOM 2567 N LEU B 54 -5.276 -8.237 11.508 1.00 0.00 N ATOM 2568 CA LEU B 54 -4.735 -7.551 10.337 1.00 0.00 C ATOM 2569 C LEU B 54 -4.515 -8.526 9.185 1.00 0.00 C ATOM 2570 O LEU B 54 -5.128 -8.393 8.127 1.00 0.00 O ATOM 2571 CB LEU B 54 -3.418 -6.848 10.683 1.00 0.00 C ATOM 2572 CG LEU B 54 -3.121 -5.587 9.868 1.00 0.00 C ATOM 2573 CD1 LEU B 54 -1.697 -5.114 10.116 1.00 0.00 C ATOM 2574 CD2 LEU B 54 -3.348 -5.842 8.385 1.00 0.00 C ATOM 0 H LEU B 54 -6.249 -8.012 11.714 1.00 0.00 H new ATOM 0 HA LEU B 54 -5.464 -6.803 10.024 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -3.432 -6.583 11.740 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -2.600 -7.554 10.542 1.00 0.00 H new ATOM 0 HG LEU B 54 -3.805 -4.802 10.190 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -1.504 -4.217 9.528 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -1.567 -4.889 11.175 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -0.997 -5.897 9.823 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -3.132 -4.934 7.822 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -2.690 -6.643 8.049 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -4.386 -6.132 8.220 1.00 0.00 H new ATOM 2586 N CYS B 55 -3.637 -9.501 9.398 1.00 0.00 N ATOM 2587 CA CYS B 55 -3.333 -10.501 8.379 1.00 0.00 C ATOM 2588 C CYS B 55 -4.210 -11.741 8.557 1.00 0.00 C ATOM 2589 O CYS B 55 -3.997 -12.530 9.477 1.00 0.00 O ATOM 2590 CB CYS B 55 -1.855 -10.890 8.455 1.00 0.00 C ATOM 2591 SG CYS B 55 -1.358 -12.160 7.269 1.00 0.00 S ATOM 0 H CYS B 55 -3.122 -9.620 10.270 1.00 0.00 H new ATOM 0 HA CYS B 55 -3.542 -10.070 7.400 1.00 0.00 H new ATOM 0 HB2 CYS B 55 -1.248 -9.999 8.292 1.00 0.00 H new ATOM 0 HB3 CYS B 55 -1.636 -11.244 9.462 1.00 0.00 H new ATOM 0 HG CYS B 55 -1.911 -11.918 6.117 1.00 0.00 H new ATOM 2597 N PRO B 56 -5.218 -11.929 7.683 1.00 0.00 N ATOM 2598 CA PRO B 56 -6.128 -13.058 7.747 1.00 0.00 C ATOM 2599 C PRO B 56 -5.743 -14.176 6.784 1.00 0.00 C ATOM 2600 O PRO B 56 -5.441 -13.924 5.618 1.00 0.00 O ATOM 2601 CB PRO B 56 -7.443 -12.415 7.315 1.00 0.00 C ATOM 2602 CG PRO B 56 -7.049 -11.329 6.354 1.00 0.00 C ATOM 2603 CD PRO B 56 -5.574 -11.053 6.560 1.00 0.00 C ATOM 0 HA PRO B 56 -6.146 -13.534 8.727 1.00 0.00 H new ATOM 0 HB2 PRO B 56 -8.101 -13.143 6.840 1.00 0.00 H new ATOM 0 HB3 PRO B 56 -7.983 -12.008 8.170 1.00 0.00 H new ATOM 0 HG2 PRO B 56 -7.242 -11.638 5.327 1.00 0.00 H new ATOM 0 HG3 PRO B 56 -7.636 -10.428 6.532 1.00 0.00 H new ATOM 0 HD2 PRO B 56 -4.993 -11.287 5.668 1.00 0.00 H new ATOM 0 HD3 PRO B 56 -5.390 -10.004 6.794 1.00 0.00 H new ATOM 2611 N THR B 57 -5.759 -15.410 7.275 1.00 0.00 N ATOM 2612 CA THR B 57 -5.415 -16.559 6.447 1.00 0.00 C ATOM 2613 C THR B 57 -6.492 -16.851 5.442 1.00 0.00 C ATOM 2614 O THR B 57 -7.634 -16.407 5.569 1.00 0.00 O ATOM 2615 CB THR B 57 -5.169 -17.808 7.298 1.00 0.00 C ATOM 2616 OG1 THR B 57 -3.818 -17.873 7.705 1.00 0.00 O ATOM 2617 CG2 THR B 57 -5.502 -19.125 6.601 1.00 0.00 C ATOM 0 H THR B 57 -6.005 -15.640 8.238 1.00 0.00 H new ATOM 0 HA THR B 57 -4.496 -16.302 5.920 1.00 0.00 H new ATOM 0 HB THR B 57 -5.845 -17.699 8.146 1.00 0.00 H new ATOM 0 HG1 THR B 57 -3.241 -17.931 6.915 1.00 0.00 H new ATOM 0 HG21 THR B 57 -5.298 -19.956 7.276 1.00 0.00 H new ATOM 0 HG22 THR B 57 -6.556 -19.134 6.324 1.00 0.00 H new ATOM 0 HG23 THR B 57 -4.890 -19.227 5.705 1.00 0.00 H new ATOM 2625 N ILE B 58 -6.115 -17.641 4.458 1.00 0.00 N ATOM 2626 CA ILE B 58 -7.038 -18.050 3.438 1.00 0.00 C ATOM 2627 C ILE B 58 -6.922 -19.545 3.180 1.00 0.00 C ATOM 2628 O ILE B 58 -5.862 -20.131 3.382 1.00 0.00 O ATOM 2629 CB ILE B 58 -6.834 -17.253 2.132 1.00 0.00 C ATOM 2630 CG1 ILE B 58 -6.808 -15.741 2.456 1.00 0.00 C ATOM 2631 CG2 ILE B 58 -7.877 -17.628 1.095 1.00 0.00 C ATOM 2632 CD1 ILE B 58 -7.818 -14.887 1.718 1.00 0.00 C ATOM 0 H ILE B 58 -5.170 -18.010 4.349 1.00 0.00 H new ATOM 0 HA ILE B 58 -8.044 -17.836 3.798 1.00 0.00 H new ATOM 0 HB ILE B 58 -5.873 -17.510 1.686 1.00 0.00 H new ATOM 0 HG12 ILE B 58 -6.969 -15.616 3.527 1.00 0.00 H new ATOM 0 HG13 ILE B 58 -5.811 -15.360 2.237 1.00 0.00 H new ATOM 0 HG21 ILE B 58 -7.709 -17.051 0.185 1.00 0.00 H new ATOM 0 HG22 ILE B 58 -7.800 -18.692 0.870 1.00 0.00 H new ATOM 0 HG23 ILE B 58 -8.872 -17.411 1.484 1.00 0.00 H new ATOM 0 HD11 ILE B 58 -7.708 -13.847 2.024 1.00 0.00 H new ATOM 0 HD12 ILE B 58 -7.649 -14.969 0.644 1.00 0.00 H new ATOM 0 HD13 ILE B 58 -8.826 -15.230 1.954 1.00 0.00 H new ATOM 2644 N HIS B 59 -8.014 -20.158 2.739 1.00 0.00 N ATOM 2645 CA HIS B 59 -8.026 -21.584 2.463 1.00 0.00 C ATOM 2646 C HIS B 59 -8.625 -21.854 1.102 1.00 0.00 C ATOM 2647 O HIS B 59 -9.831 -22.059 0.957 1.00 0.00 O ATOM 2648 CB HIS B 59 -8.804 -22.344 3.523 1.00 0.00 C ATOM 2649 CG HIS B 59 -8.430 -21.981 4.926 1.00 0.00 C ATOM 2650 ND1 HIS B 59 -8.332 -20.775 5.534 1.00 0.00 N flip ATOM 2651 CD2 HIS B 59 -8.103 -22.918 5.884 1.00 0.00 C flip ATOM 2652 CE1 HIS B 59 -7.951 -21.004 6.833 1.00 0.00 C flip ATOM 2653 NE2 HIS B 59 -7.820 -22.304 7.020 1.00 0.00 N flip ATOM 0 H HIS B 59 -8.902 -19.687 2.566 1.00 0.00 H new ATOM 0 HA HIS B 59 -6.993 -21.931 2.477 1.00 0.00 H new ATOM 0 HB2 HIS B 59 -9.869 -22.158 3.381 1.00 0.00 H new ATOM 0 HB3 HIS B 59 -8.645 -23.413 3.380 1.00 0.00 H new ATOM 0 HD2 HIS B 59 -8.082 -23.987 5.730 1.00 0.00 H new ATOM 0 HE1 HIS B 59 -7.785 -20.243 7.581 1.00 0.00 H new ATOM 0 HE2 HIS B 59 -7.547 -22.757 7.892 1.00 0.00 H new ATOM 2662 N ILE B 60 -7.765 -21.846 0.115 1.00 0.00 N ATOM 2663 CA ILE B 60 -8.163 -22.082 -1.259 1.00 0.00 C ATOM 2664 C ILE B 60 -7.723 -23.471 -1.718 1.00 0.00 C ATOM 2665 O ILE B 60 -7.278 -24.285 -0.909 1.00 0.00 O ATOM 2666 CB ILE B 60 -7.575 -21.000 -2.184 1.00 0.00 C ATOM 2667 CG1 ILE B 60 -6.046 -21.053 -2.156 1.00 0.00 C ATOM 2668 CG2 ILE B 60 -8.071 -19.621 -1.755 1.00 0.00 C ATOM 2669 CD1 ILE B 60 -5.407 -20.854 -3.512 1.00 0.00 C ATOM 0 H ILE B 60 -6.767 -21.676 0.237 1.00 0.00 H new ATOM 0 HA ILE B 60 -9.250 -22.031 -1.313 1.00 0.00 H new ATOM 0 HB ILE B 60 -7.907 -21.188 -3.205 1.00 0.00 H new ATOM 0 HG12 ILE B 60 -5.677 -20.287 -1.474 1.00 0.00 H new ATOM 0 HG13 ILE B 60 -5.732 -22.016 -1.754 1.00 0.00 H new ATOM 0 HG21 ILE B 60 -7.650 -18.862 -2.414 1.00 0.00 H new ATOM 0 HG22 ILE B 60 -9.159 -19.591 -1.814 1.00 0.00 H new ATOM 0 HG23 ILE B 60 -7.758 -19.425 -0.730 1.00 0.00 H new ATOM 0 HD11 ILE B 60 -4.323 -20.904 -3.414 1.00 0.00 H new ATOM 0 HD12 ILE B 60 -5.746 -21.635 -4.192 1.00 0.00 H new ATOM 0 HD13 ILE B 60 -5.691 -19.879 -3.908 1.00 0.00 H new ATOM 2681 N ASP B 61 -7.863 -23.745 -3.009 1.00 0.00 N ATOM 2682 CA ASP B 61 -7.491 -25.047 -3.555 1.00 0.00 C ATOM 2683 C ASP B 61 -6.022 -25.371 -3.302 1.00 0.00 C ATOM 2684 O ASP B 61 -5.635 -26.540 -3.274 1.00 0.00 O ATOM 2685 CB ASP B 61 -7.785 -25.097 -5.055 1.00 0.00 C ATOM 2686 CG ASP B 61 -7.750 -26.510 -5.604 1.00 0.00 C ATOM 2687 OD1 ASP B 61 -8.779 -27.210 -5.508 1.00 0.00 O ATOM 2688 OD2 ASP B 61 -6.692 -26.915 -6.131 1.00 0.00 O ATOM 0 H ASP B 61 -8.230 -23.087 -3.696 1.00 0.00 H new ATOM 0 HA ASP B 61 -8.091 -25.799 -3.042 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -8.766 -24.660 -5.245 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -7.055 -24.486 -5.586 1.00 0.00 H new ATOM 2693 N GLU B 62 -5.205 -24.342 -3.119 1.00 0.00 N ATOM 2694 CA GLU B 62 -3.782 -24.541 -2.872 1.00 0.00 C ATOM 2695 C GLU B 62 -3.497 -24.762 -1.386 1.00 0.00 C ATOM 2696 O GLU B 62 -2.357 -25.022 -1.000 1.00 0.00 O ATOM 2697 CB GLU B 62 -2.979 -23.345 -3.386 1.00 0.00 C ATOM 2698 CG GLU B 62 -3.127 -23.110 -4.881 1.00 0.00 C ATOM 2699 CD GLU B 62 -1.987 -23.710 -5.681 1.00 0.00 C ATOM 2700 OE1 GLU B 62 -1.324 -24.636 -5.168 1.00 0.00 O ATOM 2701 OE2 GLU B 62 -1.757 -23.253 -6.821 1.00 0.00 O ATOM 0 H GLU B 62 -5.501 -23.366 -3.137 1.00 0.00 H new ATOM 0 HA GLU B 62 -3.476 -25.437 -3.412 1.00 0.00 H new ATOM 0 HB2 GLU B 62 -3.296 -22.449 -2.853 1.00 0.00 H new ATOM 0 HB3 GLU B 62 -1.925 -23.498 -3.153 1.00 0.00 H new ATOM 0 HG2 GLU B 62 -4.070 -23.539 -5.221 1.00 0.00 H new ATOM 0 HG3 GLU B 62 -3.177 -22.038 -5.074 1.00 0.00 H new ATOM 2708 N GLY B 63 -4.533 -24.668 -0.554 1.00 0.00 N ATOM 2709 CA GLY B 63 -4.351 -24.871 0.875 1.00 0.00 C ATOM 2710 C GLY B 63 -4.534 -23.597 1.683 1.00 0.00 C ATOM 2711 O GLY B 63 -5.286 -22.707 1.289 1.00 0.00 O ATOM 0 H GLY B 63 -5.489 -24.456 -0.841 1.00 0.00 H new ATOM 0 HA2 GLY B 63 -5.061 -25.621 1.223 1.00 0.00 H new ATOM 0 HA3 GLY B 63 -3.353 -25.269 1.056 1.00 0.00 H new ATOM 2715 N ASP B 64 -3.847 -23.517 2.823 1.00 0.00 N ATOM 2716 CA ASP B 64 -3.941 -22.350 3.699 1.00 0.00 C ATOM 2717 C ASP B 64 -2.889 -21.302 3.347 1.00 0.00 C ATOM 2718 O ASP B 64 -1.780 -21.634 2.931 1.00 0.00 O ATOM 2719 CB ASP B 64 -3.790 -22.770 5.162 1.00 0.00 C ATOM 2720 CG ASP B 64 -4.878 -23.729 5.603 1.00 0.00 C ATOM 2721 OD1 ASP B 64 -5.280 -24.586 4.789 1.00 0.00 O ATOM 2722 OD2 ASP B 64 -5.328 -23.623 6.764 1.00 0.00 O ATOM 0 H ASP B 64 -3.220 -24.247 3.161 1.00 0.00 H new ATOM 0 HA ASP B 64 -4.925 -21.904 3.553 1.00 0.00 H new ATOM 0 HB2 ASP B 64 -2.816 -23.239 5.304 1.00 0.00 H new ATOM 0 HB3 ASP B 64 -3.812 -21.884 5.796 1.00 0.00 H new ATOM 2727 N PHE B 65 -3.259 -20.035 3.511 1.00 0.00 N ATOM 2728 CA PHE B 65 -2.368 -18.919 3.204 1.00 0.00 C ATOM 2729 C PHE B 65 -2.696 -17.716 4.083 1.00 0.00 C ATOM 2730 O PHE B 65 -3.513 -17.829 4.992 1.00 0.00 O ATOM 2731 CB PHE B 65 -2.477 -18.577 1.726 1.00 0.00 C ATOM 2732 CG PHE B 65 -2.279 -19.787 0.857 1.00 0.00 C ATOM 2733 CD1 PHE B 65 -1.018 -20.335 0.698 1.00 0.00 C ATOM 2734 CD2 PHE B 65 -3.355 -20.398 0.235 1.00 0.00 C ATOM 2735 CE1 PHE B 65 -0.830 -21.470 -0.065 1.00 0.00 C ATOM 2736 CE2 PHE B 65 -3.171 -21.530 -0.538 1.00 0.00 C ATOM 2737 CZ PHE B 65 -1.907 -22.067 -0.685 1.00 0.00 C ATOM 0 H PHE B 65 -4.176 -19.754 3.857 1.00 0.00 H new ATOM 0 HA PHE B 65 -1.338 -19.205 3.417 1.00 0.00 H new ATOM 0 HB2 PHE B 65 -3.456 -18.141 1.525 1.00 0.00 H new ATOM 0 HB3 PHE B 65 -1.734 -17.821 1.472 1.00 0.00 H new ATOM 0 HD1 PHE B 65 -0.170 -19.869 1.177 1.00 0.00 H new ATOM 0 HD2 PHE B 65 -4.347 -19.987 0.355 1.00 0.00 H new ATOM 0 HE1 PHE B 65 0.159 -21.890 -0.176 1.00 0.00 H new ATOM 0 HE2 PHE B 65 -4.015 -21.994 -1.026 1.00 0.00 H new ATOM 0 HZ PHE B 65 -1.763 -22.953 -1.285 1.00 0.00 H new ATOM 2747 N ILE B 66 -2.057 -16.568 3.837 1.00 0.00 N ATOM 2748 CA ILE B 66 -2.314 -15.385 4.655 1.00 0.00 C ATOM 2749 C ILE B 66 -2.032 -14.101 3.894 1.00 0.00 C ATOM 2750 O ILE B 66 -0.913 -13.872 3.437 1.00 0.00 O ATOM 2751 CB ILE B 66 -1.481 -15.379 5.962 1.00 0.00 C ATOM 2752 CG1 ILE B 66 -0.467 -16.518 5.958 1.00 0.00 C ATOM 2753 CG2 ILE B 66 -2.383 -15.465 7.183 1.00 0.00 C ATOM 2754 CD1 ILE B 66 0.580 -16.345 4.893 1.00 0.00 C ATOM 0 H ILE B 66 -1.372 -16.436 3.093 1.00 0.00 H new ATOM 0 HA ILE B 66 -3.372 -15.431 4.911 1.00 0.00 H new ATOM 0 HB ILE B 66 -0.937 -14.436 6.012 1.00 0.00 H new ATOM 0 HG12 ILE B 66 0.016 -16.575 6.933 1.00 0.00 H new ATOM 0 HG13 ILE B 66 -0.987 -17.464 5.804 1.00 0.00 H new ATOM 0 HG21 ILE B 66 -1.774 -15.459 8.087 1.00 0.00 H new ATOM 0 HG22 ILE B 66 -3.060 -14.611 7.196 1.00 0.00 H new ATOM 0 HG23 ILE B 66 -2.963 -16.387 7.143 1.00 0.00 H new ATOM 0 HD11 ILE B 66 1.279 -17.181 4.930 1.00 0.00 H new ATOM 0 HD12 ILE B 66 0.102 -16.315 3.914 1.00 0.00 H new ATOM 0 HD13 ILE B 66 1.120 -15.413 5.061 1.00 0.00 H new ATOM 2766 N MET B 67 -3.048 -13.253 3.781 1.00 0.00 N ATOM 2767 CA MET B 67 -2.891 -11.983 3.097 1.00 0.00 C ATOM 2768 C MET B 67 -1.987 -11.075 3.915 1.00 0.00 C ATOM 2769 O MET B 67 -2.348 -10.637 5.006 1.00 0.00 O ATOM 2770 CB MET B 67 -4.250 -11.326 2.868 1.00 0.00 C ATOM 2771 CG MET B 67 -5.266 -12.255 2.237 1.00 0.00 C ATOM 2772 SD MET B 67 -6.880 -11.485 2.049 1.00 0.00 S ATOM 2773 CE MET B 67 -6.625 -10.597 0.518 1.00 0.00 C ATOM 0 H MET B 67 -3.982 -13.424 4.153 1.00 0.00 H new ATOM 0 HA MET B 67 -2.434 -12.156 2.123 1.00 0.00 H new ATOM 0 HB2 MET B 67 -4.638 -10.968 3.822 1.00 0.00 H new ATOM 0 HB3 MET B 67 -4.120 -10.453 2.229 1.00 0.00 H new ATOM 0 HG2 MET B 67 -4.904 -12.575 1.260 1.00 0.00 H new ATOM 0 HG3 MET B 67 -5.364 -13.151 2.850 1.00 0.00 H new ATOM 0 HE1 MET B 67 -7.021 -9.586 0.613 1.00 0.00 H new ATOM 0 HE2 MET B 67 -5.558 -10.549 0.298 1.00 0.00 H new ATOM 0 HE3 MET B 67 -7.140 -11.114 -0.292 1.00 0.00 H new ATOM 2783 N LEU B 68 -0.800 -10.818 3.388 1.00 0.00 N ATOM 2784 CA LEU B 68 0.178 -9.985 4.077 1.00 0.00 C ATOM 2785 C LEU B 68 -0.090 -8.493 3.857 1.00 0.00 C ATOM 2786 O LEU B 68 0.594 -7.842 3.067 1.00 0.00 O ATOM 2787 CB LEU B 68 1.600 -10.349 3.613 1.00 0.00 C ATOM 2788 CG LEU B 68 2.628 -10.545 4.729 1.00 0.00 C ATOM 2789 CD1 LEU B 68 2.085 -11.476 5.803 1.00 0.00 C ATOM 2790 CD2 LEU B 68 3.927 -11.095 4.157 1.00 0.00 C ATOM 0 H LEU B 68 -0.489 -11.174 2.484 1.00 0.00 H new ATOM 0 HA LEU B 68 0.087 -10.179 5.146 1.00 0.00 H new ATOM 0 HB2 LEU B 68 1.548 -11.266 3.026 1.00 0.00 H new ATOM 0 HB3 LEU B 68 1.958 -9.564 2.947 1.00 0.00 H new ATOM 0 HG LEU B 68 2.829 -9.576 5.187 1.00 0.00 H new ATOM 0 HD11 LEU B 68 2.832 -11.602 6.587 1.00 0.00 H new ATOM 0 HD12 LEU B 68 1.178 -11.048 6.231 1.00 0.00 H new ATOM 0 HD13 LEU B 68 1.855 -12.446 5.362 1.00 0.00 H new ATOM 0 HD21 LEU B 68 4.650 -11.230 4.961 1.00 0.00 H new ATOM 0 HD22 LEU B 68 3.736 -12.054 3.676 1.00 0.00 H new ATOM 0 HD23 LEU B 68 4.327 -10.395 3.423 1.00 0.00 H new ATOM 2802 N THR B 69 -1.075 -7.948 4.576 1.00 0.00 N ATOM 2803 CA THR B 69 -1.399 -6.525 4.462 1.00 0.00 C ATOM 2804 C THR B 69 -0.419 -5.686 5.280 1.00 0.00 C ATOM 2805 O THR B 69 -0.411 -4.459 5.187 1.00 0.00 O ATOM 2806 CB THR B 69 -2.840 -6.241 4.917 1.00 0.00 C ATOM 2807 OG1 THR B 69 -3.539 -7.447 5.170 1.00 0.00 O ATOM 2808 CG2 THR B 69 -3.645 -5.437 3.904 1.00 0.00 C ATOM 0 H THR B 69 -1.656 -8.465 5.236 1.00 0.00 H new ATOM 0 HA THR B 69 -1.313 -6.250 3.411 1.00 0.00 H new ATOM 0 HB THR B 69 -2.741 -5.650 5.827 1.00 0.00 H new ATOM 0 HG1 THR B 69 -4.452 -7.241 5.460 1.00 0.00 H new ATOM 0 HG21 THR B 69 -4.652 -5.272 4.288 1.00 0.00 H new ATOM 0 HG22 THR B 69 -3.160 -4.476 3.734 1.00 0.00 H new ATOM 0 HG23 THR B 69 -3.700 -5.987 2.964 1.00 0.00 H new ATOM 2816 N GLN B 70 0.416 -6.358 6.074 1.00 0.00 N ATOM 2817 CA GLN B 70 1.408 -5.674 6.895 1.00 0.00 C ATOM 2818 C GLN B 70 2.339 -4.831 6.028 1.00 0.00 C ATOM 2819 O GLN B 70 3.001 -3.917 6.520 1.00 0.00 O ATOM 2820 CB GLN B 70 2.221 -6.689 7.701 1.00 0.00 C ATOM 2821 CG GLN B 70 1.588 -7.054 9.034 1.00 0.00 C ATOM 2822 CD GLN B 70 2.581 -7.667 10.002 1.00 0.00 C ATOM 2823 OE1 GLN B 70 2.896 -8.854 9.918 1.00 0.00 O ATOM 2824 NE2 GLN B 70 3.079 -6.857 10.930 1.00 0.00 N ATOM 0 H GLN B 70 0.423 -7.374 6.164 1.00 0.00 H new ATOM 0 HA GLN B 70 0.882 -5.013 7.584 1.00 0.00 H new ATOM 0 HB2 GLN B 70 2.347 -7.595 7.108 1.00 0.00 H new ATOM 0 HB3 GLN B 70 3.217 -6.284 7.880 1.00 0.00 H new ATOM 0 HG2 GLN B 70 1.153 -6.161 9.482 1.00 0.00 H new ATOM 0 HG3 GLN B 70 0.771 -7.755 8.864 1.00 0.00 H new ATOM 0 HE21 GLN B 70 2.789 -5.879 10.962 1.00 0.00 H new ATOM 0 HE22 GLN B 70 3.751 -7.213 11.610 1.00 0.00 H new ATOM 2833 N GLN B 71 2.374 -5.133 4.732 1.00 0.00 N ATOM 2834 CA GLN B 71 3.206 -4.394 3.797 1.00 0.00 C ATOM 2835 C GLN B 71 2.316 -3.656 2.812 1.00 0.00 C ATOM 2836 O GLN B 71 2.481 -2.459 2.585 1.00 0.00 O ATOM 2837 CB GLN B 71 4.151 -5.339 3.052 1.00 0.00 C ATOM 2838 CG GLN B 71 5.057 -6.142 3.971 1.00 0.00 C ATOM 2839 CD GLN B 71 6.333 -6.590 3.286 1.00 0.00 C ATOM 2840 OE1 GLN B 71 6.467 -7.749 2.893 1.00 0.00 O ATOM 2841 NE2 GLN B 71 7.280 -5.671 3.138 1.00 0.00 N ATOM 0 H GLN B 71 1.833 -5.887 4.309 1.00 0.00 H new ATOM 0 HA GLN B 71 3.813 -3.676 4.349 1.00 0.00 H new ATOM 0 HB2 GLN B 71 3.561 -6.026 2.446 1.00 0.00 H new ATOM 0 HB3 GLN B 71 4.767 -4.757 2.366 1.00 0.00 H new ATOM 0 HG2 GLN B 71 5.310 -5.539 4.843 1.00 0.00 H new ATOM 0 HG3 GLN B 71 4.517 -7.017 4.334 1.00 0.00 H new ATOM 0 HE21 GLN B 71 7.127 -4.722 3.479 1.00 0.00 H new ATOM 0 HE22 GLN B 71 8.160 -5.914 2.684 1.00 0.00 H new ATOM 2850 N MET B 72 1.352 -4.386 2.255 1.00 0.00 N ATOM 2851 CA MET B 72 0.392 -3.823 1.311 1.00 0.00 C ATOM 2852 C MET B 72 1.079 -2.963 0.247 1.00 0.00 C ATOM 2853 O MET B 72 1.599 -1.887 0.537 1.00 0.00 O ATOM 2854 CB MET B 72 -0.650 -3.012 2.078 1.00 0.00 C ATOM 2855 CG MET B 72 -1.981 -2.900 1.355 1.00 0.00 C ATOM 2856 SD MET B 72 -2.916 -1.436 1.841 1.00 0.00 S ATOM 2857 CE MET B 72 -2.681 -1.458 3.617 1.00 0.00 C ATOM 0 H MET B 72 1.215 -5.379 2.445 1.00 0.00 H new ATOM 0 HA MET B 72 -0.099 -4.642 0.785 1.00 0.00 H new ATOM 0 HB2 MET B 72 -0.812 -3.472 3.053 1.00 0.00 H new ATOM 0 HB3 MET B 72 -0.259 -2.011 2.260 1.00 0.00 H new ATOM 0 HG2 MET B 72 -1.805 -2.873 0.280 1.00 0.00 H new ATOM 0 HG3 MET B 72 -2.576 -3.790 1.558 1.00 0.00 H new ATOM 0 HE1 MET B 72 -3.612 -1.180 4.111 1.00 0.00 H new ATOM 0 HE2 MET B 72 -2.388 -2.459 3.933 1.00 0.00 H new ATOM 0 HE3 MET B 72 -1.900 -0.749 3.889 1.00 0.00 H new ATOM 2867 N THR B 73 1.082 -3.457 -0.989 1.00 0.00 N ATOM 2868 CA THR B 73 1.717 -2.748 -2.098 1.00 0.00 C ATOM 2869 C THR B 73 0.859 -2.809 -3.363 1.00 0.00 C ATOM 2870 O THR B 73 0.411 -3.878 -3.761 1.00 0.00 O ATOM 2871 CB THR B 73 3.094 -3.359 -2.373 1.00 0.00 C ATOM 2872 OG1 THR B 73 3.574 -2.963 -3.646 1.00 0.00 O ATOM 2873 CG2 THR B 73 3.099 -4.877 -2.329 1.00 0.00 C ATOM 0 H THR B 73 0.652 -4.345 -1.248 1.00 0.00 H new ATOM 0 HA THR B 73 1.826 -1.700 -1.817 1.00 0.00 H new ATOM 0 HB THR B 73 3.738 -2.988 -1.576 1.00 0.00 H new ATOM 0 HG1 THR B 73 4.455 -3.362 -3.802 1.00 0.00 H new ATOM 0 HG21 THR B 73 4.105 -5.244 -2.532 1.00 0.00 H new ATOM 0 HG22 THR B 73 2.783 -5.213 -1.342 1.00 0.00 H new ATOM 0 HG23 THR B 73 2.413 -5.265 -3.081 1.00 0.00 H new ATOM 2881 N SER B 74 0.637 -1.659 -3.997 1.00 0.00 N ATOM 2882 CA SER B 74 -0.168 -1.611 -5.217 1.00 0.00 C ATOM 2883 C SER B 74 0.568 -2.245 -6.389 1.00 0.00 C ATOM 2884 O SER B 74 1.597 -1.744 -6.843 1.00 0.00 O ATOM 2885 CB SER B 74 -0.554 -0.172 -5.562 1.00 0.00 C ATOM 2886 OG SER B 74 -1.369 0.393 -4.549 1.00 0.00 O ATOM 0 H SER B 74 0.999 -0.756 -3.690 1.00 0.00 H new ATOM 0 HA SER B 74 -1.077 -2.183 -5.029 1.00 0.00 H new ATOM 0 HB2 SER B 74 0.346 0.430 -5.687 1.00 0.00 H new ATOM 0 HB3 SER B 74 -1.085 -0.153 -6.514 1.00 0.00 H new ATOM 0 HG SER B 74 -0.881 1.116 -4.102 1.00 0.00 H new ATOM 2892 N VAL B 75 0.017 -3.348 -6.877 1.00 0.00 N ATOM 2893 CA VAL B 75 0.591 -4.066 -8.004 1.00 0.00 C ATOM 2894 C VAL B 75 -0.081 -3.625 -9.304 1.00 0.00 C ATOM 2895 O VAL B 75 -1.303 -3.701 -9.431 1.00 0.00 O ATOM 2896 CB VAL B 75 0.429 -5.589 -7.828 1.00 0.00 C ATOM 2897 CG1 VAL B 75 1.143 -6.066 -6.575 1.00 0.00 C ATOM 2898 CG2 VAL B 75 -1.039 -5.972 -7.808 1.00 0.00 C ATOM 0 H VAL B 75 -0.835 -3.767 -6.505 1.00 0.00 H new ATOM 0 HA VAL B 75 1.655 -3.833 -8.048 1.00 0.00 H new ATOM 0 HB VAL B 75 0.891 -6.086 -8.681 1.00 0.00 H new ATOM 0 HG11 VAL B 75 1.015 -7.143 -6.471 1.00 0.00 H new ATOM 0 HG12 VAL B 75 2.205 -5.832 -6.650 1.00 0.00 H new ATOM 0 HG13 VAL B 75 0.722 -5.565 -5.703 1.00 0.00 H new ATOM 0 HG21 VAL B 75 -1.132 -7.051 -7.683 1.00 0.00 H new ATOM 0 HG22 VAL B 75 -1.536 -5.467 -6.980 1.00 0.00 H new ATOM 0 HG23 VAL B 75 -1.506 -5.674 -8.747 1.00 0.00 H new ATOM 2908 N PRO B 76 0.697 -3.137 -10.285 1.00 0.00 N ATOM 2909 CA PRO B 76 0.141 -2.673 -11.557 1.00 0.00 C ATOM 2910 C PRO B 76 -0.689 -3.742 -12.258 1.00 0.00 C ATOM 2911 O PRO B 76 -0.366 -4.929 -12.213 1.00 0.00 O ATOM 2912 CB PRO B 76 1.373 -2.312 -12.391 1.00 0.00 C ATOM 2913 CG PRO B 76 2.463 -2.087 -11.398 1.00 0.00 C ATOM 2914 CD PRO B 76 2.161 -2.985 -10.229 1.00 0.00 C ATOM 0 HA PRO B 76 -0.543 -1.837 -11.412 1.00 0.00 H new ATOM 0 HB2 PRO B 76 1.630 -3.114 -13.083 1.00 0.00 H new ATOM 0 HB3 PRO B 76 1.195 -1.419 -12.990 1.00 0.00 H new ATOM 0 HG2 PRO B 76 3.436 -2.323 -11.829 1.00 0.00 H new ATOM 0 HG3 PRO B 76 2.497 -1.043 -11.088 1.00 0.00 H new ATOM 0 HD2 PRO B 76 2.668 -3.946 -10.318 1.00 0.00 H new ATOM 0 HD3 PRO B 76 2.483 -2.541 -9.287 1.00 0.00 H new ATOM 2922 N VAL B 77 -1.766 -3.303 -12.902 1.00 0.00 N ATOM 2923 CA VAL B 77 -2.665 -4.205 -13.619 1.00 0.00 C ATOM 2924 C VAL B 77 -1.896 -5.164 -14.524 1.00 0.00 C ATOM 2925 O VAL B 77 -2.189 -6.358 -14.573 1.00 0.00 O ATOM 2926 CB VAL B 77 -3.678 -3.418 -14.474 1.00 0.00 C ATOM 2927 CG1 VAL B 77 -2.954 -2.553 -15.495 1.00 0.00 C ATOM 2928 CG2 VAL B 77 -4.652 -4.364 -15.161 1.00 0.00 C ATOM 0 H VAL B 77 -2.040 -2.321 -12.943 1.00 0.00 H new ATOM 0 HA VAL B 77 -3.197 -4.781 -12.862 1.00 0.00 H new ATOM 0 HB VAL B 77 -4.250 -2.764 -13.815 1.00 0.00 H new ATOM 0 HG11 VAL B 77 -3.684 -2.004 -16.090 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -2.303 -1.848 -14.978 1.00 0.00 H new ATOM 0 HG13 VAL B 77 -2.355 -3.187 -16.149 1.00 0.00 H new ATOM 0 HG21 VAL B 77 -5.358 -3.788 -15.759 1.00 0.00 H new ATOM 0 HG22 VAL B 77 -4.101 -5.047 -15.808 1.00 0.00 H new ATOM 0 HG23 VAL B 77 -5.196 -4.936 -14.409 1.00 0.00 H new ATOM 2938 N LYS B 78 -0.915 -4.633 -15.241 1.00 0.00 N ATOM 2939 CA LYS B 78 -0.106 -5.448 -16.149 1.00 0.00 C ATOM 2940 C LYS B 78 0.515 -6.613 -15.409 1.00 0.00 C ATOM 2941 O LYS B 78 0.326 -7.780 -15.752 1.00 0.00 O ATOM 2942 CB LYS B 78 1.036 -4.653 -16.781 1.00 0.00 C ATOM 2943 CG LYS B 78 1.330 -3.349 -16.083 1.00 0.00 C ATOM 2944 CD LYS B 78 0.360 -2.274 -16.535 1.00 0.00 C ATOM 2945 CE LYS B 78 0.973 -1.378 -17.599 1.00 0.00 C ATOM 2946 NZ LYS B 78 -0.067 -0.721 -18.438 1.00 0.00 N ATOM 0 H LYS B 78 -0.658 -3.646 -15.215 1.00 0.00 H new ATOM 0 HA LYS B 78 -0.785 -5.793 -16.929 1.00 0.00 H new ATOM 0 HB2 LYS B 78 1.937 -5.266 -16.780 1.00 0.00 H new ATOM 0 HB3 LYS B 78 0.791 -4.449 -17.823 1.00 0.00 H new ATOM 0 HG2 LYS B 78 1.257 -3.483 -15.004 1.00 0.00 H new ATOM 0 HG3 LYS B 78 2.352 -3.038 -16.297 1.00 0.00 H new ATOM 0 HD2 LYS B 78 -0.544 -2.740 -16.928 1.00 0.00 H new ATOM 0 HD3 LYS B 78 0.060 -1.670 -15.678 1.00 0.00 H new ATOM 0 HE2 LYS B 78 1.589 -0.616 -17.121 1.00 0.00 H new ATOM 0 HE3 LYS B 78 1.633 -1.968 -18.235 1.00 0.00 H new ATOM 0 HZ1 LYS B 78 0.392 -0.119 -19.151 1.00 0.00 H new ATOM 0 HZ2 LYS B 78 -0.639 -1.448 -18.914 1.00 0.00 H new ATOM 0 HZ3 LYS B 78 -0.681 -0.137 -17.835 1.00 0.00 H new ATOM 2960 N ILE B 79 1.294 -6.252 -14.405 1.00 0.00 N ATOM 2961 CA ILE B 79 2.016 -7.200 -13.592 1.00 0.00 C ATOM 2962 C ILE B 79 1.173 -7.734 -12.412 1.00 0.00 C ATOM 2963 O ILE B 79 1.708 -8.171 -11.401 1.00 0.00 O ATOM 2964 CB ILE B 79 3.362 -6.599 -13.140 1.00 0.00 C ATOM 2965 CG1 ILE B 79 4.135 -7.601 -12.266 1.00 0.00 C ATOM 2966 CG2 ILE B 79 3.132 -5.265 -12.442 1.00 0.00 C ATOM 2967 CD1 ILE B 79 4.485 -7.054 -10.909 1.00 0.00 C ATOM 0 H ILE B 79 1.441 -5.280 -14.132 1.00 0.00 H new ATOM 0 HA ILE B 79 2.232 -8.074 -14.207 1.00 0.00 H new ATOM 0 HB ILE B 79 3.983 -6.402 -14.014 1.00 0.00 H new ATOM 0 HG12 ILE B 79 3.537 -8.504 -12.144 1.00 0.00 H new ATOM 0 HG13 ILE B 79 5.051 -7.892 -12.781 1.00 0.00 H new ATOM 0 HG21 ILE B 79 4.089 -4.849 -12.127 1.00 0.00 H new ATOM 0 HG22 ILE B 79 2.645 -4.574 -13.130 1.00 0.00 H new ATOM 0 HG23 ILE B 79 2.497 -5.416 -11.569 1.00 0.00 H new ATOM 0 HD11 ILE B 79 5.029 -7.809 -10.342 1.00 0.00 H new ATOM 0 HD12 ILE B 79 5.108 -6.167 -11.024 1.00 0.00 H new ATOM 0 HD13 ILE B 79 3.571 -6.789 -10.377 1.00 0.00 H new ATOM 2979 N LEU B 80 -0.160 -7.723 -12.558 1.00 0.00 N ATOM 2980 CA LEU B 80 -1.055 -8.261 -11.517 1.00 0.00 C ATOM 2981 C LEU B 80 -0.656 -9.684 -11.201 1.00 0.00 C ATOM 2982 O LEU B 80 -0.364 -10.473 -12.099 1.00 0.00 O ATOM 2983 CB LEU B 80 -2.515 -8.216 -11.977 1.00 0.00 C ATOM 2984 CG LEU B 80 -3.524 -7.801 -10.901 1.00 0.00 C ATOM 2985 CD1 LEU B 80 -3.132 -8.367 -9.542 1.00 0.00 C ATOM 2986 CD2 LEU B 80 -3.637 -6.285 -10.837 1.00 0.00 C ATOM 0 H LEU B 80 -0.641 -7.352 -13.377 1.00 0.00 H new ATOM 0 HA LEU B 80 -0.962 -7.646 -10.622 1.00 0.00 H new ATOM 0 HB2 LEU B 80 -2.595 -7.523 -12.814 1.00 0.00 H new ATOM 0 HB3 LEU B 80 -2.792 -9.201 -12.352 1.00 0.00 H new ATOM 0 HG LEU B 80 -4.498 -8.211 -11.169 1.00 0.00 H new ATOM 0 HD11 LEU B 80 -3.863 -8.059 -8.795 1.00 0.00 H new ATOM 0 HD12 LEU B 80 -3.104 -9.455 -9.595 1.00 0.00 H new ATOM 0 HD13 LEU B 80 -2.147 -7.992 -9.262 1.00 0.00 H new ATOM 0 HD21 LEU B 80 -4.357 -6.006 -10.068 1.00 0.00 H new ATOM 0 HD22 LEU B 80 -2.664 -5.858 -10.595 1.00 0.00 H new ATOM 0 HD23 LEU B 80 -3.971 -5.904 -11.802 1.00 0.00 H new ATOM 2998 N SER B 81 -0.617 -9.996 -9.916 1.00 0.00 N ATOM 2999 CA SER B 81 -0.221 -11.317 -9.467 1.00 0.00 C ATOM 3000 C SER B 81 -0.823 -12.414 -10.340 1.00 0.00 C ATOM 3001 O SER B 81 -2.014 -12.399 -10.647 1.00 0.00 O ATOM 3002 CB SER B 81 -0.593 -11.521 -8.004 1.00 0.00 C ATOM 3003 OG SER B 81 -1.271 -10.392 -7.487 1.00 0.00 O ATOM 0 H SER B 81 -0.856 -9.349 -9.165 1.00 0.00 H new ATOM 0 HA SER B 81 0.863 -11.386 -9.561 1.00 0.00 H new ATOM 0 HB2 SER B 81 -1.224 -12.404 -7.906 1.00 0.00 H new ATOM 0 HB3 SER B 81 0.308 -11.707 -7.419 1.00 0.00 H new ATOM 0 HG SER B 81 -1.061 -10.292 -6.535 1.00 0.00 H new ATOM 3009 N GLU B 82 0.018 -13.362 -10.741 1.00 0.00 N ATOM 3010 CA GLU B 82 -0.417 -14.467 -11.584 1.00 0.00 C ATOM 3011 C GLU B 82 -1.607 -15.175 -10.944 1.00 0.00 C ATOM 3012 O GLU B 82 -1.452 -15.869 -9.944 1.00 0.00 O ATOM 3013 CB GLU B 82 0.734 -15.454 -11.808 1.00 0.00 C ATOM 3014 CG GLU B 82 0.594 -16.267 -13.085 1.00 0.00 C ATOM 3015 CD GLU B 82 1.881 -16.325 -13.884 1.00 0.00 C ATOM 3016 OE1 GLU B 82 2.965 -16.238 -13.270 1.00 0.00 O ATOM 3017 OE2 GLU B 82 1.805 -16.459 -15.123 1.00 0.00 O ATOM 0 H GLU B 82 1.007 -13.386 -10.494 1.00 0.00 H new ATOM 0 HA GLU B 82 -0.723 -14.070 -12.552 1.00 0.00 H new ATOM 0 HB2 GLU B 82 1.674 -14.903 -11.838 1.00 0.00 H new ATOM 0 HB3 GLU B 82 0.790 -16.134 -10.958 1.00 0.00 H new ATOM 0 HG2 GLU B 82 0.281 -17.280 -12.834 1.00 0.00 H new ATOM 0 HG3 GLU B 82 -0.193 -15.834 -13.702 1.00 0.00 H new ATOM 3024 N PRO B 83 -2.818 -14.986 -11.498 1.00 0.00 N ATOM 3025 CA PRO B 83 -4.039 -15.592 -10.956 1.00 0.00 C ATOM 3026 C PRO B 83 -3.932 -17.099 -10.748 1.00 0.00 C ATOM 3027 O PRO B 83 -4.455 -17.881 -11.543 1.00 0.00 O ATOM 3028 CB PRO B 83 -5.094 -15.276 -12.018 1.00 0.00 C ATOM 3029 CG PRO B 83 -4.602 -14.036 -12.674 1.00 0.00 C ATOM 3030 CD PRO B 83 -3.102 -14.147 -12.681 1.00 0.00 C ATOM 0 HA PRO B 83 -4.267 -15.198 -9.965 1.00 0.00 H new ATOM 0 HB2 PRO B 83 -5.193 -16.092 -12.734 1.00 0.00 H new ATOM 0 HB3 PRO B 83 -6.076 -15.125 -11.569 1.00 0.00 H new ATOM 0 HG2 PRO B 83 -4.993 -13.948 -13.688 1.00 0.00 H new ATOM 0 HG3 PRO B 83 -4.926 -13.150 -12.129 1.00 0.00 H new ATOM 0 HD2 PRO B 83 -2.737 -14.609 -13.599 1.00 0.00 H new ATOM 0 HD3 PRO B 83 -2.626 -13.169 -12.605 1.00 0.00 H new ATOM 3038 N VAL B 84 -3.285 -17.506 -9.657 1.00 0.00 N ATOM 3039 CA VAL B 84 -3.157 -18.922 -9.338 1.00 0.00 C ATOM 3040 C VAL B 84 -4.555 -19.542 -9.272 1.00 0.00 C ATOM 3041 O VAL B 84 -4.790 -20.661 -9.727 1.00 0.00 O ATOM 3042 CB VAL B 84 -2.478 -19.136 -7.972 1.00 0.00 C ATOM 3043 CG1 VAL B 84 -3.200 -18.338 -6.893 1.00 0.00 C ATOM 3044 CG2 VAL B 84 -2.437 -20.617 -7.613 1.00 0.00 C ATOM 0 H VAL B 84 -2.845 -16.878 -8.985 1.00 0.00 H new ATOM 0 HA VAL B 84 -2.547 -19.388 -10.112 1.00 0.00 H new ATOM 0 HB VAL B 84 -1.450 -18.778 -8.038 1.00 0.00 H new ATOM 0 HG11 VAL B 84 -2.710 -18.498 -5.933 1.00 0.00 H new ATOM 0 HG12 VAL B 84 -3.170 -17.278 -7.143 1.00 0.00 H new ATOM 0 HG13 VAL B 84 -4.237 -18.667 -6.830 1.00 0.00 H new ATOM 0 HG21 VAL B 84 -1.953 -20.743 -6.645 1.00 0.00 H new ATOM 0 HG22 VAL B 84 -3.453 -21.008 -7.565 1.00 0.00 H new ATOM 0 HG23 VAL B 84 -1.875 -21.160 -8.373 1.00 0.00 H new ATOM 3054 N ASN B 85 -5.470 -18.771 -8.678 1.00 0.00 N ATOM 3055 CA ASN B 85 -6.863 -19.170 -8.500 1.00 0.00 C ATOM 3056 C ASN B 85 -7.734 -17.927 -8.292 1.00 0.00 C ATOM 3057 O ASN B 85 -7.416 -16.852 -8.802 1.00 0.00 O ATOM 3058 CB ASN B 85 -6.986 -20.121 -7.305 1.00 0.00 C ATOM 3059 CG ASN B 85 -8.020 -21.206 -7.534 1.00 0.00 C ATOM 3060 OD1 ASN B 85 -8.959 -21.359 -6.754 1.00 0.00 O ATOM 3061 ND2 ASN B 85 -7.851 -21.967 -8.609 1.00 0.00 N ATOM 0 H ASN B 85 -5.260 -17.845 -8.305 1.00 0.00 H new ATOM 0 HA ASN B 85 -7.207 -19.692 -9.393 1.00 0.00 H new ATOM 0 HB2 ASN B 85 -6.018 -20.581 -7.109 1.00 0.00 H new ATOM 0 HB3 ASN B 85 -7.253 -19.550 -6.416 1.00 0.00 H new ATOM 0 HD21 ASN B 85 -8.515 -22.714 -8.815 1.00 0.00 H new ATOM 0 HD22 ASN B 85 -7.058 -21.805 -9.229 1.00 0.00 H new ATOM 3068 N GLU B 86 -8.825 -18.068 -7.543 1.00 0.00 N ATOM 3069 CA GLU B 86 -9.718 -16.947 -7.277 1.00 0.00 C ATOM 3070 C GLU B 86 -10.431 -17.147 -5.949 1.00 0.00 C ATOM 3071 O GLU B 86 -11.073 -18.177 -5.737 1.00 0.00 O ATOM 3072 CB GLU B 86 -10.741 -16.800 -8.405 1.00 0.00 C ATOM 3073 CG GLU B 86 -10.135 -16.912 -9.795 1.00 0.00 C ATOM 3074 CD GLU B 86 -11.138 -16.621 -10.893 1.00 0.00 C ATOM 3075 OE1 GLU B 86 -11.867 -15.613 -10.780 1.00 0.00 O ATOM 3076 OE2 GLU B 86 -11.195 -17.400 -11.867 1.00 0.00 O ATOM 0 H GLU B 86 -9.110 -18.947 -7.111 1.00 0.00 H new ATOM 0 HA GLU B 86 -9.123 -16.035 -7.224 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -11.509 -17.565 -8.290 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -11.237 -15.834 -8.311 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -9.298 -16.219 -9.879 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -9.733 -17.916 -9.932 1.00 0.00 H new ATOM 3083 N LEU B 87 -10.317 -16.174 -5.045 1.00 0.00 N ATOM 3084 CA LEU B 87 -10.967 -16.303 -3.744 1.00 0.00 C ATOM 3085 C LEU B 87 -11.950 -15.179 -3.437 1.00 0.00 C ATOM 3086 O LEU B 87 -11.736 -14.347 -2.555 1.00 0.00 O ATOM 3087 CB LEU B 87 -9.960 -16.459 -2.619 1.00 0.00 C ATOM 3088 CG LEU B 87 -9.214 -15.210 -2.150 1.00 0.00 C ATOM 3089 CD1 LEU B 87 -7.906 -15.630 -1.488 1.00 0.00 C ATOM 3090 CD2 LEU B 87 -8.967 -14.247 -3.309 1.00 0.00 C ATOM 0 H LEU B 87 -9.794 -15.309 -5.184 1.00 0.00 H new ATOM 0 HA LEU B 87 -11.555 -17.219 -3.809 1.00 0.00 H new ATOM 0 HB2 LEU B 87 -10.481 -16.880 -1.759 1.00 0.00 H new ATOM 0 HB3 LEU B 87 -9.218 -17.194 -2.933 1.00 0.00 H new ATOM 0 HG LEU B 87 -9.826 -14.678 -1.422 1.00 0.00 H new ATOM 0 HD11 LEU B 87 -7.368 -14.744 -1.151 1.00 0.00 H new ATOM 0 HD12 LEU B 87 -8.120 -16.272 -0.633 1.00 0.00 H new ATOM 0 HD13 LEU B 87 -7.293 -16.175 -2.206 1.00 0.00 H new ATOM 0 HD21 LEU B 87 -8.435 -13.368 -2.945 1.00 0.00 H new ATOM 0 HD22 LEU B 87 -8.368 -14.743 -4.073 1.00 0.00 H new ATOM 0 HD23 LEU B 87 -9.921 -13.941 -3.738 1.00 0.00 H new ATOM 3102 N SER B 88 -13.045 -15.215 -4.162 1.00 0.00 N ATOM 3103 CA SER B 88 -14.148 -14.261 -4.006 1.00 0.00 C ATOM 3104 C SER B 88 -14.888 -14.510 -2.717 1.00 0.00 C ATOM 3105 O SER B 88 -15.241 -13.571 -2.019 1.00 0.00 O ATOM 3106 CB SER B 88 -15.117 -14.341 -5.180 1.00 0.00 C ATOM 3107 OG SER B 88 -14.996 -15.576 -5.863 1.00 0.00 O ATOM 0 H SER B 88 -13.208 -15.912 -4.889 1.00 0.00 H new ATOM 0 HA SER B 88 -13.716 -13.260 -3.982 1.00 0.00 H new ATOM 0 HB2 SER B 88 -16.139 -14.221 -4.820 1.00 0.00 H new ATOM 0 HB3 SER B 88 -14.924 -13.520 -5.871 1.00 0.00 H new ATOM 0 HG SER B 88 -15.630 -15.600 -6.610 1.00 0.00 H new ATOM 3113 N THR B 89 -15.110 -15.774 -2.382 1.00 0.00 N ATOM 3114 CA THR B 89 -15.789 -16.093 -1.138 1.00 0.00 C ATOM 3115 C THR B 89 -15.014 -15.464 0.013 1.00 0.00 C ATOM 3116 O THR B 89 -15.561 -15.182 1.079 1.00 0.00 O ATOM 3117 CB THR B 89 -15.904 -17.606 -0.949 1.00 0.00 C ATOM 3118 OG1 THR B 89 -16.869 -17.906 0.045 1.00 0.00 O ATOM 3119 CG2 THR B 89 -14.601 -18.266 -0.546 1.00 0.00 C ATOM 0 H THR B 89 -14.835 -16.580 -2.943 1.00 0.00 H new ATOM 0 HA THR B 89 -16.802 -15.692 -1.164 1.00 0.00 H new ATOM 0 HB THR B 89 -16.197 -18.001 -1.922 1.00 0.00 H new ATOM 0 HG1 THR B 89 -16.934 -18.878 0.155 1.00 0.00 H new ATOM 0 HG21 THR B 89 -14.757 -19.338 -0.430 1.00 0.00 H new ATOM 0 HG22 THR B 89 -13.850 -18.090 -1.317 1.00 0.00 H new ATOM 0 HG23 THR B 89 -14.257 -17.845 0.399 1.00 0.00 H new ATOM 3127 N PHE B 90 -13.728 -15.227 -0.243 1.00 0.00 N ATOM 3128 CA PHE B 90 -12.843 -14.605 0.725 1.00 0.00 C ATOM 3129 C PHE B 90 -12.877 -13.084 0.575 1.00 0.00 C ATOM 3130 O PHE B 90 -12.115 -12.367 1.224 1.00 0.00 O ATOM 3131 CB PHE B 90 -11.424 -15.120 0.515 1.00 0.00 C ATOM 3132 CG PHE B 90 -11.013 -16.166 1.504 1.00 0.00 C ATOM 3133 CD1 PHE B 90 -10.729 -15.824 2.814 1.00 0.00 C ATOM 3134 CD2 PHE B 90 -10.891 -17.490 1.123 1.00 0.00 C ATOM 3135 CE1 PHE B 90 -10.332 -16.781 3.719 1.00 0.00 C ATOM 3136 CE2 PHE B 90 -10.502 -18.443 2.018 1.00 0.00 C ATOM 3137 CZ PHE B 90 -10.219 -18.094 3.320 1.00 0.00 C ATOM 0 H PHE B 90 -13.277 -15.462 -1.127 1.00 0.00 H new ATOM 0 HA PHE B 90 -13.176 -14.860 1.731 1.00 0.00 H new ATOM 0 HB2 PHE B 90 -11.341 -15.531 -0.491 1.00 0.00 H new ATOM 0 HB3 PHE B 90 -10.730 -14.282 0.576 1.00 0.00 H new ATOM 0 HD1 PHE B 90 -10.820 -14.795 3.129 1.00 0.00 H new ATOM 0 HD2 PHE B 90 -11.107 -17.773 0.103 1.00 0.00 H new ATOM 0 HE1 PHE B 90 -10.110 -16.503 4.739 1.00 0.00 H new ATOM 0 HE2 PHE B 90 -10.416 -19.473 1.705 1.00 0.00 H new ATOM 0 HZ PHE B 90 -9.909 -18.849 4.027 1.00 0.00 H new ATOM 3147 N ARG B 91 -13.764 -12.604 -0.299 1.00 0.00 N ATOM 3148 CA ARG B 91 -13.914 -11.175 -0.566 1.00 0.00 C ATOM 3149 C ARG B 91 -13.844 -10.346 0.710 1.00 0.00 C ATOM 3150 O ARG B 91 -13.171 -9.317 0.744 1.00 0.00 O ATOM 3151 CB ARG B 91 -15.234 -10.905 -1.266 1.00 0.00 C ATOM 3152 CG ARG B 91 -16.343 -11.685 -0.638 1.00 0.00 C ATOM 3153 CD ARG B 91 -17.486 -11.958 -1.599 1.00 0.00 C ATOM 3154 NE ARG B 91 -18.624 -11.072 -1.366 1.00 0.00 N ATOM 3155 CZ ARG B 91 -19.511 -11.245 -0.389 1.00 0.00 C ATOM 3156 NH1 ARG B 91 -19.395 -12.269 0.448 1.00 0.00 N ATOM 3157 NH2 ARG B 91 -20.516 -10.392 -0.248 1.00 0.00 N ATOM 0 H ARG B 91 -14.396 -13.194 -0.839 1.00 0.00 H new ATOM 0 HA ARG B 91 -13.085 -10.881 -1.209 1.00 0.00 H new ATOM 0 HB2 ARG B 91 -15.463 -9.840 -1.221 1.00 0.00 H new ATOM 0 HB3 ARG B 91 -15.151 -11.169 -2.320 1.00 0.00 H new ATOM 0 HG2 ARG B 91 -15.951 -12.632 -0.268 1.00 0.00 H new ATOM 0 HG3 ARG B 91 -16.722 -11.138 0.225 1.00 0.00 H new ATOM 0 HD2 ARG B 91 -17.135 -11.834 -2.623 1.00 0.00 H new ATOM 0 HD3 ARG B 91 -17.807 -12.994 -1.495 1.00 0.00 H new ATOM 0 HE ARG B 91 -18.746 -10.274 -1.989 1.00 0.00 H new ATOM 0 HH11 ARG B 91 -18.623 -12.928 0.344 1.00 0.00 H new ATOM 0 HH12 ARG B 91 -20.078 -12.397 1.195 1.00 0.00 H new ATOM 0 HH21 ARG B 91 -20.609 -9.603 -0.888 1.00 0.00 H new ATOM 0 HH22 ARG B 91 -21.196 -10.524 0.501 1.00 0.00 H new ATOM 3171 N ASN B 92 -14.528 -10.784 1.768 1.00 0.00 N ATOM 3172 CA ASN B 92 -14.485 -10.035 3.017 1.00 0.00 C ATOM 3173 C ASN B 92 -13.047 -9.920 3.481 1.00 0.00 C ATOM 3174 O ASN B 92 -12.544 -8.825 3.689 1.00 0.00 O ATOM 3175 CB ASN B 92 -15.314 -10.680 4.119 1.00 0.00 C ATOM 3176 CG ASN B 92 -16.537 -9.859 4.475 1.00 0.00 C ATOM 3177 OD1 ASN B 92 -17.636 -10.108 3.980 1.00 0.00 O ATOM 3178 ND2 ASN B 92 -16.344 -8.870 5.341 1.00 0.00 N ATOM 0 H ASN B 92 -15.101 -11.628 1.785 1.00 0.00 H new ATOM 0 HA ASN B 92 -14.913 -9.052 2.820 1.00 0.00 H new ATOM 0 HB2 ASN B 92 -15.627 -11.674 3.800 1.00 0.00 H new ATOM 0 HB3 ASN B 92 -14.695 -10.810 5.007 1.00 0.00 H new ATOM 0 HD21 ASN B 92 -17.126 -8.279 5.622 1.00 0.00 H new ATOM 0 HD22 ASN B 92 -15.414 -8.702 5.725 1.00 0.00 H new ATOM 3185 N GLU B 93 -12.375 -11.067 3.609 1.00 0.00 N ATOM 3186 CA GLU B 93 -10.971 -11.085 4.010 1.00 0.00 C ATOM 3187 C GLU B 93 -10.260 -9.949 3.326 1.00 0.00 C ATOM 3188 O GLU B 93 -9.544 -9.157 3.940 1.00 0.00 O ATOM 3189 CB GLU B 93 -10.309 -12.379 3.558 1.00 0.00 C ATOM 3190 CG GLU B 93 -9.645 -13.155 4.681 1.00 0.00 C ATOM 3191 CD GLU B 93 -10.645 -13.735 5.662 1.00 0.00 C ATOM 3192 OE1 GLU B 93 -11.337 -14.710 5.299 1.00 0.00 O ATOM 3193 OE2 GLU B 93 -10.737 -13.215 6.793 1.00 0.00 O ATOM 0 H GLU B 93 -12.779 -11.988 3.441 1.00 0.00 H new ATOM 0 HA GLU B 93 -10.914 -10.997 5.095 1.00 0.00 H new ATOM 0 HB2 GLU B 93 -11.059 -13.013 3.085 1.00 0.00 H new ATOM 0 HB3 GLU B 93 -9.562 -12.148 2.798 1.00 0.00 H new ATOM 0 HG2 GLU B 93 -9.049 -13.962 4.256 1.00 0.00 H new ATOM 0 HG3 GLU B 93 -8.958 -12.498 5.214 1.00 0.00 H new ATOM 3200 N ILE B 94 -10.491 -9.894 2.028 1.00 0.00 N ATOM 3201 CA ILE B 94 -9.916 -8.882 1.193 1.00 0.00 C ATOM 3202 C ILE B 94 -10.391 -7.504 1.654 1.00 0.00 C ATOM 3203 O ILE B 94 -9.597 -6.578 1.816 1.00 0.00 O ATOM 3204 CB ILE B 94 -10.312 -9.119 -0.281 1.00 0.00 C ATOM 3205 CG1 ILE B 94 -9.425 -10.200 -0.891 1.00 0.00 C ATOM 3206 CG2 ILE B 94 -10.224 -7.836 -1.091 1.00 0.00 C ATOM 3207 CD1 ILE B 94 -9.526 -11.539 -0.193 1.00 0.00 C ATOM 0 H ILE B 94 -11.086 -10.557 1.531 1.00 0.00 H new ATOM 0 HA ILE B 94 -8.830 -8.929 1.271 1.00 0.00 H new ATOM 0 HB ILE B 94 -11.349 -9.454 -0.306 1.00 0.00 H new ATOM 0 HG12 ILE B 94 -9.692 -10.327 -1.940 1.00 0.00 H new ATOM 0 HG13 ILE B 94 -8.388 -9.864 -0.864 1.00 0.00 H new ATOM 0 HG21 ILE B 94 -10.509 -8.037 -2.124 1.00 0.00 H new ATOM 0 HG22 ILE B 94 -10.898 -7.091 -0.667 1.00 0.00 H new ATOM 0 HG23 ILE B 94 -9.202 -7.458 -1.064 1.00 0.00 H new ATOM 0 HD11 ILE B 94 -8.867 -12.256 -0.683 1.00 0.00 H new ATOM 0 HD12 ILE B 94 -9.230 -11.429 0.850 1.00 0.00 H new ATOM 0 HD13 ILE B 94 -10.554 -11.898 -0.242 1.00 0.00 H new ATOM 3219 N ILE B 95 -11.702 -7.391 1.867 1.00 0.00 N ATOM 3220 CA ILE B 95 -12.312 -6.144 2.312 1.00 0.00 C ATOM 3221 C ILE B 95 -11.989 -5.851 3.775 1.00 0.00 C ATOM 3222 O ILE B 95 -11.333 -4.853 4.074 1.00 0.00 O ATOM 3223 CB ILE B 95 -13.843 -6.168 2.132 1.00 0.00 C ATOM 3224 CG1 ILE B 95 -14.209 -6.589 0.708 1.00 0.00 C ATOM 3225 CG2 ILE B 95 -14.439 -4.804 2.453 1.00 0.00 C ATOM 3226 CD1 ILE B 95 -15.447 -7.456 0.635 1.00 0.00 C ATOM 0 H ILE B 95 -12.364 -8.156 1.736 1.00 0.00 H new ATOM 0 HA ILE B 95 -11.890 -5.355 1.689 1.00 0.00 H new ATOM 0 HB ILE B 95 -14.259 -6.899 2.825 1.00 0.00 H new ATOM 0 HG12 ILE B 95 -14.364 -5.696 0.102 1.00 0.00 H new ATOM 0 HG13 ILE B 95 -13.370 -7.130 0.270 1.00 0.00 H new ATOM 0 HG21 ILE B 95 -15.520 -4.839 2.321 1.00 0.00 H new ATOM 0 HG22 ILE B 95 -14.208 -4.540 3.485 1.00 0.00 H new ATOM 0 HG23 ILE B 95 -14.016 -4.055 1.783 1.00 0.00 H new ATOM 0 HD11 ILE B 95 -15.648 -7.717 -0.404 1.00 0.00 H new ATOM 0 HD12 ILE B 95 -15.289 -8.366 1.214 1.00 0.00 H new ATOM 0 HD13 ILE B 95 -16.298 -6.910 1.043 1.00 0.00 H new ATOM 3238 N ALA B 96 -12.448 -6.716 4.691 1.00 0.00 N ATOM 3239 CA ALA B 96 -12.188 -6.516 6.116 1.00 0.00 C ATOM 3240 C ALA B 96 -10.747 -6.066 6.348 1.00 0.00 C ATOM 3241 O ALA B 96 -10.475 -5.267 7.237 1.00 0.00 O ATOM 3242 CB ALA B 96 -12.500 -7.783 6.898 1.00 0.00 C ATOM 0 H ALA B 96 -12.994 -7.549 4.471 1.00 0.00 H new ATOM 0 HA ALA B 96 -12.845 -5.725 6.478 1.00 0.00 H new ATOM 0 HB1 ALA B 96 -12.301 -7.616 7.956 1.00 0.00 H new ATOM 0 HB2 ALA B 96 -13.550 -8.045 6.763 1.00 0.00 H new ATOM 0 HB3 ALA B 96 -11.874 -8.598 6.535 1.00 0.00 H new ATOM 3248 N ALA B 97 -9.834 -6.545 5.507 1.00 0.00 N ATOM 3249 CA ALA B 97 -8.430 -6.144 5.586 1.00 0.00 C ATOM 3250 C ALA B 97 -8.348 -4.633 5.549 1.00 0.00 C ATOM 3251 O ALA B 97 -8.112 -3.972 6.556 1.00 0.00 O ATOM 3252 CB ALA B 97 -7.670 -6.722 4.405 1.00 0.00 C ATOM 0 H ALA B 97 -10.040 -7.211 4.763 1.00 0.00 H new ATOM 0 HA ALA B 97 -7.991 -6.515 6.512 1.00 0.00 H new ATOM 0 HB1 ALA B 97 -6.624 -6.423 4.464 1.00 0.00 H new ATOM 0 HB2 ALA B 97 -7.738 -7.810 4.426 1.00 0.00 H new ATOM 0 HB3 ALA B 97 -8.102 -6.349 3.476 1.00 0.00 H new ATOM 3258 N ILE B 98 -8.594 -4.106 4.369 1.00 0.00 N ATOM 3259 CA ILE B 98 -8.603 -2.687 4.130 1.00 0.00 C ATOM 3260 C ILE B 98 -9.519 -1.990 5.129 1.00 0.00 C ATOM 3261 O ILE B 98 -9.182 -0.978 5.738 1.00 0.00 O ATOM 3262 CB ILE B 98 -9.176 -2.448 2.722 1.00 0.00 C ATOM 3263 CG1 ILE B 98 -8.079 -2.500 1.662 1.00 0.00 C ATOM 3264 CG2 ILE B 98 -9.930 -1.124 2.638 1.00 0.00 C ATOM 3265 CD1 ILE B 98 -7.460 -3.864 1.503 1.00 0.00 C ATOM 0 H ILE B 98 -8.796 -4.664 3.539 1.00 0.00 H new ATOM 0 HA ILE B 98 -7.590 -2.296 4.228 1.00 0.00 H new ATOM 0 HB ILE B 98 -9.884 -3.253 2.526 1.00 0.00 H new ATOM 0 HG12 ILE B 98 -8.495 -2.185 0.705 1.00 0.00 H new ATOM 0 HG13 ILE B 98 -7.299 -1.784 1.922 1.00 0.00 H new ATOM 0 HG21 ILE B 98 -10.320 -0.991 1.629 1.00 0.00 H new ATOM 0 HG22 ILE B 98 -10.757 -1.130 3.348 1.00 0.00 H new ATOM 0 HG23 ILE B 98 -9.253 -0.304 2.877 1.00 0.00 H new ATOM 0 HD11 ILE B 98 -6.689 -3.826 0.733 1.00 0.00 H new ATOM 0 HD12 ILE B 98 -7.014 -4.174 2.448 1.00 0.00 H new ATOM 0 HD13 ILE B 98 -8.228 -4.580 1.212 1.00 0.00 H new ATOM 3277 N ASP B 99 -10.712 -2.544 5.211 1.00 0.00 N ATOM 3278 CA ASP B 99 -11.786 -2.025 6.034 1.00 0.00 C ATOM 3279 C ASP B 99 -11.528 -2.077 7.543 1.00 0.00 C ATOM 3280 O ASP B 99 -12.122 -1.304 8.292 1.00 0.00 O ATOM 3281 CB ASP B 99 -13.048 -2.795 5.672 1.00 0.00 C ATOM 3282 CG ASP B 99 -14.285 -1.919 5.665 1.00 0.00 C ATOM 3283 OD1 ASP B 99 -14.212 -0.792 5.131 1.00 0.00 O ATOM 3284 OD2 ASP B 99 -15.327 -2.359 6.194 1.00 0.00 O ATOM 0 H ASP B 99 -10.967 -3.386 4.696 1.00 0.00 H new ATOM 0 HA ASP B 99 -11.881 -0.960 5.821 1.00 0.00 H new ATOM 0 HB2 ASP B 99 -12.923 -3.248 4.689 1.00 0.00 H new ATOM 0 HB3 ASP B 99 -13.188 -3.609 6.383 1.00 0.00 H new ATOM 3289 N PHE B 100 -10.659 -2.967 8.000 1.00 0.00 N ATOM 3290 CA PHE B 100 -10.365 -3.061 9.427 1.00 0.00 C ATOM 3291 C PHE B 100 -9.014 -2.443 9.716 1.00 0.00 C ATOM 3292 O PHE B 100 -8.831 -1.692 10.673 1.00 0.00 O ATOM 3293 CB PHE B 100 -10.390 -4.523 9.887 1.00 0.00 C ATOM 3294 CG PHE B 100 -9.882 -4.729 11.287 1.00 0.00 C ATOM 3295 CD1 PHE B 100 -10.685 -4.446 12.379 1.00 0.00 C ATOM 3296 CD2 PHE B 100 -8.600 -5.207 11.506 1.00 0.00 C ATOM 3297 CE1 PHE B 100 -10.219 -4.636 13.666 1.00 0.00 C ATOM 3298 CE2 PHE B 100 -8.128 -5.399 12.791 1.00 0.00 C ATOM 3299 CZ PHE B 100 -8.939 -5.113 13.872 1.00 0.00 C ATOM 0 H PHE B 100 -10.149 -3.628 7.414 1.00 0.00 H new ATOM 0 HA PHE B 100 -11.131 -2.515 9.979 1.00 0.00 H new ATOM 0 HB2 PHE B 100 -11.412 -4.897 9.823 1.00 0.00 H new ATOM 0 HB3 PHE B 100 -9.789 -5.120 9.201 1.00 0.00 H new ATOM 0 HD1 PHE B 100 -11.686 -4.073 12.223 1.00 0.00 H new ATOM 0 HD2 PHE B 100 -7.963 -5.432 10.664 1.00 0.00 H new ATOM 0 HE1 PHE B 100 -10.855 -4.412 14.510 1.00 0.00 H new ATOM 0 HE2 PHE B 100 -7.127 -5.772 12.949 1.00 0.00 H new ATOM 0 HZ PHE B 100 -8.573 -5.262 14.877 1.00 0.00 H new ATOM 3309 N LEU B 101 -8.076 -2.802 8.868 1.00 0.00 N ATOM 3310 CA LEU B 101 -6.707 -2.349 8.966 1.00 0.00 C ATOM 3311 C LEU B 101 -6.558 -0.917 8.475 1.00 0.00 C ATOM 3312 O LEU B 101 -5.793 -0.134 9.039 1.00 0.00 O ATOM 3313 CB LEU B 101 -5.848 -3.294 8.130 1.00 0.00 C ATOM 3314 CG LEU B 101 -4.862 -2.643 7.161 1.00 0.00 C ATOM 3315 CD1 LEU B 101 -3.590 -2.213 7.874 1.00 0.00 C ATOM 3316 CD2 LEU B 101 -4.557 -3.598 6.023 1.00 0.00 C ATOM 0 H LEU B 101 -8.246 -3.426 8.079 1.00 0.00 H new ATOM 0 HA LEU B 101 -6.389 -2.359 10.008 1.00 0.00 H new ATOM 0 HB2 LEU B 101 -5.286 -3.935 8.809 1.00 0.00 H new ATOM 0 HB3 LEU B 101 -6.512 -3.942 7.557 1.00 0.00 H new ATOM 0 HG LEU B 101 -5.319 -1.743 6.750 1.00 0.00 H new ATOM 0 HD11 LEU B 101 -2.909 -1.754 7.158 1.00 0.00 H new ATOM 0 HD12 LEU B 101 -3.836 -1.493 8.654 1.00 0.00 H new ATOM 0 HD13 LEU B 101 -3.112 -3.084 8.322 1.00 0.00 H new ATOM 0 HD21 LEU B 101 -3.854 -3.130 5.334 1.00 0.00 H new ATOM 0 HD22 LEU B 101 -4.119 -4.513 6.423 1.00 0.00 H new ATOM 0 HD23 LEU B 101 -5.479 -3.838 5.493 1.00 0.00 H new ATOM 3328 N ILE B 102 -7.270 -0.588 7.405 1.00 0.00 N ATOM 3329 CA ILE B 102 -7.182 0.741 6.831 1.00 0.00 C ATOM 3330 C ILE B 102 -8.380 1.605 7.217 1.00 0.00 C ATOM 3331 O ILE B 102 -8.350 2.824 7.046 1.00 0.00 O ATOM 3332 CB ILE B 102 -7.054 0.683 5.293 1.00 0.00 C ATOM 3333 CG1 ILE B 102 -6.104 -0.451 4.877 1.00 0.00 C ATOM 3334 CG2 ILE B 102 -6.559 2.018 4.755 1.00 0.00 C ATOM 3335 CD1 ILE B 102 -5.873 -0.531 3.383 1.00 0.00 C ATOM 0 H ILE B 102 -7.909 -1.220 6.923 1.00 0.00 H new ATOM 0 HA ILE B 102 -6.282 1.199 7.241 1.00 0.00 H new ATOM 0 HB ILE B 102 -8.037 0.481 4.868 1.00 0.00 H new ATOM 0 HG12 ILE B 102 -5.146 -0.313 5.377 1.00 0.00 H new ATOM 0 HG13 ILE B 102 -6.511 -1.401 5.225 1.00 0.00 H new ATOM 0 HG21 ILE B 102 -6.473 1.964 3.670 1.00 0.00 H new ATOM 0 HG22 ILE B 102 -7.265 2.803 5.024 1.00 0.00 H new ATOM 0 HG23 ILE B 102 -5.583 2.244 5.185 1.00 0.00 H new ATOM 0 HD11 ILE B 102 -5.193 -1.354 3.164 1.00 0.00 H new ATOM 0 HD12 ILE B 102 -6.823 -0.701 2.876 1.00 0.00 H new ATOM 0 HD13 ILE B 102 -5.437 0.404 3.032 1.00 0.00 H new ATOM 3347 N THR B 103 -9.436 0.982 7.743 1.00 0.00 N ATOM 3348 CA THR B 103 -10.622 1.733 8.146 1.00 0.00 C ATOM 3349 C THR B 103 -10.984 1.450 9.601 1.00 0.00 C ATOM 3350 O THR B 103 -11.257 2.371 10.371 1.00 0.00 O ATOM 3351 CB THR B 103 -11.799 1.405 7.219 1.00 0.00 C ATOM 3352 OG1 THR B 103 -11.663 2.083 5.983 1.00 0.00 O ATOM 3353 CG2 THR B 103 -13.155 1.771 7.792 1.00 0.00 C ATOM 0 H THR B 103 -9.493 -0.025 7.897 1.00 0.00 H new ATOM 0 HA THR B 103 -10.398 2.796 8.061 1.00 0.00 H new ATOM 0 HB THR B 103 -11.764 0.323 7.092 1.00 0.00 H new ATOM 0 HG1 THR B 103 -12.421 1.861 5.403 1.00 0.00 H new ATOM 0 HG21 THR B 103 -13.935 1.508 7.077 1.00 0.00 H new ATOM 0 HG22 THR B 103 -13.316 1.226 8.722 1.00 0.00 H new ATOM 0 HG23 THR B 103 -13.190 2.842 7.989 1.00 0.00 H new ATOM 3361 N GLY B 104 -10.990 0.176 9.972 1.00 0.00 N ATOM 3362 CA GLY B 104 -11.327 -0.194 11.333 1.00 0.00 C ATOM 3363 C GLY B 104 -12.804 -0.498 11.502 1.00 0.00 C ATOM 3364 O GLY B 104 -13.183 -1.335 12.321 1.00 0.00 O ATOM 0 H GLY B 104 -10.768 -0.606 9.356 1.00 0.00 H new ATOM 0 HA2 GLY B 104 -10.744 -1.068 11.624 1.00 0.00 H new ATOM 0 HA3 GLY B 104 -11.046 0.616 12.007 1.00 0.00 H new ATOM 3368 N ILE B 105 -13.639 0.185 10.724 1.00 0.00 N ATOM 3369 CA ILE B 105 -15.081 -0.011 10.787 1.00 0.00 C ATOM 3370 C ILE B 105 -15.633 0.407 12.147 1.00 0.00 C ATOM 3371 O ILE B 105 -16.863 0.595 12.253 1.00 0.00 O ATOM 3372 CB ILE B 105 -15.461 -1.478 10.515 1.00 0.00 C ATOM 3373 CG1 ILE B 105 -14.890 -1.935 9.170 1.00 0.00 C ATOM 3374 CG2 ILE B 105 -16.973 -1.656 10.544 1.00 0.00 C ATOM 3375 CD1 ILE B 105 -13.912 -3.079 9.296 1.00 0.00 C ATOM 3376 OXT ILE B 105 -14.830 0.542 13.094 1.00 0.00 O ATOM 0 H ILE B 105 -13.339 0.881 10.041 1.00 0.00 H new ATOM 0 HA ILE B 105 -15.521 0.617 10.012 1.00 0.00 H new ATOM 0 HB ILE B 105 -15.031 -2.097 11.302 1.00 0.00 H new ATOM 0 HG12 ILE B 105 -15.710 -2.237 8.518 1.00 0.00 H new ATOM 0 HG13 ILE B 105 -14.394 -1.093 8.688 1.00 0.00 H new ATOM 0 HG21 ILE B 105 -17.220 -2.700 10.350 1.00 0.00 H new ATOM 0 HG22 ILE B 105 -17.354 -1.369 11.524 1.00 0.00 H new ATOM 0 HG23 ILE B 105 -17.428 -1.027 9.779 1.00 0.00 H new ATOM 0 HD11 ILE B 105 -13.545 -3.354 8.307 1.00 0.00 H new ATOM 0 HD12 ILE B 105 -13.074 -2.774 9.922 1.00 0.00 H new ATOM 0 HD13 ILE B 105 -14.411 -3.936 9.749 1.00 0.00 H new