USER MOD reduce.3.24.130724 H: found=0, std=0, add=1240, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1238 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 Single : A 1 GLN : amide:sc= -0.197 K(o=-0.2,f=-2.4!) USER MOD Single : A 1 GLN N :NH3+ -136:sc= -0.317 (180deg=-1.68!) USER MOD Single : A 6 ASN :FLIP amide:sc= -4.21! C(o=-5.5!,f=-4.2!) USER MOD Single : A 10 THR OG1 : rot 180:sc= -0.134 USER MOD Single : A 13 TYR OH : rot 137:sc= -1.3! USER MOD Single : A 14 ASN :FLIP amide:sc= -3.03! C(o=-5.1!,f=-3!) USER MOD Single : A 16 THR OG1 : rot -77:sc= 0.408 USER MOD Single : A 17 ASN : amide:sc= -0.638 X(o=-0.64,f=-0.64) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 23 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 SER OG : rot 54:sc= 0.254 USER MOD Single : A 28 TYR OH : rot 145:sc= 0.122 USER MOD Single : A 32 THR OG1 : rot 180:sc= -0.974! USER MOD Single : A 33 SER OG : rot 120:sc= -1.49! USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.107) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot -87:sc= -0.465 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 GLN : amide:sc= -1.75 K(o=-1.8,f=-5.5!) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 GLN : amide:sc= -0.148 K(o=-0.15,f=-1.3!) USER MOD Single : A 63 SER OG : rot 93:sc= 1.02 USER MOD Single : A 64 MET CE :methyl 178:sc= -11.8! (180deg=-12.1!) USER MOD Single : A 66 HIS :FLIP no HD1:sc= -2.97! C(o=-4.4!,f=-3!) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 GLN : amide:sc= -0.24 X(o=-0.24,f=-0.12) USER MOD Single : A 71 THR OG1 : rot -48:sc= 0.965 USER MOD Single : A 72 GLN : amide:sc= -0.127 X(o=-0.13,f=-0.13) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot -67:sc= 1.17 USER MOD Single : B 1 GLN : amide:sc= -0.169 K(o=-0.17,f=-2.4!) USER MOD Single : B 1 GLN N :NH3+ -134:sc= -0.31 (180deg=-1.66!) USER MOD Single : B 6 ASN :FLIP amide:sc= -4.21! C(o=-5.7!,f=-4.2!) USER MOD Single : B 10 THR OG1 : rot 180:sc= -0.144 USER MOD Single : B 13 TYR OH : rot 138:sc= -1.31! USER MOD Single : B 14 ASN :FLIP amide:sc= -3! C(o=-5!,f=-3!) USER MOD Single : B 16 THR OG1 : rot -78:sc= 0.391 USER MOD Single : B 17 ASN : amide:sc= -0.671 X(o=-0.67,f=-0.67) USER MOD Single : B 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 21 SER OG : rot 180:sc= 0 USER MOD Single : B 23 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 27 SER OG : rot 53:sc= 0.257 USER MOD Single : B 28 TYR OH : rot 146:sc= 0.123 USER MOD Single : B 32 THR OG1 : rot 180:sc= -0.913! USER MOD Single : B 33 SER OG : rot 120:sc= -1.3! USER MOD Single : B 34 SER OG : rot 180:sc= 0 USER MOD Single : B 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 38 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.123) USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 45 THR OG1 : rot -89:sc= -0.496 USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 GLN : amide:sc= -1.68 K(o=-1.7,f=-5.8!) USER MOD Single : B 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 61 GLN : amide:sc= -0.132 K(o=-0.13,f=-1.2!) USER MOD Single : B 63 SER OG : rot 93:sc= 1.05 USER MOD Single : B 64 MET CE :methyl 174:sc= -11.7! (180deg=-11.8!) USER MOD Single : B 66 HIS :FLIP no HD1:sc= -3.04! C(o=-4.5!,f=-3!) USER MOD Single : B 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 70 GLN : amide:sc= -0.226 X(o=-0.23,f=-0.15) USER MOD Single : B 71 THR OG1 : rot -48:sc= 1.04 USER MOD Single : B 72 GLN : amide:sc= -0.119 X(o=-0.12,f=-0.12) USER MOD Single : B 73 THR OG1 : rot 180:sc= 0 USER MOD Single : B 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 76 THR OG1 : rot -56:sc= 1.15 USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 1 64.960 -21.880 -0.361 1.00 0.00 N ATOM 2 CA GLN A 1 65.360 -21.317 -1.681 1.00 0.00 C ATOM 3 C GLN A 1 64.544 -20.044 -1.964 1.00 0.00 C ATOM 4 O GLN A 1 63.617 -20.072 -2.747 1.00 0.00 O ATOM 5 CB GLN A 1 65.093 -22.349 -2.778 1.00 0.00 C ATOM 6 CG GLN A 1 66.225 -22.308 -3.806 1.00 0.00 C ATOM 7 CD GLN A 1 67.390 -23.171 -3.317 1.00 0.00 C ATOM 8 OE1 GLN A 1 67.196 -24.101 -2.560 1.00 0.00 O ATOM 9 NE2 GLN A 1 68.600 -22.900 -3.720 1.00 0.00 N ATOM 0 H1 GLN A 1 65.810 -22.161 0.169 1.00 0.00 H new ATOM 0 H2 GLN A 1 64.437 -21.161 0.179 1.00 0.00 H new ATOM 0 H3 GLN A 1 64.353 -22.712 -0.508 1.00 0.00 H new ATOM 0 HA GLN A 1 66.422 -21.071 -1.665 1.00 0.00 H new ATOM 0 HB2 GLN A 1 65.018 -23.346 -2.343 1.00 0.00 H new ATOM 0 HB3 GLN A 1 64.139 -22.141 -3.263 1.00 0.00 H new ATOM 0 HG2 GLN A 1 65.869 -22.672 -4.770 1.00 0.00 H new ATOM 0 HG3 GLN A 1 66.557 -21.281 -3.956 1.00 0.00 H new ATOM 0 HE21 GLN A 1 68.763 -22.119 -4.356 1.00 0.00 H new ATOM 0 HE22 GLN A 1 69.384 -23.469 -3.400 1.00 0.00 H new ATOM 20 N PRO A 2 64.917 -18.958 -1.309 1.00 0.00 N ATOM 21 CA PRO A 2 64.227 -17.678 -1.479 1.00 0.00 C ATOM 22 C PRO A 2 64.332 -17.204 -2.929 1.00 0.00 C ATOM 23 O PRO A 2 65.221 -16.458 -3.286 1.00 0.00 O ATOM 24 CB PRO A 2 64.957 -16.701 -0.541 1.00 0.00 C ATOM 25 CG PRO A 2 66.102 -17.498 0.161 1.00 0.00 C ATOM 26 CD PRO A 2 66.041 -18.944 -0.362 1.00 0.00 C ATOM 0 HA PRO A 2 63.165 -17.752 -1.246 1.00 0.00 H new ATOM 0 HB2 PRO A 2 65.363 -15.860 -1.103 1.00 0.00 H new ATOM 0 HB3 PRO A 2 64.268 -16.289 0.196 1.00 0.00 H new ATOM 0 HG2 PRO A 2 67.072 -17.051 -0.058 1.00 0.00 H new ATOM 0 HG3 PRO A 2 65.978 -17.475 1.244 1.00 0.00 H new ATOM 0 HD2 PRO A 2 66.973 -19.227 -0.851 1.00 0.00 H new ATOM 0 HD3 PRO A 2 65.881 -19.652 0.451 1.00 0.00 H new ATOM 34 N ASP A 3 63.426 -17.627 -3.765 1.00 0.00 N ATOM 35 CA ASP A 3 63.468 -17.198 -5.182 1.00 0.00 C ATOM 36 C ASP A 3 63.303 -15.680 -5.254 1.00 0.00 C ATOM 37 O ASP A 3 62.519 -15.102 -4.528 1.00 0.00 O ATOM 38 CB ASP A 3 62.334 -17.872 -5.955 1.00 0.00 C ATOM 39 CG ASP A 3 62.803 -19.235 -6.465 1.00 0.00 C ATOM 40 OD1 ASP A 3 63.414 -19.956 -5.693 1.00 0.00 O ATOM 41 OD2 ASP A 3 62.544 -19.534 -7.619 1.00 0.00 O ATOM 0 H ASP A 3 62.658 -18.253 -3.523 1.00 0.00 H new ATOM 0 HA ASP A 3 64.424 -17.484 -5.622 1.00 0.00 H new ATOM 0 HB2 ASP A 3 61.463 -17.993 -5.311 1.00 0.00 H new ATOM 0 HB3 ASP A 3 62.027 -17.245 -6.792 1.00 0.00 H new ATOM 46 N ALA A 4 64.069 -15.030 -6.108 1.00 0.00 N ATOM 47 CA ALA A 4 64.006 -13.534 -6.238 1.00 0.00 C ATOM 48 C ALA A 4 64.983 -12.931 -5.250 1.00 0.00 C ATOM 49 O ALA A 4 64.606 -12.291 -4.288 1.00 0.00 O ATOM 50 CB ALA A 4 62.590 -13.012 -5.962 1.00 0.00 C ATOM 0 H ALA A 4 64.743 -15.480 -6.727 1.00 0.00 H new ATOM 0 HA ALA A 4 64.268 -13.249 -7.257 1.00 0.00 H new ATOM 0 HB1 ALA A 4 62.576 -11.927 -6.064 1.00 0.00 H new ATOM 0 HB2 ALA A 4 61.894 -13.452 -6.676 1.00 0.00 H new ATOM 0 HB3 ALA A 4 62.292 -13.285 -4.950 1.00 0.00 H new ATOM 56 N ILE A 5 66.240 -13.159 -5.468 1.00 0.00 N ATOM 57 CA ILE A 5 67.265 -12.638 -4.544 1.00 0.00 C ATOM 58 C ILE A 5 67.660 -11.223 -4.945 1.00 0.00 C ATOM 59 O ILE A 5 68.236 -10.490 -4.168 1.00 0.00 O ATOM 60 CB ILE A 5 68.486 -13.543 -4.596 1.00 0.00 C ATOM 61 CG1 ILE A 5 68.123 -14.934 -4.073 1.00 0.00 C ATOM 62 CG2 ILE A 5 69.577 -12.951 -3.736 1.00 0.00 C ATOM 63 CD1 ILE A 5 67.533 -14.821 -2.664 1.00 0.00 C ATOM 0 H ILE A 5 66.603 -13.692 -6.258 1.00 0.00 H new ATOM 0 HA ILE A 5 66.862 -12.617 -3.531 1.00 0.00 H new ATOM 0 HB ILE A 5 68.832 -13.628 -5.626 1.00 0.00 H new ATOM 0 HG12 ILE A 5 67.404 -15.408 -4.741 1.00 0.00 H new ATOM 0 HG13 ILE A 5 69.009 -15.569 -4.056 1.00 0.00 H new ATOM 0 HG21 ILE A 5 70.456 -13.595 -3.769 1.00 0.00 H new ATOM 0 HG22 ILE A 5 69.838 -11.961 -4.110 1.00 0.00 H new ATOM 0 HG23 ILE A 5 69.225 -12.869 -2.708 1.00 0.00 H new ATOM 0 HD11 ILE A 5 67.276 -15.814 -2.296 1.00 0.00 H new ATOM 0 HD12 ILE A 5 68.266 -14.366 -1.998 1.00 0.00 H new ATOM 0 HD13 ILE A 5 66.636 -14.202 -2.694 1.00 0.00 H new ATOM 75 N ASN A 6 67.334 -10.821 -6.132 1.00 0.00 N ATOM 76 CA ASN A 6 67.663 -9.434 -6.552 1.00 0.00 C ATOM 77 C ASN A 6 66.498 -8.553 -6.151 1.00 0.00 C ATOM 78 O ASN A 6 65.830 -7.980 -6.976 1.00 0.00 O ATOM 79 CB ASN A 6 67.883 -9.324 -8.087 1.00 0.00 C ATOM 80 CG ASN A 6 67.666 -10.676 -8.786 1.00 0.00 C ATOM 81 OD1 ASN A 6 66.454 -11.152 -8.901 1.00 0.00 O flip ATOM 82 ND2 ASN A 6 68.609 -11.303 -9.228 1.00 0.00 N flip ATOM 0 H ASN A 6 66.855 -11.388 -6.831 1.00 0.00 H new ATOM 0 HA ASN A 6 68.592 -9.127 -6.071 1.00 0.00 H new ATOM 0 HB2 ASN A 6 67.198 -8.585 -8.502 1.00 0.00 H new ATOM 0 HB3 ASN A 6 68.894 -8.968 -8.286 1.00 0.00 H new ATOM 0 HD21 ASN A 6 69.555 -10.932 -9.139 1.00 0.00 H new ATOM 0 HD22 ASN A 6 68.454 -12.200 -9.688 1.00 0.00 H new ATOM 89 N ALA A 7 66.202 -8.503 -4.891 1.00 0.00 N ATOM 90 CA ALA A 7 65.036 -7.708 -4.436 1.00 0.00 C ATOM 91 C ALA A 7 65.493 -6.426 -3.737 1.00 0.00 C ATOM 92 O ALA A 7 66.402 -6.459 -2.932 1.00 0.00 O ATOM 93 CB ALA A 7 64.235 -8.526 -3.429 1.00 0.00 C ATOM 0 H ALA A 7 66.718 -8.980 -4.152 1.00 0.00 H new ATOM 0 HA ALA A 7 64.433 -7.455 -5.308 1.00 0.00 H new ATOM 0 HB1 ALA A 7 63.376 -7.947 -3.091 1.00 0.00 H new ATOM 0 HB2 ALA A 7 63.889 -9.446 -3.900 1.00 0.00 H new ATOM 0 HB3 ALA A 7 64.866 -8.771 -2.575 1.00 0.00 H new ATOM 99 N PRO A 8 64.780 -5.338 -3.986 1.00 0.00 N ATOM 100 CA PRO A 8 65.047 -4.094 -3.294 1.00 0.00 C ATOM 101 C PRO A 8 64.677 -4.300 -1.839 1.00 0.00 C ATOM 102 O PRO A 8 63.515 -4.329 -1.481 1.00 0.00 O ATOM 103 CB PRO A 8 64.126 -3.058 -3.943 1.00 0.00 C ATOM 104 CG PRO A 8 63.240 -3.819 -4.977 1.00 0.00 C ATOM 105 CD PRO A 8 63.692 -5.288 -4.969 1.00 0.00 C ATOM 0 HA PRO A 8 66.087 -3.773 -3.353 1.00 0.00 H new ATOM 0 HB2 PRO A 8 63.507 -2.568 -3.192 1.00 0.00 H new ATOM 0 HB3 PRO A 8 64.708 -2.278 -4.434 1.00 0.00 H new ATOM 0 HG2 PRO A 8 62.186 -3.739 -4.712 1.00 0.00 H new ATOM 0 HG3 PRO A 8 63.352 -3.387 -5.972 1.00 0.00 H new ATOM 0 HD2 PRO A 8 62.874 -5.952 -4.689 1.00 0.00 H new ATOM 0 HD3 PRO A 8 64.034 -5.602 -5.955 1.00 0.00 H new ATOM 113 N VAL A 9 65.637 -4.531 -1.014 1.00 0.00 N ATOM 114 CA VAL A 9 65.338 -4.838 0.395 1.00 0.00 C ATOM 115 C VAL A 9 65.229 -3.536 1.200 1.00 0.00 C ATOM 116 O VAL A 9 66.211 -2.882 1.489 1.00 0.00 O ATOM 117 CB VAL A 9 66.474 -5.689 0.925 1.00 0.00 C ATOM 118 CG1 VAL A 9 67.761 -4.908 0.786 1.00 0.00 C ATOM 119 CG2 VAL A 9 66.230 -6.042 2.380 1.00 0.00 C ATOM 0 H VAL A 9 66.628 -4.521 -1.256 1.00 0.00 H new ATOM 0 HA VAL A 9 64.391 -5.370 0.483 1.00 0.00 H new ATOM 0 HB VAL A 9 66.539 -6.617 0.357 1.00 0.00 H new ATOM 0 HG11 VAL A 9 68.591 -5.505 1.163 1.00 0.00 H new ATOM 0 HG12 VAL A 9 67.931 -4.671 -0.264 1.00 0.00 H new ATOM 0 HG13 VAL A 9 67.689 -3.984 1.359 1.00 0.00 H new ATOM 0 HG21 VAL A 9 67.053 -6.654 2.749 1.00 0.00 H new ATOM 0 HG22 VAL A 9 66.164 -5.128 2.970 1.00 0.00 H new ATOM 0 HG23 VAL A 9 65.297 -6.599 2.468 1.00 0.00 H new ATOM 129 N THR A 10 64.038 -3.149 1.557 1.00 0.00 N ATOM 130 CA THR A 10 63.872 -1.892 2.328 1.00 0.00 C ATOM 131 C THR A 10 64.477 -2.057 3.720 1.00 0.00 C ATOM 132 O THR A 10 63.950 -2.762 4.557 1.00 0.00 O ATOM 133 CB THR A 10 62.385 -1.561 2.455 1.00 0.00 C ATOM 134 OG1 THR A 10 61.738 -1.808 1.215 1.00 0.00 O ATOM 135 CG2 THR A 10 62.228 -0.089 2.831 1.00 0.00 C ATOM 0 H THR A 10 63.174 -3.649 1.348 1.00 0.00 H new ATOM 0 HA THR A 10 64.382 -1.082 1.807 1.00 0.00 H new ATOM 0 HB THR A 10 61.934 -2.185 3.227 1.00 0.00 H new ATOM 0 HG1 THR A 10 60.784 -1.598 1.296 1.00 0.00 H new ATOM 0 HG21 THR A 10 61.169 0.152 2.923 1.00 0.00 H new ATOM 0 HG22 THR A 10 62.727 0.099 3.782 1.00 0.00 H new ATOM 0 HG23 THR A 10 62.676 0.534 2.057 1.00 0.00 H new ATOM 143 N CYS A 11 65.574 -1.401 3.979 1.00 0.00 N ATOM 144 CA CYS A 11 66.204 -1.510 5.328 1.00 0.00 C ATOM 145 C CYS A 11 66.516 -0.111 5.860 1.00 0.00 C ATOM 146 O CYS A 11 66.091 0.883 5.305 1.00 0.00 O ATOM 147 CB CYS A 11 67.498 -2.321 5.241 1.00 0.00 C ATOM 148 SG CYS A 11 67.215 -3.813 4.261 1.00 0.00 S ATOM 0 H CYS A 11 66.061 -0.796 3.318 1.00 0.00 H new ATOM 0 HA CYS A 11 65.512 -2.014 6.003 1.00 0.00 H new ATOM 0 HB2 CYS A 11 68.286 -1.720 4.787 1.00 0.00 H new ATOM 0 HB3 CYS A 11 67.838 -2.590 6.241 1.00 0.00 H new ATOM 153 N CYS A 12 67.249 -0.025 6.934 1.00 0.00 N ATOM 154 CA CYS A 12 67.579 1.315 7.508 1.00 0.00 C ATOM 155 C CYS A 12 69.091 1.427 7.727 1.00 0.00 C ATOM 156 O CYS A 12 69.851 0.545 7.378 1.00 0.00 O ATOM 157 CB CYS A 12 66.885 1.487 8.866 1.00 0.00 C ATOM 158 SG CYS A 12 65.220 0.791 8.810 1.00 0.00 S ATOM 0 H CYS A 12 67.635 -0.822 7.441 1.00 0.00 H new ATOM 0 HA CYS A 12 67.240 2.083 6.813 1.00 0.00 H new ATOM 0 HB2 CYS A 12 67.467 0.994 9.645 1.00 0.00 H new ATOM 0 HB3 CYS A 12 66.836 2.544 9.126 1.00 0.00 H new ATOM 163 N TYR A 13 69.516 2.490 8.349 1.00 0.00 N ATOM 164 CA TYR A 13 70.967 2.665 8.658 1.00 0.00 C ATOM 165 C TYR A 13 71.097 3.299 10.044 1.00 0.00 C ATOM 166 O TYR A 13 71.934 2.921 10.839 1.00 0.00 O ATOM 167 CB TYR A 13 71.622 3.581 7.623 1.00 0.00 C ATOM 168 CG TYR A 13 71.713 2.870 6.296 1.00 0.00 C ATOM 169 CD1 TYR A 13 72.072 1.502 6.238 1.00 0.00 C ATOM 170 CD2 TYR A 13 71.436 3.573 5.113 1.00 0.00 C ATOM 171 CE1 TYR A 13 72.149 0.846 4.991 1.00 0.00 C ATOM 172 CE2 TYR A 13 71.512 2.918 3.866 1.00 0.00 C ATOM 173 CZ TYR A 13 71.865 1.552 3.806 1.00 0.00 C ATOM 174 OH TYR A 13 71.936 0.910 2.587 1.00 0.00 O ATOM 0 H TYR A 13 68.916 3.254 8.661 1.00 0.00 H new ATOM 0 HA TYR A 13 71.463 1.695 8.634 1.00 0.00 H new ATOM 0 HB2 TYR A 13 71.042 4.497 7.516 1.00 0.00 H new ATOM 0 HB3 TYR A 13 72.617 3.872 7.959 1.00 0.00 H new ATOM 0 HD1 TYR A 13 72.287 0.961 7.148 1.00 0.00 H new ATOM 0 HD2 TYR A 13 71.164 4.617 5.158 1.00 0.00 H new ATOM 0 HE1 TYR A 13 72.426 -0.197 4.945 1.00 0.00 H new ATOM 0 HE2 TYR A 13 71.300 3.461 2.957 1.00 0.00 H new ATOM 0 HH TYR A 13 71.172 1.174 2.033 1.00 0.00 H new ATOM 184 N ASN A 14 70.253 4.251 10.340 1.00 0.00 N ATOM 185 CA ASN A 14 70.291 4.905 11.671 1.00 0.00 C ATOM 186 C ASN A 14 68.916 4.764 12.314 1.00 0.00 C ATOM 187 O ASN A 14 67.986 4.288 11.695 1.00 0.00 O ATOM 188 CB ASN A 14 70.636 6.385 11.500 1.00 0.00 C ATOM 189 CG ASN A 14 71.953 6.509 10.734 1.00 0.00 C ATOM 190 OD1 ASN A 14 71.949 7.024 9.536 1.00 0.00 O flip ATOM 191 ND2 ASN A 14 72.997 6.135 11.230 1.00 0.00 N flip ATOM 0 H ASN A 14 69.534 4.603 9.708 1.00 0.00 H new ATOM 0 HA ASN A 14 71.046 4.438 12.303 1.00 0.00 H new ATOM 0 HB2 ASN A 14 69.839 6.897 10.961 1.00 0.00 H new ATOM 0 HB3 ASN A 14 70.722 6.866 12.475 1.00 0.00 H new ATOM 0 HD21 ASN A 14 73.001 5.732 12.167 1.00 0.00 H new ATOM 0 HD22 ASN A 14 73.870 6.224 10.709 1.00 0.00 H new ATOM 198 N PHE A 15 68.768 5.154 13.548 1.00 0.00 N ATOM 199 CA PHE A 15 67.440 5.006 14.200 1.00 0.00 C ATOM 200 C PHE A 15 67.128 6.229 15.066 1.00 0.00 C ATOM 201 O PHE A 15 67.854 6.548 15.986 1.00 0.00 O ATOM 202 CB PHE A 15 67.441 3.753 15.078 1.00 0.00 C ATOM 203 CG PHE A 15 67.662 2.530 14.219 1.00 0.00 C ATOM 204 CD1 PHE A 15 66.856 2.310 13.079 1.00 0.00 C ATOM 205 CD2 PHE A 15 68.675 1.603 14.557 1.00 0.00 C ATOM 206 CE1 PHE A 15 67.064 1.165 12.277 1.00 0.00 C ATOM 207 CE2 PHE A 15 68.882 0.459 13.755 1.00 0.00 C ATOM 208 CZ PHE A 15 68.076 0.240 12.615 1.00 0.00 C ATOM 0 H PHE A 15 69.500 5.564 14.127 1.00 0.00 H new ATOM 0 HA PHE A 15 66.678 4.918 13.426 1.00 0.00 H new ATOM 0 HB2 PHE A 15 68.225 3.826 15.832 1.00 0.00 H new ATOM 0 HB3 PHE A 15 66.493 3.669 15.610 1.00 0.00 H new ATOM 0 HD1 PHE A 15 66.081 3.017 12.821 1.00 0.00 H new ATOM 0 HD2 PHE A 15 69.291 1.770 15.429 1.00 0.00 H new ATOM 0 HE1 PHE A 15 66.449 0.997 11.405 1.00 0.00 H new ATOM 0 HE2 PHE A 15 69.656 -0.248 14.013 1.00 0.00 H new ATOM 0 HZ PHE A 15 68.234 -0.635 12.002 1.00 0.00 H new ATOM 218 N THR A 16 66.024 6.896 14.802 1.00 0.00 N ATOM 219 CA THR A 16 65.636 8.079 15.650 1.00 0.00 C ATOM 220 C THR A 16 65.725 7.670 17.123 1.00 0.00 C ATOM 221 O THR A 16 64.830 7.053 17.653 1.00 0.00 O ATOM 222 CB THR A 16 64.183 8.528 15.334 1.00 0.00 C ATOM 223 OG1 THR A 16 63.601 9.099 16.500 1.00 0.00 O ATOM 224 CG2 THR A 16 63.344 7.327 14.890 1.00 0.00 C ATOM 0 H THR A 16 65.379 6.676 14.043 1.00 0.00 H new ATOM 0 HA THR A 16 66.310 8.909 15.437 1.00 0.00 H new ATOM 0 HB THR A 16 64.207 9.265 14.531 1.00 0.00 H new ATOM 0 HG1 THR A 16 63.331 8.385 17.114 1.00 0.00 H new ATOM 0 HG21 THR A 16 62.328 7.654 14.671 1.00 0.00 H new ATOM 0 HG22 THR A 16 63.784 6.887 13.995 1.00 0.00 H new ATOM 0 HG23 THR A 16 63.322 6.584 15.687 1.00 0.00 H new ATOM 232 N ASN A 17 66.804 7.981 17.779 1.00 0.00 N ATOM 233 CA ASN A 17 66.936 7.574 19.204 1.00 0.00 C ATOM 234 C ASN A 17 66.365 8.662 20.115 1.00 0.00 C ATOM 235 O ASN A 17 66.413 8.555 21.324 1.00 0.00 O ATOM 236 CB ASN A 17 68.412 7.348 19.539 1.00 0.00 C ATOM 237 CG ASN A 17 68.544 6.916 20.999 1.00 0.00 C ATOM 238 OD1 ASN A 17 68.033 5.885 21.389 1.00 0.00 O ATOM 239 ND2 ASN A 17 69.214 7.667 21.831 1.00 0.00 N ATOM 0 H ASN A 17 67.596 8.496 17.395 1.00 0.00 H new ATOM 0 HA ASN A 17 66.381 6.649 19.362 1.00 0.00 H new ATOM 0 HB2 ASN A 17 68.832 6.585 18.884 1.00 0.00 H new ATOM 0 HB3 ASN A 17 68.979 8.263 19.367 1.00 0.00 H new ATOM 0 HD21 ASN A 17 69.308 7.388 22.808 1.00 0.00 H new ATOM 0 HD22 ASN A 17 69.643 8.533 21.504 1.00 0.00 H new ATOM 246 N ARG A 18 65.801 9.694 19.552 1.00 0.00 N ATOM 247 CA ARG A 18 65.205 10.757 20.398 1.00 0.00 C ATOM 248 C ARG A 18 63.735 10.428 20.629 1.00 0.00 C ATOM 249 O ARG A 18 63.014 10.106 19.708 1.00 0.00 O ATOM 250 CB ARG A 18 65.324 12.107 19.692 1.00 0.00 C ATOM 251 CG ARG A 18 66.743 12.652 19.866 1.00 0.00 C ATOM 252 CD ARG A 18 67.217 13.270 18.552 1.00 0.00 C ATOM 253 NE ARG A 18 67.473 14.736 18.748 1.00 0.00 N ATOM 254 CZ ARG A 18 68.209 15.166 19.748 1.00 0.00 C ATOM 255 NH1 ARG A 18 68.871 14.310 20.477 1.00 0.00 N ATOM 256 NH2 ARG A 18 68.225 16.438 20.068 1.00 0.00 N ATOM 0 H ARG A 18 65.729 9.844 18.546 1.00 0.00 H new ATOM 0 HA ARG A 18 65.730 10.810 21.352 1.00 0.00 H new ATOM 0 HB2 ARG A 18 65.093 11.997 18.632 1.00 0.00 H new ATOM 0 HB3 ARG A 18 64.600 12.810 20.104 1.00 0.00 H new ATOM 0 HG2 ARG A 18 66.762 13.399 20.659 1.00 0.00 H new ATOM 0 HG3 ARG A 18 67.417 11.850 20.167 1.00 0.00 H new ATOM 0 HD2 ARG A 18 68.126 12.774 18.212 1.00 0.00 H new ATOM 0 HD3 ARG A 18 66.465 13.122 17.777 1.00 0.00 H new ATOM 0 HE ARG A 18 67.070 15.408 18.095 1.00 0.00 H new ATOM 0 HH11 ARG A 18 68.816 13.313 20.269 1.00 0.00 H new ATOM 0 HH12 ARG A 18 69.444 14.638 21.255 1.00 0.00 H new ATOM 0 HH21 ARG A 18 67.662 17.104 19.539 1.00 0.00 H new ATOM 0 HH22 ARG A 18 68.800 16.761 20.846 1.00 0.00 H new ATOM 270 N LYS A 19 63.284 10.490 21.852 1.00 0.00 N ATOM 271 CA LYS A 19 61.857 10.164 22.136 1.00 0.00 C ATOM 272 C LYS A 19 60.954 11.005 21.236 1.00 0.00 C ATOM 273 O LYS A 19 60.591 12.117 21.563 1.00 0.00 O ATOM 274 CB LYS A 19 61.544 10.464 23.603 1.00 0.00 C ATOM 275 CG LYS A 19 61.463 9.153 24.386 1.00 0.00 C ATOM 276 CD LYS A 19 61.987 9.372 25.806 1.00 0.00 C ATOM 277 CE LYS A 19 61.173 8.527 26.786 1.00 0.00 C ATOM 278 NZ LYS A 19 61.033 9.260 28.077 1.00 0.00 N ATOM 0 H LYS A 19 63.841 10.752 22.666 1.00 0.00 H new ATOM 0 HA LYS A 19 61.680 9.106 21.940 1.00 0.00 H new ATOM 0 HB2 LYS A 19 62.316 11.106 24.027 1.00 0.00 H new ATOM 0 HB3 LYS A 19 60.601 11.006 23.681 1.00 0.00 H new ATOM 0 HG2 LYS A 19 60.432 8.800 24.418 1.00 0.00 H new ATOM 0 HG3 LYS A 19 62.049 8.382 23.886 1.00 0.00 H new ATOM 0 HD2 LYS A 19 63.041 9.099 25.862 1.00 0.00 H new ATOM 0 HD3 LYS A 19 61.916 10.427 26.073 1.00 0.00 H new ATOM 0 HE2 LYS A 19 60.189 8.313 26.368 1.00 0.00 H new ATOM 0 HE3 LYS A 19 61.664 7.568 26.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 60.479 8.686 28.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 61.976 9.442 28.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 60.546 10.164 27.912 1.00 0.00 H new ATOM 292 N ILE A 20 60.588 10.477 20.103 1.00 0.00 N ATOM 293 CA ILE A 20 59.718 11.226 19.180 1.00 0.00 C ATOM 294 C ILE A 20 58.282 11.127 19.673 1.00 0.00 C ATOM 295 O ILE A 20 57.768 10.056 19.929 1.00 0.00 O ATOM 296 CB ILE A 20 59.851 10.633 17.763 1.00 0.00 C ATOM 297 CG1 ILE A 20 61.090 11.238 17.089 1.00 0.00 C ATOM 298 CG2 ILE A 20 58.604 10.952 16.920 1.00 0.00 C ATOM 299 CD1 ILE A 20 61.065 10.921 15.595 1.00 0.00 C ATOM 0 H ILE A 20 60.861 9.549 19.781 1.00 0.00 H new ATOM 0 HA ILE A 20 60.010 12.275 19.145 1.00 0.00 H new ATOM 0 HB ILE A 20 59.949 9.550 17.838 1.00 0.00 H new ATOM 0 HG12 ILE A 20 61.110 12.317 17.242 1.00 0.00 H new ATOM 0 HG13 ILE A 20 61.996 10.835 17.542 1.00 0.00 H new ATOM 0 HG21 ILE A 20 58.719 10.524 15.924 1.00 0.00 H new ATOM 0 HG22 ILE A 20 57.722 10.525 17.399 1.00 0.00 H new ATOM 0 HG23 ILE A 20 58.486 12.033 16.839 1.00 0.00 H new ATOM 0 HD11 ILE A 20 61.945 11.351 15.117 1.00 0.00 H new ATOM 0 HD12 ILE A 20 61.066 9.840 15.452 1.00 0.00 H new ATOM 0 HD13 ILE A 20 60.166 11.345 15.148 1.00 0.00 H new ATOM 311 N SER A 21 57.646 12.239 19.809 1.00 0.00 N ATOM 312 CA SER A 21 56.235 12.263 20.284 1.00 0.00 C ATOM 313 C SER A 21 55.414 11.193 19.557 1.00 0.00 C ATOM 314 O SER A 21 55.363 11.154 18.345 1.00 0.00 O ATOM 315 CB SER A 21 55.643 13.635 19.987 1.00 0.00 C ATOM 316 OG SER A 21 54.697 13.972 20.994 1.00 0.00 O ATOM 0 H SER A 21 58.044 13.157 19.609 1.00 0.00 H new ATOM 0 HA SER A 21 56.210 12.061 21.355 1.00 0.00 H new ATOM 0 HB2 SER A 21 56.434 14.384 19.951 1.00 0.00 H new ATOM 0 HB3 SER A 21 55.163 13.631 19.009 1.00 0.00 H new ATOM 0 HG SER A 21 54.317 14.855 20.804 1.00 0.00 H new ATOM 322 N VAL A 22 54.762 10.331 20.290 1.00 0.00 N ATOM 323 CA VAL A 22 53.936 9.278 19.642 1.00 0.00 C ATOM 324 C VAL A 22 52.936 9.937 18.687 1.00 0.00 C ATOM 325 O VAL A 22 52.435 9.317 17.769 1.00 0.00 O ATOM 326 CB VAL A 22 53.181 8.490 20.713 1.00 0.00 C ATOM 327 CG1 VAL A 22 52.290 9.440 21.515 1.00 0.00 C ATOM 328 CG2 VAL A 22 52.313 7.423 20.043 1.00 0.00 C ATOM 0 H VAL A 22 54.767 10.312 21.310 1.00 0.00 H new ATOM 0 HA VAL A 22 54.580 8.599 19.083 1.00 0.00 H new ATOM 0 HB VAL A 22 53.896 8.011 21.382 1.00 0.00 H new ATOM 0 HG11 VAL A 22 51.752 8.877 22.278 1.00 0.00 H new ATOM 0 HG12 VAL A 22 52.907 10.201 21.993 1.00 0.00 H new ATOM 0 HG13 VAL A 22 51.575 9.920 20.847 1.00 0.00 H new ATOM 0 HG21 VAL A 22 51.774 6.861 20.806 1.00 0.00 H new ATOM 0 HG22 VAL A 22 51.599 7.903 19.374 1.00 0.00 H new ATOM 0 HG23 VAL A 22 52.947 6.745 19.472 1.00 0.00 H new ATOM 338 N GLN A 23 52.652 11.196 18.892 1.00 0.00 N ATOM 339 CA GLN A 23 51.713 11.901 18.010 1.00 0.00 C ATOM 340 C GLN A 23 52.361 12.058 16.644 1.00 0.00 C ATOM 341 O GLN A 23 51.753 11.820 15.618 1.00 0.00 O ATOM 342 CB GLN A 23 51.394 13.283 18.631 1.00 0.00 C ATOM 343 CG GLN A 23 51.829 14.433 17.702 1.00 0.00 C ATOM 344 CD GLN A 23 51.338 15.765 18.274 1.00 0.00 C ATOM 345 OE1 GLN A 23 52.072 16.457 18.949 1.00 0.00 O ATOM 346 NE2 GLN A 23 50.117 16.157 18.028 1.00 0.00 N ATOM 0 H GLN A 23 53.042 11.762 19.646 1.00 0.00 H new ATOM 0 HA GLN A 23 50.783 11.343 17.899 1.00 0.00 H new ATOM 0 HB2 GLN A 23 50.324 13.357 18.827 1.00 0.00 H new ATOM 0 HB3 GLN A 23 51.901 13.378 19.591 1.00 0.00 H new ATOM 0 HG2 GLN A 23 52.915 14.445 17.604 1.00 0.00 H new ATOM 0 HG3 GLN A 23 51.421 14.282 16.703 1.00 0.00 H new ATOM 0 HE21 GLN A 23 49.499 15.576 17.461 1.00 0.00 H new ATOM 0 HE22 GLN A 23 49.781 17.044 18.403 1.00 0.00 H new ATOM 355 N ARG A 24 53.594 12.469 16.627 1.00 0.00 N ATOM 356 CA ARG A 24 54.293 12.660 15.343 1.00 0.00 C ATOM 357 C ARG A 24 54.216 11.385 14.538 1.00 0.00 C ATOM 358 O ARG A 24 54.176 11.400 13.327 1.00 0.00 O ATOM 359 CB ARG A 24 55.759 12.998 15.600 1.00 0.00 C ATOM 360 CG ARG A 24 55.855 14.274 16.424 1.00 0.00 C ATOM 361 CD ARG A 24 55.638 15.480 15.517 1.00 0.00 C ATOM 362 NE ARG A 24 56.216 16.697 16.160 1.00 0.00 N ATOM 363 CZ ARG A 24 55.906 17.897 15.720 1.00 0.00 C ATOM 364 NH1 ARG A 24 55.079 18.047 14.713 1.00 0.00 N ATOM 365 NH2 ARG A 24 56.424 18.949 16.292 1.00 0.00 N ATOM 0 H ARG A 24 54.147 12.681 17.457 1.00 0.00 H new ATOM 0 HA ARG A 24 53.821 13.475 14.795 1.00 0.00 H new ATOM 0 HB2 ARG A 24 56.245 12.176 16.127 1.00 0.00 H new ATOM 0 HB3 ARG A 24 56.284 13.125 14.653 1.00 0.00 H new ATOM 0 HG2 ARG A 24 55.109 14.264 17.219 1.00 0.00 H new ATOM 0 HG3 ARG A 24 56.831 14.337 16.904 1.00 0.00 H new ATOM 0 HD2 ARG A 24 56.108 15.309 14.549 1.00 0.00 H new ATOM 0 HD3 ARG A 24 54.573 15.624 15.334 1.00 0.00 H new ATOM 0 HE ARG A 24 56.857 16.597 16.947 1.00 0.00 H new ATOM 0 HH11 ARG A 24 54.669 17.228 14.263 1.00 0.00 H new ATOM 0 HH12 ARG A 24 54.845 18.982 14.380 1.00 0.00 H new ATOM 0 HH21 ARG A 24 57.066 18.839 17.077 1.00 0.00 H new ATOM 0 HH22 ARG A 24 56.187 19.882 15.954 1.00 0.00 H new ATOM 379 N LEU A 25 54.219 10.282 15.205 1.00 0.00 N ATOM 380 CA LEU A 25 54.186 8.987 14.500 1.00 0.00 C ATOM 381 C LEU A 25 52.824 8.756 13.873 1.00 0.00 C ATOM 382 O LEU A 25 51.922 8.222 14.488 1.00 0.00 O ATOM 383 CB LEU A 25 54.490 7.874 15.487 1.00 0.00 C ATOM 384 CG LEU A 25 55.772 8.221 16.266 1.00 0.00 C ATOM 385 CD1 LEU A 25 56.201 7.024 17.104 1.00 0.00 C ATOM 386 CD2 LEU A 25 56.899 8.579 15.289 1.00 0.00 C ATOM 0 H LEU A 25 54.243 10.220 16.223 1.00 0.00 H new ATOM 0 HA LEU A 25 54.934 8.995 13.708 1.00 0.00 H new ATOM 0 HB2 LEU A 25 53.655 7.746 16.176 1.00 0.00 H new ATOM 0 HB3 LEU A 25 54.616 6.929 14.959 1.00 0.00 H new ATOM 0 HG LEU A 25 55.571 9.073 16.915 1.00 0.00 H new ATOM 0 HD11 LEU A 25 57.109 7.272 17.655 1.00 0.00 H new ATOM 0 HD12 LEU A 25 55.408 6.769 17.807 1.00 0.00 H new ATOM 0 HD13 LEU A 25 56.394 6.173 16.451 1.00 0.00 H new ATOM 0 HD21 LEU A 25 57.802 8.823 15.849 1.00 0.00 H new ATOM 0 HD22 LEU A 25 57.096 7.730 14.634 1.00 0.00 H new ATOM 0 HD23 LEU A 25 56.601 9.439 14.689 1.00 0.00 H new ATOM 398 N ALA A 26 52.669 9.148 12.649 1.00 0.00 N ATOM 399 CA ALA A 26 51.373 8.952 11.965 1.00 0.00 C ATOM 400 C ALA A 26 51.138 7.460 11.695 1.00 0.00 C ATOM 401 O ALA A 26 50.029 7.034 11.439 1.00 0.00 O ATOM 402 CB ALA A 26 51.388 9.699 10.636 1.00 0.00 C ATOM 0 H ALA A 26 53.391 9.600 12.088 1.00 0.00 H new ATOM 0 HA ALA A 26 50.575 9.333 12.602 1.00 0.00 H new ATOM 0 HB1 ALA A 26 50.434 9.557 10.128 1.00 0.00 H new ATOM 0 HB2 ALA A 26 51.548 10.762 10.818 1.00 0.00 H new ATOM 0 HB3 ALA A 26 52.193 9.313 10.011 1.00 0.00 H new ATOM 408 N SER A 27 52.173 6.671 11.731 1.00 0.00 N ATOM 409 CA SER A 27 52.012 5.212 11.456 1.00 0.00 C ATOM 410 C SER A 27 53.320 4.488 11.779 1.00 0.00 C ATOM 411 O SER A 27 54.301 5.100 12.151 1.00 0.00 O ATOM 412 CB SER A 27 51.667 5.005 9.981 1.00 0.00 C ATOM 413 OG SER A 27 50.308 4.601 9.868 1.00 0.00 O ATOM 0 H SER A 27 53.126 6.971 11.939 1.00 0.00 H new ATOM 0 HA SER A 27 51.210 4.811 12.076 1.00 0.00 H new ATOM 0 HB2 SER A 27 51.832 5.928 9.424 1.00 0.00 H new ATOM 0 HB3 SER A 27 52.320 4.249 9.545 1.00 0.00 H new ATOM 0 HG SER A 27 49.736 5.243 10.337 1.00 0.00 H new ATOM 419 N TYR A 28 53.341 3.185 11.663 1.00 0.00 N ATOM 420 CA TYR A 28 54.586 2.436 11.989 1.00 0.00 C ATOM 421 C TYR A 28 54.628 1.123 11.168 1.00 0.00 C ATOM 422 O TYR A 28 53.685 0.357 11.158 1.00 0.00 O ATOM 423 CB TYR A 28 54.593 2.166 13.519 1.00 0.00 C ATOM 424 CG TYR A 28 54.698 0.695 13.841 1.00 0.00 C ATOM 425 CD1 TYR A 28 55.957 0.061 13.836 1.00 0.00 C ATOM 426 CD2 TYR A 28 53.539 -0.033 14.181 1.00 0.00 C ATOM 427 CE1 TYR A 28 56.058 -1.305 14.169 1.00 0.00 C ATOM 428 CE2 TYR A 28 53.635 -1.399 14.511 1.00 0.00 C ATOM 429 CZ TYR A 28 54.897 -2.038 14.507 1.00 0.00 C ATOM 430 OH TYR A 28 54.994 -3.375 14.834 1.00 0.00 O ATOM 0 H TYR A 28 52.554 2.612 11.358 1.00 0.00 H new ATOM 0 HA TYR A 28 55.476 3.009 11.728 1.00 0.00 H new ATOM 0 HB2 TYR A 28 55.429 2.696 13.975 1.00 0.00 H new ATOM 0 HB3 TYR A 28 53.681 2.568 13.961 1.00 0.00 H new ATOM 0 HD1 TYR A 28 56.843 0.621 13.577 1.00 0.00 H new ATOM 0 HD2 TYR A 28 52.577 0.457 14.188 1.00 0.00 H new ATOM 0 HE1 TYR A 28 57.022 -1.792 14.166 1.00 0.00 H new ATOM 0 HE2 TYR A 28 52.747 -1.957 14.767 1.00 0.00 H new ATOM 0 HH TYR A 28 54.336 -3.591 15.527 1.00 0.00 H new ATOM 440 N ARG A 29 55.716 0.872 10.477 1.00 0.00 N ATOM 441 CA ARG A 29 55.813 -0.379 9.656 1.00 0.00 C ATOM 442 C ARG A 29 57.098 -1.136 10.018 1.00 0.00 C ATOM 443 O ARG A 29 58.087 -1.054 9.330 1.00 0.00 O ATOM 444 CB ARG A 29 55.842 -0.013 8.171 1.00 0.00 C ATOM 445 CG ARG A 29 54.446 -0.198 7.572 1.00 0.00 C ATOM 446 CD ARG A 29 54.558 -0.347 6.055 1.00 0.00 C ATOM 447 NE ARG A 29 53.265 0.047 5.419 1.00 0.00 N ATOM 448 CZ ARG A 29 53.013 -0.265 4.167 1.00 0.00 C ATOM 449 NH1 ARG A 29 53.891 -0.929 3.455 1.00 0.00 N ATOM 450 NH2 ARG A 29 51.879 0.089 3.629 1.00 0.00 N ATOM 0 H ARG A 29 56.537 1.476 10.446 1.00 0.00 H new ATOM 0 HA ARG A 29 54.950 -1.012 9.860 1.00 0.00 H new ATOM 0 HB2 ARG A 29 56.169 1.019 8.046 1.00 0.00 H new ATOM 0 HB3 ARG A 29 56.561 -0.641 7.645 1.00 0.00 H new ATOM 0 HG2 ARG A 29 53.969 -1.079 8.000 1.00 0.00 H new ATOM 0 HG3 ARG A 29 53.817 0.657 7.819 1.00 0.00 H new ATOM 0 HD2 ARG A 29 55.367 0.278 5.676 1.00 0.00 H new ATOM 0 HD3 ARG A 29 54.803 -1.377 5.797 1.00 0.00 H new ATOM 0 HE ARG A 29 52.572 0.563 5.961 1.00 0.00 H new ATOM 0 HH11 ARG A 29 54.779 -1.208 3.872 1.00 0.00 H new ATOM 0 HH12 ARG A 29 53.686 -1.166 2.484 1.00 0.00 H new ATOM 0 HH21 ARG A 29 51.193 0.605 4.179 1.00 0.00 H new ATOM 0 HH22 ARG A 29 51.678 -0.150 2.658 1.00 0.00 H new ATOM 464 N ARG A 30 57.081 -1.861 11.105 1.00 0.00 N ATOM 465 CA ARG A 30 58.302 -2.616 11.553 1.00 0.00 C ATOM 466 C ARG A 30 59.018 -3.288 10.367 1.00 0.00 C ATOM 467 O ARG A 30 58.563 -4.284 9.839 1.00 0.00 O ATOM 468 CB ARG A 30 57.883 -3.691 12.556 1.00 0.00 C ATOM 469 CG ARG A 30 58.977 -3.858 13.613 1.00 0.00 C ATOM 470 CD ARG A 30 58.432 -4.667 14.790 1.00 0.00 C ATOM 471 NE ARG A 30 59.567 -5.146 15.634 1.00 0.00 N ATOM 472 CZ ARG A 30 59.384 -6.094 16.526 1.00 0.00 C ATOM 473 NH1 ARG A 30 58.201 -6.637 16.691 1.00 0.00 N ATOM 474 NH2 ARG A 30 60.388 -6.501 17.254 1.00 0.00 N ATOM 0 H ARG A 30 56.268 -1.967 11.712 1.00 0.00 H new ATOM 0 HA ARG A 30 58.992 -1.907 12.011 1.00 0.00 H new ATOM 0 HB2 ARG A 30 56.943 -3.413 13.032 1.00 0.00 H new ATOM 0 HB3 ARG A 30 57.712 -4.637 12.041 1.00 0.00 H new ATOM 0 HG2 ARG A 30 59.841 -4.363 13.180 1.00 0.00 H new ATOM 0 HG3 ARG A 30 59.317 -2.881 13.956 1.00 0.00 H new ATOM 0 HD2 ARG A 30 57.756 -4.053 15.385 1.00 0.00 H new ATOM 0 HD3 ARG A 30 57.853 -5.515 14.425 1.00 0.00 H new ATOM 0 HE ARG A 30 60.493 -4.734 15.517 1.00 0.00 H new ATOM 0 HH11 ARG A 30 57.413 -6.324 16.124 1.00 0.00 H new ATOM 0 HH12 ARG A 30 58.070 -7.372 17.386 1.00 0.00 H new ATOM 0 HH21 ARG A 30 61.310 -6.084 17.130 1.00 0.00 H new ATOM 0 HH22 ARG A 30 60.250 -7.236 17.947 1.00 0.00 H new ATOM 488 N ILE A 31 60.167 -2.776 9.985 1.00 0.00 N ATOM 489 CA ILE A 31 60.945 -3.417 8.882 1.00 0.00 C ATOM 490 C ILE A 31 61.513 -4.746 9.391 1.00 0.00 C ATOM 491 O ILE A 31 61.619 -4.970 10.578 1.00 0.00 O ATOM 492 CB ILE A 31 62.101 -2.473 8.435 1.00 0.00 C ATOM 493 CG1 ILE A 31 61.612 -1.591 7.274 1.00 0.00 C ATOM 494 CG2 ILE A 31 63.326 -3.290 7.971 1.00 0.00 C ATOM 495 CD1 ILE A 31 62.784 -0.775 6.704 1.00 0.00 C ATOM 0 H ILE A 31 60.596 -1.944 10.390 1.00 0.00 H new ATOM 0 HA ILE A 31 60.297 -3.600 8.025 1.00 0.00 H new ATOM 0 HB ILE A 31 62.395 -1.854 9.283 1.00 0.00 H new ATOM 0 HG12 ILE A 31 61.177 -2.213 6.492 1.00 0.00 H new ATOM 0 HG13 ILE A 31 60.826 -0.920 7.622 1.00 0.00 H new ATOM 0 HG21 ILE A 31 64.121 -2.611 7.663 1.00 0.00 H new ATOM 0 HG22 ILE A 31 63.679 -3.914 8.792 1.00 0.00 H new ATOM 0 HG23 ILE A 31 63.044 -3.923 7.130 1.00 0.00 H new ATOM 0 HD11 ILE A 31 62.429 -0.153 5.882 1.00 0.00 H new ATOM 0 HD12 ILE A 31 63.200 -0.140 7.486 1.00 0.00 H new ATOM 0 HD13 ILE A 31 63.556 -1.453 6.339 1.00 0.00 H new ATOM 507 N THR A 32 61.898 -5.613 8.496 1.00 0.00 N ATOM 508 CA THR A 32 62.480 -6.922 8.909 1.00 0.00 C ATOM 509 C THR A 32 62.657 -7.800 7.670 1.00 0.00 C ATOM 510 O THR A 32 62.401 -8.988 7.697 1.00 0.00 O ATOM 511 CB THR A 32 61.547 -7.621 9.900 1.00 0.00 C ATOM 512 OG1 THR A 32 60.243 -7.067 9.796 1.00 0.00 O ATOM 513 CG2 THR A 32 62.074 -7.434 11.325 1.00 0.00 C ATOM 0 H THR A 32 61.834 -5.470 7.488 1.00 0.00 H new ATOM 0 HA THR A 32 63.444 -6.755 9.389 1.00 0.00 H new ATOM 0 HB THR A 32 61.507 -8.686 9.669 1.00 0.00 H new ATOM 0 HG1 THR A 32 59.645 -7.516 10.430 1.00 0.00 H new ATOM 0 HG21 THR A 32 61.407 -7.933 12.028 1.00 0.00 H new ATOM 0 HG22 THR A 32 63.072 -7.865 11.403 1.00 0.00 H new ATOM 0 HG23 THR A 32 62.119 -6.371 11.560 1.00 0.00 H new ATOM 521 N SER A 33 63.086 -7.222 6.580 1.00 0.00 N ATOM 522 CA SER A 33 63.273 -8.018 5.334 1.00 0.00 C ATOM 523 C SER A 33 64.179 -9.216 5.623 1.00 0.00 C ATOM 524 O SER A 33 64.580 -9.447 6.748 1.00 0.00 O ATOM 525 CB SER A 33 63.913 -7.141 4.257 1.00 0.00 C ATOM 526 OG SER A 33 63.598 -7.665 2.974 1.00 0.00 O ATOM 0 H SER A 33 63.315 -6.231 6.499 1.00 0.00 H new ATOM 0 HA SER A 33 62.304 -8.373 4.983 1.00 0.00 H new ATOM 0 HB2 SER A 33 63.550 -6.117 4.343 1.00 0.00 H new ATOM 0 HB3 SER A 33 64.994 -7.109 4.394 1.00 0.00 H new ATOM 0 HG SER A 33 63.106 -6.993 2.458 1.00 0.00 H new ATOM 532 N SER A 34 64.497 -9.987 4.621 1.00 0.00 N ATOM 533 CA SER A 34 65.366 -11.175 4.844 1.00 0.00 C ATOM 534 C SER A 34 66.836 -10.791 4.652 1.00 0.00 C ATOM 535 O SER A 34 67.729 -11.510 5.057 1.00 0.00 O ATOM 536 CB SER A 34 64.994 -12.272 3.846 1.00 0.00 C ATOM 537 OG SER A 34 63.783 -12.895 4.260 1.00 0.00 O ATOM 0 H SER A 34 64.193 -9.846 3.658 1.00 0.00 H new ATOM 0 HA SER A 34 65.220 -11.538 5.861 1.00 0.00 H new ATOM 0 HB2 SER A 34 64.875 -11.847 2.849 1.00 0.00 H new ATOM 0 HB3 SER A 34 65.794 -13.010 3.785 1.00 0.00 H new ATOM 0 HG SER A 34 63.541 -13.598 3.621 1.00 0.00 H new ATOM 543 N LYS A 35 67.102 -9.670 4.036 1.00 0.00 N ATOM 544 CA LYS A 35 68.519 -9.263 3.824 1.00 0.00 C ATOM 545 C LYS A 35 68.854 -8.032 4.679 1.00 0.00 C ATOM 546 O LYS A 35 69.998 -7.636 4.781 1.00 0.00 O ATOM 547 CB LYS A 35 68.749 -8.926 2.349 1.00 0.00 C ATOM 548 CG LYS A 35 68.363 -10.111 1.457 1.00 0.00 C ATOM 549 CD LYS A 35 69.069 -11.381 1.940 1.00 0.00 C ATOM 550 CE LYS A 35 70.584 -11.190 1.850 1.00 0.00 C ATOM 551 NZ LYS A 35 71.269 -12.439 2.290 1.00 0.00 N ATOM 0 H LYS A 35 66.403 -9.022 3.673 1.00 0.00 H new ATOM 0 HA LYS A 35 69.164 -10.091 4.117 1.00 0.00 H new ATOM 0 HB2 LYS A 35 68.160 -8.051 2.075 1.00 0.00 H new ATOM 0 HB3 LYS A 35 69.796 -8.669 2.188 1.00 0.00 H new ATOM 0 HG2 LYS A 35 67.283 -10.255 1.477 1.00 0.00 H new ATOM 0 HG3 LYS A 35 68.638 -9.903 0.423 1.00 0.00 H new ATOM 0 HD2 LYS A 35 68.780 -11.602 2.968 1.00 0.00 H new ATOM 0 HD3 LYS A 35 68.763 -12.233 1.333 1.00 0.00 H new ATOM 0 HE2 LYS A 35 70.870 -10.946 0.827 1.00 0.00 H new ATOM 0 HE3 LYS A 35 70.894 -10.353 2.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 72.299 -12.310 2.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 71.004 -12.652 3.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 70.982 -13.227 1.675 1.00 0.00 H new ATOM 565 N CYS A 36 67.874 -7.415 5.288 1.00 0.00 N ATOM 566 CA CYS A 36 68.167 -6.209 6.121 1.00 0.00 C ATOM 567 C CYS A 36 69.097 -6.601 7.280 1.00 0.00 C ATOM 568 O CYS A 36 68.771 -7.472 8.061 1.00 0.00 O ATOM 569 CB CYS A 36 66.864 -5.632 6.684 1.00 0.00 C ATOM 570 SG CYS A 36 65.886 -4.886 5.349 1.00 0.00 S ATOM 0 H CYS A 36 66.893 -7.690 5.246 1.00 0.00 H new ATOM 0 HA CYS A 36 68.652 -5.455 5.501 1.00 0.00 H new ATOM 0 HB2 CYS A 36 66.289 -6.419 7.171 1.00 0.00 H new ATOM 0 HB3 CYS A 36 67.087 -4.883 7.444 1.00 0.00 H new ATOM 575 N PRO A 37 70.243 -5.942 7.353 1.00 0.00 N ATOM 576 CA PRO A 37 71.222 -6.218 8.400 1.00 0.00 C ATOM 577 C PRO A 37 70.634 -5.928 9.779 1.00 0.00 C ATOM 578 O PRO A 37 71.151 -6.369 10.787 1.00 0.00 O ATOM 579 CB PRO A 37 72.388 -5.258 8.117 1.00 0.00 C ATOM 580 CG PRO A 37 72.007 -4.409 6.869 1.00 0.00 C ATOM 581 CD PRO A 37 70.630 -4.888 6.399 1.00 0.00 C ATOM 0 HA PRO A 37 71.531 -7.263 8.398 1.00 0.00 H new ATOM 0 HB2 PRO A 37 72.571 -4.614 8.977 1.00 0.00 H new ATOM 0 HB3 PRO A 37 73.307 -5.815 7.935 1.00 0.00 H new ATOM 0 HG2 PRO A 37 71.981 -3.348 7.119 1.00 0.00 H new ATOM 0 HG3 PRO A 37 72.748 -4.532 6.079 1.00 0.00 H new ATOM 0 HD2 PRO A 37 69.908 -4.072 6.399 1.00 0.00 H new ATOM 0 HD3 PRO A 37 70.674 -5.275 5.381 1.00 0.00 H new ATOM 589 N LYS A 38 69.580 -5.168 9.840 1.00 0.00 N ATOM 590 CA LYS A 38 68.997 -4.831 11.158 1.00 0.00 C ATOM 591 C LYS A 38 67.492 -4.576 11.035 1.00 0.00 C ATOM 592 O LYS A 38 67.044 -3.846 10.174 1.00 0.00 O ATOM 593 CB LYS A 38 69.674 -3.567 11.694 1.00 0.00 C ATOM 594 CG LYS A 38 70.987 -3.940 12.383 1.00 0.00 C ATOM 595 CD LYS A 38 71.160 -3.088 13.641 1.00 0.00 C ATOM 596 CE LYS A 38 72.643 -3.016 14.009 1.00 0.00 C ATOM 597 NZ LYS A 38 73.145 -4.385 14.321 1.00 0.00 N ATOM 0 H LYS A 38 69.100 -4.768 9.034 1.00 0.00 H new ATOM 0 HA LYS A 38 69.158 -5.668 11.838 1.00 0.00 H new ATOM 0 HB2 LYS A 38 69.865 -2.871 10.877 1.00 0.00 H new ATOM 0 HB3 LYS A 38 69.014 -3.059 12.398 1.00 0.00 H new ATOM 0 HG2 LYS A 38 70.986 -4.998 12.644 1.00 0.00 H new ATOM 0 HG3 LYS A 38 71.825 -3.780 11.704 1.00 0.00 H new ATOM 0 HD2 LYS A 38 70.768 -2.085 13.471 1.00 0.00 H new ATOM 0 HD3 LYS A 38 70.590 -3.518 14.465 1.00 0.00 H new ATOM 0 HE2 LYS A 38 73.213 -2.587 13.185 1.00 0.00 H new ATOM 0 HE3 LYS A 38 72.784 -2.361 14.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 74.084 -4.318 14.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 72.487 -4.855 14.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 73.215 -4.938 13.443 1.00 0.00 H new ATOM 611 N GLU A 39 66.715 -5.125 11.933 1.00 0.00 N ATOM 612 CA GLU A 39 65.248 -4.860 11.912 1.00 0.00 C ATOM 613 C GLU A 39 65.024 -3.414 12.361 1.00 0.00 C ATOM 614 O GLU A 39 65.962 -2.714 12.688 1.00 0.00 O ATOM 615 CB GLU A 39 64.542 -5.812 12.881 1.00 0.00 C ATOM 616 CG GLU A 39 65.069 -7.235 12.674 1.00 0.00 C ATOM 617 CD GLU A 39 65.997 -7.610 13.831 1.00 0.00 C ATOM 618 OE1 GLU A 39 65.624 -7.364 14.966 1.00 0.00 O ATOM 619 OE2 GLU A 39 67.064 -8.136 13.562 1.00 0.00 O ATOM 0 H GLU A 39 67.034 -5.744 12.678 1.00 0.00 H new ATOM 0 HA GLU A 39 64.847 -5.015 10.910 1.00 0.00 H new ATOM 0 HB2 GLU A 39 64.715 -5.495 13.909 1.00 0.00 H new ATOM 0 HB3 GLU A 39 63.465 -5.784 12.715 1.00 0.00 H new ATOM 0 HG2 GLU A 39 64.237 -7.937 12.619 1.00 0.00 H new ATOM 0 HG3 GLU A 39 65.606 -7.301 11.728 1.00 0.00 H new ATOM 626 N ALA A 40 63.804 -2.948 12.384 1.00 0.00 N ATOM 627 CA ALA A 40 63.575 -1.539 12.818 1.00 0.00 C ATOM 628 C ALA A 40 62.087 -1.207 12.796 1.00 0.00 C ATOM 629 O ALA A 40 61.258 -2.026 12.460 1.00 0.00 O ATOM 630 CB ALA A 40 64.306 -0.599 11.861 1.00 0.00 C ATOM 0 H ALA A 40 62.968 -3.472 12.126 1.00 0.00 H new ATOM 0 HA ALA A 40 63.950 -1.418 13.834 1.00 0.00 H new ATOM 0 HB1 ALA A 40 64.144 0.433 12.171 1.00 0.00 H new ATOM 0 HB2 ALA A 40 65.373 -0.820 11.878 1.00 0.00 H new ATOM 0 HB3 ALA A 40 63.923 -0.739 10.850 1.00 0.00 H new ATOM 636 N VAL A 41 61.752 0.010 13.129 1.00 0.00 N ATOM 637 CA VAL A 41 60.330 0.436 13.096 1.00 0.00 C ATOM 638 C VAL A 41 60.201 1.607 12.140 1.00 0.00 C ATOM 639 O VAL A 41 60.833 2.627 12.311 1.00 0.00 O ATOM 640 CB VAL A 41 59.870 0.865 14.505 1.00 0.00 C ATOM 641 CG1 VAL A 41 58.914 2.073 14.414 1.00 0.00 C ATOM 642 CG2 VAL A 41 59.137 -0.293 15.159 1.00 0.00 C ATOM 0 H VAL A 41 62.410 0.731 13.424 1.00 0.00 H new ATOM 0 HA VAL A 41 59.705 -0.393 12.764 1.00 0.00 H new ATOM 0 HB VAL A 41 60.744 1.145 15.093 1.00 0.00 H new ATOM 0 HG11 VAL A 41 58.598 2.364 15.416 1.00 0.00 H new ATOM 0 HG12 VAL A 41 59.428 2.909 13.939 1.00 0.00 H new ATOM 0 HG13 VAL A 41 58.040 1.801 13.823 1.00 0.00 H new ATOM 0 HG21 VAL A 41 58.808 0.001 16.156 1.00 0.00 H new ATOM 0 HG22 VAL A 41 58.270 -0.562 14.555 1.00 0.00 H new ATOM 0 HG23 VAL A 41 59.806 -1.150 15.236 1.00 0.00 H new ATOM 652 N ILE A 42 59.370 1.495 11.164 1.00 0.00 N ATOM 653 CA ILE A 42 59.201 2.625 10.238 1.00 0.00 C ATOM 654 C ILE A 42 58.173 3.586 10.804 1.00 0.00 C ATOM 655 O ILE A 42 57.039 3.615 10.380 1.00 0.00 O ATOM 656 CB ILE A 42 58.741 2.120 8.891 1.00 0.00 C ATOM 657 CG1 ILE A 42 59.632 0.950 8.464 1.00 0.00 C ATOM 658 CG2 ILE A 42 58.847 3.256 7.879 1.00 0.00 C ATOM 659 CD1 ILE A 42 61.037 1.454 8.150 1.00 0.00 C ATOM 0 H ILE A 42 58.800 0.672 10.966 1.00 0.00 H new ATOM 0 HA ILE A 42 60.154 3.140 10.116 1.00 0.00 H new ATOM 0 HB ILE A 42 57.707 1.779 8.946 1.00 0.00 H new ATOM 0 HG12 ILE A 42 59.673 0.204 9.258 1.00 0.00 H new ATOM 0 HG13 ILE A 42 59.208 0.460 7.588 1.00 0.00 H new ATOM 0 HG21 ILE A 42 58.518 2.904 6.901 1.00 0.00 H new ATOM 0 HG22 ILE A 42 58.217 4.087 8.197 1.00 0.00 H new ATOM 0 HG23 ILE A 42 59.882 3.590 7.814 1.00 0.00 H new ATOM 0 HD11 ILE A 42 61.665 0.616 7.847 1.00 0.00 H new ATOM 0 HD12 ILE A 42 60.990 2.183 7.341 1.00 0.00 H new ATOM 0 HD13 ILE A 42 61.462 1.924 9.037 1.00 0.00 H new ATOM 671 N PHE A 43 58.563 4.374 11.764 1.00 0.00 N ATOM 672 CA PHE A 43 57.615 5.342 12.370 1.00 0.00 C ATOM 673 C PHE A 43 57.236 6.405 11.334 1.00 0.00 C ATOM 674 O PHE A 43 57.813 7.473 11.295 1.00 0.00 O ATOM 675 CB PHE A 43 58.288 6.023 13.565 1.00 0.00 C ATOM 676 CG PHE A 43 58.109 5.183 14.810 1.00 0.00 C ATOM 677 CD1 PHE A 43 56.844 4.630 15.107 1.00 0.00 C ATOM 678 CD2 PHE A 43 59.203 4.942 15.674 1.00 0.00 C ATOM 679 CE1 PHE A 43 56.672 3.839 16.264 1.00 0.00 C ATOM 680 CE2 PHE A 43 59.026 4.147 16.831 1.00 0.00 C ATOM 681 CZ PHE A 43 57.763 3.598 17.124 1.00 0.00 C ATOM 0 H PHE A 43 59.504 4.388 12.156 1.00 0.00 H new ATOM 0 HA PHE A 43 56.718 4.817 12.698 1.00 0.00 H new ATOM 0 HB2 PHE A 43 59.350 6.165 13.362 1.00 0.00 H new ATOM 0 HB3 PHE A 43 57.858 7.013 13.719 1.00 0.00 H new ATOM 0 HD1 PHE A 43 56.007 4.812 14.449 1.00 0.00 H new ATOM 0 HD2 PHE A 43 60.172 5.364 15.451 1.00 0.00 H new ATOM 0 HE1 PHE A 43 55.704 3.418 16.490 1.00 0.00 H new ATOM 0 HE2 PHE A 43 59.861 3.961 17.490 1.00 0.00 H new ATOM 0 HZ PHE A 43 57.630 2.992 18.008 1.00 0.00 H new ATOM 691 N LYS A 44 56.258 6.138 10.507 1.00 0.00 N ATOM 692 CA LYS A 44 55.848 7.155 9.504 1.00 0.00 C ATOM 693 C LYS A 44 55.345 8.376 10.248 1.00 0.00 C ATOM 694 O LYS A 44 54.234 8.399 10.719 1.00 0.00 O ATOM 695 CB LYS A 44 54.720 6.601 8.629 1.00 0.00 C ATOM 696 CG LYS A 44 55.179 6.556 7.171 1.00 0.00 C ATOM 697 CD LYS A 44 53.958 6.597 6.250 1.00 0.00 C ATOM 698 CE LYS A 44 54.223 5.740 5.010 1.00 0.00 C ATOM 699 NZ LYS A 44 53.377 4.514 5.065 1.00 0.00 N ATOM 0 H LYS A 44 55.731 5.265 10.486 1.00 0.00 H new ATOM 0 HA LYS A 44 56.695 7.412 8.869 1.00 0.00 H new ATOM 0 HB2 LYS A 44 54.443 5.602 8.965 1.00 0.00 H new ATOM 0 HB3 LYS A 44 53.832 7.227 8.723 1.00 0.00 H new ATOM 0 HG2 LYS A 44 55.836 7.400 6.959 1.00 0.00 H new ATOM 0 HG3 LYS A 44 55.756 5.649 6.988 1.00 0.00 H new ATOM 0 HD2 LYS A 44 53.079 6.229 6.778 1.00 0.00 H new ATOM 0 HD3 LYS A 44 53.746 7.625 5.956 1.00 0.00 H new ATOM 0 HE2 LYS A 44 54.000 6.309 4.107 1.00 0.00 H new ATOM 0 HE3 LYS A 44 55.277 5.466 4.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 53.556 3.931 4.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 53.610 3.969 5.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 52.373 4.786 5.091 1.00 0.00 H new ATOM 713 N THR A 45 56.163 9.376 10.391 1.00 0.00 N ATOM 714 CA THR A 45 55.732 10.579 11.149 1.00 0.00 C ATOM 715 C THR A 45 54.487 11.198 10.480 1.00 0.00 C ATOM 716 O THR A 45 53.765 10.532 9.767 1.00 0.00 O ATOM 717 CB THR A 45 56.883 11.585 11.190 1.00 0.00 C ATOM 718 OG1 THR A 45 57.532 11.616 9.929 1.00 0.00 O ATOM 719 CG2 THR A 45 57.875 11.155 12.268 1.00 0.00 C ATOM 0 H THR A 45 57.111 9.413 10.016 1.00 0.00 H new ATOM 0 HA THR A 45 55.469 10.301 12.170 1.00 0.00 H new ATOM 0 HB THR A 45 56.499 12.579 11.417 1.00 0.00 H new ATOM 0 HG1 THR A 45 58.230 10.928 9.903 1.00 0.00 H new ATOM 0 HG21 THR A 45 58.701 11.865 12.307 1.00 0.00 H new ATOM 0 HG22 THR A 45 57.373 11.129 13.235 1.00 0.00 H new ATOM 0 HG23 THR A 45 58.260 10.163 12.033 1.00 0.00 H new ATOM 727 N ILE A 46 54.231 12.460 10.699 1.00 0.00 N ATOM 728 CA ILE A 46 53.031 13.094 10.077 1.00 0.00 C ATOM 729 C ILE A 46 53.413 13.662 8.747 1.00 0.00 C ATOM 730 O ILE A 46 52.607 13.766 7.844 1.00 0.00 O ATOM 731 CB ILE A 46 52.509 14.230 10.955 1.00 0.00 C ATOM 732 CG1 ILE A 46 53.693 15.111 11.437 1.00 0.00 C ATOM 733 CG2 ILE A 46 51.736 13.652 12.154 1.00 0.00 C ATOM 734 CD1 ILE A 46 54.212 14.634 12.802 1.00 0.00 C ATOM 0 H ILE A 46 54.798 13.078 11.279 1.00 0.00 H new ATOM 0 HA ILE A 46 52.254 12.337 9.966 1.00 0.00 H new ATOM 0 HB ILE A 46 51.829 14.853 10.374 1.00 0.00 H new ATOM 0 HG12 ILE A 46 54.499 15.076 10.704 1.00 0.00 H new ATOM 0 HG13 ILE A 46 53.372 16.150 11.508 1.00 0.00 H new ATOM 0 HG21 ILE A 46 51.367 14.467 12.776 1.00 0.00 H new ATOM 0 HG22 ILE A 46 50.894 13.061 11.793 1.00 0.00 H new ATOM 0 HG23 ILE A 46 52.399 13.018 12.743 1.00 0.00 H new ATOM 0 HD11 ILE A 46 55.041 15.267 13.118 1.00 0.00 H new ATOM 0 HD12 ILE A 46 53.410 14.693 13.537 1.00 0.00 H new ATOM 0 HD13 ILE A 46 54.554 13.602 12.721 1.00 0.00 H new ATOM 746 N VAL A 47 54.636 14.022 8.605 1.00 0.00 N ATOM 747 CA VAL A 47 55.084 14.574 7.336 1.00 0.00 C ATOM 748 C VAL A 47 55.546 13.426 6.433 1.00 0.00 C ATOM 749 O VAL A 47 56.198 13.632 5.429 1.00 0.00 O ATOM 750 CB VAL A 47 56.218 15.549 7.605 1.00 0.00 C ATOM 751 CG1 VAL A 47 57.493 14.793 7.991 1.00 0.00 C ATOM 752 CG2 VAL A 47 56.462 16.373 6.364 1.00 0.00 C ATOM 0 H VAL A 47 55.352 13.954 9.328 1.00 0.00 H new ATOM 0 HA VAL A 47 54.276 15.106 6.834 1.00 0.00 H new ATOM 0 HB VAL A 47 55.943 16.202 8.433 1.00 0.00 H new ATOM 0 HG11 VAL A 47 58.296 15.506 8.180 1.00 0.00 H new ATOM 0 HG12 VAL A 47 57.310 14.206 8.891 1.00 0.00 H new ATOM 0 HG13 VAL A 47 57.783 14.129 7.177 1.00 0.00 H new ATOM 0 HG21 VAL A 47 57.275 17.076 6.548 1.00 0.00 H new ATOM 0 HG22 VAL A 47 56.731 15.715 5.538 1.00 0.00 H new ATOM 0 HG23 VAL A 47 55.557 16.924 6.109 1.00 0.00 H new ATOM 762 N ALA A 48 55.187 12.208 6.781 1.00 0.00 N ATOM 763 CA ALA A 48 55.571 11.046 5.952 1.00 0.00 C ATOM 764 C ALA A 48 57.072 10.791 6.079 1.00 0.00 C ATOM 765 O ALA A 48 57.666 10.115 5.262 1.00 0.00 O ATOM 766 CB ALA A 48 55.212 11.328 4.504 1.00 0.00 C ATOM 0 H ALA A 48 54.641 11.982 7.612 1.00 0.00 H new ATOM 0 HA ALA A 48 55.036 10.160 6.293 1.00 0.00 H new ATOM 0 HB1 ALA A 48 55.493 10.475 3.887 1.00 0.00 H new ATOM 0 HB2 ALA A 48 54.138 11.498 4.422 1.00 0.00 H new ATOM 0 HB3 ALA A 48 55.747 12.214 4.163 1.00 0.00 H new ATOM 772 N LYS A 49 57.687 11.303 7.108 1.00 0.00 N ATOM 773 CA LYS A 49 59.140 11.064 7.296 1.00 0.00 C ATOM 774 C LYS A 49 59.338 9.697 7.943 1.00 0.00 C ATOM 775 O LYS A 49 59.511 9.585 9.140 1.00 0.00 O ATOM 776 CB LYS A 49 59.729 12.148 8.193 1.00 0.00 C ATOM 777 CG LYS A 49 60.835 12.889 7.440 1.00 0.00 C ATOM 778 CD LYS A 49 60.920 14.329 7.947 1.00 0.00 C ATOM 779 CE LYS A 49 61.842 14.388 9.166 1.00 0.00 C ATOM 780 NZ LYS A 49 62.297 15.791 9.379 1.00 0.00 N ATOM 0 H LYS A 49 57.244 11.876 7.826 1.00 0.00 H new ATOM 0 HA LYS A 49 59.645 11.091 6.330 1.00 0.00 H new ATOM 0 HB2 LYS A 49 58.950 12.847 8.496 1.00 0.00 H new ATOM 0 HB3 LYS A 49 60.130 11.703 9.104 1.00 0.00 H new ATOM 0 HG2 LYS A 49 61.790 12.384 7.585 1.00 0.00 H new ATOM 0 HG3 LYS A 49 60.630 12.881 6.370 1.00 0.00 H new ATOM 0 HD2 LYS A 49 61.298 14.981 7.160 1.00 0.00 H new ATOM 0 HD3 LYS A 49 59.927 14.692 8.211 1.00 0.00 H new ATOM 0 HE2 LYS A 49 61.317 14.027 10.050 1.00 0.00 H new ATOM 0 HE3 LYS A 49 62.702 13.735 9.017 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 62.924 15.831 10.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 62.813 16.120 8.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 61.472 16.403 9.540 1.00 0.00 H new ATOM 794 N GLU A 50 59.310 8.651 7.160 1.00 0.00 N ATOM 795 CA GLU A 50 59.490 7.287 7.730 1.00 0.00 C ATOM 796 C GLU A 50 60.763 7.260 8.568 1.00 0.00 C ATOM 797 O GLU A 50 61.856 7.383 8.053 1.00 0.00 O ATOM 798 CB GLU A 50 59.607 6.271 6.592 1.00 0.00 C ATOM 799 CG GLU A 50 58.224 6.013 5.993 1.00 0.00 C ATOM 800 CD GLU A 50 58.310 6.069 4.466 1.00 0.00 C ATOM 801 OE1 GLU A 50 59.245 5.502 3.924 1.00 0.00 O ATOM 802 OE2 GLU A 50 57.440 6.678 3.866 1.00 0.00 O ATOM 0 H GLU A 50 59.170 8.684 6.150 1.00 0.00 H new ATOM 0 HA GLU A 50 58.634 7.033 8.355 1.00 0.00 H new ATOM 0 HB2 GLU A 50 60.283 6.646 5.824 1.00 0.00 H new ATOM 0 HB3 GLU A 50 60.033 5.339 6.965 1.00 0.00 H new ATOM 0 HG2 GLU A 50 57.854 5.038 6.311 1.00 0.00 H new ATOM 0 HG3 GLU A 50 57.515 6.757 6.355 1.00 0.00 H new ATOM 809 N ILE A 51 60.638 7.116 9.858 1.00 0.00 N ATOM 810 CA ILE A 51 61.862 7.102 10.710 1.00 0.00 C ATOM 811 C ILE A 51 62.111 5.714 11.251 1.00 0.00 C ATOM 812 O ILE A 51 61.438 5.260 12.156 1.00 0.00 O ATOM 813 CB ILE A 51 61.724 8.042 11.907 1.00 0.00 C ATOM 814 CG1 ILE A 51 60.623 9.064 11.682 1.00 0.00 C ATOM 815 CG2 ILE A 51 63.043 8.772 12.117 1.00 0.00 C ATOM 816 CD1 ILE A 51 60.463 9.873 12.958 1.00 0.00 C ATOM 0 H ILE A 51 59.754 7.009 10.355 1.00 0.00 H new ATOM 0 HA ILE A 51 62.688 7.428 10.079 1.00 0.00 H new ATOM 0 HB ILE A 51 61.467 7.448 12.784 1.00 0.00 H new ATOM 0 HG12 ILE A 51 60.875 9.717 10.846 1.00 0.00 H new ATOM 0 HG13 ILE A 51 59.688 8.566 11.427 1.00 0.00 H new ATOM 0 HG21 ILE A 51 62.954 9.446 12.969 1.00 0.00 H new ATOM 0 HG22 ILE A 51 63.834 8.047 12.308 1.00 0.00 H new ATOM 0 HG23 ILE A 51 63.287 9.347 11.224 1.00 0.00 H new ATOM 0 HD11 ILE A 51 59.677 10.615 12.822 1.00 0.00 H new ATOM 0 HD12 ILE A 51 60.196 9.208 13.779 1.00 0.00 H new ATOM 0 HD13 ILE A 51 61.401 10.377 13.189 1.00 0.00 H new ATOM 828 N CYS A 52 63.120 5.069 10.779 1.00 0.00 N ATOM 829 CA CYS A 52 63.469 3.756 11.340 1.00 0.00 C ATOM 830 C CYS A 52 63.852 3.971 12.799 1.00 0.00 C ATOM 831 O CYS A 52 64.625 4.844 13.116 1.00 0.00 O ATOM 832 CB CYS A 52 64.642 3.175 10.570 1.00 0.00 C ATOM 833 SG CYS A 52 64.023 2.389 9.062 1.00 0.00 S ATOM 0 H CYS A 52 63.723 5.396 10.024 1.00 0.00 H new ATOM 0 HA CYS A 52 62.632 3.062 11.267 1.00 0.00 H new ATOM 0 HB2 CYS A 52 65.355 3.961 10.320 1.00 0.00 H new ATOM 0 HB3 CYS A 52 65.172 2.447 11.184 1.00 0.00 H new ATOM 838 N ALA A 53 63.288 3.224 13.690 1.00 0.00 N ATOM 839 CA ALA A 53 63.601 3.432 15.130 1.00 0.00 C ATOM 840 C ALA A 53 63.923 2.085 15.784 1.00 0.00 C ATOM 841 O ALA A 53 63.332 1.074 15.464 1.00 0.00 O ATOM 842 CB ALA A 53 62.397 4.080 15.824 1.00 0.00 C ATOM 0 H ALA A 53 62.623 2.477 13.491 1.00 0.00 H new ATOM 0 HA ALA A 53 64.465 4.089 15.227 1.00 0.00 H new ATOM 0 HB1 ALA A 53 62.624 4.233 16.879 1.00 0.00 H new ATOM 0 HB2 ALA A 53 62.181 5.040 15.356 1.00 0.00 H new ATOM 0 HB3 ALA A 53 61.529 3.428 15.731 1.00 0.00 H new ATOM 848 N ASP A 54 64.867 2.064 16.685 1.00 0.00 N ATOM 849 CA ASP A 54 65.246 0.781 17.345 1.00 0.00 C ATOM 850 C ASP A 54 64.064 0.259 18.191 1.00 0.00 C ATOM 851 O ASP A 54 63.695 0.878 19.168 1.00 0.00 O ATOM 852 CB ASP A 54 66.451 1.023 18.258 1.00 0.00 C ATOM 853 CG ASP A 54 66.842 -0.287 18.943 1.00 0.00 C ATOM 854 OD1 ASP A 54 66.661 -1.329 18.335 1.00 0.00 O ATOM 855 OD2 ASP A 54 67.316 -0.226 20.066 1.00 0.00 O ATOM 0 H ASP A 54 65.393 2.881 16.993 1.00 0.00 H new ATOM 0 HA ASP A 54 65.498 0.043 16.584 1.00 0.00 H new ATOM 0 HB2 ASP A 54 67.290 1.407 17.677 1.00 0.00 H new ATOM 0 HB3 ASP A 54 66.209 1.779 19.005 1.00 0.00 H new ATOM 860 N PRO A 55 63.506 -0.881 17.795 1.00 0.00 N ATOM 861 CA PRO A 55 62.388 -1.480 18.527 1.00 0.00 C ATOM 862 C PRO A 55 62.830 -1.873 19.942 1.00 0.00 C ATOM 863 O PRO A 55 62.017 -2.137 20.806 1.00 0.00 O ATOM 864 CB PRO A 55 62.004 -2.733 17.721 1.00 0.00 C ATOM 865 CG PRO A 55 62.997 -2.835 16.521 1.00 0.00 C ATOM 866 CD PRO A 55 63.948 -1.630 16.608 1.00 0.00 C ATOM 0 HA PRO A 55 61.551 -0.790 18.632 1.00 0.00 H new ATOM 0 HB2 PRO A 55 62.063 -3.625 18.345 1.00 0.00 H new ATOM 0 HB3 PRO A 55 60.976 -2.661 17.365 1.00 0.00 H new ATOM 0 HG2 PRO A 55 63.556 -3.769 16.564 1.00 0.00 H new ATOM 0 HG3 PRO A 55 62.457 -2.830 15.574 1.00 0.00 H new ATOM 0 HD2 PRO A 55 64.985 -1.952 16.708 1.00 0.00 H new ATOM 0 HD3 PRO A 55 63.890 -1.016 15.709 1.00 0.00 H new ATOM 874 N LYS A 56 64.116 -1.925 20.183 1.00 0.00 N ATOM 875 CA LYS A 56 64.606 -2.311 21.527 1.00 0.00 C ATOM 876 C LYS A 56 64.692 -1.076 22.433 1.00 0.00 C ATOM 877 O LYS A 56 65.293 -1.113 23.488 1.00 0.00 O ATOM 878 CB LYS A 56 65.993 -2.945 21.400 1.00 0.00 C ATOM 879 CG LYS A 56 65.950 -4.063 20.357 1.00 0.00 C ATOM 880 CD LYS A 56 65.196 -5.265 20.927 1.00 0.00 C ATOM 881 CE LYS A 56 64.762 -6.185 19.785 1.00 0.00 C ATOM 882 NZ LYS A 56 63.387 -6.695 20.054 1.00 0.00 N ATOM 0 H LYS A 56 64.844 -1.715 19.500 1.00 0.00 H new ATOM 0 HA LYS A 56 63.911 -3.027 21.966 1.00 0.00 H new ATOM 0 HB2 LYS A 56 66.724 -2.190 21.110 1.00 0.00 H new ATOM 0 HB3 LYS A 56 66.312 -3.344 22.363 1.00 0.00 H new ATOM 0 HG2 LYS A 56 65.460 -3.710 19.450 1.00 0.00 H new ATOM 0 HG3 LYS A 56 66.963 -4.354 20.079 1.00 0.00 H new ATOM 0 HD2 LYS A 56 65.833 -5.809 21.624 1.00 0.00 H new ATOM 0 HD3 LYS A 56 64.324 -4.928 21.488 1.00 0.00 H new ATOM 0 HE2 LYS A 56 64.782 -5.643 18.839 1.00 0.00 H new ATOM 0 HE3 LYS A 56 65.458 -7.018 19.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 63.091 -7.321 19.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 63.383 -7.226 20.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 62.727 -5.894 20.124 1.00 0.00 H new ATOM 896 N GLN A 57 64.094 0.018 22.037 1.00 0.00 N ATOM 897 CA GLN A 57 64.145 1.240 22.885 1.00 0.00 C ATOM 898 C GLN A 57 62.963 1.229 23.855 1.00 0.00 C ATOM 899 O GLN A 57 62.073 0.408 23.753 1.00 0.00 O ATOM 900 CB GLN A 57 64.067 2.483 21.997 1.00 0.00 C ATOM 901 CG GLN A 57 65.398 3.235 22.052 1.00 0.00 C ATOM 902 CD GLN A 57 65.602 3.812 23.455 1.00 0.00 C ATOM 903 OE1 GLN A 57 65.791 3.079 24.405 1.00 0.00 O ATOM 904 NE2 GLN A 57 65.573 5.106 23.626 1.00 0.00 N ATOM 0 H GLN A 57 63.574 0.115 21.165 1.00 0.00 H new ATOM 0 HA GLN A 57 65.079 1.257 23.447 1.00 0.00 H new ATOM 0 HB2 GLN A 57 63.842 2.195 20.970 1.00 0.00 H new ATOM 0 HB3 GLN A 57 63.257 3.131 22.331 1.00 0.00 H new ATOM 0 HG2 GLN A 57 66.218 2.562 21.801 1.00 0.00 H new ATOM 0 HG3 GLN A 57 65.406 4.036 21.313 1.00 0.00 H new ATOM 0 HE21 GLN A 57 65.414 5.722 22.829 1.00 0.00 H new ATOM 0 HE22 GLN A 57 65.709 5.501 24.557 1.00 0.00 H new ATOM 913 N LYS A 58 62.946 2.127 24.800 1.00 0.00 N ATOM 914 CA LYS A 58 61.821 2.155 25.776 1.00 0.00 C ATOM 915 C LYS A 58 60.754 3.152 25.310 1.00 0.00 C ATOM 916 O LYS A 58 59.633 3.129 25.775 1.00 0.00 O ATOM 917 CB LYS A 58 62.349 2.568 27.160 1.00 0.00 C ATOM 918 CG LYS A 58 61.172 2.833 28.120 1.00 0.00 C ATOM 919 CD LYS A 58 60.203 1.642 28.104 1.00 0.00 C ATOM 920 CE LYS A 58 60.879 0.423 28.734 1.00 0.00 C ATOM 921 NZ LYS A 58 60.133 0.020 29.959 1.00 0.00 N ATOM 0 H LYS A 58 63.661 2.841 24.939 1.00 0.00 H new ATOM 0 HA LYS A 58 61.377 1.162 25.841 1.00 0.00 H new ATOM 0 HB2 LYS A 58 62.987 1.782 27.563 1.00 0.00 H new ATOM 0 HB3 LYS A 58 62.964 3.464 27.071 1.00 0.00 H new ATOM 0 HG2 LYS A 58 61.546 2.995 29.131 1.00 0.00 H new ATOM 0 HG3 LYS A 58 60.649 3.742 27.825 1.00 0.00 H new ATOM 0 HD2 LYS A 58 59.295 1.891 28.653 1.00 0.00 H new ATOM 0 HD3 LYS A 58 59.905 1.417 27.080 1.00 0.00 H new ATOM 0 HE2 LYS A 58 60.903 -0.402 28.022 1.00 0.00 H new ATOM 0 HE3 LYS A 58 61.913 0.657 28.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 60.592 -0.809 30.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 60.132 0.806 30.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 59.153 -0.219 29.706 1.00 0.00 H new ATOM 935 N TRP A 59 61.082 4.018 24.391 1.00 0.00 N ATOM 936 CA TRP A 59 60.068 4.986 23.907 1.00 0.00 C ATOM 937 C TRP A 59 59.434 4.431 22.636 1.00 0.00 C ATOM 938 O TRP A 59 58.290 4.696 22.331 1.00 0.00 O ATOM 939 CB TRP A 59 60.736 6.352 23.640 1.00 0.00 C ATOM 940 CG TRP A 59 61.502 6.321 22.352 1.00 0.00 C ATOM 941 CD1 TRP A 59 62.780 5.891 22.213 1.00 0.00 C ATOM 942 CD2 TRP A 59 61.061 6.734 21.032 1.00 0.00 C ATOM 943 NE1 TRP A 59 63.151 6.016 20.882 1.00 0.00 N ATOM 944 CE2 TRP A 59 62.126 6.530 20.113 1.00 0.00 C ATOM 945 CE3 TRP A 59 59.842 7.265 20.540 1.00 0.00 C ATOM 946 CZ2 TRP A 59 61.990 6.842 18.748 1.00 0.00 C ATOM 947 CZ3 TRP A 59 59.703 7.580 19.165 1.00 0.00 C ATOM 948 CH2 TRP A 59 60.782 7.365 18.276 1.00 0.00 C ATOM 0 H TRP A 59 62.003 4.094 23.959 1.00 0.00 H new ATOM 0 HA TRP A 59 59.293 5.132 24.659 1.00 0.00 H new ATOM 0 HB2 TRP A 59 59.976 7.133 23.599 1.00 0.00 H new ATOM 0 HB3 TRP A 59 61.406 6.602 24.462 1.00 0.00 H new ATOM 0 HD1 TRP A 59 63.406 5.513 23.008 1.00 0.00 H new ATOM 0 HE1 TRP A 59 64.068 5.760 20.517 1.00 0.00 H new ATOM 0 HE3 TRP A 59 59.016 7.430 21.216 1.00 0.00 H new ATOM 0 HZ2 TRP A 59 62.814 6.679 18.069 1.00 0.00 H new ATOM 0 HZ3 TRP A 59 58.772 7.985 18.796 1.00 0.00 H new ATOM 0 HH2 TRP A 59 60.673 7.606 17.229 1.00 0.00 H new ATOM 959 N VAL A 60 60.162 3.630 21.911 1.00 0.00 N ATOM 960 CA VAL A 60 59.600 3.021 20.685 1.00 0.00 C ATOM 961 C VAL A 60 58.738 1.816 21.074 1.00 0.00 C ATOM 962 O VAL A 60 58.000 1.293 20.274 1.00 0.00 O ATOM 963 CB VAL A 60 60.740 2.576 19.774 1.00 0.00 C ATOM 964 CG1 VAL A 60 60.175 1.818 18.575 1.00 0.00 C ATOM 965 CG2 VAL A 60 61.491 3.808 19.284 1.00 0.00 C ATOM 0 H VAL A 60 61.127 3.372 22.120 1.00 0.00 H new ATOM 0 HA VAL A 60 58.984 3.748 20.156 1.00 0.00 H new ATOM 0 HB VAL A 60 61.416 1.923 20.326 1.00 0.00 H new ATOM 0 HG11 VAL A 60 60.992 1.502 17.927 1.00 0.00 H new ATOM 0 HG12 VAL A 60 59.628 0.942 18.923 1.00 0.00 H new ATOM 0 HG13 VAL A 60 59.501 2.469 18.018 1.00 0.00 H new ATOM 0 HG21 VAL A 60 62.308 3.500 18.632 1.00 0.00 H new ATOM 0 HG22 VAL A 60 60.809 4.454 18.731 1.00 0.00 H new ATOM 0 HG23 VAL A 60 61.894 4.352 20.138 1.00 0.00 H new ATOM 975 N GLN A 61 58.807 1.388 22.306 1.00 0.00 N ATOM 976 CA GLN A 61 57.958 0.248 22.739 1.00 0.00 C ATOM 977 C GLN A 61 56.586 0.790 23.120 1.00 0.00 C ATOM 978 O GLN A 61 55.584 0.112 23.011 1.00 0.00 O ATOM 979 CB GLN A 61 58.596 -0.442 23.947 1.00 0.00 C ATOM 980 CG GLN A 61 59.561 -1.527 23.464 1.00 0.00 C ATOM 981 CD GLN A 61 58.834 -2.872 23.414 1.00 0.00 C ATOM 982 OE1 GLN A 61 58.054 -3.186 24.290 1.00 0.00 O ATOM 983 NE2 GLN A 61 59.057 -3.684 22.418 1.00 0.00 N ATOM 0 H GLN A 61 59.413 1.779 23.027 1.00 0.00 H new ATOM 0 HA GLN A 61 57.863 -0.478 21.931 1.00 0.00 H new ATOM 0 HB2 GLN A 61 59.128 0.288 24.557 1.00 0.00 H new ATOM 0 HB3 GLN A 61 57.824 -0.882 24.578 1.00 0.00 H new ATOM 0 HG2 GLN A 61 59.946 -1.273 22.476 1.00 0.00 H new ATOM 0 HG3 GLN A 61 60.419 -1.590 24.134 1.00 0.00 H new ATOM 0 HE21 GLN A 61 59.712 -3.420 21.682 1.00 0.00 H new ATOM 0 HE22 GLN A 61 58.576 -4.583 22.375 1.00 0.00 H new ATOM 992 N ASP A 62 56.530 2.026 23.538 1.00 0.00 N ATOM 993 CA ASP A 62 55.228 2.629 23.892 1.00 0.00 C ATOM 994 C ASP A 62 54.611 3.233 22.633 1.00 0.00 C ATOM 995 O ASP A 62 53.408 3.232 22.454 1.00 0.00 O ATOM 996 CB ASP A 62 55.437 3.726 24.939 1.00 0.00 C ATOM 997 CG ASP A 62 56.125 3.133 26.169 1.00 0.00 C ATOM 998 OD1 ASP A 62 55.478 2.385 26.882 1.00 0.00 O ATOM 999 OD2 ASP A 62 57.287 3.439 26.378 1.00 0.00 O ATOM 0 H ASP A 62 57.337 2.640 23.647 1.00 0.00 H new ATOM 0 HA ASP A 62 54.565 1.868 24.303 1.00 0.00 H new ATOM 0 HB2 ASP A 62 56.043 4.530 24.522 1.00 0.00 H new ATOM 0 HB3 ASP A 62 54.479 4.162 25.220 1.00 0.00 H new ATOM 1004 N SER A 63 55.432 3.734 21.749 1.00 0.00 N ATOM 1005 CA SER A 63 54.908 4.327 20.490 1.00 0.00 C ATOM 1006 C SER A 63 54.530 3.206 19.524 1.00 0.00 C ATOM 1007 O SER A 63 53.429 3.149 19.029 1.00 0.00 O ATOM 1008 CB SER A 63 55.988 5.192 19.853 1.00 0.00 C ATOM 1009 OG SER A 63 56.736 5.841 20.873 1.00 0.00 O ATOM 0 H SER A 63 56.447 3.757 21.848 1.00 0.00 H new ATOM 0 HA SER A 63 54.031 4.936 20.710 1.00 0.00 H new ATOM 0 HB2 SER A 63 56.646 4.577 19.239 1.00 0.00 H new ATOM 0 HB3 SER A 63 55.535 5.931 19.193 1.00 0.00 H new ATOM 0 HG SER A 63 57.524 5.302 21.094 1.00 0.00 H new ATOM 1015 N MET A 64 55.446 2.311 19.250 1.00 0.00 N ATOM 1016 CA MET A 64 55.143 1.190 18.309 1.00 0.00 C ATOM 1017 C MET A 64 53.838 0.513 18.731 1.00 0.00 C ATOM 1018 O MET A 64 53.111 -0.008 17.917 1.00 0.00 O ATOM 1019 CB MET A 64 56.302 0.163 18.324 1.00 0.00 C ATOM 1020 CG MET A 64 56.224 -0.734 19.580 1.00 0.00 C ATOM 1021 SD MET A 64 57.419 -2.088 19.435 1.00 0.00 S ATOM 1022 CE MET A 64 58.920 -1.081 19.440 1.00 0.00 C ATOM 0 H MET A 64 56.390 2.308 19.637 1.00 0.00 H new ATOM 0 HA MET A 64 55.035 1.583 17.298 1.00 0.00 H new ATOM 0 HB2 MET A 64 56.258 -0.455 17.427 1.00 0.00 H new ATOM 0 HB3 MET A 64 57.258 0.686 18.304 1.00 0.00 H new ATOM 0 HG2 MET A 64 56.433 -0.145 20.473 1.00 0.00 H new ATOM 0 HG3 MET A 64 55.217 -1.135 19.691 1.00 0.00 H new ATOM 0 HE1 MET A 64 59.794 -1.731 19.393 1.00 0.00 H new ATOM 0 HE2 MET A 64 58.915 -0.417 18.576 1.00 0.00 H new ATOM 0 HE3 MET A 64 58.957 -0.488 20.354 1.00 0.00 H new ATOM 1032 N ASP A 65 53.546 0.522 20.003 1.00 0.00 N ATOM 1033 CA ASP A 65 52.299 -0.109 20.487 1.00 0.00 C ATOM 1034 C ASP A 65 51.151 0.870 20.306 1.00 0.00 C ATOM 1035 O ASP A 65 50.044 0.495 19.973 1.00 0.00 O ATOM 1036 CB ASP A 65 52.446 -0.463 21.969 1.00 0.00 C ATOM 1037 CG ASP A 65 52.942 -1.904 22.103 1.00 0.00 C ATOM 1038 OD1 ASP A 65 53.837 -2.272 21.361 1.00 0.00 O ATOM 1039 OD2 ASP A 65 52.417 -2.614 22.945 1.00 0.00 O ATOM 0 H ASP A 65 54.126 0.944 20.728 1.00 0.00 H new ATOM 0 HA ASP A 65 52.100 -1.019 19.921 1.00 0.00 H new ATOM 0 HB2 ASP A 65 53.147 0.220 22.449 1.00 0.00 H new ATOM 0 HB3 ASP A 65 51.489 -0.348 22.478 1.00 0.00 H new ATOM 1044 N HIS A 66 51.413 2.126 20.503 1.00 0.00 N ATOM 1045 CA HIS A 66 50.351 3.142 20.323 1.00 0.00 C ATOM 1046 C HIS A 66 49.867 3.093 18.876 1.00 0.00 C ATOM 1047 O HIS A 66 48.738 3.422 18.574 1.00 0.00 O ATOM 1048 CB HIS A 66 50.910 4.532 20.632 1.00 0.00 C ATOM 1049 CG HIS A 66 49.823 5.557 20.464 1.00 0.00 C ATOM 1050 ND1 HIS A 66 49.550 6.447 19.456 1.00 0.00 N flip ATOM 1051 CD2 HIS A 66 48.842 5.759 21.423 1.00 0.00 C flip ATOM 1052 CE1 HIS A 66 48.420 7.191 19.778 1.00 0.00 C flip ATOM 1053 NE2 HIS A 66 48.032 6.737 20.974 1.00 0.00 N flip ATOM 0 H HIS A 66 52.322 2.494 20.783 1.00 0.00 H new ATOM 0 HA HIS A 66 49.522 2.936 20.999 1.00 0.00 H new ATOM 0 HB2 HIS A 66 51.298 4.562 21.650 1.00 0.00 H new ATOM 0 HB3 HIS A 66 51.743 4.757 19.966 1.00 0.00 H new ATOM 0 HD2 HIS A 66 48.745 5.229 22.359 1.00 0.00 H new ATOM 0 HE1 HIS A 66 47.956 7.968 19.189 1.00 0.00 H new ATOM 0 HE2 HIS A 66 47.222 7.088 21.484 1.00 0.00 H new ATOM 1061 N LEU A 67 50.716 2.664 17.983 1.00 0.00 N ATOM 1062 CA LEU A 67 50.318 2.562 16.558 1.00 0.00 C ATOM 1063 C LEU A 67 49.855 1.140 16.292 1.00 0.00 C ATOM 1064 O LEU A 67 48.993 0.895 15.469 1.00 0.00 O ATOM 1065 CB LEU A 67 51.520 2.896 15.659 1.00 0.00 C ATOM 1066 CG LEU A 67 52.277 4.104 16.229 1.00 0.00 C ATOM 1067 CD1 LEU A 67 53.650 4.206 15.583 1.00 0.00 C ATOM 1068 CD2 LEU A 67 51.500 5.372 15.933 1.00 0.00 C ATOM 0 H LEU A 67 51.674 2.379 18.185 1.00 0.00 H new ATOM 0 HA LEU A 67 49.513 3.264 16.341 1.00 0.00 H new ATOM 0 HB2 LEU A 67 52.186 2.036 15.593 1.00 0.00 H new ATOM 0 HB3 LEU A 67 51.179 3.114 14.647 1.00 0.00 H new ATOM 0 HG LEU A 67 52.389 3.977 17.306 1.00 0.00 H new ATOM 0 HD11 LEU A 67 54.182 5.065 15.992 1.00 0.00 H new ATOM 0 HD12 LEU A 67 54.217 3.298 15.788 1.00 0.00 H new ATOM 0 HD13 LEU A 67 53.537 4.328 14.506 1.00 0.00 H new ATOM 0 HD21 LEU A 67 52.037 6.230 16.337 1.00 0.00 H new ATOM 0 HD22 LEU A 67 51.390 5.488 14.855 1.00 0.00 H new ATOM 0 HD23 LEU A 67 50.514 5.311 16.394 1.00 0.00 H new ATOM 1080 N ASP A 68 50.385 0.202 17.021 1.00 0.00 N ATOM 1081 CA ASP A 68 49.950 -1.196 16.863 1.00 0.00 C ATOM 1082 C ASP A 68 48.505 -1.318 17.346 1.00 0.00 C ATOM 1083 O ASP A 68 47.838 -2.303 17.099 1.00 0.00 O ATOM 1084 CB ASP A 68 50.855 -2.109 17.695 1.00 0.00 C ATOM 1085 CG ASP A 68 51.509 -3.149 16.782 1.00 0.00 C ATOM 1086 OD1 ASP A 68 50.826 -3.648 15.902 1.00 0.00 O ATOM 1087 OD2 ASP A 68 52.680 -3.428 16.978 1.00 0.00 O ATOM 0 H ASP A 68 51.108 0.353 17.725 1.00 0.00 H new ATOM 0 HA ASP A 68 50.014 -1.492 15.816 1.00 0.00 H new ATOM 0 HB2 ASP A 68 51.621 -1.519 18.199 1.00 0.00 H new ATOM 0 HB3 ASP A 68 50.273 -2.606 18.472 1.00 0.00 H new ATOM 1092 N LYS A 69 48.005 -0.308 18.018 1.00 0.00 N ATOM 1093 CA LYS A 69 46.614 -0.355 18.490 1.00 0.00 C ATOM 1094 C LYS A 69 45.961 1.004 18.274 1.00 0.00 C ATOM 1095 O LYS A 69 45.190 1.475 19.086 1.00 0.00 O ATOM 1096 CB LYS A 69 46.577 -0.721 19.976 1.00 0.00 C ATOM 1097 CG LYS A 69 47.297 0.357 20.787 1.00 0.00 C ATOM 1098 CD LYS A 69 48.183 -0.304 21.845 1.00 0.00 C ATOM 1099 CE LYS A 69 48.819 0.774 22.723 1.00 0.00 C ATOM 1100 NZ LYS A 69 48.451 0.536 24.147 1.00 0.00 N ATOM 0 H LYS A 69 48.515 0.544 18.253 1.00 0.00 H new ATOM 0 HA LYS A 69 46.068 -1.113 17.928 1.00 0.00 H new ATOM 0 HB2 LYS A 69 45.544 -0.815 20.312 1.00 0.00 H new ATOM 0 HB3 LYS A 69 47.053 -1.689 20.135 1.00 0.00 H new ATOM 0 HG2 LYS A 69 47.903 0.979 20.128 1.00 0.00 H new ATOM 0 HG3 LYS A 69 46.570 1.013 21.265 1.00 0.00 H new ATOM 0 HD2 LYS A 69 47.591 -0.984 22.457 1.00 0.00 H new ATOM 0 HD3 LYS A 69 48.958 -0.901 21.364 1.00 0.00 H new ATOM 0 HE2 LYS A 69 49.903 0.758 22.609 1.00 0.00 H new ATOM 0 HE3 LYS A 69 48.480 1.761 22.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 48.883 1.269 24.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 47.417 0.572 24.249 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 48.796 -0.400 24.443 1.00 0.00 H new ATOM 1114 N GLN A 70 46.260 1.632 17.177 1.00 0.00 N ATOM 1115 CA GLN A 70 45.666 2.947 16.885 1.00 0.00 C ATOM 1116 C GLN A 70 44.444 2.775 15.975 1.00 0.00 C ATOM 1117 O GLN A 70 43.717 3.714 15.714 1.00 0.00 O ATOM 1118 CB GLN A 70 46.700 3.834 16.188 1.00 0.00 C ATOM 1119 CG GLN A 70 47.141 3.172 14.881 1.00 0.00 C ATOM 1120 CD GLN A 70 46.919 4.142 13.719 1.00 0.00 C ATOM 1121 OE1 GLN A 70 47.765 4.281 12.859 1.00 0.00 O ATOM 1122 NE2 GLN A 70 45.808 4.822 13.655 1.00 0.00 N ATOM 0 H GLN A 70 46.900 1.280 16.465 1.00 0.00 H new ATOM 0 HA GLN A 70 45.356 3.415 17.819 1.00 0.00 H new ATOM 0 HB2 GLN A 70 46.274 4.817 15.985 1.00 0.00 H new ATOM 0 HB3 GLN A 70 47.561 3.988 16.839 1.00 0.00 H new ATOM 0 HG2 GLN A 70 48.193 2.892 14.939 1.00 0.00 H new ATOM 0 HG3 GLN A 70 46.576 2.255 14.716 1.00 0.00 H new ATOM 0 HE21 GLN A 70 45.097 4.706 14.377 1.00 0.00 H new ATOM 0 HE22 GLN A 70 45.650 5.470 12.883 1.00 0.00 H new ATOM 1131 N THR A 71 44.214 1.585 15.485 1.00 0.00 N ATOM 1132 CA THR A 71 43.054 1.361 14.595 1.00 0.00 C ATOM 1133 C THR A 71 42.560 -0.080 14.750 1.00 0.00 C ATOM 1134 O THR A 71 42.157 -0.714 13.796 1.00 0.00 O ATOM 1135 CB THR A 71 43.473 1.603 13.145 1.00 0.00 C ATOM 1136 OG1 THR A 71 42.357 1.402 12.289 1.00 0.00 O ATOM 1137 CG2 THR A 71 44.592 0.629 12.767 1.00 0.00 C ATOM 0 H THR A 71 44.786 0.760 15.668 1.00 0.00 H new ATOM 0 HA THR A 71 42.252 2.049 14.863 1.00 0.00 H new ATOM 0 HB THR A 71 43.832 2.626 13.037 1.00 0.00 H new ATOM 0 HG1 THR A 71 41.920 0.554 12.515 1.00 0.00 H new ATOM 0 HG21 THR A 71 44.891 0.802 11.733 1.00 0.00 H new ATOM 0 HG22 THR A 71 45.448 0.786 13.423 1.00 0.00 H new ATOM 0 HG23 THR A 71 44.235 -0.395 12.875 1.00 0.00 H new ATOM 1145 N GLN A 72 42.584 -0.601 15.947 1.00 0.00 N ATOM 1146 CA GLN A 72 42.115 -1.989 16.160 1.00 0.00 C ATOM 1147 C GLN A 72 41.550 -2.126 17.576 1.00 0.00 C ATOM 1148 O GLN A 72 42.095 -2.826 18.407 1.00 0.00 O ATOM 1149 CB GLN A 72 43.284 -2.960 15.978 1.00 0.00 C ATOM 1150 CG GLN A 72 44.447 -2.533 16.875 1.00 0.00 C ATOM 1151 CD GLN A 72 45.235 -3.768 17.315 1.00 0.00 C ATOM 1152 OE1 GLN A 72 45.694 -4.534 16.492 1.00 0.00 O ATOM 1153 NE2 GLN A 72 45.410 -3.995 18.587 1.00 0.00 N ATOM 0 H GLN A 72 42.910 -0.119 16.785 1.00 0.00 H new ATOM 0 HA GLN A 72 41.336 -2.223 15.435 1.00 0.00 H new ATOM 0 HB2 GLN A 72 42.971 -3.974 16.228 1.00 0.00 H new ATOM 0 HB3 GLN A 72 43.601 -2.973 14.935 1.00 0.00 H new ATOM 0 HG2 GLN A 72 45.100 -1.845 16.338 1.00 0.00 H new ATOM 0 HG3 GLN A 72 44.070 -2.000 17.748 1.00 0.00 H new ATOM 0 HE21 GLN A 72 45.024 -3.351 19.278 1.00 0.00 H new ATOM 0 HE22 GLN A 72 45.933 -4.816 18.891 1.00 0.00 H new ATOM 1162 N THR A 73 40.462 -1.464 17.856 1.00 0.00 N ATOM 1163 CA THR A 73 39.863 -1.555 19.217 1.00 0.00 C ATOM 1164 C THR A 73 38.493 -2.248 19.126 1.00 0.00 C ATOM 1165 O THR A 73 37.480 -1.590 19.000 1.00 0.00 O ATOM 1166 CB THR A 73 39.686 -0.147 19.789 1.00 0.00 C ATOM 1167 OG1 THR A 73 40.955 0.483 19.895 1.00 0.00 O ATOM 1168 CG2 THR A 73 39.042 -0.235 21.173 1.00 0.00 C ATOM 0 H THR A 73 39.961 -0.864 17.201 1.00 0.00 H new ATOM 0 HA THR A 73 40.520 -2.132 19.868 1.00 0.00 H new ATOM 0 HB THR A 73 39.045 0.436 19.128 1.00 0.00 H new ATOM 0 HG1 THR A 73 40.843 1.386 20.260 1.00 0.00 H new ATOM 0 HG21 THR A 73 38.916 0.768 21.580 1.00 0.00 H new ATOM 0 HG22 THR A 73 38.068 -0.718 21.091 1.00 0.00 H new ATOM 0 HG23 THR A 73 39.682 -0.818 21.836 1.00 0.00 H new ATOM 1176 N PRO A 74 38.501 -3.569 19.194 1.00 0.00 N ATOM 1177 CA PRO A 74 37.266 -4.352 19.120 1.00 0.00 C ATOM 1178 C PRO A 74 36.325 -3.967 20.265 1.00 0.00 C ATOM 1179 O PRO A 74 36.756 -3.570 21.329 1.00 0.00 O ATOM 1180 CB PRO A 74 37.712 -5.818 19.258 1.00 0.00 C ATOM 1181 CG PRO A 74 39.268 -5.821 19.400 1.00 0.00 C ATOM 1182 CD PRO A 74 39.734 -4.354 19.350 1.00 0.00 C ATOM 0 HA PRO A 74 36.723 -4.178 18.191 1.00 0.00 H new ATOM 0 HB2 PRO A 74 37.246 -6.281 20.128 1.00 0.00 H new ATOM 0 HB3 PRO A 74 37.405 -6.396 18.387 1.00 0.00 H new ATOM 0 HG2 PRO A 74 39.568 -6.288 20.338 1.00 0.00 H new ATOM 0 HG3 PRO A 74 39.726 -6.398 18.597 1.00 0.00 H new ATOM 0 HD2 PRO A 74 40.266 -4.077 20.260 1.00 0.00 H new ATOM 0 HD3 PRO A 74 40.418 -4.185 18.518 1.00 0.00 H new ATOM 1190 N LYS A 75 35.043 -4.081 20.054 1.00 0.00 N ATOM 1191 CA LYS A 75 34.075 -3.720 21.129 1.00 0.00 C ATOM 1192 C LYS A 75 34.196 -2.227 21.441 1.00 0.00 C ATOM 1193 O LYS A 75 34.766 -1.836 22.441 1.00 0.00 O ATOM 1194 CB LYS A 75 34.384 -4.534 22.388 1.00 0.00 C ATOM 1195 CG LYS A 75 33.199 -5.446 22.709 1.00 0.00 C ATOM 1196 CD LYS A 75 33.654 -6.563 23.651 1.00 0.00 C ATOM 1197 CE LYS A 75 32.522 -7.577 23.824 1.00 0.00 C ATOM 1198 NZ LYS A 75 33.099 -8.919 24.121 1.00 0.00 N ATOM 0 H LYS A 75 34.623 -4.408 19.184 1.00 0.00 H new ATOM 0 HA LYS A 75 33.061 -3.940 20.796 1.00 0.00 H new ATOM 0 HB2 LYS A 75 35.284 -5.129 22.237 1.00 0.00 H new ATOM 0 HB3 LYS A 75 34.580 -3.866 23.227 1.00 0.00 H new ATOM 0 HG2 LYS A 75 32.398 -4.870 23.172 1.00 0.00 H new ATOM 0 HG3 LYS A 75 32.795 -5.872 21.791 1.00 0.00 H new ATOM 0 HD2 LYS A 75 34.539 -7.055 23.248 1.00 0.00 H new ATOM 0 HD3 LYS A 75 33.934 -6.146 24.618 1.00 0.00 H new ATOM 0 HE2 LYS A 75 31.861 -7.266 24.633 1.00 0.00 H new ATOM 0 HE3 LYS A 75 31.917 -7.621 22.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 32.330 -9.609 24.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 33.712 -9.215 23.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 33.658 -8.871 24.997 1.00 0.00 H new ATOM 1212 N THR A 76 33.664 -1.389 20.594 1.00 0.00 N ATOM 1213 CA THR A 76 33.750 0.077 20.843 1.00 0.00 C ATOM 1214 C THR A 76 32.341 0.648 21.017 1.00 0.00 C ATOM 1215 O THR A 76 31.526 -0.017 21.636 1.00 0.00 O ATOM 1216 CB THR A 76 34.432 0.758 19.654 1.00 0.00 C ATOM 1217 OG1 THR A 76 34.394 2.166 19.829 1.00 0.00 O ATOM 1218 CG2 THR A 76 33.703 0.383 18.363 1.00 0.00 C ATOM 1219 OXT THR A 76 32.100 1.738 20.527 1.00 0.00 O ATOM 0 H THR A 76 33.174 -1.656 19.741 1.00 0.00 H new ATOM 0 HA THR A 76 34.331 0.258 21.748 1.00 0.00 H new ATOM 0 HB THR A 76 35.469 0.428 19.593 1.00 0.00 H new ATOM 0 HG1 THR A 76 33.467 2.478 19.769 1.00 0.00 H new ATOM 0 HG21 THR A 76 34.189 0.868 17.517 1.00 0.00 H new ATOM 0 HG22 THR A 76 33.734 -0.698 18.228 1.00 0.00 H new ATOM 0 HG23 THR A 76 32.665 0.711 18.423 1.00 0.00 H new TER 1227 THR A 76 ATOM 1228 N GLN B 1 72.750 19.374 5.158 1.00 0.00 N ATOM 1229 CA GLN B 1 72.248 18.834 6.453 1.00 0.00 C ATOM 1230 C GLN B 1 70.960 18.030 6.207 1.00 0.00 C ATOM 1231 O GLN B 1 69.877 18.504 6.485 1.00 0.00 O ATOM 1232 CB GLN B 1 71.952 19.992 7.408 1.00 0.00 C ATOM 1233 CG GLN B 1 72.375 19.605 8.826 1.00 0.00 C ATOM 1234 CD GLN B 1 73.870 19.876 9.005 1.00 0.00 C ATOM 1235 OE1 GLN B 1 74.428 20.725 8.340 1.00 0.00 O ATOM 1236 NE2 GLN B 1 74.546 19.186 9.882 1.00 0.00 N ATOM 0 H1 GLN B 1 73.774 19.206 5.085 1.00 0.00 H new ATOM 0 H2 GLN B 1 72.264 18.898 4.372 1.00 0.00 H new ATOM 0 H3 GLN B 1 72.563 20.396 5.112 1.00 0.00 H new ATOM 0 HA GLN B 1 73.004 18.184 6.894 1.00 0.00 H new ATOM 0 HB2 GLN B 1 72.487 20.886 7.089 1.00 0.00 H new ATOM 0 HB3 GLN B 1 70.889 20.232 7.387 1.00 0.00 H new ATOM 0 HG2 GLN B 1 71.801 20.175 9.556 1.00 0.00 H new ATOM 0 HG3 GLN B 1 72.162 18.551 9.006 1.00 0.00 H new ATOM 0 HE21 GLN B 1 74.077 18.473 10.441 1.00 0.00 H new ATOM 0 HE22 GLN B 1 75.543 19.360 10.009 1.00 0.00 H new ATOM 1247 N PRO B 2 71.120 16.826 5.685 1.00 0.00 N ATOM 1248 CA PRO B 2 69.979 15.951 5.398 1.00 0.00 C ATOM 1249 C PRO B 2 69.219 15.623 6.682 1.00 0.00 C ATOM 1250 O PRO B 2 69.469 14.623 7.325 1.00 0.00 O ATOM 1251 CB PRO B 2 70.595 14.676 4.797 1.00 0.00 C ATOM 1252 CG PRO B 2 72.145 14.873 4.769 1.00 0.00 C ATOM 1253 CD PRO B 2 72.438 16.268 5.352 1.00 0.00 C ATOM 0 HA PRO B 2 69.265 16.420 4.721 1.00 0.00 H new ATOM 0 HB2 PRO B 2 70.330 13.804 5.394 1.00 0.00 H new ATOM 0 HB3 PRO B 2 70.212 14.502 3.791 1.00 0.00 H new ATOM 0 HG2 PRO B 2 72.642 14.099 5.355 1.00 0.00 H new ATOM 0 HG3 PRO B 2 72.524 14.794 3.750 1.00 0.00 H new ATOM 0 HD2 PRO B 2 73.073 16.201 6.236 1.00 0.00 H new ATOM 0 HD3 PRO B 2 72.961 16.895 4.630 1.00 0.00 H new ATOM 1261 N ASP B 3 68.288 16.455 7.057 1.00 0.00 N ATOM 1262 CA ASP B 3 67.511 16.189 8.290 1.00 0.00 C ATOM 1263 C ASP B 3 66.740 14.879 8.127 1.00 0.00 C ATOM 1264 O ASP B 3 66.212 14.593 7.071 1.00 0.00 O ATOM 1265 CB ASP B 3 66.526 17.334 8.531 1.00 0.00 C ATOM 1266 CG ASP B 3 67.216 18.439 9.332 1.00 0.00 C ATOM 1267 OD1 ASP B 3 68.340 18.775 8.995 1.00 0.00 O ATOM 1268 OD2 ASP B 3 66.609 18.932 10.269 1.00 0.00 O ATOM 0 H ASP B 3 68.034 17.308 6.559 1.00 0.00 H new ATOM 0 HA ASP B 3 68.189 16.112 9.140 1.00 0.00 H new ATOM 0 HB2 ASP B 3 66.170 17.728 7.579 1.00 0.00 H new ATOM 0 HB3 ASP B 3 65.653 16.969 9.072 1.00 0.00 H new ATOM 1273 N ALA B 4 66.707 14.067 9.165 1.00 0.00 N ATOM 1274 CA ALA B 4 65.999 12.742 9.101 1.00 0.00 C ATOM 1275 C ALA B 4 66.983 11.703 8.605 1.00 0.00 C ATOM 1276 O ALA B 4 66.861 11.173 7.519 1.00 0.00 O ATOM 1277 CB ALA B 4 64.785 12.805 8.165 1.00 0.00 C ATOM 0 H ALA B 4 67.146 14.270 10.063 1.00 0.00 H new ATOM 0 HA ALA B 4 65.634 12.480 10.094 1.00 0.00 H new ATOM 0 HB1 ALA B 4 64.294 11.832 8.140 1.00 0.00 H new ATOM 0 HB2 ALA B 4 64.084 13.556 8.529 1.00 0.00 H new ATOM 0 HB3 ALA B 4 65.114 13.072 7.160 1.00 0.00 H new ATOM 1283 N ILE B 5 67.979 11.429 9.389 1.00 0.00 N ATOM 1284 CA ILE B 5 69.005 10.454 8.980 1.00 0.00 C ATOM 1285 C ILE B 5 68.573 9.046 9.372 1.00 0.00 C ATOM 1286 O ILE B 5 69.091 8.069 8.870 1.00 0.00 O ATOM 1287 CB ILE B 5 70.317 10.794 9.668 1.00 0.00 C ATOM 1288 CG1 ILE B 5 70.822 12.154 9.180 1.00 0.00 C ATOM 1289 CG2 ILE B 5 71.340 9.732 9.338 1.00 0.00 C ATOM 1290 CD1 ILE B 5 70.940 12.145 7.653 1.00 0.00 C ATOM 0 H ILE B 5 68.124 11.847 10.308 1.00 0.00 H new ATOM 0 HA ILE B 5 69.133 10.496 7.898 1.00 0.00 H new ATOM 0 HB ILE B 5 70.160 10.835 10.746 1.00 0.00 H new ATOM 0 HG12 ILE B 5 70.138 12.941 9.497 1.00 0.00 H new ATOM 0 HG13 ILE B 5 71.791 12.375 9.628 1.00 0.00 H new ATOM 0 HG21 ILE B 5 72.283 9.971 9.829 1.00 0.00 H new ATOM 0 HG22 ILE B 5 70.984 8.763 9.687 1.00 0.00 H new ATOM 0 HG23 ILE B 5 71.491 9.695 8.259 1.00 0.00 H new ATOM 0 HD11 ILE B 5 71.300 13.115 7.310 1.00 0.00 H new ATOM 0 HD12 ILE B 5 71.641 11.369 7.347 1.00 0.00 H new ATOM 0 HD13 ILE B 5 69.963 11.945 7.214 1.00 0.00 H new ATOM 1302 N ASN B 6 67.617 8.929 10.237 1.00 0.00 N ATOM 1303 CA ASN B 6 67.136 7.576 10.618 1.00 0.00 C ATOM 1304 C ASN B 6 66.035 7.199 9.649 1.00 0.00 C ATOM 1305 O ASN B 6 64.902 7.027 10.021 1.00 0.00 O ATOM 1306 CB ASN B 6 66.575 7.542 12.067 1.00 0.00 C ATOM 1307 CG ASN B 6 66.627 8.930 12.726 1.00 0.00 C ATOM 1308 OD1 ASN B 6 65.798 9.860 12.327 1.00 0.00 O flip ATOM 1309 ND2 ASN B 6 67.430 9.169 13.606 1.00 0.00 N flip ATOM 0 H ASN B 6 67.146 9.707 10.698 1.00 0.00 H new ATOM 0 HA ASN B 6 67.971 6.877 10.579 1.00 0.00 H new ATOM 0 HB2 ASN B 6 65.545 7.184 12.051 1.00 0.00 H new ATOM 0 HB3 ASN B 6 67.149 6.833 12.664 1.00 0.00 H new ATOM 0 HD21 ASN B 6 68.076 8.444 13.917 1.00 0.00 H new ATOM 0 HD22 ASN B 6 67.458 10.095 14.034 1.00 0.00 H new ATOM 1316 N ALA B 7 66.348 7.145 8.394 1.00 0.00 N ATOM 1317 CA ALA B 7 65.306 6.841 7.384 1.00 0.00 C ATOM 1318 C ALA B 7 65.471 5.420 6.841 1.00 0.00 C ATOM 1319 O ALA B 7 66.574 5.006 6.541 1.00 0.00 O ATOM 1320 CB ALA B 7 65.447 7.806 6.211 1.00 0.00 C ATOM 0 H ALA B 7 67.284 7.299 8.020 1.00 0.00 H new ATOM 0 HA ALA B 7 64.331 6.939 7.862 1.00 0.00 H new ATOM 0 HB1 ALA B 7 64.683 7.586 5.465 1.00 0.00 H new ATOM 0 HB2 ALA B 7 65.325 8.830 6.565 1.00 0.00 H new ATOM 0 HB3 ALA B 7 66.434 7.692 5.763 1.00 0.00 H new ATOM 1326 N PRO B 8 64.356 4.740 6.631 1.00 0.00 N ATOM 1327 CA PRO B 8 64.383 3.429 6.013 1.00 0.00 C ATOM 1328 C PRO B 8 64.828 3.620 4.576 1.00 0.00 C ATOM 1329 O PRO B 8 64.075 4.075 3.737 1.00 0.00 O ATOM 1330 CB PRO B 8 62.942 2.919 6.070 1.00 0.00 C ATOM 1331 CG PRO B 8 62.073 4.070 6.662 1.00 0.00 C ATOM 1332 CD PRO B 8 63.024 5.227 7.006 1.00 0.00 C ATOM 0 HA PRO B 8 65.057 2.725 6.502 1.00 0.00 H new ATOM 0 HB2 PRO B 8 62.591 2.643 5.076 1.00 0.00 H new ATOM 0 HB3 PRO B 8 62.874 2.026 6.691 1.00 0.00 H new ATOM 0 HG2 PRO B 8 61.320 4.392 5.943 1.00 0.00 H new ATOM 0 HG3 PRO B 8 61.541 3.732 7.551 1.00 0.00 H new ATOM 0 HD2 PRO B 8 62.763 6.131 6.455 1.00 0.00 H new ATOM 0 HD3 PRO B 8 62.978 5.476 8.066 1.00 0.00 H new ATOM 1340 N VAL B 9 66.057 3.363 4.302 1.00 0.00 N ATOM 1341 CA VAL B 9 66.578 3.620 2.947 1.00 0.00 C ATOM 1342 C VAL B 9 66.334 2.397 2.054 1.00 0.00 C ATOM 1343 O VAL B 9 66.987 1.380 2.175 1.00 0.00 O ATOM 1344 CB VAL B 9 68.064 3.888 3.076 1.00 0.00 C ATOM 1345 CG1 VAL B 9 68.717 2.677 3.702 1.00 0.00 C ATOM 1346 CG2 VAL B 9 68.667 4.162 1.711 1.00 0.00 C ATOM 0 H VAL B 9 66.734 2.982 4.963 1.00 0.00 H new ATOM 0 HA VAL B 9 66.075 4.474 2.494 1.00 0.00 H new ATOM 0 HB VAL B 9 68.230 4.764 3.703 1.00 0.00 H new ATOM 0 HG11 VAL B 9 69.788 2.852 3.803 1.00 0.00 H new ATOM 0 HG12 VAL B 9 68.284 2.499 4.686 1.00 0.00 H new ATOM 0 HG13 VAL B 9 68.550 1.806 3.069 1.00 0.00 H new ATOM 0 HG21 VAL B 9 69.735 4.353 1.817 1.00 0.00 H new ATOM 0 HG22 VAL B 9 68.515 3.297 1.066 1.00 0.00 H new ATOM 0 HG23 VAL B 9 68.185 5.033 1.268 1.00 0.00 H new ATOM 1356 N THR B 10 65.390 2.485 1.163 1.00 0.00 N ATOM 1357 CA THR B 10 65.102 1.329 0.277 1.00 0.00 C ATOM 1358 C THR B 10 66.280 1.097 -0.669 1.00 0.00 C ATOM 1359 O THR B 10 66.519 1.867 -1.577 1.00 0.00 O ATOM 1360 CB THR B 10 63.842 1.608 -0.540 1.00 0.00 C ATOM 1361 OG1 THR B 10 62.865 2.217 0.292 1.00 0.00 O ATOM 1362 CG2 THR B 10 63.298 0.293 -1.093 1.00 0.00 C ATOM 0 H THR B 10 64.806 3.307 1.010 1.00 0.00 H new ATOM 0 HA THR B 10 64.949 0.440 0.889 1.00 0.00 H new ATOM 0 HB THR B 10 64.081 2.278 -1.366 1.00 0.00 H new ATOM 0 HG1 THR B 10 62.057 2.398 -0.231 1.00 0.00 H new ATOM 0 HG21 THR B 10 62.398 0.488 -1.677 1.00 0.00 H new ATOM 0 HG22 THR B 10 64.050 -0.173 -1.730 1.00 0.00 H new ATOM 0 HG23 THR B 10 63.057 -0.377 -0.268 1.00 0.00 H new ATOM 1370 N CYS B 11 67.010 0.034 -0.469 1.00 0.00 N ATOM 1371 CA CYS B 11 68.165 -0.252 -1.370 1.00 0.00 C ATOM 1372 C CYS B 11 68.094 -1.706 -1.840 1.00 0.00 C ATOM 1373 O CYS B 11 67.108 -2.386 -1.640 1.00 0.00 O ATOM 1374 CB CYS B 11 69.483 -0.022 -0.627 1.00 0.00 C ATOM 1375 SG CYS B 11 69.410 1.548 0.264 1.00 0.00 S ATOM 0 H CYS B 11 66.859 -0.647 0.275 1.00 0.00 H new ATOM 0 HA CYS B 11 68.120 0.417 -2.229 1.00 0.00 H new ATOM 0 HB2 CYS B 11 69.666 -0.839 0.070 1.00 0.00 H new ATOM 0 HB3 CYS B 11 70.313 -0.013 -1.333 1.00 0.00 H new ATOM 1380 N CYS B 12 69.130 -2.185 -2.472 1.00 0.00 N ATOM 1381 CA CYS B 12 69.117 -3.595 -2.965 1.00 0.00 C ATOM 1382 C CYS B 12 70.376 -4.323 -2.488 1.00 0.00 C ATOM 1383 O CYS B 12 71.179 -3.789 -1.748 1.00 0.00 O ATOM 1384 CB CYS B 12 69.106 -3.611 -4.500 1.00 0.00 C ATOM 1385 SG CYS B 12 68.031 -2.306 -5.132 1.00 0.00 S ATOM 0 H CYS B 12 69.984 -1.664 -2.669 1.00 0.00 H new ATOM 0 HA CYS B 12 68.226 -4.090 -2.578 1.00 0.00 H new ATOM 0 HB2 CYS B 12 70.119 -3.473 -4.879 1.00 0.00 H new ATOM 0 HB3 CYS B 12 68.761 -4.581 -4.858 1.00 0.00 H new ATOM 1390 N TYR B 13 70.571 -5.525 -2.955 1.00 0.00 N ATOM 1391 CA TYR B 13 71.798 -6.294 -2.592 1.00 0.00 C ATOM 1392 C TYR B 13 72.274 -7.063 -3.825 1.00 0.00 C ATOM 1393 O TYR B 13 73.451 -7.133 -4.115 1.00 0.00 O ATOM 1394 CB TYR B 13 71.487 -7.286 -1.471 1.00 0.00 C ATOM 1395 CG TYR B 13 71.246 -6.543 -0.181 1.00 0.00 C ATOM 1396 CD1 TYR B 13 72.053 -5.434 0.171 1.00 0.00 C ATOM 1397 CD2 TYR B 13 70.209 -6.954 0.673 1.00 0.00 C ATOM 1398 CE1 TYR B 13 71.815 -4.742 1.375 1.00 0.00 C ATOM 1399 CE2 TYR B 13 69.970 -6.262 1.878 1.00 0.00 C ATOM 1400 CZ TYR B 13 70.770 -5.153 2.228 1.00 0.00 C ATOM 1401 OH TYR B 13 70.533 -4.474 3.404 1.00 0.00 O ATOM 0 H TYR B 13 69.928 -6.013 -3.578 1.00 0.00 H new ATOM 0 HA TYR B 13 72.570 -5.605 -2.250 1.00 0.00 H new ATOM 0 HB2 TYR B 13 70.609 -7.877 -1.730 1.00 0.00 H new ATOM 0 HB3 TYR B 13 72.316 -7.983 -1.350 1.00 0.00 H new ATOM 0 HD1 TYR B 13 72.852 -5.118 -0.484 1.00 0.00 H new ATOM 0 HD2 TYR B 13 69.594 -7.801 0.406 1.00 0.00 H new ATOM 0 HE1 TYR B 13 72.432 -3.898 1.644 1.00 0.00 H new ATOM 0 HE2 TYR B 13 69.174 -6.581 2.534 1.00 0.00 H new ATOM 0 HH TYR B 13 69.567 -4.368 3.532 1.00 0.00 H new ATOM 1411 N ASN B 14 71.354 -7.622 -4.565 1.00 0.00 N ATOM 1412 CA ASN B 14 71.724 -8.368 -5.794 1.00 0.00 C ATOM 1413 C ASN B 14 70.973 -7.754 -6.971 1.00 0.00 C ATOM 1414 O ASN B 14 70.141 -6.886 -6.793 1.00 0.00 O ATOM 1415 CB ASN B 14 71.329 -9.837 -5.634 1.00 0.00 C ATOM 1416 CG ASN B 14 71.984 -10.400 -4.373 1.00 0.00 C ATOM 1417 OD1 ASN B 14 71.235 -10.747 -3.365 1.00 0.00 O flip ATOM 1418 ND2 ASN B 14 73.191 -10.525 -4.306 1.00 0.00 N flip ATOM 0 H ASN B 14 70.354 -7.591 -4.365 1.00 0.00 H new ATOM 0 HA ASN B 14 72.799 -8.309 -5.967 1.00 0.00 H new ATOM 0 HB2 ASN B 14 70.245 -9.929 -5.567 1.00 0.00 H new ATOM 0 HB3 ASN B 14 71.644 -10.408 -6.508 1.00 0.00 H new ATOM 0 HD21 ASN B 14 73.776 -10.253 -5.096 1.00 0.00 H new ATOM 0 HD22 ASN B 14 73.619 -10.902 -3.460 1.00 0.00 H new ATOM 1425 N PHE B 15 71.256 -8.174 -8.170 1.00 0.00 N ATOM 1426 CA PHE B 15 70.549 -7.574 -9.332 1.00 0.00 C ATOM 1427 C PHE B 15 70.203 -8.650 -10.365 1.00 0.00 C ATOM 1428 O PHE B 15 71.069 -9.323 -10.884 1.00 0.00 O ATOM 1429 CB PHE B 15 71.447 -6.520 -9.985 1.00 0.00 C ATOM 1430 CG PHE B 15 71.726 -5.408 -9.001 1.00 0.00 C ATOM 1431 CD1 PHE B 15 70.656 -4.771 -8.332 1.00 0.00 C ATOM 1432 CD2 PHE B 15 73.056 -5.003 -8.750 1.00 0.00 C ATOM 1433 CE1 PHE B 15 70.917 -3.730 -7.411 1.00 0.00 C ATOM 1434 CE2 PHE B 15 73.317 -3.962 -7.831 1.00 0.00 C ATOM 1435 CZ PHE B 15 72.247 -3.326 -7.161 1.00 0.00 C ATOM 0 H PHE B 15 71.938 -8.898 -8.395 1.00 0.00 H new ATOM 0 HA PHE B 15 69.626 -7.113 -8.979 1.00 0.00 H new ATOM 0 HB2 PHE B 15 72.383 -6.976 -10.308 1.00 0.00 H new ATOM 0 HB3 PHE B 15 70.964 -6.118 -10.875 1.00 0.00 H new ATOM 0 HD1 PHE B 15 69.639 -5.079 -8.524 1.00 0.00 H new ATOM 0 HD2 PHE B 15 73.874 -5.489 -9.261 1.00 0.00 H new ATOM 0 HE1 PHE B 15 70.100 -3.244 -6.899 1.00 0.00 H new ATOM 0 HE2 PHE B 15 74.334 -3.652 -7.640 1.00 0.00 H new ATOM 0 HZ PHE B 15 72.447 -2.531 -6.458 1.00 0.00 H new ATOM 1445 N THR B 16 68.935 -8.789 -10.695 1.00 0.00 N ATOM 1446 CA THR B 16 68.536 -9.798 -11.741 1.00 0.00 C ATOM 1447 C THR B 16 69.435 -9.609 -12.966 1.00 0.00 C ATOM 1448 O THR B 16 69.208 -8.741 -13.778 1.00 0.00 O ATOM 1449 CB THR B 16 67.054 -9.593 -12.162 1.00 0.00 C ATOM 1450 OG1 THR B 16 66.887 -9.998 -13.515 1.00 0.00 O ATOM 1451 CG2 THR B 16 66.665 -8.121 -12.026 1.00 0.00 C ATOM 0 H THR B 16 68.166 -8.254 -10.291 1.00 0.00 H new ATOM 0 HA THR B 16 68.646 -10.802 -11.332 1.00 0.00 H new ATOM 0 HB THR B 16 66.416 -10.192 -11.513 1.00 0.00 H new ATOM 0 HG1 THR B 16 67.235 -9.302 -14.110 1.00 0.00 H new ATOM 0 HG21 THR B 16 65.625 -7.991 -12.324 1.00 0.00 H new ATOM 0 HG22 THR B 16 66.788 -7.806 -10.990 1.00 0.00 H new ATOM 0 HG23 THR B 16 67.305 -7.515 -12.667 1.00 0.00 H new ATOM 1459 N ASN B 17 70.468 -10.388 -13.092 1.00 0.00 N ATOM 1460 CA ASN B 17 71.380 -10.214 -14.255 1.00 0.00 C ATOM 1461 C ASN B 17 70.899 -11.068 -15.429 1.00 0.00 C ATOM 1462 O ASN B 17 71.525 -11.111 -16.470 1.00 0.00 O ATOM 1463 CB ASN B 17 72.798 -10.633 -13.862 1.00 0.00 C ATOM 1464 CG ASN B 17 73.735 -10.438 -15.056 1.00 0.00 C ATOM 1465 OD1 ASN B 17 73.916 -9.333 -15.527 1.00 0.00 O ATOM 1466 ND2 ASN B 17 74.345 -11.473 -15.566 1.00 0.00 N ATOM 0 H ASN B 17 70.721 -11.135 -12.445 1.00 0.00 H new ATOM 0 HA ASN B 17 71.381 -9.166 -14.554 1.00 0.00 H new ATOM 0 HB2 ASN B 17 73.143 -10.040 -13.015 1.00 0.00 H new ATOM 0 HB3 ASN B 17 72.806 -11.676 -13.546 1.00 0.00 H new ATOM 0 HD21 ASN B 17 74.974 -11.354 -16.360 1.00 0.00 H new ATOM 0 HD22 ASN B 17 74.193 -12.401 -15.170 1.00 0.00 H new ATOM 1473 N ARG B 18 69.782 -11.726 -15.289 1.00 0.00 N ATOM 1474 CA ARG B 18 69.263 -12.542 -16.416 1.00 0.00 C ATOM 1475 C ARG B 18 68.327 -11.678 -17.250 1.00 0.00 C ATOM 1476 O ARG B 18 67.465 -11.004 -16.727 1.00 0.00 O ATOM 1477 CB ARG B 18 68.499 -13.748 -15.870 1.00 0.00 C ATOM 1478 CG ARG B 18 69.493 -14.829 -15.439 1.00 0.00 C ATOM 1479 CD ARG B 18 69.031 -15.451 -14.121 1.00 0.00 C ATOM 1480 NE ARG B 18 68.738 -16.909 -14.327 1.00 0.00 N ATOM 1481 CZ ARG B 18 69.605 -17.694 -14.925 1.00 0.00 C ATOM 1482 NH1 ARG B 18 70.805 -17.251 -15.186 1.00 0.00 N ATOM 1483 NH2 ARG B 18 69.255 -18.891 -15.330 1.00 0.00 N ATOM 0 H ARG B 18 69.209 -11.733 -14.445 1.00 0.00 H new ATOM 0 HA ARG B 18 70.090 -12.897 -17.031 1.00 0.00 H new ATOM 0 HB2 ARG B 18 67.882 -13.448 -15.023 1.00 0.00 H new ATOM 0 HB3 ARG B 18 67.826 -14.141 -16.632 1.00 0.00 H new ATOM 0 HG2 ARG B 18 69.568 -15.597 -16.209 1.00 0.00 H new ATOM 0 HG3 ARG B 18 70.487 -14.398 -15.321 1.00 0.00 H new ATOM 0 HD2 ARG B 18 69.802 -15.329 -13.360 1.00 0.00 H new ATOM 0 HD3 ARG B 18 68.140 -14.939 -13.758 1.00 0.00 H new ATOM 0 HE ARG B 18 67.853 -17.295 -13.998 1.00 0.00 H new ATOM 0 HH11 ARG B 18 71.065 -16.300 -14.926 1.00 0.00 H new ATOM 0 HH12 ARG B 18 71.482 -17.856 -15.650 1.00 0.00 H new ATOM 0 HH21 ARG B 18 68.301 -19.221 -15.182 1.00 0.00 H new ATOM 0 HH22 ARG B 18 69.936 -19.492 -15.793 1.00 0.00 H new ATOM 1497 N LYS B 19 68.494 -11.676 -18.544 1.00 0.00 N ATOM 1498 CA LYS B 19 67.614 -10.837 -19.407 1.00 0.00 C ATOM 1499 C LYS B 19 66.151 -11.152 -19.101 1.00 0.00 C ATOM 1500 O LYS B 19 65.565 -12.053 -19.666 1.00 0.00 O ATOM 1501 CB LYS B 19 67.907 -11.133 -20.879 1.00 0.00 C ATOM 1502 CG LYS B 19 68.720 -9.984 -21.477 1.00 0.00 C ATOM 1503 CD LYS B 19 69.691 -10.537 -22.523 1.00 0.00 C ATOM 1504 CE LYS B 19 69.821 -9.539 -23.676 1.00 0.00 C ATOM 1505 NZ LYS B 19 69.999 -10.281 -24.955 1.00 0.00 N ATOM 0 H LYS B 19 69.201 -12.218 -19.041 1.00 0.00 H new ATOM 0 HA LYS B 19 67.807 -9.783 -19.207 1.00 0.00 H new ATOM 0 HB2 LYS B 19 68.458 -12.069 -20.970 1.00 0.00 H new ATOM 0 HB3 LYS B 19 66.974 -11.258 -21.429 1.00 0.00 H new ATOM 0 HG2 LYS B 19 68.054 -9.252 -21.934 1.00 0.00 H new ATOM 0 HG3 LYS B 19 69.271 -9.467 -20.691 1.00 0.00 H new ATOM 0 HD2 LYS B 19 70.667 -10.716 -22.071 1.00 0.00 H new ATOM 0 HD3 LYS B 19 69.332 -11.496 -22.897 1.00 0.00 H new ATOM 0 HE2 LYS B 19 68.933 -8.910 -23.729 1.00 0.00 H new ATOM 0 HE3 LYS B 19 70.671 -8.878 -23.505 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 70.088 -9.604 -25.740 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 70.859 -10.864 -24.902 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 69.175 -10.894 -25.118 1.00 0.00 H new ATOM 1519 N ILE B 20 65.560 -10.412 -18.208 1.00 0.00 N ATOM 1520 CA ILE B 20 64.149 -10.653 -17.858 1.00 0.00 C ATOM 1521 C ILE B 20 63.267 -10.039 -18.933 1.00 0.00 C ATOM 1522 O ILE B 20 63.399 -8.882 -19.285 1.00 0.00 O ATOM 1523 CB ILE B 20 63.853 -10.025 -16.481 1.00 0.00 C ATOM 1524 CG1 ILE B 20 64.295 -11.002 -15.385 1.00 0.00 C ATOM 1525 CG2 ILE B 20 62.350 -9.731 -16.329 1.00 0.00 C ATOM 1526 CD1 ILE B 20 63.729 -10.554 -14.041 1.00 0.00 C ATOM 0 H ILE B 20 66.005 -9.644 -17.705 1.00 0.00 H new ATOM 0 HA ILE B 20 63.946 -11.722 -17.801 1.00 0.00 H new ATOM 0 HB ILE B 20 64.399 -9.086 -16.394 1.00 0.00 H new ATOM 0 HG12 ILE B 20 63.948 -12.008 -15.620 1.00 0.00 H new ATOM 0 HG13 ILE B 20 65.383 -11.043 -15.337 1.00 0.00 H new ATOM 0 HG21 ILE B 20 62.163 -9.288 -15.351 1.00 0.00 H new ATOM 0 HG22 ILE B 20 62.035 -9.037 -17.108 1.00 0.00 H new ATOM 0 HG23 ILE B 20 61.787 -10.660 -16.421 1.00 0.00 H new ATOM 0 HD11 ILE B 20 64.044 -11.250 -13.263 1.00 0.00 H new ATOM 0 HD12 ILE B 20 64.097 -9.555 -13.806 1.00 0.00 H new ATOM 0 HD13 ILE B 20 62.640 -10.536 -14.092 1.00 0.00 H new ATOM 1538 N SER B 21 62.374 -10.811 -19.451 1.00 0.00 N ATOM 1539 CA SER B 21 61.454 -10.316 -20.513 1.00 0.00 C ATOM 1540 C SER B 21 60.898 -8.940 -20.131 1.00 0.00 C ATOM 1541 O SER B 21 60.327 -8.762 -19.074 1.00 0.00 O ATOM 1542 CB SER B 21 60.299 -11.300 -20.654 1.00 0.00 C ATOM 1543 OG SER B 21 59.864 -11.329 -22.007 1.00 0.00 O ATOM 0 H SER B 21 62.232 -11.785 -19.184 1.00 0.00 H new ATOM 0 HA SER B 21 61.998 -10.229 -21.453 1.00 0.00 H new ATOM 0 HB2 SER B 21 60.615 -12.295 -20.341 1.00 0.00 H new ATOM 0 HB3 SER B 21 59.476 -11.007 -20.002 1.00 0.00 H new ATOM 0 HG SER B 21 59.122 -11.963 -22.099 1.00 0.00 H new ATOM 1549 N VAL B 22 61.054 -7.967 -20.988 1.00 0.00 N ATOM 1550 CA VAL B 22 60.524 -6.613 -20.681 1.00 0.00 C ATOM 1551 C VAL B 22 59.030 -6.717 -20.352 1.00 0.00 C ATOM 1552 O VAL B 22 58.465 -5.860 -19.702 1.00 0.00 O ATOM 1553 CB VAL B 22 60.720 -5.700 -21.892 1.00 0.00 C ATOM 1554 CG1 VAL B 22 59.992 -6.291 -23.101 1.00 0.00 C ATOM 1555 CG2 VAL B 22 60.151 -4.314 -21.583 1.00 0.00 C ATOM 0 H VAL B 22 61.527 -8.054 -21.888 1.00 0.00 H new ATOM 0 HA VAL B 22 61.058 -6.197 -19.827 1.00 0.00 H new ATOM 0 HB VAL B 22 61.784 -5.616 -22.114 1.00 0.00 H new ATOM 0 HG11 VAL B 22 60.132 -5.640 -23.964 1.00 0.00 H new ATOM 0 HG12 VAL B 22 60.397 -7.279 -23.322 1.00 0.00 H new ATOM 0 HG13 VAL B 22 58.928 -6.376 -22.879 1.00 0.00 H new ATOM 0 HG21 VAL B 22 60.290 -3.663 -22.446 1.00 0.00 H new ATOM 0 HG22 VAL B 22 59.087 -4.399 -21.360 1.00 0.00 H new ATOM 0 HG23 VAL B 22 60.669 -3.892 -20.722 1.00 0.00 H new ATOM 1565 N GLN B 23 58.393 -7.772 -20.787 1.00 0.00 N ATOM 1566 CA GLN B 23 56.965 -7.950 -20.499 1.00 0.00 C ATOM 1567 C GLN B 23 56.803 -8.215 -19.012 1.00 0.00 C ATOM 1568 O GLN B 23 55.950 -7.653 -18.352 1.00 0.00 O ATOM 1569 CB GLN B 23 56.438 -9.144 -21.334 1.00 0.00 C ATOM 1570 CG GLN B 23 55.905 -10.273 -20.429 1.00 0.00 C ATOM 1571 CD GLN B 23 55.240 -11.348 -21.291 1.00 0.00 C ATOM 1572 OE1 GLN B 23 55.855 -12.339 -21.628 1.00 0.00 O ATOM 1573 NE2 GLN B 23 53.999 -11.192 -21.664 1.00 0.00 N ATOM 0 H GLN B 23 58.818 -8.520 -21.335 1.00 0.00 H new ATOM 0 HA GLN B 23 56.396 -7.059 -20.763 1.00 0.00 H new ATOM 0 HB2 GLN B 23 55.644 -8.803 -21.998 1.00 0.00 H new ATOM 0 HB3 GLN B 23 57.238 -9.529 -21.966 1.00 0.00 H new ATOM 0 HG2 GLN B 23 56.722 -10.708 -19.853 1.00 0.00 H new ATOM 0 HG3 GLN B 23 55.188 -9.871 -19.713 1.00 0.00 H new ATOM 0 HE21 GLN B 23 53.482 -10.359 -21.381 1.00 0.00 H new ATOM 0 HE22 GLN B 23 53.546 -11.903 -22.239 1.00 0.00 H new ATOM 1582 N ARG B 24 57.614 -9.082 -18.482 1.00 0.00 N ATOM 1583 CA ARG B 24 57.516 -9.405 -17.047 1.00 0.00 C ATOM 1584 C ARG B 24 57.602 -8.132 -16.240 1.00 0.00 C ATOM 1585 O ARG B 24 57.017 -8.009 -15.186 1.00 0.00 O ATOM 1586 CB ARG B 24 58.667 -10.326 -16.646 1.00 0.00 C ATOM 1587 CG ARG B 24 58.605 -11.609 -17.463 1.00 0.00 C ATOM 1588 CD ARG B 24 57.540 -12.529 -16.877 1.00 0.00 C ATOM 1589 NE ARG B 24 57.805 -13.935 -17.309 1.00 0.00 N ATOM 1590 CZ ARG B 24 56.879 -14.860 -17.180 1.00 0.00 C ATOM 1591 NH1 ARG B 24 55.706 -14.564 -16.675 1.00 0.00 N ATOM 1592 NH2 ARG B 24 57.131 -16.082 -17.559 1.00 0.00 N ATOM 0 H ARG B 24 58.344 -9.581 -18.990 1.00 0.00 H new ATOM 0 HA ARG B 24 56.565 -9.903 -16.856 1.00 0.00 H new ATOM 0 HB2 ARG B 24 59.621 -9.825 -16.810 1.00 0.00 H new ATOM 0 HB3 ARG B 24 58.607 -10.557 -15.583 1.00 0.00 H new ATOM 0 HG2 ARG B 24 58.372 -11.380 -18.503 1.00 0.00 H new ATOM 0 HG3 ARG B 24 59.575 -12.106 -17.455 1.00 0.00 H new ATOM 0 HD2 ARG B 24 57.547 -12.464 -15.789 1.00 0.00 H new ATOM 0 HD3 ARG B 24 56.550 -12.215 -17.209 1.00 0.00 H new ATOM 0 HE ARG B 24 58.712 -14.179 -17.707 1.00 0.00 H new ATOM 0 HH11 ARG B 24 55.505 -13.609 -16.378 1.00 0.00 H new ATOM 0 HH12 ARG B 24 54.994 -15.289 -16.579 1.00 0.00 H new ATOM 0 HH21 ARG B 24 58.042 -16.316 -17.953 1.00 0.00 H new ATOM 0 HH22 ARG B 24 56.417 -16.804 -17.461 1.00 0.00 H new ATOM 1606 N LEU B 25 58.345 -7.196 -16.719 1.00 0.00 N ATOM 1607 CA LEU B 25 58.519 -5.932 -15.980 1.00 0.00 C ATOM 1608 C LEU B 25 57.241 -5.113 -16.015 1.00 0.00 C ATOM 1609 O LEU B 25 57.014 -4.328 -16.913 1.00 0.00 O ATOM 1610 CB LEU B 25 59.652 -5.139 -16.605 1.00 0.00 C ATOM 1611 CG LEU B 25 60.888 -6.045 -16.752 1.00 0.00 C ATOM 1612 CD1 LEU B 25 62.086 -5.211 -17.182 1.00 0.00 C ATOM 1613 CD2 LEU B 25 61.203 -6.724 -15.414 1.00 0.00 C ATOM 0 H LEU B 25 58.848 -7.251 -17.605 1.00 0.00 H new ATOM 0 HA LEU B 25 58.756 -6.159 -14.941 1.00 0.00 H new ATOM 0 HB2 LEU B 25 59.349 -4.757 -17.580 1.00 0.00 H new ATOM 0 HB3 LEU B 25 59.892 -4.275 -15.985 1.00 0.00 H new ATOM 0 HG LEU B 25 60.680 -6.806 -17.504 1.00 0.00 H new ATOM 0 HD11 LEU B 25 62.959 -5.855 -17.285 1.00 0.00 H new ATOM 0 HD12 LEU B 25 61.872 -4.733 -18.138 1.00 0.00 H new ATOM 0 HD13 LEU B 25 62.286 -4.447 -16.431 1.00 0.00 H new ATOM 0 HD21 LEU B 25 62.079 -7.363 -15.528 1.00 0.00 H new ATOM 0 HD22 LEU B 25 61.404 -5.964 -14.659 1.00 0.00 H new ATOM 0 HD23 LEU B 25 60.351 -7.328 -15.103 1.00 0.00 H new ATOM 1625 N ALA B 26 56.408 -5.287 -15.039 1.00 0.00 N ATOM 1626 CA ALA B 26 55.144 -4.521 -14.998 1.00 0.00 C ATOM 1627 C ALA B 26 55.432 -3.041 -14.714 1.00 0.00 C ATOM 1628 O ALA B 26 54.603 -2.183 -14.946 1.00 0.00 O ATOM 1629 CB ALA B 26 54.258 -5.073 -13.887 1.00 0.00 C ATOM 0 H ALA B 26 56.550 -5.932 -14.262 1.00 0.00 H new ATOM 0 HA ALA B 26 54.642 -4.613 -15.961 1.00 0.00 H new ATOM 0 HB1 ALA B 26 53.325 -4.511 -13.853 1.00 0.00 H new ATOM 0 HB2 ALA B 26 54.042 -6.124 -14.082 1.00 0.00 H new ATOM 0 HB3 ALA B 26 54.773 -4.980 -12.931 1.00 0.00 H new ATOM 1635 N SER B 27 56.589 -2.739 -14.200 1.00 0.00 N ATOM 1636 CA SER B 27 56.920 -1.318 -13.882 1.00 0.00 C ATOM 1637 C SER B 27 58.399 -1.213 -13.506 1.00 0.00 C ATOM 1638 O SER B 27 59.105 -2.200 -13.455 1.00 0.00 O ATOM 1639 CB SER B 27 56.062 -0.843 -12.710 1.00 0.00 C ATOM 1640 OG SER B 27 55.088 0.080 -13.182 1.00 0.00 O ATOM 0 H SER B 27 57.323 -3.414 -13.985 1.00 0.00 H new ATOM 0 HA SER B 27 56.720 -0.695 -14.753 1.00 0.00 H new ATOM 0 HB2 SER B 27 55.573 -1.693 -12.235 1.00 0.00 H new ATOM 0 HB3 SER B 27 56.689 -0.372 -11.953 1.00 0.00 H new ATOM 0 HG SER B 27 54.597 -0.317 -13.931 1.00 0.00 H new ATOM 1646 N TYR B 28 58.884 -0.023 -13.263 1.00 0.00 N ATOM 1647 CA TYR B 28 60.324 0.129 -12.916 1.00 0.00 C ATOM 1648 C TYR B 28 60.512 1.391 -12.035 1.00 0.00 C ATOM 1649 O TYR B 28 60.062 2.467 -12.376 1.00 0.00 O ATOM 1650 CB TYR B 28 61.128 0.218 -14.242 1.00 0.00 C ATOM 1651 CG TYR B 28 61.945 1.485 -14.332 1.00 0.00 C ATOM 1652 CD1 TYR B 28 63.201 1.560 -13.696 1.00 0.00 C ATOM 1653 CD2 TYR B 28 61.464 2.577 -15.083 1.00 0.00 C ATOM 1654 CE1 TYR B 28 63.978 2.729 -13.809 1.00 0.00 C ATOM 1655 CE2 TYR B 28 62.237 3.749 -15.195 1.00 0.00 C ATOM 1656 CZ TYR B 28 63.497 3.828 -14.558 1.00 0.00 C ATOM 1657 OH TYR B 28 64.257 4.975 -14.670 1.00 0.00 O ATOM 0 H TYR B 28 58.347 0.844 -13.290 1.00 0.00 H new ATOM 0 HA TYR B 28 60.688 -0.723 -12.342 1.00 0.00 H new ATOM 0 HB2 TYR B 28 61.789 -0.645 -14.322 1.00 0.00 H new ATOM 0 HB3 TYR B 28 60.440 0.171 -15.086 1.00 0.00 H new ATOM 0 HD1 TYR B 28 63.567 0.721 -13.122 1.00 0.00 H new ATOM 0 HD2 TYR B 28 60.503 2.515 -15.572 1.00 0.00 H new ATOM 0 HE1 TYR B 28 64.941 2.786 -13.324 1.00 0.00 H new ATOM 0 HE2 TYR B 28 61.868 4.587 -15.767 1.00 0.00 H new ATOM 0 HH TYR B 28 64.118 5.375 -15.554 1.00 0.00 H new ATOM 1667 N ARG B 29 61.168 1.254 -10.906 1.00 0.00 N ATOM 1668 CA ARG B 29 61.376 2.438 -10.010 1.00 0.00 C ATOM 1669 C ARG B 29 62.866 2.576 -9.675 1.00 0.00 C ATOM 1670 O ARG B 29 63.313 2.175 -8.626 1.00 0.00 O ATOM 1671 CB ARG B 29 60.582 2.241 -8.718 1.00 0.00 C ATOM 1672 CG ARG B 29 59.273 3.027 -8.798 1.00 0.00 C ATOM 1673 CD ARG B 29 58.736 3.272 -7.386 1.00 0.00 C ATOM 1674 NE ARG B 29 57.260 3.493 -7.446 1.00 0.00 N ATOM 1675 CZ ARG B 29 56.619 4.004 -6.418 1.00 0.00 C ATOM 1676 NH1 ARG B 29 57.264 4.329 -5.323 1.00 0.00 N ATOM 1677 NH2 ARG B 29 55.330 4.189 -6.488 1.00 0.00 N ATOM 0 H ARG B 29 61.567 0.378 -10.567 1.00 0.00 H new ATOM 0 HA ARG B 29 61.034 3.340 -10.517 1.00 0.00 H new ATOM 0 HB2 ARG B 29 60.374 1.182 -8.565 1.00 0.00 H new ATOM 0 HB3 ARG B 29 61.169 2.578 -7.863 1.00 0.00 H new ATOM 0 HG2 ARG B 29 59.438 3.977 -9.306 1.00 0.00 H new ATOM 0 HG3 ARG B 29 58.540 2.474 -9.386 1.00 0.00 H new ATOM 0 HD2 ARG B 29 58.961 2.418 -6.747 1.00 0.00 H new ATOM 0 HD3 ARG B 29 59.227 4.139 -6.944 1.00 0.00 H new ATOM 0 HE ARG B 29 56.745 3.246 -8.291 1.00 0.00 H new ATOM 0 HH11 ARG B 29 58.272 4.186 -5.263 1.00 0.00 H new ATOM 0 HH12 ARG B 29 56.757 4.725 -4.531 1.00 0.00 H new ATOM 0 HH21 ARG B 29 54.824 3.938 -7.337 1.00 0.00 H new ATOM 0 HH22 ARG B 29 54.828 4.585 -5.693 1.00 0.00 H new ATOM 1691 N ARG B 30 63.633 3.135 -10.575 1.00 0.00 N ATOM 1692 CA ARG B 30 65.112 3.289 -10.344 1.00 0.00 C ATOM 1693 C ARG B 30 65.416 3.735 -8.903 1.00 0.00 C ATOM 1694 O ARG B 30 65.214 4.877 -8.539 1.00 0.00 O ATOM 1695 CB ARG B 30 65.661 4.336 -11.316 1.00 0.00 C ATOM 1696 CG ARG B 30 67.076 3.944 -11.741 1.00 0.00 C ATOM 1697 CD ARG B 30 67.496 4.782 -12.951 1.00 0.00 C ATOM 1698 NE ARG B 30 68.974 4.680 -13.139 1.00 0.00 N ATOM 1699 CZ ARG B 30 69.609 5.527 -13.916 1.00 0.00 C ATOM 1700 NH1 ARG B 30 68.958 6.478 -14.542 1.00 0.00 N ATOM 1701 NH2 ARG B 30 70.902 5.423 -14.068 1.00 0.00 N ATOM 0 H ARG B 30 63.301 3.496 -11.469 1.00 0.00 H new ATOM 0 HA ARG B 30 65.586 2.321 -10.508 1.00 0.00 H new ATOM 0 HB2 ARG B 30 65.015 4.410 -12.190 1.00 0.00 H new ATOM 0 HB3 ARG B 30 65.671 5.318 -10.842 1.00 0.00 H new ATOM 0 HG2 ARG B 30 67.772 4.102 -10.917 1.00 0.00 H new ATOM 0 HG3 ARG B 30 67.112 2.883 -11.990 1.00 0.00 H new ATOM 0 HD2 ARG B 30 66.980 4.433 -13.845 1.00 0.00 H new ATOM 0 HD3 ARG B 30 67.209 5.823 -12.803 1.00 0.00 H new ATOM 0 HE ARG B 30 69.495 3.946 -12.660 1.00 0.00 H new ATOM 0 HH11 ARG B 30 67.948 6.565 -14.428 1.00 0.00 H new ATOM 0 HH12 ARG B 30 69.462 7.130 -15.143 1.00 0.00 H new ATOM 0 HH21 ARG B 30 71.415 4.686 -13.584 1.00 0.00 H new ATOM 0 HH22 ARG B 30 71.399 6.079 -14.671 1.00 0.00 H new ATOM 1715 N ILE B 31 65.956 2.847 -8.096 1.00 0.00 N ATOM 1716 CA ILE B 31 66.336 3.231 -6.703 1.00 0.00 C ATOM 1717 C ILE B 31 67.550 4.164 -6.764 1.00 0.00 C ATOM 1718 O ILE B 31 68.259 4.206 -7.746 1.00 0.00 O ATOM 1719 CB ILE B 31 66.679 1.954 -5.880 1.00 0.00 C ATOM 1720 CG1 ILE B 31 65.412 1.463 -5.159 1.00 0.00 C ATOM 1721 CG2 ILE B 31 67.774 2.255 -4.833 1.00 0.00 C ATOM 1722 CD1 ILE B 31 65.763 0.307 -4.208 1.00 0.00 C ATOM 0 H ILE B 31 66.148 1.877 -8.345 1.00 0.00 H new ATOM 0 HA ILE B 31 65.506 3.744 -6.217 1.00 0.00 H new ATOM 0 HB ILE B 31 67.048 1.187 -6.561 1.00 0.00 H new ATOM 0 HG12 ILE B 31 64.962 2.282 -4.598 1.00 0.00 H new ATOM 0 HG13 ILE B 31 64.673 1.133 -5.889 1.00 0.00 H new ATOM 0 HG21 ILE B 31 67.998 1.349 -4.270 1.00 0.00 H new ATOM 0 HG22 ILE B 31 68.676 2.600 -5.339 1.00 0.00 H new ATOM 0 HG23 ILE B 31 67.422 3.029 -4.151 1.00 0.00 H new ATOM 0 HD11 ILE B 31 64.860 -0.034 -3.702 1.00 0.00 H new ATOM 0 HD12 ILE B 31 66.192 -0.516 -4.779 1.00 0.00 H new ATOM 0 HD13 ILE B 31 66.486 0.651 -3.468 1.00 0.00 H new ATOM 1734 N THR B 32 67.799 4.890 -5.710 1.00 0.00 N ATOM 1735 CA THR B 32 68.973 5.807 -5.682 1.00 0.00 C ATOM 1736 C THR B 32 68.908 6.661 -4.416 1.00 0.00 C ATOM 1737 O THR B 32 69.190 7.843 -4.436 1.00 0.00 O ATOM 1738 CB THR B 32 68.956 6.718 -6.912 1.00 0.00 C ATOM 1739 OG1 THR B 32 67.647 6.746 -7.463 1.00 0.00 O ATOM 1740 CG2 THR B 32 69.944 6.194 -7.956 1.00 0.00 C ATOM 0 H THR B 32 67.235 4.887 -4.860 1.00 0.00 H new ATOM 0 HA THR B 32 69.891 5.220 -5.688 1.00 0.00 H new ATOM 0 HB THR B 32 69.247 7.727 -6.619 1.00 0.00 H new ATOM 0 HG1 THR B 32 67.636 7.330 -8.250 1.00 0.00 H new ATOM 0 HG21 THR B 32 69.929 6.845 -8.830 1.00 0.00 H new ATOM 0 HG22 THR B 32 70.948 6.179 -7.532 1.00 0.00 H new ATOM 0 HG23 THR B 32 69.660 5.184 -8.251 1.00 0.00 H new ATOM 1748 N SER B 33 68.526 6.072 -3.314 1.00 0.00 N ATOM 1749 CA SER B 33 68.431 6.849 -2.045 1.00 0.00 C ATOM 1750 C SER B 33 69.764 7.549 -1.773 1.00 0.00 C ATOM 1751 O SER B 33 70.683 7.485 -2.564 1.00 0.00 O ATOM 1752 CB SER B 33 68.106 5.901 -0.889 1.00 0.00 C ATOM 1753 OG SER B 33 67.485 6.634 0.160 1.00 0.00 O ATOM 0 H SER B 33 68.276 5.086 -3.238 1.00 0.00 H new ATOM 0 HA SER B 33 67.642 7.595 -2.135 1.00 0.00 H new ATOM 0 HB2 SER B 33 67.446 5.104 -1.232 1.00 0.00 H new ATOM 0 HB3 SER B 33 69.017 5.426 -0.526 1.00 0.00 H new ATOM 0 HG SER B 33 66.591 6.270 0.328 1.00 0.00 H new ATOM 1759 N SER B 34 69.874 8.224 -0.662 1.00 0.00 N ATOM 1760 CA SER B 34 71.143 8.937 -0.349 1.00 0.00 C ATOM 1761 C SER B 34 72.075 8.019 0.446 1.00 0.00 C ATOM 1762 O SER B 34 73.257 8.275 0.563 1.00 0.00 O ATOM 1763 CB SER B 34 70.833 10.185 0.478 1.00 0.00 C ATOM 1764 OG SER B 34 70.304 11.194 -0.372 1.00 0.00 O ATOM 0 H SER B 34 69.141 8.312 0.041 1.00 0.00 H new ATOM 0 HA SER B 34 71.632 9.224 -1.280 1.00 0.00 H new ATOM 0 HB2 SER B 34 70.118 9.945 1.265 1.00 0.00 H new ATOM 0 HB3 SER B 34 71.738 10.544 0.968 1.00 0.00 H new ATOM 0 HG SER B 34 70.103 11.994 0.156 1.00 0.00 H new ATOM 1770 N LYS B 35 71.560 6.952 1.000 1.00 0.00 N ATOM 1771 CA LYS B 35 72.433 6.037 1.787 1.00 0.00 C ATOM 1772 C LYS B 35 72.593 4.695 1.056 1.00 0.00 C ATOM 1773 O LYS B 35 73.394 3.868 1.442 1.00 0.00 O ATOM 1774 CB LYS B 35 71.817 5.786 3.165 1.00 0.00 C ATOM 1775 CG LYS B 35 71.579 7.109 3.901 1.00 0.00 C ATOM 1776 CD LYS B 35 72.868 7.936 3.918 1.00 0.00 C ATOM 1777 CE LYS B 35 73.959 7.166 4.662 1.00 0.00 C ATOM 1778 NZ LYS B 35 75.203 7.985 4.706 1.00 0.00 N ATOM 0 H LYS B 35 70.579 6.678 0.941 1.00 0.00 H new ATOM 0 HA LYS B 35 73.411 6.505 1.901 1.00 0.00 H new ATOM 0 HB2 LYS B 35 70.874 5.250 3.055 1.00 0.00 H new ATOM 0 HB3 LYS B 35 72.478 5.150 3.754 1.00 0.00 H new ATOM 0 HG2 LYS B 35 70.783 7.670 3.411 1.00 0.00 H new ATOM 0 HG3 LYS B 35 71.249 6.913 4.921 1.00 0.00 H new ATOM 0 HD2 LYS B 35 73.189 8.149 2.898 1.00 0.00 H new ATOM 0 HD3 LYS B 35 72.690 8.896 4.403 1.00 0.00 H new ATOM 0 HE2 LYS B 35 73.629 6.933 5.674 1.00 0.00 H new ATOM 0 HE3 LYS B 35 74.153 6.216 4.163 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 75.946 7.462 5.212 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 75.521 8.186 3.736 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 75.012 8.880 5.200 1.00 0.00 H new ATOM 1792 N CYS B 36 71.839 4.464 0.012 1.00 0.00 N ATOM 1793 CA CYS B 36 71.968 3.164 -0.716 1.00 0.00 C ATOM 1794 C CYS B 36 73.389 3.032 -1.283 1.00 0.00 C ATOM 1795 O CYS B 36 73.830 3.879 -2.037 1.00 0.00 O ATOM 1796 CB CYS B 36 70.951 3.103 -1.862 1.00 0.00 C ATOM 1797 SG CYS B 36 69.270 2.949 -1.192 1.00 0.00 S ATOM 0 H CYS B 36 71.147 5.111 -0.365 1.00 0.00 H new ATOM 0 HA CYS B 36 71.774 2.346 -0.023 1.00 0.00 H new ATOM 0 HB2 CYS B 36 71.026 4.001 -2.475 1.00 0.00 H new ATOM 0 HB3 CYS B 36 71.172 2.255 -2.511 1.00 0.00 H new ATOM 1802 N PRO B 37 74.073 1.966 -0.898 1.00 0.00 N ATOM 1803 CA PRO B 37 75.436 1.722 -1.356 1.00 0.00 C ATOM 1804 C PRO B 37 75.474 1.556 -2.874 1.00 0.00 C ATOM 1805 O PRO B 37 76.518 1.649 -3.491 1.00 0.00 O ATOM 1806 CB PRO B 37 75.855 0.410 -0.676 1.00 0.00 C ATOM 1807 CG PRO B 37 74.649 -0.086 0.173 1.00 0.00 C ATOM 1808 CD PRO B 37 73.530 0.949 0.017 1.00 0.00 C ATOM 0 HA PRO B 37 76.100 2.551 -1.109 1.00 0.00 H new ATOM 0 HB2 PRO B 37 76.131 -0.336 -1.421 1.00 0.00 H new ATOM 0 HB3 PRO B 37 76.729 0.568 -0.044 1.00 0.00 H new ATOM 0 HG2 PRO B 37 74.316 -1.067 -0.167 1.00 0.00 H new ATOM 0 HG3 PRO B 37 74.933 -0.191 1.220 1.00 0.00 H new ATOM 0 HD2 PRO B 37 72.627 0.495 -0.390 1.00 0.00 H new ATOM 0 HD3 PRO B 37 73.261 1.387 0.978 1.00 0.00 H new ATOM 1816 N LYS B 38 74.358 1.278 -3.480 1.00 0.00 N ATOM 1817 CA LYS B 38 74.352 1.071 -4.947 1.00 0.00 C ATOM 1818 C LYS B 38 72.994 1.453 -5.542 1.00 0.00 C ATOM 1819 O LYS B 38 71.956 1.054 -5.053 1.00 0.00 O ATOM 1820 CB LYS B 38 74.628 -0.403 -5.242 1.00 0.00 C ATOM 1821 CG LYS B 38 76.136 -0.659 -5.223 1.00 0.00 C ATOM 1822 CD LYS B 38 76.502 -1.632 -6.347 1.00 0.00 C ATOM 1823 CE LYS B 38 77.822 -2.326 -6.010 1.00 0.00 C ATOM 1824 NZ LYS B 38 78.910 -1.310 -5.924 1.00 0.00 N ATOM 0 H LYS B 38 73.451 1.186 -3.022 1.00 0.00 H new ATOM 0 HA LYS B 38 75.121 1.701 -5.394 1.00 0.00 H new ATOM 0 HB2 LYS B 38 74.133 -1.031 -4.501 1.00 0.00 H new ATOM 0 HB3 LYS B 38 74.216 -0.673 -6.214 1.00 0.00 H new ATOM 0 HG2 LYS B 38 76.677 0.279 -5.349 1.00 0.00 H new ATOM 0 HG3 LYS B 38 76.434 -1.071 -4.259 1.00 0.00 H new ATOM 0 HD2 LYS B 38 75.712 -2.372 -6.474 1.00 0.00 H new ATOM 0 HD3 LYS B 38 76.591 -1.096 -7.292 1.00 0.00 H new ATOM 0 HE2 LYS B 38 77.733 -2.860 -5.064 1.00 0.00 H new ATOM 0 HE3 LYS B 38 78.061 -3.067 -6.773 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 79.834 -1.787 -5.949 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 78.837 -0.654 -6.728 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 78.819 -0.779 -5.035 1.00 0.00 H new ATOM 1838 N GLU B 39 72.998 2.173 -6.634 1.00 0.00 N ATOM 1839 CA GLU B 39 71.713 2.522 -7.303 1.00 0.00 C ATOM 1840 C GLU B 39 71.157 1.249 -7.948 1.00 0.00 C ATOM 1841 O GLU B 39 71.774 0.202 -7.884 1.00 0.00 O ATOM 1842 CB GLU B 39 71.968 3.574 -8.385 1.00 0.00 C ATOM 1843 CG GLU B 39 72.863 4.680 -7.821 1.00 0.00 C ATOM 1844 CD GLU B 39 74.275 4.534 -8.391 1.00 0.00 C ATOM 1845 OE1 GLU B 39 74.392 4.345 -9.591 1.00 0.00 O ATOM 1846 OE2 GLU B 39 75.214 4.613 -7.617 1.00 0.00 O ATOM 0 H GLU B 39 73.836 2.533 -7.090 1.00 0.00 H new ATOM 0 HA GLU B 39 71.004 2.925 -6.580 1.00 0.00 H new ATOM 0 HB2 GLU B 39 72.443 3.113 -9.251 1.00 0.00 H new ATOM 0 HB3 GLU B 39 71.023 3.996 -8.727 1.00 0.00 H new ATOM 0 HG2 GLU B 39 72.455 5.658 -8.077 1.00 0.00 H new ATOM 0 HG3 GLU B 39 72.891 4.621 -6.733 1.00 0.00 H new ATOM 1853 N ALA B 40 70.008 1.310 -8.565 1.00 0.00 N ATOM 1854 CA ALA B 40 69.459 0.074 -9.195 1.00 0.00 C ATOM 1855 C ALA B 40 68.129 0.368 -9.880 1.00 0.00 C ATOM 1856 O ALA B 40 67.643 1.479 -9.874 1.00 0.00 O ATOM 1857 CB ALA B 40 69.235 -0.980 -8.111 1.00 0.00 C ATOM 0 H ALA B 40 69.433 2.147 -8.660 1.00 0.00 H new ATOM 0 HA ALA B 40 70.169 -0.288 -9.939 1.00 0.00 H new ATOM 0 HB1 ALA B 40 68.834 -1.887 -8.563 1.00 0.00 H new ATOM 0 HB2 ALA B 40 70.183 -1.207 -7.623 1.00 0.00 H new ATOM 0 HB3 ALA B 40 68.529 -0.599 -7.373 1.00 0.00 H new ATOM 1863 N VAL B 41 67.526 -0.640 -10.448 1.00 0.00 N ATOM 1864 CA VAL B 41 66.205 -0.456 -11.104 1.00 0.00 C ATOM 1865 C VAL B 41 65.203 -1.376 -10.432 1.00 0.00 C ATOM 1866 O VAL B 41 65.377 -2.574 -10.401 1.00 0.00 O ATOM 1867 CB VAL B 41 66.304 -0.804 -12.605 1.00 0.00 C ATOM 1868 CG1 VAL B 41 65.017 -1.514 -13.076 1.00 0.00 C ATOM 1869 CG2 VAL B 41 66.477 0.477 -13.398 1.00 0.00 C ATOM 0 H VAL B 41 67.896 -1.590 -10.485 1.00 0.00 H new ATOM 0 HA VAL B 41 65.887 0.582 -11.008 1.00 0.00 H new ATOM 0 HB VAL B 41 67.155 -1.467 -12.761 1.00 0.00 H new ATOM 0 HG11 VAL B 41 65.101 -1.753 -14.136 1.00 0.00 H new ATOM 0 HG12 VAL B 41 64.879 -2.433 -12.506 1.00 0.00 H new ATOM 0 HG13 VAL B 41 64.161 -0.858 -12.919 1.00 0.00 H new ATOM 0 HG21 VAL B 41 66.548 0.241 -14.460 1.00 0.00 H new ATOM 0 HG22 VAL B 41 65.620 1.129 -13.228 1.00 0.00 H new ATOM 0 HG23 VAL B 41 67.387 0.983 -13.077 1.00 0.00 H new ATOM 1879 N ILE B 42 64.144 -0.844 -9.930 1.00 0.00 N ATOM 1880 CA ILE B 42 63.141 -1.712 -9.299 1.00 0.00 C ATOM 1881 C ILE B 42 62.191 -2.235 -10.361 1.00 0.00 C ATOM 1882 O ILE B 42 61.084 -1.764 -10.499 1.00 0.00 O ATOM 1883 CB ILE B 42 62.367 -0.934 -8.260 1.00 0.00 C ATOM 1884 CG1 ILE B 42 63.354 -0.181 -7.362 1.00 0.00 C ATOM 1885 CG2 ILE B 42 61.540 -1.909 -7.430 1.00 0.00 C ATOM 1886 CD1 ILE B 42 64.131 -1.171 -6.500 1.00 0.00 C ATOM 0 H ILE B 42 63.929 0.153 -9.929 1.00 0.00 H new ATOM 0 HA ILE B 42 63.642 -2.549 -8.813 1.00 0.00 H new ATOM 0 HB ILE B 42 61.702 -0.216 -8.740 1.00 0.00 H new ATOM 0 HG12 ILE B 42 64.043 0.402 -7.973 1.00 0.00 H new ATOM 0 HG13 ILE B 42 62.817 0.524 -6.727 1.00 0.00 H new ATOM 0 HG21 ILE B 42 60.977 -1.359 -6.676 1.00 0.00 H new ATOM 0 HG22 ILE B 42 60.849 -2.445 -8.080 1.00 0.00 H new ATOM 0 HG23 ILE B 42 62.203 -2.622 -6.939 1.00 0.00 H new ATOM 0 HD11 ILE B 42 64.831 -0.629 -5.864 1.00 0.00 H new ATOM 0 HD12 ILE B 42 63.436 -1.734 -5.877 1.00 0.00 H new ATOM 0 HD13 ILE B 42 64.682 -1.858 -7.142 1.00 0.00 H new ATOM 1898 N PHE B 43 62.620 -3.204 -11.116 1.00 0.00 N ATOM 1899 CA PHE B 43 61.752 -3.768 -12.178 1.00 0.00 C ATOM 1900 C PHE B 43 60.555 -4.481 -11.537 1.00 0.00 C ATOM 1901 O PHE B 43 60.571 -5.681 -11.348 1.00 0.00 O ATOM 1902 CB PHE B 43 62.555 -4.778 -13.002 1.00 0.00 C ATOM 1903 CG PHE B 43 63.309 -4.065 -14.103 1.00 0.00 C ATOM 1904 CD1 PHE B 43 62.654 -3.086 -14.881 1.00 0.00 C ATOM 1905 CD2 PHE B 43 64.668 -4.369 -14.350 1.00 0.00 C ATOM 1906 CE1 PHE B 43 63.355 -2.413 -15.906 1.00 0.00 C ATOM 1907 CE2 PHE B 43 65.365 -3.690 -15.377 1.00 0.00 C ATOM 1908 CZ PHE B 43 64.710 -2.715 -16.152 1.00 0.00 C ATOM 0 H PHE B 43 63.543 -3.632 -11.041 1.00 0.00 H new ATOM 0 HA PHE B 43 61.396 -2.964 -12.822 1.00 0.00 H new ATOM 0 HB2 PHE B 43 63.254 -5.311 -12.358 1.00 0.00 H new ATOM 0 HB3 PHE B 43 61.886 -5.523 -13.432 1.00 0.00 H new ATOM 0 HD1 PHE B 43 61.617 -2.852 -14.692 1.00 0.00 H new ATOM 0 HD2 PHE B 43 65.172 -5.117 -13.756 1.00 0.00 H new ATOM 0 HE1 PHE B 43 62.852 -1.666 -16.502 1.00 0.00 H new ATOM 0 HE2 PHE B 43 66.403 -3.921 -15.567 1.00 0.00 H new ATOM 0 HZ PHE B 43 65.245 -2.198 -16.935 1.00 0.00 H new ATOM 1918 N LYS B 44 59.510 -3.764 -11.219 1.00 0.00 N ATOM 1919 CA LYS B 44 58.322 -4.427 -10.615 1.00 0.00 C ATOM 1920 C LYS B 44 57.769 -5.412 -11.625 1.00 0.00 C ATOM 1921 O LYS B 44 57.086 -5.035 -12.546 1.00 0.00 O ATOM 1922 CB LYS B 44 57.250 -3.382 -10.293 1.00 0.00 C ATOM 1923 CG LYS B 44 56.976 -3.378 -8.788 1.00 0.00 C ATOM 1924 CD LYS B 44 55.570 -2.836 -8.527 1.00 0.00 C ATOM 1925 CE LYS B 44 55.564 -2.036 -7.222 1.00 0.00 C ATOM 1926 NZ LYS B 44 55.404 -0.587 -7.529 1.00 0.00 N ATOM 0 H LYS B 44 59.429 -2.756 -11.351 1.00 0.00 H new ATOM 0 HA LYS B 44 58.607 -4.937 -9.695 1.00 0.00 H new ATOM 0 HB2 LYS B 44 57.581 -2.395 -10.616 1.00 0.00 H new ATOM 0 HB3 LYS B 44 56.334 -3.605 -10.839 1.00 0.00 H new ATOM 0 HG2 LYS B 44 57.068 -4.388 -8.388 1.00 0.00 H new ATOM 0 HG3 LYS B 44 57.715 -2.763 -8.275 1.00 0.00 H new ATOM 0 HD2 LYS B 44 55.254 -2.202 -9.356 1.00 0.00 H new ATOM 0 HD3 LYS B 44 54.858 -3.659 -8.465 1.00 0.00 H new ATOM 0 HE2 LYS B 44 54.751 -2.374 -6.579 1.00 0.00 H new ATOM 0 HE3 LYS B 44 56.493 -2.203 -6.676 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 55.400 -0.043 -6.643 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 56.194 -0.269 -8.127 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 54.507 -0.436 -8.032 1.00 0.00 H new ATOM 1940 N THR B 45 58.087 -6.665 -11.484 1.00 0.00 N ATOM 1941 CA THR B 45 57.604 -7.664 -12.470 1.00 0.00 C ATOM 1942 C THR B 45 56.061 -7.662 -12.500 1.00 0.00 C ATOM 1943 O THR B 45 55.429 -6.695 -12.128 1.00 0.00 O ATOM 1944 CB THR B 45 58.138 -9.045 -12.087 1.00 0.00 C ATOM 1945 OG1 THR B 45 58.074 -9.206 -10.680 1.00 0.00 O ATOM 1946 CG2 THR B 45 59.588 -9.158 -12.553 1.00 0.00 C ATOM 0 H THR B 45 58.660 -7.040 -10.729 1.00 0.00 H new ATOM 0 HA THR B 45 57.966 -7.410 -13.466 1.00 0.00 H new ATOM 0 HB THR B 45 57.536 -9.821 -12.561 1.00 0.00 H new ATOM 0 HG1 THR B 45 58.907 -8.885 -10.276 1.00 0.00 H new ATOM 0 HG21 THR B 45 59.981 -10.139 -12.286 1.00 0.00 H new ATOM 0 HG22 THR B 45 59.633 -9.031 -13.635 1.00 0.00 H new ATOM 0 HG23 THR B 45 60.186 -8.384 -12.072 1.00 0.00 H new ATOM 1954 N ILE B 46 55.451 -8.733 -12.938 1.00 0.00 N ATOM 1955 CA ILE B 46 53.960 -8.768 -12.990 1.00 0.00 C ATOM 1956 C ILE B 46 53.438 -9.304 -11.696 1.00 0.00 C ATOM 1957 O ILE B 46 52.344 -8.987 -11.269 1.00 0.00 O ATOM 1958 CB ILE B 46 53.485 -9.683 -14.119 1.00 0.00 C ATOM 1959 CG1 ILE B 46 54.295 -11.007 -14.101 1.00 0.00 C ATOM 1960 CG2 ILE B 46 53.640 -8.968 -15.473 1.00 0.00 C ATOM 1961 CD1 ILE B 46 55.516 -10.917 -15.028 1.00 0.00 C ATOM 0 H ILE B 46 55.918 -9.580 -13.260 1.00 0.00 H new ATOM 0 HA ILE B 46 53.593 -7.757 -13.166 1.00 0.00 H new ATOM 0 HB ILE B 46 52.431 -9.920 -13.973 1.00 0.00 H new ATOM 0 HG12 ILE B 46 54.621 -11.224 -13.084 1.00 0.00 H new ATOM 0 HG13 ILE B 46 53.656 -11.833 -14.414 1.00 0.00 H new ATOM 0 HG21 ILE B 46 53.300 -9.626 -16.273 1.00 0.00 H new ATOM 0 HG22 ILE B 46 53.042 -8.057 -15.474 1.00 0.00 H new ATOM 0 HG23 ILE B 46 54.688 -8.715 -15.633 1.00 0.00 H new ATOM 0 HD11 ILE B 46 56.066 -11.857 -14.997 1.00 0.00 H new ATOM 0 HD12 ILE B 46 55.185 -10.724 -16.048 1.00 0.00 H new ATOM 0 HD13 ILE B 46 56.165 -10.106 -14.697 1.00 0.00 H new ATOM 1973 N VAL B 47 54.204 -10.107 -11.054 1.00 0.00 N ATOM 1974 CA VAL B 47 53.769 -10.661 -9.781 1.00 0.00 C ATOM 1975 C VAL B 47 54.189 -9.711 -8.658 1.00 0.00 C ATOM 1976 O VAL B 47 54.174 -10.058 -7.494 1.00 0.00 O ATOM 1977 CB VAL B 47 54.405 -12.031 -9.606 1.00 0.00 C ATOM 1978 CG1 VAL B 47 55.898 -11.891 -9.298 1.00 0.00 C ATOM 1979 CG2 VAL B 47 53.710 -12.755 -8.480 1.00 0.00 C ATOM 0 H VAL B 47 55.128 -10.406 -11.366 1.00 0.00 H new ATOM 0 HA VAL B 47 52.685 -10.771 -9.753 1.00 0.00 H new ATOM 0 HB VAL B 47 54.298 -12.600 -10.530 1.00 0.00 H new ATOM 0 HG11 VAL B 47 56.339 -12.880 -9.176 1.00 0.00 H new ATOM 0 HG12 VAL B 47 56.392 -11.373 -10.120 1.00 0.00 H new ATOM 0 HG13 VAL B 47 56.028 -11.320 -8.379 1.00 0.00 H new ATOM 0 HG21 VAL B 47 54.160 -13.739 -8.348 1.00 0.00 H new ATOM 0 HG22 VAL B 47 53.815 -12.181 -7.559 1.00 0.00 H new ATOM 0 HG23 VAL B 47 52.653 -12.869 -8.718 1.00 0.00 H new ATOM 1989 N ALA B 48 54.547 -8.492 -9.007 1.00 0.00 N ATOM 1990 CA ALA B 48 54.943 -7.503 -7.982 1.00 0.00 C ATOM 1991 C ALA B 48 56.299 -7.884 -7.391 1.00 0.00 C ATOM 1992 O ALA B 48 56.675 -7.424 -6.330 1.00 0.00 O ATOM 1993 CB ALA B 48 53.891 -7.473 -6.887 1.00 0.00 C ATOM 0 H ALA B 48 54.577 -8.151 -9.968 1.00 0.00 H new ATOM 0 HA ALA B 48 55.023 -6.516 -8.437 1.00 0.00 H new ATOM 0 HB1 ALA B 48 54.177 -6.745 -6.127 1.00 0.00 H new ATOM 0 HB2 ALA B 48 52.929 -7.192 -7.315 1.00 0.00 H new ATOM 0 HB3 ALA B 48 53.811 -8.460 -6.432 1.00 0.00 H new ATOM 1999 N LYS B 49 57.050 -8.700 -8.077 1.00 0.00 N ATOM 2000 CA LYS B 49 58.390 -9.082 -7.564 1.00 0.00 C ATOM 2001 C LYS B 49 59.387 -7.981 -7.911 1.00 0.00 C ATOM 2002 O LYS B 49 60.110 -8.067 -8.884 1.00 0.00 O ATOM 2003 CB LYS B 49 58.831 -10.394 -8.202 1.00 0.00 C ATOM 2004 CG LYS B 49 59.078 -11.437 -7.111 1.00 0.00 C ATOM 2005 CD LYS B 49 58.799 -12.835 -7.666 1.00 0.00 C ATOM 2006 CE LYS B 49 60.062 -13.378 -8.337 1.00 0.00 C ATOM 2007 NZ LYS B 49 59.959 -14.860 -8.460 1.00 0.00 N ATOM 0 H LYS B 49 56.791 -9.118 -8.971 1.00 0.00 H new ATOM 0 HA LYS B 49 58.346 -9.211 -6.483 1.00 0.00 H new ATOM 0 HB2 LYS B 49 58.066 -10.749 -8.893 1.00 0.00 H new ATOM 0 HB3 LYS B 49 59.739 -10.240 -8.784 1.00 0.00 H new ATOM 0 HG2 LYS B 49 60.108 -11.373 -6.759 1.00 0.00 H new ATOM 0 HG3 LYS B 49 58.435 -11.240 -6.253 1.00 0.00 H new ATOM 0 HD2 LYS B 49 58.486 -13.501 -6.862 1.00 0.00 H new ATOM 0 HD3 LYS B 49 57.980 -12.796 -8.385 1.00 0.00 H new ATOM 0 HE2 LYS B 49 60.186 -12.928 -9.322 1.00 0.00 H new ATOM 0 HE3 LYS B 49 60.942 -13.111 -7.752 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 60.817 -15.231 -8.916 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 59.860 -15.281 -7.514 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 59.128 -15.104 -9.036 1.00 0.00 H new ATOM 2021 N GLU B 50 59.428 -6.938 -7.126 1.00 0.00 N ATOM 2022 CA GLU B 50 60.376 -5.824 -7.412 1.00 0.00 C ATOM 2023 C GLU B 50 61.780 -6.392 -7.579 1.00 0.00 C ATOM 2024 O GLU B 50 62.370 -6.889 -6.641 1.00 0.00 O ATOM 2025 CB GLU B 50 60.361 -4.831 -6.248 1.00 0.00 C ATOM 2026 CG GLU B 50 59.090 -3.983 -6.315 1.00 0.00 C ATOM 2027 CD GLU B 50 58.448 -3.916 -4.929 1.00 0.00 C ATOM 2028 OE1 GLU B 50 59.175 -3.718 -3.970 1.00 0.00 O ATOM 2029 OE2 GLU B 50 57.240 -4.063 -4.850 1.00 0.00 O ATOM 0 H GLU B 50 58.845 -6.810 -6.299 1.00 0.00 H new ATOM 0 HA GLU B 50 60.077 -5.313 -8.327 1.00 0.00 H new ATOM 0 HB2 GLU B 50 60.404 -5.366 -5.299 1.00 0.00 H new ATOM 0 HB3 GLU B 50 61.241 -4.190 -6.292 1.00 0.00 H new ATOM 0 HG2 GLU B 50 59.328 -2.979 -6.666 1.00 0.00 H new ATOM 0 HG3 GLU B 50 58.390 -4.414 -7.031 1.00 0.00 H new ATOM 2036 N ILE B 51 62.320 -6.342 -8.764 1.00 0.00 N ATOM 2037 CA ILE B 51 63.686 -6.902 -8.966 1.00 0.00 C ATOM 2038 C ILE B 51 64.684 -5.792 -9.194 1.00 0.00 C ATOM 2039 O ILE B 51 64.736 -5.200 -10.254 1.00 0.00 O ATOM 2040 CB ILE B 51 63.741 -7.824 -10.184 1.00 0.00 C ATOM 2041 CG1 ILE B 51 62.352 -8.293 -10.584 1.00 0.00 C ATOM 2042 CG2 ILE B 51 64.597 -9.038 -9.848 1.00 0.00 C ATOM 2043 CD1 ILE B 51 62.476 -9.093 -11.868 1.00 0.00 C ATOM 0 H ILE B 51 61.881 -5.942 -9.594 1.00 0.00 H new ATOM 0 HA ILE B 51 63.930 -7.465 -8.065 1.00 0.00 H new ATOM 0 HB ILE B 51 64.170 -7.268 -11.018 1.00 0.00 H new ATOM 0 HG12 ILE B 51 61.915 -8.905 -9.795 1.00 0.00 H new ATOM 0 HG13 ILE B 51 61.689 -7.440 -10.730 1.00 0.00 H new ATOM 0 HG21 ILE B 51 64.642 -9.702 -10.711 1.00 0.00 H new ATOM 0 HG22 ILE B 51 65.604 -8.712 -9.588 1.00 0.00 H new ATOM 0 HG23 ILE B 51 64.158 -9.570 -9.004 1.00 0.00 H new ATOM 0 HD11 ILE B 51 61.490 -9.441 -12.176 1.00 0.00 H new ATOM 0 HD12 ILE B 51 62.899 -8.463 -12.650 1.00 0.00 H new ATOM 0 HD13 ILE B 51 63.128 -9.950 -11.701 1.00 0.00 H new ATOM 2055 N CYS B 52 65.534 -5.561 -8.255 1.00 0.00 N ATOM 2056 CA CYS B 52 66.590 -4.560 -8.463 1.00 0.00 C ATOM 2057 C CYS B 52 67.468 -5.055 -9.606 1.00 0.00 C ATOM 2058 O CYS B 52 67.879 -6.191 -9.626 1.00 0.00 O ATOM 2059 CB CYS B 52 67.411 -4.423 -7.192 1.00 0.00 C ATOM 2060 SG CYS B 52 66.551 -3.307 -6.056 1.00 0.00 S ATOM 0 H CYS B 52 65.543 -6.025 -7.347 1.00 0.00 H new ATOM 0 HA CYS B 52 66.166 -3.585 -8.706 1.00 0.00 H new ATOM 0 HB2 CYS B 52 67.552 -5.399 -6.727 1.00 0.00 H new ATOM 0 HB3 CYS B 52 68.403 -4.034 -7.424 1.00 0.00 H new ATOM 2065 N ALA B 53 67.720 -4.239 -10.576 1.00 0.00 N ATOM 2066 CA ALA B 53 68.536 -4.698 -11.731 1.00 0.00 C ATOM 2067 C ALA B 53 69.625 -3.666 -12.031 1.00 0.00 C ATOM 2068 O ALA B 53 69.415 -2.476 -11.912 1.00 0.00 O ATOM 2069 CB ALA B 53 67.629 -4.877 -12.956 1.00 0.00 C ATOM 0 H ALA B 53 67.399 -3.272 -10.625 1.00 0.00 H new ATOM 0 HA ALA B 53 69.007 -5.651 -11.492 1.00 0.00 H new ATOM 0 HB1 ALA B 53 68.225 -5.214 -13.804 1.00 0.00 H new ATOM 0 HB2 ALA B 53 66.861 -5.619 -12.735 1.00 0.00 H new ATOM 0 HB3 ALA B 53 67.155 -3.926 -13.200 1.00 0.00 H new ATOM 2075 N ASP B 54 70.794 -4.114 -12.401 1.00 0.00 N ATOM 2076 CA ASP B 54 71.907 -3.164 -12.687 1.00 0.00 C ATOM 2077 C ASP B 54 71.554 -2.299 -13.918 1.00 0.00 C ATOM 2078 O ASP B 54 71.454 -2.814 -15.014 1.00 0.00 O ATOM 2079 CB ASP B 54 73.184 -3.956 -12.978 1.00 0.00 C ATOM 2080 CG ASP B 54 74.329 -2.988 -13.278 1.00 0.00 C ATOM 2081 OD1 ASP B 54 74.326 -1.906 -12.715 1.00 0.00 O ATOM 2082 OD2 ASP B 54 75.190 -3.346 -14.066 1.00 0.00 O ATOM 0 H ASP B 54 71.027 -5.100 -12.518 1.00 0.00 H new ATOM 0 HA ASP B 54 72.060 -2.517 -11.823 1.00 0.00 H new ATOM 0 HB2 ASP B 54 73.438 -4.583 -12.123 1.00 0.00 H new ATOM 0 HB3 ASP B 54 73.026 -4.622 -13.826 1.00 0.00 H new ATOM 2087 N PRO B 55 71.388 -0.999 -13.705 1.00 0.00 N ATOM 2088 CA PRO B 55 71.065 -0.079 -14.799 1.00 0.00 C ATOM 2089 C PRO B 55 72.213 -0.040 -15.815 1.00 0.00 C ATOM 2090 O PRO B 55 72.060 0.440 -16.921 1.00 0.00 O ATOM 2091 CB PRO B 55 70.896 1.297 -14.132 1.00 0.00 C ATOM 2092 CG PRO B 55 71.187 1.114 -12.608 1.00 0.00 C ATOM 2093 CD PRO B 55 71.503 -0.374 -12.379 1.00 0.00 C ATOM 0 HA PRO B 55 70.169 -0.384 -15.339 1.00 0.00 H new ATOM 0 HB2 PRO B 55 71.581 2.023 -14.570 1.00 0.00 H new ATOM 0 HB3 PRO B 55 69.887 1.678 -14.287 1.00 0.00 H new ATOM 0 HG2 PRO B 55 72.026 1.737 -12.299 1.00 0.00 H new ATOM 0 HG3 PRO B 55 70.327 1.420 -12.013 1.00 0.00 H new ATOM 0 HD2 PRO B 55 72.503 -0.506 -11.967 1.00 0.00 H new ATOM 0 HD3 PRO B 55 70.805 -0.821 -11.671 1.00 0.00 H new ATOM 2101 N LYS B 56 73.369 -0.530 -15.443 1.00 0.00 N ATOM 2102 CA LYS B 56 74.521 -0.509 -16.375 1.00 0.00 C ATOM 2103 C LYS B 56 74.504 -1.761 -17.263 1.00 0.00 C ATOM 2104 O LYS B 56 75.475 -2.073 -17.924 1.00 0.00 O ATOM 2105 CB LYS B 56 75.823 -0.474 -15.572 1.00 0.00 C ATOM 2106 CG LYS B 56 75.765 0.666 -14.554 1.00 0.00 C ATOM 2107 CD LYS B 56 75.902 2.006 -15.281 1.00 0.00 C ATOM 2108 CE LYS B 56 75.407 3.132 -14.371 1.00 0.00 C ATOM 2109 NZ LYS B 56 74.636 4.120 -15.178 1.00 0.00 N ATOM 0 H LYS B 56 73.558 -0.943 -14.530 1.00 0.00 H new ATOM 0 HA LYS B 56 74.452 0.377 -17.006 1.00 0.00 H new ATOM 0 HB2 LYS B 56 75.973 -1.425 -15.061 1.00 0.00 H new ATOM 0 HB3 LYS B 56 76.672 -0.335 -16.242 1.00 0.00 H new ATOM 0 HG2 LYS B 56 74.823 0.632 -14.007 1.00 0.00 H new ATOM 0 HG3 LYS B 56 76.564 0.554 -13.821 1.00 0.00 H new ATOM 0 HD2 LYS B 56 76.942 2.178 -15.557 1.00 0.00 H new ATOM 0 HD3 LYS B 56 75.325 1.991 -16.206 1.00 0.00 H new ATOM 0 HE2 LYS B 56 74.779 2.724 -13.579 1.00 0.00 H new ATOM 0 HE3 LYS B 56 76.252 3.622 -13.888 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 74.299 4.886 -14.560 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 75.249 4.517 -15.919 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 73.821 3.648 -15.619 1.00 0.00 H new ATOM 2123 N GLN B 57 73.411 -2.478 -17.291 1.00 0.00 N ATOM 2124 CA GLN B 57 73.346 -3.697 -18.144 1.00 0.00 C ATOM 2125 C GLN B 57 72.845 -3.312 -19.536 1.00 0.00 C ATOM 2126 O GLN B 57 72.417 -2.197 -19.764 1.00 0.00 O ATOM 2127 CB GLN B 57 72.386 -4.709 -17.515 1.00 0.00 C ATOM 2128 CG GLN B 57 73.172 -5.933 -17.039 1.00 0.00 C ATOM 2129 CD GLN B 57 73.737 -6.680 -18.250 1.00 0.00 C ATOM 2130 OE1 GLN B 57 74.609 -6.183 -18.932 1.00 0.00 O ATOM 2131 NE2 GLN B 57 73.274 -7.865 -18.544 1.00 0.00 N ATOM 0 H GLN B 57 72.564 -2.272 -16.761 1.00 0.00 H new ATOM 0 HA GLN B 57 74.338 -4.142 -18.224 1.00 0.00 H new ATOM 0 HB2 GLN B 57 71.859 -4.254 -16.676 1.00 0.00 H new ATOM 0 HB3 GLN B 57 71.630 -5.009 -18.241 1.00 0.00 H new ATOM 0 HG2 GLN B 57 73.982 -5.624 -16.379 1.00 0.00 H new ATOM 0 HG3 GLN B 57 72.524 -6.592 -16.461 1.00 0.00 H new ATOM 0 HE21 GLN B 57 72.541 -8.283 -17.971 1.00 0.00 H new ATOM 0 HE22 GLN B 57 73.645 -8.373 -19.347 1.00 0.00 H new ATOM 2140 N LYS B 58 72.899 -4.218 -20.471 1.00 0.00 N ATOM 2141 CA LYS B 58 72.431 -3.891 -21.847 1.00 0.00 C ATOM 2142 C LYS B 58 70.971 -4.327 -22.016 1.00 0.00 C ATOM 2143 O LYS B 58 70.294 -3.904 -22.933 1.00 0.00 O ATOM 2144 CB LYS B 58 73.312 -4.617 -22.877 1.00 0.00 C ATOM 2145 CG LYS B 58 72.700 -4.485 -24.287 1.00 0.00 C ATOM 2146 CD LYS B 58 72.394 -3.011 -24.590 1.00 0.00 C ATOM 2147 CE LYS B 58 73.706 -2.234 -24.721 1.00 0.00 C ATOM 2148 NZ LYS B 58 73.825 -1.692 -26.104 1.00 0.00 N ATOM 0 H LYS B 58 73.246 -5.169 -20.343 1.00 0.00 H new ATOM 0 HA LYS B 58 72.503 -2.815 -22.005 1.00 0.00 H new ATOM 0 HB2 LYS B 58 74.317 -4.196 -22.868 1.00 0.00 H new ATOM 0 HB3 LYS B 58 73.405 -5.670 -22.610 1.00 0.00 H new ATOM 0 HG2 LYS B 58 73.391 -4.882 -25.031 1.00 0.00 H new ATOM 0 HG3 LYS B 58 71.786 -5.076 -24.353 1.00 0.00 H new ATOM 0 HD2 LYS B 58 71.818 -2.930 -25.512 1.00 0.00 H new ATOM 0 HD3 LYS B 58 71.784 -2.584 -23.794 1.00 0.00 H new ATOM 0 HE2 LYS B 58 73.733 -1.420 -23.996 1.00 0.00 H new ATOM 0 HE3 LYS B 58 74.551 -2.886 -24.500 1.00 0.00 H new ATOM 0 HZ1 LYS B 58 74.716 -1.164 -26.194 1.00 0.00 H new ATOM 0 HZ2 LYS B 58 73.817 -2.477 -26.786 1.00 0.00 H new ATOM 0 HZ3 LYS B 58 73.025 -1.057 -26.298 1.00 0.00 H new ATOM 2162 N TRP B 59 70.471 -5.154 -21.139 1.00 0.00 N ATOM 2163 CA TRP B 59 69.057 -5.582 -21.265 1.00 0.00 C ATOM 2164 C TRP B 59 68.198 -4.695 -20.369 1.00 0.00 C ATOM 2165 O TRP B 59 67.042 -4.449 -20.641 1.00 0.00 O ATOM 2166 CB TRP B 59 68.923 -7.067 -20.864 1.00 0.00 C ATOM 2167 CG TRP B 59 68.965 -7.216 -19.373 1.00 0.00 C ATOM 2168 CD1 TRP B 59 70.093 -7.322 -18.629 1.00 0.00 C ATOM 2169 CD2 TRP B 59 67.852 -7.283 -18.443 1.00 0.00 C ATOM 2170 NE1 TRP B 59 69.740 -7.449 -17.294 1.00 0.00 N ATOM 2171 CE2 TRP B 59 68.369 -7.431 -17.127 1.00 0.00 C ATOM 2172 CE3 TRP B 59 66.444 -7.231 -18.609 1.00 0.00 C ATOM 2173 CZ2 TRP B 59 67.520 -7.524 -16.010 1.00 0.00 C ATOM 2174 CZ3 TRP B 59 65.589 -7.324 -17.485 1.00 0.00 C ATOM 2175 CH2 TRP B 59 66.134 -7.470 -16.187 1.00 0.00 C ATOM 0 H TRP B 59 70.980 -5.547 -20.347 1.00 0.00 H new ATOM 0 HA TRP B 59 68.721 -5.480 -22.297 1.00 0.00 H new ATOM 0 HB2 TRP B 59 67.986 -7.470 -21.249 1.00 0.00 H new ATOM 0 HB3 TRP B 59 69.729 -7.646 -21.316 1.00 0.00 H new ATOM 0 HD1 TRP B 59 71.102 -7.310 -19.013 1.00 0.00 H new ATOM 0 HE1 TRP B 59 70.410 -7.544 -16.530 1.00 0.00 H new ATOM 0 HE3 TRP B 59 66.023 -7.120 -19.597 1.00 0.00 H new ATOM 0 HZ2 TRP B 59 67.936 -7.637 -15.020 1.00 0.00 H new ATOM 0 HZ3 TRP B 59 64.518 -7.283 -17.618 1.00 0.00 H new ATOM 0 HH2 TRP B 59 65.478 -7.540 -15.332 1.00 0.00 H new ATOM 2186 N VAL B 60 68.773 -4.184 -19.316 1.00 0.00 N ATOM 2187 CA VAL B 60 68.015 -3.282 -18.422 1.00 0.00 C ATOM 2188 C VAL B 60 67.984 -1.878 -19.034 1.00 0.00 C ATOM 2189 O VAL B 60 67.243 -1.026 -18.606 1.00 0.00 O ATOM 2190 CB VAL B 60 68.690 -3.240 -17.055 1.00 0.00 C ATOM 2191 CG1 VAL B 60 68.001 -2.204 -16.171 1.00 0.00 C ATOM 2192 CG2 VAL B 60 68.576 -4.614 -16.405 1.00 0.00 C ATOM 0 H VAL B 60 69.740 -4.356 -19.040 1.00 0.00 H new ATOM 0 HA VAL B 60 66.995 -3.647 -18.304 1.00 0.00 H new ATOM 0 HB VAL B 60 69.739 -2.969 -17.173 1.00 0.00 H new ATOM 0 HG11 VAL B 60 68.487 -2.177 -15.195 1.00 0.00 H new ATOM 0 HG12 VAL B 60 68.072 -1.222 -16.638 1.00 0.00 H new ATOM 0 HG13 VAL B 60 66.952 -2.472 -16.047 1.00 0.00 H new ATOM 0 HG21 VAL B 60 69.056 -4.595 -15.427 1.00 0.00 H new ATOM 0 HG22 VAL B 60 67.524 -4.875 -16.288 1.00 0.00 H new ATOM 0 HG23 VAL B 60 69.066 -5.356 -17.035 1.00 0.00 H new ATOM 2202 N GLN B 61 68.766 -1.639 -20.053 1.00 0.00 N ATOM 2203 CA GLN B 61 68.741 -0.305 -20.706 1.00 0.00 C ATOM 2204 C GLN B 61 67.601 -0.289 -21.717 1.00 0.00 C ATOM 2205 O GLN B 61 67.025 0.742 -22.005 1.00 0.00 O ATOM 2206 CB GLN B 61 70.070 -0.052 -21.419 1.00 0.00 C ATOM 2207 CG GLN B 61 71.056 0.599 -20.447 1.00 0.00 C ATOM 2208 CD GLN B 61 70.991 2.120 -20.596 1.00 0.00 C ATOM 2209 OE1 GLN B 61 70.890 2.630 -21.694 1.00 0.00 O ATOM 2210 NE2 GLN B 61 71.045 2.870 -19.530 1.00 0.00 N ATOM 0 H GLN B 61 69.418 -2.310 -20.458 1.00 0.00 H new ATOM 0 HA GLN B 61 68.592 0.476 -19.960 1.00 0.00 H new ATOM 0 HB2 GLN B 61 70.478 -0.991 -21.793 1.00 0.00 H new ATOM 0 HB3 GLN B 61 69.914 0.595 -22.283 1.00 0.00 H new ATOM 0 HG2 GLN B 61 70.816 0.313 -19.423 1.00 0.00 H new ATOM 0 HG3 GLN B 61 72.068 0.246 -20.648 1.00 0.00 H new ATOM 0 HE21 GLN B 61 71.130 2.441 -18.608 1.00 0.00 H new ATOM 0 HE22 GLN B 61 71.002 3.885 -19.618 1.00 0.00 H new ATOM 2219 N ASP B 62 67.250 -1.434 -22.238 1.00 0.00 N ATOM 2220 CA ASP B 62 66.131 -1.499 -23.199 1.00 0.00 C ATOM 2221 C ASP B 62 64.828 -1.674 -22.422 1.00 0.00 C ATOM 2222 O ASP B 62 63.788 -1.176 -22.805 1.00 0.00 O ATOM 2223 CB ASP B 62 66.330 -2.686 -24.143 1.00 0.00 C ATOM 2224 CG ASP B 62 67.672 -2.545 -24.865 1.00 0.00 C ATOM 2225 OD1 ASP B 62 67.777 -1.674 -25.714 1.00 0.00 O ATOM 2226 OD2 ASP B 62 68.573 -3.308 -24.556 1.00 0.00 O ATOM 0 H ASP B 62 67.698 -2.327 -22.033 1.00 0.00 H new ATOM 0 HA ASP B 62 66.093 -0.582 -23.787 1.00 0.00 H new ATOM 0 HB2 ASP B 62 66.304 -3.620 -23.581 1.00 0.00 H new ATOM 0 HB3 ASP B 62 65.517 -2.728 -24.868 1.00 0.00 H new ATOM 2231 N SER B 63 64.885 -2.371 -21.319 1.00 0.00 N ATOM 2232 CA SER B 63 63.662 -2.575 -20.498 1.00 0.00 C ATOM 2233 C SER B 63 63.372 -1.306 -19.699 1.00 0.00 C ATOM 2234 O SER B 63 62.291 -0.765 -19.751 1.00 0.00 O ATOM 2235 CB SER B 63 63.891 -3.732 -19.533 1.00 0.00 C ATOM 2236 OG SER B 63 64.686 -4.725 -20.163 1.00 0.00 O ATOM 0 H SER B 63 65.730 -2.808 -20.952 1.00 0.00 H new ATOM 0 HA SER B 63 62.818 -2.800 -21.150 1.00 0.00 H new ATOM 0 HB2 SER B 63 64.386 -3.374 -18.630 1.00 0.00 H new ATOM 0 HB3 SER B 63 62.936 -4.157 -19.225 1.00 0.00 H new ATOM 0 HG SER B 63 65.630 -4.571 -19.951 1.00 0.00 H new ATOM 2242 N MET B 64 64.337 -0.830 -18.953 1.00 0.00 N ATOM 2243 CA MET B 64 64.119 0.408 -18.143 1.00 0.00 C ATOM 2244 C MET B 64 63.539 1.503 -19.037 1.00 0.00 C ATOM 2245 O MET B 64 62.799 2.351 -18.592 1.00 0.00 O ATOM 2246 CB MET B 64 65.461 0.878 -17.530 1.00 0.00 C ATOM 2247 CG MET B 64 66.323 1.601 -18.589 1.00 0.00 C ATOM 2248 SD MET B 64 67.754 2.371 -17.785 1.00 0.00 S ATOM 2249 CE MET B 64 68.550 0.852 -17.214 1.00 0.00 C ATOM 0 H MET B 64 65.265 -1.244 -18.870 1.00 0.00 H new ATOM 0 HA MET B 64 63.419 0.195 -17.335 1.00 0.00 H new ATOM 0 HB2 MET B 64 65.269 1.548 -16.692 1.00 0.00 H new ATOM 0 HB3 MET B 64 66.006 0.021 -17.134 1.00 0.00 H new ATOM 0 HG2 MET B 64 66.657 0.892 -19.347 1.00 0.00 H new ATOM 0 HG3 MET B 64 65.729 2.359 -19.101 1.00 0.00 H new ATOM 0 HE1 MET B 64 69.519 1.091 -16.777 1.00 0.00 H new ATOM 0 HE2 MET B 64 67.922 0.372 -16.464 1.00 0.00 H new ATOM 0 HE3 MET B 64 68.690 0.175 -18.057 1.00 0.00 H new ATOM 2259 N ASP B 65 63.875 1.484 -20.299 1.00 0.00 N ATOM 2260 CA ASP B 65 63.352 2.508 -21.227 1.00 0.00 C ATOM 2261 C ASP B 65 61.964 2.094 -21.682 1.00 0.00 C ATOM 2262 O ASP B 65 61.079 2.912 -21.849 1.00 0.00 O ATOM 2263 CB ASP B 65 64.279 2.624 -22.439 1.00 0.00 C ATOM 2264 CG ASP B 65 65.312 3.724 -22.190 1.00 0.00 C ATOM 2265 OD1 ASP B 65 65.839 3.777 -21.091 1.00 0.00 O ATOM 2266 OD2 ASP B 65 65.558 4.497 -23.102 1.00 0.00 O ATOM 0 H ASP B 65 64.495 0.794 -20.723 1.00 0.00 H new ATOM 0 HA ASP B 65 63.303 3.474 -20.724 1.00 0.00 H new ATOM 0 HB2 ASP B 65 64.781 1.673 -22.618 1.00 0.00 H new ATOM 0 HB3 ASP B 65 63.699 2.851 -23.333 1.00 0.00 H new ATOM 2271 N HIS B 66 61.759 0.826 -21.866 1.00 0.00 N ATOM 2272 CA HIS B 66 60.424 0.342 -22.287 1.00 0.00 C ATOM 2273 C HIS B 66 59.405 0.724 -21.218 1.00 0.00 C ATOM 2274 O HIS B 66 58.237 0.908 -21.492 1.00 0.00 O ATOM 2275 CB HIS B 66 60.454 -1.178 -22.448 1.00 0.00 C ATOM 2276 CG HIS B 66 59.101 -1.662 -22.892 1.00 0.00 C ATOM 2277 ND1 HIS B 66 58.073 -2.262 -22.211 1.00 0.00 N flip ATOM 2278 CD2 HIS B 66 58.670 -1.549 -24.206 1.00 0.00 C flip ATOM 2279 CE1 HIS B 66 57.019 -2.519 -23.082 1.00 0.00 C flip ATOM 2280 NE2 HIS B 66 57.430 -2.071 -24.271 1.00 0.00 N flip ATOM 0 H HIS B 66 62.464 0.099 -21.742 1.00 0.00 H new ATOM 0 HA HIS B 66 60.150 0.794 -23.240 1.00 0.00 H new ATOM 0 HB2 HIS B 66 61.211 -1.462 -23.179 1.00 0.00 H new ATOM 0 HB3 HIS B 66 60.729 -1.649 -21.504 1.00 0.00 H new ATOM 0 HD2 HIS B 66 59.227 -1.121 -25.026 1.00 0.00 H new ATOM 0 HE1 HIS B 66 56.072 -2.982 -22.847 1.00 0.00 H new ATOM 0 HE2 HIS B 66 56.873 -2.118 -25.124 1.00 0.00 H new ATOM 2288 N LEU B 67 59.850 0.868 -20.000 1.00 0.00 N ATOM 2289 CA LEU B 67 58.930 1.263 -18.905 1.00 0.00 C ATOM 2290 C LEU B 67 59.009 2.771 -18.735 1.00 0.00 C ATOM 2291 O LEU B 67 58.049 3.420 -18.370 1.00 0.00 O ATOM 2292 CB LEU B 67 59.350 0.567 -17.599 1.00 0.00 C ATOM 2293 CG LEU B 67 59.728 -0.893 -17.885 1.00 0.00 C ATOM 2294 CD1 LEU B 67 60.491 -1.470 -16.701 1.00 0.00 C ATOM 2295 CD2 LEU B 67 58.468 -1.708 -18.100 1.00 0.00 C ATOM 0 H LEU B 67 60.820 0.727 -19.718 1.00 0.00 H new ATOM 0 HA LEU B 67 57.909 0.967 -19.146 1.00 0.00 H new ATOM 0 HB2 LEU B 67 60.196 1.090 -17.153 1.00 0.00 H new ATOM 0 HB3 LEU B 67 58.534 0.606 -16.877 1.00 0.00 H new ATOM 0 HG LEU B 67 60.353 -0.930 -18.777 1.00 0.00 H new ATOM 0 HD11 LEU B 67 60.757 -2.506 -16.910 1.00 0.00 H new ATOM 0 HD12 LEU B 67 61.398 -0.889 -16.535 1.00 0.00 H new ATOM 0 HD13 LEU B 67 59.865 -1.428 -15.810 1.00 0.00 H new ATOM 0 HD21 LEU B 67 58.736 -2.745 -18.303 1.00 0.00 H new ATOM 0 HD22 LEU B 67 57.848 -1.662 -17.205 1.00 0.00 H new ATOM 0 HD23 LEU B 67 57.913 -1.304 -18.947 1.00 0.00 H new ATOM 2307 N ASP B 68 60.137 3.338 -19.048 1.00 0.00 N ATOM 2308 CA ASP B 68 60.277 4.803 -18.965 1.00 0.00 C ATOM 2309 C ASP B 68 59.390 5.443 -20.032 1.00 0.00 C ATOM 2310 O ASP B 68 59.141 6.632 -20.016 1.00 0.00 O ATOM 2311 CB ASP B 68 61.740 5.189 -19.202 1.00 0.00 C ATOM 2312 CG ASP B 68 62.264 5.966 -17.994 1.00 0.00 C ATOM 2313 OD1 ASP B 68 61.523 6.783 -17.471 1.00 0.00 O ATOM 2314 OD2 ASP B 68 63.399 5.733 -17.611 1.00 0.00 O ATOM 0 H ASP B 68 60.971 2.840 -19.360 1.00 0.00 H new ATOM 0 HA ASP B 68 59.973 5.153 -17.979 1.00 0.00 H new ATOM 0 HB2 ASP B 68 62.342 4.294 -19.362 1.00 0.00 H new ATOM 0 HB3 ASP B 68 61.826 5.796 -20.103 1.00 0.00 H new ATOM 2319 N LYS B 69 58.892 4.655 -20.956 1.00 0.00 N ATOM 2320 CA LYS B 69 58.013 5.207 -21.997 1.00 0.00 C ATOM 2321 C LYS B 69 56.852 4.252 -22.236 1.00 0.00 C ATOM 2322 O LYS B 69 56.415 4.048 -23.351 1.00 0.00 O ATOM 2323 CB LYS B 69 58.801 5.406 -23.294 1.00 0.00 C ATOM 2324 CG LYS B 69 59.310 4.053 -23.796 1.00 0.00 C ATOM 2325 CD LYS B 69 60.758 4.197 -24.269 1.00 0.00 C ATOM 2326 CE LYS B 69 61.232 2.871 -24.869 1.00 0.00 C ATOM 2327 NZ LYS B 69 61.676 3.093 -26.273 1.00 0.00 N ATOM 0 H LYS B 69 59.066 3.652 -21.021 1.00 0.00 H new ATOM 0 HA LYS B 69 57.626 6.172 -21.670 1.00 0.00 H new ATOM 0 HB2 LYS B 69 58.167 5.871 -24.049 1.00 0.00 H new ATOM 0 HB3 LYS B 69 59.640 6.081 -23.122 1.00 0.00 H new ATOM 0 HG2 LYS B 69 59.248 3.311 -23.000 1.00 0.00 H new ATOM 0 HG3 LYS B 69 58.683 3.697 -24.613 1.00 0.00 H new ATOM 0 HD2 LYS B 69 60.832 4.992 -25.011 1.00 0.00 H new ATOM 0 HD3 LYS B 69 61.398 4.480 -23.434 1.00 0.00 H new ATOM 0 HE2 LYS B 69 62.052 2.464 -24.277 1.00 0.00 H new ATOM 0 HE3 LYS B 69 60.425 2.138 -24.843 1.00 0.00 H new ATOM 0 HZ1 LYS B 69 61.998 2.193 -26.682 1.00 0.00 H new ATOM 0 HZ2 LYS B 69 60.882 3.463 -26.834 1.00 0.00 H new ATOM 0 HZ3 LYS B 69 62.458 3.778 -26.286 1.00 0.00 H new ATOM 2341 N GLN B 70 56.345 3.670 -21.192 1.00 0.00 N ATOM 2342 CA GLN B 70 55.212 2.738 -21.334 1.00 0.00 C ATOM 2343 C GLN B 70 53.896 3.475 -21.061 1.00 0.00 C ATOM 2344 O GLN B 70 52.823 2.936 -21.251 1.00 0.00 O ATOM 2345 CB GLN B 70 55.367 1.587 -20.338 1.00 0.00 C ATOM 2346 CG GLN B 70 55.395 2.145 -18.913 1.00 0.00 C ATOM 2347 CD GLN B 70 54.306 1.467 -18.079 1.00 0.00 C ATOM 2348 OE1 GLN B 70 54.537 1.087 -16.949 1.00 0.00 O ATOM 2349 NE2 GLN B 70 53.118 1.297 -18.593 1.00 0.00 N ATOM 0 H GLN B 70 56.675 3.805 -20.236 1.00 0.00 H new ATOM 0 HA GLN B 70 55.199 2.342 -22.349 1.00 0.00 H new ATOM 0 HB2 GLN B 70 54.542 0.883 -20.448 1.00 0.00 H new ATOM 0 HB3 GLN B 70 56.285 1.036 -20.542 1.00 0.00 H new ATOM 0 HG2 GLN B 70 56.373 1.973 -18.463 1.00 0.00 H new ATOM 0 HG3 GLN B 70 55.237 3.223 -18.930 1.00 0.00 H new ATOM 0 HE21 GLN B 70 52.923 1.616 -19.542 1.00 0.00 H new ATOM 0 HE22 GLN B 70 52.385 0.846 -18.046 1.00 0.00 H new ATOM 2358 N THR B 71 53.967 4.700 -20.610 1.00 0.00 N ATOM 2359 CA THR B 71 52.730 5.458 -20.323 1.00 0.00 C ATOM 2360 C THR B 71 52.981 6.952 -20.538 1.00 0.00 C ATOM 2361 O THR B 71 52.482 7.787 -19.810 1.00 0.00 O ATOM 2362 CB THR B 71 52.313 5.215 -18.871 1.00 0.00 C ATOM 2363 OG1 THR B 71 51.116 5.930 -18.596 1.00 0.00 O ATOM 2364 CG2 THR B 71 53.424 5.693 -17.935 1.00 0.00 C ATOM 0 H THR B 71 54.835 5.204 -20.430 1.00 0.00 H new ATOM 0 HA THR B 71 51.937 5.126 -20.993 1.00 0.00 H new ATOM 0 HB THR B 71 52.142 4.150 -18.714 1.00 0.00 H new ATOM 0 HG1 THR B 71 51.208 6.854 -18.909 1.00 0.00 H new ATOM 0 HG21 THR B 71 53.128 5.520 -16.900 1.00 0.00 H new ATOM 0 HG22 THR B 71 54.340 5.142 -18.147 1.00 0.00 H new ATOM 0 HG23 THR B 71 53.597 6.758 -18.090 1.00 0.00 H new ATOM 2372 N GLN B 72 53.749 7.297 -21.535 1.00 0.00 N ATOM 2373 CA GLN B 72 54.026 8.729 -21.798 1.00 0.00 C ATOM 2374 C GLN B 72 54.269 8.936 -23.294 1.00 0.00 C ATOM 2375 O GLN B 72 55.358 9.273 -23.715 1.00 0.00 O ATOM 2376 CB GLN B 72 55.265 9.164 -21.011 1.00 0.00 C ATOM 2377 CG GLN B 72 56.426 8.219 -21.323 1.00 0.00 C ATOM 2378 CD GLN B 72 57.747 8.986 -21.235 1.00 0.00 C ATOM 2379 OE1 GLN B 72 58.049 9.583 -20.220 1.00 0.00 O ATOM 2380 NE2 GLN B 72 58.553 8.995 -22.261 1.00 0.00 N ATOM 0 H GLN B 72 54.196 6.644 -22.178 1.00 0.00 H new ATOM 0 HA GLN B 72 53.171 9.328 -21.484 1.00 0.00 H new ATOM 0 HB2 GLN B 72 55.535 10.187 -21.273 1.00 0.00 H new ATOM 0 HB3 GLN B 72 55.052 9.154 -19.942 1.00 0.00 H new ATOM 0 HG2 GLN B 72 56.430 7.386 -20.620 1.00 0.00 H new ATOM 0 HG3 GLN B 72 56.305 7.795 -22.320 1.00 0.00 H new ATOM 0 HE21 GLN B 72 58.300 8.494 -23.113 1.00 0.00 H new ATOM 0 HE22 GLN B 72 59.436 9.503 -22.211 1.00 0.00 H new ATOM 2389 N THR B 73 53.263 8.739 -24.100 1.00 0.00 N ATOM 2390 CA THR B 73 53.436 8.926 -25.567 1.00 0.00 C ATOM 2391 C THR B 73 52.579 10.115 -26.036 1.00 0.00 C ATOM 2392 O THR B 73 51.449 9.932 -26.447 1.00 0.00 O ATOM 2393 CB THR B 73 52.989 7.657 -26.297 1.00 0.00 C ATOM 2394 OG1 THR B 73 53.797 6.564 -25.881 1.00 0.00 O ATOM 2395 CG2 THR B 73 53.135 7.856 -27.805 1.00 0.00 C ATOM 0 H THR B 73 52.328 8.456 -23.806 1.00 0.00 H new ATOM 0 HA THR B 73 54.485 9.124 -25.788 1.00 0.00 H new ATOM 0 HB THR B 73 51.946 7.449 -26.060 1.00 0.00 H new ATOM 0 HG1 THR B 73 53.511 5.750 -26.346 1.00 0.00 H new ATOM 0 HG21 THR B 73 52.816 6.952 -28.324 1.00 0.00 H new ATOM 0 HG22 THR B 73 52.515 8.694 -28.123 1.00 0.00 H new ATOM 0 HG23 THR B 73 54.178 8.064 -28.045 1.00 0.00 H new ATOM 2403 N PRO B 74 53.144 11.308 -25.960 1.00 0.00 N ATOM 2404 CA PRO B 74 52.438 12.523 -26.373 1.00 0.00 C ATOM 2405 C PRO B 74 52.050 12.433 -27.851 1.00 0.00 C ATOM 2406 O PRO B 74 52.715 11.792 -28.640 1.00 0.00 O ATOM 2407 CB PRO B 74 53.442 13.666 -26.146 1.00 0.00 C ATOM 2408 CG PRO B 74 54.749 13.032 -25.570 1.00 0.00 C ATOM 2409 CD PRO B 74 54.512 11.514 -25.463 1.00 0.00 C ATOM 0 HA PRO B 74 51.516 12.675 -25.812 1.00 0.00 H new ATOM 0 HB2 PRO B 74 53.648 14.187 -27.081 1.00 0.00 H new ATOM 0 HB3 PRO B 74 53.035 14.403 -25.453 1.00 0.00 H new ATOM 0 HG2 PRO B 74 55.598 13.244 -26.220 1.00 0.00 H new ATOM 0 HG3 PRO B 74 54.983 13.454 -24.593 1.00 0.00 H new ATOM 0 HD2 PRO B 74 55.236 10.958 -26.058 1.00 0.00 H new ATOM 0 HD3 PRO B 74 54.614 11.170 -24.434 1.00 0.00 H new ATOM 2417 N LYS B 75 50.977 13.071 -28.232 1.00 0.00 N ATOM 2418 CA LYS B 75 50.546 13.020 -29.657 1.00 0.00 C ATOM 2419 C LYS B 75 50.187 11.581 -30.030 1.00 0.00 C ATOM 2420 O LYS B 75 50.936 10.897 -30.699 1.00 0.00 O ATOM 2421 CB LYS B 75 51.687 13.513 -30.553 1.00 0.00 C ATOM 2422 CG LYS B 75 51.250 14.785 -31.282 1.00 0.00 C ATOM 2423 CD LYS B 75 52.485 15.526 -31.798 1.00 0.00 C ATOM 2424 CE LYS B 75 52.066 16.886 -32.361 1.00 0.00 C ATOM 2425 NZ LYS B 75 53.196 17.848 -32.230 1.00 0.00 N ATOM 0 H LYS B 75 50.381 13.625 -27.618 1.00 0.00 H new ATOM 0 HA LYS B 75 49.674 13.658 -29.797 1.00 0.00 H new ATOM 0 HB2 LYS B 75 52.575 13.712 -29.953 1.00 0.00 H new ATOM 0 HB3 LYS B 75 51.956 12.742 -31.275 1.00 0.00 H new ATOM 0 HG2 LYS B 75 50.591 14.533 -32.112 1.00 0.00 H new ATOM 0 HG3 LYS B 75 50.683 15.427 -30.608 1.00 0.00 H new ATOM 0 HD2 LYS B 75 53.205 15.661 -30.991 1.00 0.00 H new ATOM 0 HD3 LYS B 75 52.979 14.937 -32.571 1.00 0.00 H new ATOM 0 HE2 LYS B 75 51.780 16.785 -33.408 1.00 0.00 H new ATOM 0 HE3 LYS B 75 51.193 17.259 -31.826 1.00 0.00 H new ATOM 0 HZ1 LYS B 75 52.911 18.772 -32.613 1.00 0.00 H new ATOM 0 HZ2 LYS B 75 53.449 17.952 -31.227 1.00 0.00 H new ATOM 0 HZ3 LYS B 75 54.018 17.493 -32.759 1.00 0.00 H new ATOM 2439 N THR B 76 49.045 11.115 -29.603 1.00 0.00 N ATOM 2440 CA THR B 76 48.639 9.720 -29.932 1.00 0.00 C ATOM 2441 C THR B 76 47.365 9.746 -30.779 1.00 0.00 C ATOM 2442 O THR B 76 47.261 10.615 -31.630 1.00 0.00 O ATOM 2443 CB THR B 76 48.375 8.946 -28.638 1.00 0.00 C ATOM 2444 OG1 THR B 76 47.861 7.660 -28.953 1.00 0.00 O ATOM 2445 CG2 THR B 76 47.360 9.709 -27.784 1.00 0.00 C ATOM 2446 OXT THR B 76 46.516 8.897 -30.563 1.00 0.00 O ATOM 0 H THR B 76 48.376 11.641 -29.040 1.00 0.00 H new ATOM 0 HA THR B 76 49.438 9.232 -30.491 1.00 0.00 H new ATOM 0 HB THR B 76 49.306 8.838 -28.082 1.00 0.00 H new ATOM 0 HG1 THR B 76 47.056 7.755 -29.503 1.00 0.00 H new ATOM 0 HG21 THR B 76 47.172 9.158 -26.863 1.00 0.00 H new ATOM 0 HG22 THR B 76 47.756 10.695 -27.542 1.00 0.00 H new ATOM 0 HG23 THR B 76 46.428 9.818 -28.338 1.00 0.00 H new TER 2454 THR B 76