USER MOD reduce.3.24.130724 H: found=0, std=0, add=1857, rem=0, adj=50 USER MOD reduce.3.24.130724 removed 1853 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 73 ASN : amide:sc= 1.76 X(o=2.6,f=2.2) USER MOD Set 1.2: B 95 HIS : no HE2:sc= 0.821 K(o=2.6,f=-4.3!) USER MOD Set 2.1: A 70 MET CE :methyl -170:sc= -2.57! (180deg=-3.4!) USER MOD Set 2.2: B 69 SER OG : rot 160:sc= 0.0841 USER MOD Set 3.1: B 19 MET CE :methyl -145:sc= -0.212 (180deg=-1.99!) USER MOD Set 3.2: B 47 ASN : amide:sc= -1.81 K(o=-2,f=-4.5!) USER MOD Set 4.1: B 10 SER OG : rot 116:sc= 1.21 USER MOD Set 4.2: B 13 ASN : amide:sc= -0.312 K(o=4.4,f=0.8!) USER MOD Set 4.3: B 17 SER OG : rot 90:sc= 1.19 USER MOD Set 4.4: B 18 GLN : amide:sc= -1.42! C(o=4.4!,f=0.29!) USER MOD Set 4.5: B 36 SER OG : rot -111:sc= 2.19 USER MOD Set 4.6: B 62 GLN : amide:sc= 0.413 K(o=4.4,f=2.3) USER MOD Set 4.7: B 64 SER OG : rot -53:sc= 1.15 USER MOD Set 5.1: A 71 SER OG : rot 64:sc= 0.559 USER MOD Set 5.2: A 74 THR OG1 : rot 88:sc= 1.68 USER MOD Set 6.1: A 7 THR OG1 : rot 69:sc= 1.42 USER MOD Set 6.2: A 60 ASN : amide:sc= 0.876 K(o=2.3,f=-2) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -132:sc= 3.04 (180deg=-0.514) USER MOD Single : A 5 LYS NZ :NH3+ 176:sc= 1.28 (180deg=1.19) USER MOD Single : A 9 GLN : amide:sc= 1.17 K(o=1.2,f=0) USER MOD Single : A 10 SER OG : rot 180:sc= 0.00133 USER MOD Single : A 12 SER OG : rot 180:sc= 0.00192 USER MOD Single : A 15 THR OG1 : rot -69:sc= 1.28 USER MOD Single : A 16 SER OG : rot 70:sc= 1.22 USER MOD Single : A 32 SER OG : rot 164:sc= 1.2 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 44 GLN : amide:sc= 0.53 K(o=0.53,f=0) USER MOD Single : A 46 MET CE :methyl -159:sc= -0.331 (180deg=-1.3) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 LYS NZ :NH3+ -168:sc= 2.29 (180deg=2.27) USER MOD Single : A 54 LYS NZ :NH3+ -115:sc= 0.352 (180deg=0.105) USER MOD Single : A 61 GLN : amide:sc= -1.2! C(o=-1.2!,f=-1.7!) USER MOD Single : A 63 THR OG1 : rot -147:sc= -0.156 USER MOD Single : A 66 LYS NZ :NH3+ -175:sc= 2.15 (180deg=2.14) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ -175:sc= 1.04 (180deg=1.02) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 14:sc= 0.64 USER MOD Single : A 91 LYS NZ :NH3+ -151:sc= 0.651 (180deg=-0.199!) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 GLN : amide:sc= 1.06 K(o=1.1,f=-0.22) USER MOD Single : A 101 ASN : amide:sc=-0.00981 X(o=-0.0098,f=-0.0027) USER MOD Single : A 102 LYS NZ :NH3+ -170:sc= 1.32 (180deg=1.14) USER MOD Single : A 103 HIS : no HE2:sc= -1.57 K(o=-1.6,f=-5.1!) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 142:sc= 0.0317 (180deg=0) USER MOD Single : B 3 ASN : amide:sc= 1.1 K(o=1.1,f=-0.013) USER MOD Single : B 4 LYS NZ :NH3+ -171:sc= 1.23 (180deg=1.13) USER MOD Single : B 7 TYR OH : rot 15:sc= 0.337 USER MOD Single : B 11 THR OG1 : rot 98:sc= 0.411 USER MOD Single : B 14 SER OG : rot 180:sc= 0 USER MOD Single : B 25 LYS NZ :NH3+ 158:sc= 1.84 (180deg=1.25) USER MOD Single : B 26 GLN : amide:sc=-0.00884 X(o=-0.0088,f=-0.12) USER MOD Single : B 27 TYR OH : rot 180:sc= 0 USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 35 TYR OH : rot 150:sc= 0 USER MOD Single : B 42 HIS : no HD1:sc= 0 X(o=0,f=-0.019) USER MOD Single : B 45 ASN : amide:sc= 0.538 K(o=0.54,f=-8.4!) USER MOD Single : B 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 52 MET CE :methyl -139:sc= -0.915 (180deg=-1.72) USER MOD Single : B 53 LYS NZ :NH3+ 144:sc= 1.05 (180deg=0.132) USER MOD Single : B 60 SER OG : rot 94:sc= 1.25 USER MOD Single : B 61 ASN : amide:sc= -0.134 X(o=-0.13,f=-0.13) USER MOD Single : B 63 THR OG1 : rot 180:sc= 0 USER MOD Single : B 74 ASN : amide:sc= 1.17 K(o=1.2,f=-0.12) USER MOD Single : B 80 THR OG1 : rot 171:sc= 0.793 USER MOD Single : B 82 SER OG : rot -126:sc= 0.575 USER MOD Single : B 88 LYS NZ :NH3+ 146:sc= 1.05 (180deg=0.706) USER MOD Single : B 91 MET CE :methyl 168:sc= -2.37 (180deg=-2.96) USER MOD Single : B 92 THR OG1 : rot 42:sc= 0.0435 USER MOD Single : B 97 LYS NZ :NH3+ 180:sc= 1.01 (180deg=1.01) USER MOD Single : B 100 HIS : no HD1:sc= -0.341 X(o=-0.34,f=-0.19) USER MOD Single : B 110 GLN : amide:sc= 0.499 X(o=0.5,f=0) USER MOD Single : B 112 THR OG1 : rot 180:sc= 0.383 USER MOD Single : B 116 LYS NZ :NH3+ 177:sc= 0.92 (180deg=0.91) USER MOD Single : B 121 GLN : amide:sc= -0.0118 X(o=-0.012,f=0) USER MOD Single : B 129 ASN : amide:sc= 0.766 K(o=0.77,f=0) USER MOD Single : B 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 137 THR OG1 : rot -79:sc= 1.19 USER MOD Single : B 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -24.305 -11.685 -7.943 1.00 0.00 N ATOM 2 CA MET A 1 -24.434 -11.507 -9.399 1.00 0.00 C ATOM 3 C MET A 1 -23.177 -12.053 -10.078 1.00 0.00 C ATOM 4 O MET A 1 -23.204 -13.180 -10.575 1.00 0.00 O ATOM 5 CB MET A 1 -24.775 -10.044 -9.761 1.00 0.00 C ATOM 6 CG MET A 1 -24.959 -9.820 -11.268 1.00 0.00 C ATOM 7 SD MET A 1 -25.289 -8.092 -11.711 1.00 0.00 S ATOM 8 CE MET A 1 -25.364 -8.252 -13.516 1.00 0.00 C ATOM 0 H1 MET A 1 -25.177 -12.108 -7.566 1.00 0.00 H new ATOM 0 H2 MET A 1 -23.500 -12.312 -7.740 1.00 0.00 H new ATOM 0 H3 MET A 1 -24.146 -10.761 -7.493 1.00 0.00 H new ATOM 0 HA MET A 1 -25.278 -12.082 -9.780 1.00 0.00 H new ATOM 0 HB2 MET A 1 -25.688 -9.752 -9.243 1.00 0.00 H new ATOM 0 HB3 MET A 1 -23.980 -9.392 -9.398 1.00 0.00 H new ATOM 0 HG2 MET A 1 -24.062 -10.155 -11.789 1.00 0.00 H new ATOM 0 HG3 MET A 1 -25.783 -10.440 -11.621 1.00 0.00 H new ATOM 0 HE1 MET A 1 -25.561 -7.276 -13.960 1.00 0.00 H new ATOM 0 HE2 MET A 1 -24.413 -8.634 -13.887 1.00 0.00 H new ATOM 0 HE3 MET A 1 -26.163 -8.942 -13.787 1.00 0.00 H new ATOM 20 N ALA A 2 -22.086 -11.278 -10.117 1.00 0.00 N ATOM 21 CA ALA A 2 -20.792 -11.673 -10.652 1.00 0.00 C ATOM 22 C ALA A 2 -19.744 -10.718 -10.089 1.00 0.00 C ATOM 23 O ALA A 2 -20.086 -9.688 -9.498 1.00 0.00 O ATOM 24 CB ALA A 2 -20.813 -11.573 -12.187 1.00 0.00 C ATOM 0 H ALA A 2 -22.088 -10.322 -9.761 1.00 0.00 H new ATOM 0 HA ALA A 2 -20.561 -12.701 -10.373 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -19.842 -11.870 -12.584 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -21.584 -12.233 -12.584 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -21.027 -10.546 -12.482 1.00 0.00 H new ATOM 30 N ILE A 3 -18.476 -11.059 -10.302 1.00 0.00 N ATOM 31 CA ILE A 3 -17.352 -10.187 -10.054 1.00 0.00 C ATOM 32 C ILE A 3 -17.184 -9.440 -11.387 1.00 0.00 C ATOM 33 O ILE A 3 -16.598 -9.954 -12.344 1.00 0.00 O ATOM 34 CB ILE A 3 -16.128 -10.996 -9.545 1.00 0.00 C ATOM 35 CG1 ILE A 3 -16.247 -11.433 -8.067 1.00 0.00 C ATOM 36 CG2 ILE A 3 -14.864 -10.131 -9.597 1.00 0.00 C ATOM 37 CD1 ILE A 3 -17.262 -12.519 -7.738 1.00 0.00 C ATOM 0 H ILE A 3 -18.204 -11.974 -10.661 1.00 0.00 H new ATOM 0 HA ILE A 3 -17.487 -9.464 -9.249 1.00 0.00 H new ATOM 0 HB ILE A 3 -16.084 -11.871 -10.193 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -15.267 -11.777 -7.737 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -16.492 -10.552 -7.474 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -14.013 -10.709 -9.238 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -14.681 -9.816 -10.624 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -14.998 -9.252 -8.966 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -17.239 -12.726 -6.668 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -18.259 -12.183 -8.021 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -17.015 -13.427 -8.289 1.00 0.00 H new ATOM 49 N VAL A 4 -17.809 -8.267 -11.474 1.00 0.00 N ATOM 50 CA VAL A 4 -17.764 -7.342 -12.601 1.00 0.00 C ATOM 51 C VAL A 4 -16.407 -6.622 -12.564 1.00 0.00 C ATOM 52 O VAL A 4 -15.669 -6.729 -11.582 1.00 0.00 O ATOM 53 CB VAL A 4 -19.001 -6.409 -12.505 1.00 0.00 C ATOM 54 CG1 VAL A 4 -19.181 -5.444 -13.689 1.00 0.00 C ATOM 55 CG2 VAL A 4 -20.304 -7.227 -12.394 1.00 0.00 C ATOM 0 H VAL A 4 -18.394 -7.918 -10.715 1.00 0.00 H new ATOM 0 HA VAL A 4 -17.827 -7.834 -13.572 1.00 0.00 H new ATOM 0 HB VAL A 4 -18.807 -5.816 -11.611 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -20.071 -4.835 -13.530 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -18.308 -4.797 -13.767 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -19.292 -6.015 -14.610 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -21.155 -6.549 -12.328 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -20.412 -7.860 -13.274 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -20.267 -7.851 -11.501 1.00 0.00 H new ATOM 65 N LYS A 5 -16.067 -5.865 -13.608 1.00 0.00 N ATOM 66 CA LYS A 5 -14.915 -4.974 -13.623 1.00 0.00 C ATOM 67 C LYS A 5 -15.369 -3.592 -14.089 1.00 0.00 C ATOM 68 O LYS A 5 -16.094 -3.475 -15.078 1.00 0.00 O ATOM 69 CB LYS A 5 -13.788 -5.576 -14.480 1.00 0.00 C ATOM 70 CG LYS A 5 -12.493 -4.747 -14.385 1.00 0.00 C ATOM 71 CD LYS A 5 -11.287 -5.426 -15.049 1.00 0.00 C ATOM 72 CE LYS A 5 -11.509 -5.664 -16.551 1.00 0.00 C ATOM 73 NZ LYS A 5 -10.290 -6.179 -17.220 1.00 0.00 N ATOM 0 H LYS A 5 -16.596 -5.857 -14.480 1.00 0.00 H new ATOM 0 HA LYS A 5 -14.497 -4.859 -12.623 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -13.590 -6.598 -14.155 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -14.111 -5.629 -15.520 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -12.657 -3.776 -14.852 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -12.265 -4.562 -13.335 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -10.401 -4.807 -14.908 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -11.092 -6.379 -14.557 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -12.325 -6.374 -16.689 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -11.815 -4.731 -17.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -10.503 -6.389 -18.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -9.538 -5.462 -17.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -9.973 -7.047 -16.743 1.00 0.00 H new ATOM 87 N ALA A 6 -14.978 -2.569 -13.335 1.00 0.00 N ATOM 88 CA ALA A 6 -15.297 -1.167 -13.550 1.00 0.00 C ATOM 89 C ALA A 6 -14.209 -0.495 -14.409 1.00 0.00 C ATOM 90 O ALA A 6 -13.179 -1.092 -14.728 1.00 0.00 O ATOM 91 CB ALA A 6 -15.376 -0.475 -12.184 1.00 0.00 C ATOM 0 H ALA A 6 -14.396 -2.708 -12.509 1.00 0.00 H new ATOM 0 HA ALA A 6 -16.249 -1.083 -14.074 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -15.615 0.579 -12.324 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -16.153 -0.946 -11.582 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -14.417 -0.565 -11.674 1.00 0.00 H new ATOM 97 N THR A 7 -14.422 0.781 -14.729 1.00 0.00 N ATOM 98 CA THR A 7 -13.453 1.687 -15.334 1.00 0.00 C ATOM 99 C THR A 7 -13.835 3.111 -14.881 1.00 0.00 C ATOM 100 O THR A 7 -14.777 3.270 -14.097 1.00 0.00 O ATOM 101 CB THR A 7 -13.358 1.446 -16.862 1.00 0.00 C ATOM 102 OG1 THR A 7 -12.365 2.253 -17.455 1.00 0.00 O ATOM 103 CG2 THR A 7 -14.664 1.666 -17.625 1.00 0.00 C ATOM 0 H THR A 7 -15.322 1.231 -14.564 1.00 0.00 H new ATOM 0 HA THR A 7 -12.430 1.511 -15.001 1.00 0.00 H new ATOM 0 HB THR A 7 -13.102 0.390 -16.942 1.00 0.00 H new ATOM 0 HG1 THR A 7 -11.480 1.949 -17.164 1.00 0.00 H new ATOM 0 HG21 THR A 7 -14.502 1.475 -18.686 1.00 0.00 H new ATOM 0 HG22 THR A 7 -15.426 0.985 -17.246 1.00 0.00 H new ATOM 0 HG23 THR A 7 -14.996 2.695 -17.489 1.00 0.00 H new ATOM 111 N ASP A 8 -13.111 4.120 -15.378 1.00 0.00 N ATOM 112 CA ASP A 8 -13.101 5.535 -14.972 1.00 0.00 C ATOM 113 C ASP A 8 -14.461 6.140 -14.604 1.00 0.00 C ATOM 114 O ASP A 8 -14.544 6.945 -13.674 1.00 0.00 O ATOM 115 CB ASP A 8 -12.440 6.353 -16.093 1.00 0.00 C ATOM 116 CG ASP A 8 -12.510 7.871 -15.858 1.00 0.00 C ATOM 117 OD1 ASP A 8 -12.025 8.360 -14.814 1.00 0.00 O ATOM 118 OD2 ASP A 8 -13.052 8.583 -16.734 1.00 0.00 O ATOM 0 H ASP A 8 -12.458 3.955 -16.144 1.00 0.00 H new ATOM 0 HA ASP A 8 -12.536 5.577 -14.041 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -11.396 6.054 -16.185 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -12.924 6.116 -17.041 1.00 0.00 H new ATOM 123 N GLN A 9 -15.531 5.770 -15.311 1.00 0.00 N ATOM 124 CA GLN A 9 -16.878 6.283 -15.092 1.00 0.00 C ATOM 125 C GLN A 9 -17.886 5.144 -14.950 1.00 0.00 C ATOM 126 O GLN A 9 -18.845 5.265 -14.184 1.00 0.00 O ATOM 127 CB GLN A 9 -17.253 7.239 -16.235 1.00 0.00 C ATOM 128 CG GLN A 9 -16.468 8.559 -16.149 1.00 0.00 C ATOM 129 CD GLN A 9 -16.490 9.339 -17.464 1.00 0.00 C ATOM 130 OE1 GLN A 9 -17.542 9.725 -17.969 1.00 0.00 O ATOM 131 NE2 GLN A 9 -15.328 9.588 -18.048 1.00 0.00 N ATOM 0 H GLN A 9 -15.480 5.089 -16.069 1.00 0.00 H new ATOM 0 HA GLN A 9 -16.901 6.839 -14.155 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -17.054 6.758 -17.193 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -18.322 7.448 -16.200 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -16.889 9.177 -15.356 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -15.435 8.347 -15.873 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -14.462 9.263 -17.619 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -15.299 10.105 -18.927 1.00 0.00 H new ATOM 140 N SER A 10 -17.649 4.007 -15.611 1.00 0.00 N ATOM 141 CA SER A 10 -18.483 2.825 -15.458 1.00 0.00 C ATOM 142 C SER A 10 -18.482 2.291 -14.022 1.00 0.00 C ATOM 143 O SER A 10 -19.434 1.609 -13.662 1.00 0.00 O ATOM 144 CB SER A 10 -18.071 1.743 -16.457 1.00 0.00 C ATOM 145 OG SER A 10 -17.877 2.314 -17.743 1.00 0.00 O ATOM 0 H SER A 10 -16.875 3.886 -16.264 1.00 0.00 H new ATOM 0 HA SER A 10 -19.509 3.121 -15.676 1.00 0.00 H new ATOM 0 HB2 SER A 10 -17.153 1.259 -16.123 1.00 0.00 H new ATOM 0 HB3 SER A 10 -18.839 0.971 -16.506 1.00 0.00 H new ATOM 0 HG SER A 10 -17.612 1.614 -18.375 1.00 0.00 H new ATOM 151 N PHE A 11 -17.482 2.613 -13.181 1.00 0.00 N ATOM 152 CA PHE A 11 -17.537 2.319 -11.748 1.00 0.00 C ATOM 153 C PHE A 11 -18.861 2.801 -11.173 1.00 0.00 C ATOM 154 O PHE A 11 -19.593 2.010 -10.585 1.00 0.00 O ATOM 155 CB PHE A 11 -16.362 2.978 -11.007 1.00 0.00 C ATOM 156 CG PHE A 11 -16.533 3.117 -9.498 1.00 0.00 C ATOM 157 CD1 PHE A 11 -16.429 2.009 -8.624 1.00 0.00 C ATOM 158 CD2 PHE A 11 -16.783 4.400 -8.964 1.00 0.00 C ATOM 159 CE1 PHE A 11 -16.533 2.213 -7.235 1.00 0.00 C ATOM 160 CE2 PHE A 11 -16.888 4.591 -7.577 1.00 0.00 C ATOM 161 CZ PHE A 11 -16.751 3.496 -6.710 1.00 0.00 C ATOM 0 H PHE A 11 -16.624 3.079 -13.477 1.00 0.00 H new ATOM 0 HA PHE A 11 -17.459 1.240 -11.612 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -15.461 2.396 -11.201 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -16.199 3.969 -11.430 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -16.271 1.016 -9.019 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -16.895 5.243 -9.629 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -16.444 1.371 -6.565 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -17.074 5.578 -7.179 1.00 0.00 H new ATOM 0 HZ PHE A 11 -16.813 3.640 -5.642 1.00 0.00 H new ATOM 171 N SER A 12 -19.210 4.069 -11.385 1.00 0.00 N ATOM 172 CA SER A 12 -20.447 4.610 -10.861 1.00 0.00 C ATOM 173 C SER A 12 -21.635 3.904 -11.498 1.00 0.00 C ATOM 174 O SER A 12 -22.564 3.506 -10.798 1.00 0.00 O ATOM 175 CB SER A 12 -20.520 6.108 -11.170 1.00 0.00 C ATOM 176 OG SER A 12 -19.297 6.757 -10.845 1.00 0.00 O ATOM 0 H SER A 12 -18.649 4.735 -11.917 1.00 0.00 H new ATOM 0 HA SER A 12 -20.475 4.455 -9.782 1.00 0.00 H new ATOM 0 HB2 SER A 12 -20.743 6.254 -12.227 1.00 0.00 H new ATOM 0 HB3 SER A 12 -21.336 6.560 -10.606 1.00 0.00 H new ATOM 0 HG SER A 12 -19.368 7.712 -11.053 1.00 0.00 H new ATOM 182 N ALA A 13 -21.603 3.715 -12.820 1.00 0.00 N ATOM 183 CA ALA A 13 -22.744 3.171 -13.534 1.00 0.00 C ATOM 184 C ALA A 13 -23.076 1.750 -13.058 1.00 0.00 C ATOM 185 O ALA A 13 -24.247 1.379 -12.976 1.00 0.00 O ATOM 186 CB ALA A 13 -22.467 3.210 -15.037 1.00 0.00 C ATOM 0 H ALA A 13 -20.799 3.932 -13.409 1.00 0.00 H new ATOM 0 HA ALA A 13 -23.620 3.784 -13.323 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -23.322 2.802 -15.575 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -22.300 4.241 -15.350 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -21.581 2.615 -15.259 1.00 0.00 H new ATOM 192 N GLU A 14 -22.052 0.968 -12.712 1.00 0.00 N ATOM 193 CA GLU A 14 -22.179 -0.396 -12.228 1.00 0.00 C ATOM 194 C GLU A 14 -22.573 -0.459 -10.743 1.00 0.00 C ATOM 195 O GLU A 14 -22.987 -1.529 -10.292 1.00 0.00 O ATOM 196 CB GLU A 14 -20.872 -1.177 -12.477 1.00 0.00 C ATOM 197 CG GLU A 14 -20.582 -1.424 -13.970 1.00 0.00 C ATOM 198 CD GLU A 14 -21.568 -2.369 -14.685 1.00 0.00 C ATOM 199 OE1 GLU A 14 -22.374 -3.053 -14.019 1.00 0.00 O ATOM 200 OE2 GLU A 14 -21.537 -2.429 -15.936 1.00 0.00 O ATOM 0 H GLU A 14 -21.083 1.282 -12.765 1.00 0.00 H new ATOM 0 HA GLU A 14 -22.988 -0.863 -12.790 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -20.039 -0.627 -12.039 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -20.927 -2.136 -11.962 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -20.584 -0.465 -14.487 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -19.577 -1.835 -14.065 1.00 0.00 H new ATOM 207 N THR A 15 -22.483 0.644 -9.985 1.00 0.00 N ATOM 208 CA THR A 15 -22.622 0.649 -8.525 1.00 0.00 C ATOM 209 C THR A 15 -23.771 1.543 -8.021 1.00 0.00 C ATOM 210 O THR A 15 -24.078 1.534 -6.826 1.00 0.00 O ATOM 211 CB THR A 15 -21.282 1.079 -7.891 1.00 0.00 C ATOM 212 OG1 THR A 15 -20.930 2.372 -8.324 1.00 0.00 O ATOM 213 CG2 THR A 15 -20.085 0.172 -8.208 1.00 0.00 C ATOM 0 H THR A 15 -22.309 1.570 -10.377 1.00 0.00 H new ATOM 0 HA THR A 15 -22.879 -0.365 -8.220 1.00 0.00 H new ATOM 0 HB THR A 15 -21.469 1.023 -6.819 1.00 0.00 H new ATOM 0 HG1 THR A 15 -20.692 2.345 -9.274 1.00 0.00 H new ATOM 0 HG21 THR A 15 -19.193 0.561 -7.716 1.00 0.00 H new ATOM 0 HG22 THR A 15 -20.287 -0.837 -7.848 1.00 0.00 H new ATOM 0 HG23 THR A 15 -19.923 0.147 -9.286 1.00 0.00 H new ATOM 221 N SER A 16 -24.426 2.307 -8.903 1.00 0.00 N ATOM 222 CA SER A 16 -25.416 3.313 -8.521 1.00 0.00 C ATOM 223 C SER A 16 -26.781 2.710 -8.166 1.00 0.00 C ATOM 224 O SER A 16 -27.691 3.455 -7.803 1.00 0.00 O ATOM 225 CB SER A 16 -25.569 4.355 -9.638 1.00 0.00 C ATOM 226 OG SER A 16 -24.380 5.107 -9.781 1.00 0.00 O ATOM 0 H SER A 16 -24.280 2.241 -9.910 1.00 0.00 H new ATOM 0 HA SER A 16 -25.043 3.793 -7.617 1.00 0.00 H new ATOM 0 HB2 SER A 16 -25.806 3.857 -10.578 1.00 0.00 H new ATOM 0 HB3 SER A 16 -26.402 5.020 -9.411 1.00 0.00 H new ATOM 0 HG SER A 16 -23.677 4.538 -10.158 1.00 0.00 H new ATOM 232 N GLU A 17 -26.943 1.389 -8.248 1.00 0.00 N ATOM 233 CA GLU A 17 -28.174 0.694 -7.904 1.00 0.00 C ATOM 234 C GLU A 17 -27.824 -0.610 -7.190 1.00 0.00 C ATOM 235 O GLU A 17 -26.826 -1.249 -7.532 1.00 0.00 O ATOM 236 CB GLU A 17 -29.007 0.401 -9.165 1.00 0.00 C ATOM 237 CG GLU A 17 -29.566 1.657 -9.847 1.00 0.00 C ATOM 238 CD GLU A 17 -30.492 1.294 -11.023 1.00 0.00 C ATOM 239 OE1 GLU A 17 -30.009 1.163 -12.171 1.00 0.00 O ATOM 240 OE2 GLU A 17 -31.720 1.152 -10.820 1.00 0.00 O ATOM 0 H GLU A 17 -26.202 0.762 -8.563 1.00 0.00 H new ATOM 0 HA GLU A 17 -28.771 1.327 -7.247 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -28.388 -0.143 -9.879 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -29.836 -0.254 -8.897 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -30.116 2.253 -9.119 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -28.743 2.274 -10.207 1.00 0.00 H new ATOM 247 N GLY A 18 -28.656 -1.017 -6.224 1.00 0.00 N ATOM 248 CA GLY A 18 -28.440 -2.208 -5.415 1.00 0.00 C ATOM 249 C GLY A 18 -27.368 -1.984 -4.355 1.00 0.00 C ATOM 250 O GLY A 18 -26.909 -0.860 -4.130 1.00 0.00 O ATOM 0 H GLY A 18 -29.511 -0.515 -5.984 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -29.374 -2.494 -4.932 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -28.147 -3.037 -6.059 1.00 0.00 H new ATOM 254 N VAL A 19 -26.976 -3.074 -3.700 1.00 0.00 N ATOM 255 CA VAL A 19 -25.839 -3.104 -2.788 1.00 0.00 C ATOM 256 C VAL A 19 -24.705 -3.751 -3.567 1.00 0.00 C ATOM 257 O VAL A 19 -24.808 -4.895 -4.020 1.00 0.00 O ATOM 258 CB VAL A 19 -26.210 -3.731 -1.423 1.00 0.00 C ATOM 259 CG1 VAL A 19 -25.040 -3.558 -0.444 1.00 0.00 C ATOM 260 CG2 VAL A 19 -27.491 -3.080 -0.869 1.00 0.00 C ATOM 0 H VAL A 19 -27.447 -3.974 -3.790 1.00 0.00 H new ATOM 0 HA VAL A 19 -25.505 -2.115 -2.476 1.00 0.00 H new ATOM 0 HB VAL A 19 -26.402 -4.796 -1.553 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -25.302 -4.000 0.517 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -24.155 -4.055 -0.843 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -24.831 -2.497 -0.311 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -27.742 -3.530 0.092 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -27.328 -2.010 -0.737 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -28.312 -3.238 -1.569 1.00 0.00 H new ATOM 270 N VAL A 20 -23.651 -2.963 -3.783 1.00 0.00 N ATOM 271 CA VAL A 20 -22.566 -3.294 -4.684 1.00 0.00 C ATOM 272 C VAL A 20 -21.271 -3.009 -3.947 1.00 0.00 C ATOM 273 O VAL A 20 -21.003 -1.884 -3.531 1.00 0.00 O ATOM 274 CB VAL A 20 -22.667 -2.495 -6.002 1.00 0.00 C ATOM 275 CG1 VAL A 20 -21.653 -3.050 -7.007 1.00 0.00 C ATOM 276 CG2 VAL A 20 -24.077 -2.538 -6.609 1.00 0.00 C ATOM 0 H VAL A 20 -23.533 -2.060 -3.323 1.00 0.00 H new ATOM 0 HA VAL A 20 -22.610 -4.345 -4.970 1.00 0.00 H new ATOM 0 HB VAL A 20 -22.448 -1.452 -5.774 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -21.720 -2.489 -7.939 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -20.647 -2.955 -6.599 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -21.869 -4.101 -7.199 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -24.093 -1.961 -7.534 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -24.350 -3.572 -6.822 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -24.790 -2.112 -5.903 1.00 0.00 H new ATOM 286 N LEU A 21 -20.475 -4.050 -3.765 1.00 0.00 N ATOM 287 CA LEU A 21 -19.139 -3.938 -3.212 1.00 0.00 C ATOM 288 C LEU A 21 -18.176 -3.651 -4.360 1.00 0.00 C ATOM 289 O LEU A 21 -18.286 -4.281 -5.411 1.00 0.00 O ATOM 290 CB LEU A 21 -18.847 -5.247 -2.471 1.00 0.00 C ATOM 291 CG LEU A 21 -17.532 -5.221 -1.675 1.00 0.00 C ATOM 292 CD1 LEU A 21 -17.756 -5.913 -0.324 1.00 0.00 C ATOM 293 CD2 LEU A 21 -16.406 -5.927 -2.435 1.00 0.00 C ATOM 0 H LEU A 21 -20.743 -5.006 -4.000 1.00 0.00 H new ATOM 0 HA LEU A 21 -19.030 -3.122 -2.498 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -19.671 -5.461 -1.790 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -18.810 -6.063 -3.193 1.00 0.00 H new ATOM 0 HG LEU A 21 -17.235 -4.183 -1.526 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -16.829 -5.900 0.249 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -18.533 -5.386 0.230 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -18.066 -6.945 -0.491 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -15.490 -5.891 -1.845 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -16.683 -6.966 -2.612 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -16.242 -5.427 -3.390 1.00 0.00 H new ATOM 305 N ALA A 22 -17.220 -2.739 -4.181 1.00 0.00 N ATOM 306 CA ALA A 22 -16.159 -2.511 -5.147 1.00 0.00 C ATOM 307 C ALA A 22 -14.819 -2.777 -4.473 1.00 0.00 C ATOM 308 O ALA A 22 -14.643 -2.494 -3.288 1.00 0.00 O ATOM 309 CB ALA A 22 -16.234 -1.106 -5.765 1.00 0.00 C ATOM 0 H ALA A 22 -17.165 -2.139 -3.358 1.00 0.00 H new ATOM 0 HA ALA A 22 -16.278 -3.201 -5.982 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -15.422 -0.980 -6.481 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -17.190 -0.983 -6.275 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -16.144 -0.357 -4.978 1.00 0.00 H new ATOM 315 N ASP A 23 -13.872 -3.318 -5.227 1.00 0.00 N ATOM 316 CA ASP A 23 -12.584 -3.786 -4.731 1.00 0.00 C ATOM 317 C ASP A 23 -11.509 -3.384 -5.737 1.00 0.00 C ATOM 318 O ASP A 23 -11.753 -3.365 -6.942 1.00 0.00 O ATOM 319 CB ASP A 23 -12.612 -5.300 -4.548 1.00 0.00 C ATOM 320 CG ASP A 23 -11.215 -5.803 -4.166 1.00 0.00 C ATOM 321 OD1 ASP A 23 -10.842 -5.660 -2.981 1.00 0.00 O ATOM 322 OD2 ASP A 23 -10.511 -6.324 -5.058 1.00 0.00 O ATOM 0 H ASP A 23 -13.982 -3.448 -6.233 1.00 0.00 H new ATOM 0 HA ASP A 23 -12.366 -3.336 -3.762 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -13.330 -5.569 -3.773 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -12.942 -5.781 -5.469 1.00 0.00 H new ATOM 327 N PHE A 24 -10.326 -3.040 -5.249 1.00 0.00 N ATOM 328 CA PHE A 24 -9.256 -2.419 -6.001 1.00 0.00 C ATOM 329 C PHE A 24 -8.031 -3.300 -5.804 1.00 0.00 C ATOM 330 O PHE A 24 -7.497 -3.376 -4.690 1.00 0.00 O ATOM 331 CB PHE A 24 -9.040 -0.989 -5.482 1.00 0.00 C ATOM 332 CG PHE A 24 -10.167 0.001 -5.755 1.00 0.00 C ATOM 333 CD1 PHE A 24 -11.454 -0.168 -5.200 1.00 0.00 C ATOM 334 CD2 PHE A 24 -9.927 1.109 -6.587 1.00 0.00 C ATOM 335 CE1 PHE A 24 -12.500 0.708 -5.534 1.00 0.00 C ATOM 336 CE2 PHE A 24 -10.970 2.001 -6.901 1.00 0.00 C ATOM 337 CZ PHE A 24 -12.259 1.796 -6.386 1.00 0.00 C ATOM 0 H PHE A 24 -10.079 -3.195 -4.272 1.00 0.00 H new ATOM 0 HA PHE A 24 -9.479 -2.336 -7.065 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -8.878 -1.036 -4.405 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -8.125 -0.598 -5.926 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -11.636 -0.980 -4.511 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -8.938 1.276 -6.987 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -13.490 0.544 -5.135 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -10.777 2.848 -7.542 1.00 0.00 H new ATOM 0 HZ PHE A 24 -13.061 2.472 -6.644 1.00 0.00 H new ATOM 347 N TRP A 25 -7.611 -3.964 -6.882 1.00 0.00 N ATOM 348 CA TRP A 25 -6.603 -5.018 -6.899 1.00 0.00 C ATOM 349 C TRP A 25 -5.603 -4.704 -8.016 1.00 0.00 C ATOM 350 O TRP A 25 -5.973 -4.048 -8.992 1.00 0.00 O ATOM 351 CB TRP A 25 -7.281 -6.378 -7.165 1.00 0.00 C ATOM 352 CG TRP A 25 -7.534 -6.687 -8.616 1.00 0.00 C ATOM 353 CD1 TRP A 25 -8.388 -6.020 -9.423 1.00 0.00 C ATOM 354 CD2 TRP A 25 -6.811 -7.609 -9.495 1.00 0.00 C ATOM 355 NE1 TRP A 25 -8.245 -6.449 -10.724 1.00 0.00 N ATOM 356 CE2 TRP A 25 -7.237 -7.388 -10.838 1.00 0.00 C ATOM 357 CE3 TRP A 25 -5.809 -8.584 -9.296 1.00 0.00 C ATOM 358 CZ2 TRP A 25 -6.650 -8.057 -11.925 1.00 0.00 C ATOM 359 CZ3 TRP A 25 -5.222 -9.268 -10.377 1.00 0.00 C ATOM 360 CH2 TRP A 25 -5.634 -8.997 -11.692 1.00 0.00 C ATOM 0 H TRP A 25 -7.985 -3.770 -7.811 1.00 0.00 H new ATOM 0 HA TRP A 25 -6.088 -5.068 -5.940 1.00 0.00 H new ATOM 0 HB2 TRP A 25 -6.658 -7.167 -6.744 1.00 0.00 H new ATOM 0 HB3 TRP A 25 -8.231 -6.404 -6.632 1.00 0.00 H new ATOM 0 HD1 TRP A 25 -9.082 -5.260 -9.095 1.00 0.00 H new ATOM 0 HE1 TRP A 25 -8.811 -6.116 -11.504 1.00 0.00 H new ATOM 0 HE3 TRP A 25 -5.486 -8.810 -8.291 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 -6.978 -7.849 -12.933 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 -4.452 -10.003 -10.195 1.00 0.00 H new ATOM 0 HH2 TRP A 25 -5.170 -9.510 -12.521 1.00 0.00 H new ATOM 371 N ALA A 26 -4.359 -5.176 -7.919 1.00 0.00 N ATOM 372 CA ALA A 26 -3.392 -5.125 -9.017 1.00 0.00 C ATOM 373 C ALA A 26 -2.169 -5.985 -8.681 1.00 0.00 C ATOM 374 O ALA A 26 -1.937 -6.266 -7.503 1.00 0.00 O ATOM 375 CB ALA A 26 -2.934 -3.683 -9.249 1.00 0.00 C ATOM 0 H ALA A 26 -3.992 -5.607 -7.071 1.00 0.00 H new ATOM 0 HA ALA A 26 -3.873 -5.506 -9.918 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -2.215 -3.657 -10.068 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -3.795 -3.064 -9.502 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -2.466 -3.300 -8.342 1.00 0.00 H new ATOM 381 N PRO A 27 -1.337 -6.347 -9.673 1.00 0.00 N ATOM 382 CA PRO A 27 -0.131 -7.149 -9.476 1.00 0.00 C ATOM 383 C PRO A 27 0.873 -6.626 -8.429 1.00 0.00 C ATOM 384 O PRO A 27 1.772 -7.378 -8.047 1.00 0.00 O ATOM 385 CB PRO A 27 0.526 -7.242 -10.859 1.00 0.00 C ATOM 386 CG PRO A 27 -0.638 -7.069 -11.831 1.00 0.00 C ATOM 387 CD PRO A 27 -1.549 -6.098 -11.096 1.00 0.00 C ATOM 0 HA PRO A 27 -0.427 -8.112 -9.060 1.00 0.00 H new ATOM 0 HB2 PRO A 27 1.280 -6.467 -10.996 1.00 0.00 H new ATOM 0 HB3 PRO A 27 1.025 -8.200 -11.000 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -0.308 -6.668 -12.789 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -1.138 -8.016 -12.036 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -1.307 -5.066 -11.352 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -2.592 -6.258 -11.369 1.00 0.00 H new ATOM 395 N TRP A 28 0.763 -5.370 -7.967 1.00 0.00 N ATOM 396 CA TRP A 28 1.694 -4.773 -7.012 1.00 0.00 C ATOM 397 C TRP A 28 1.754 -5.502 -5.669 1.00 0.00 C ATOM 398 O TRP A 28 2.778 -5.384 -4.997 1.00 0.00 O ATOM 399 CB TRP A 28 1.355 -3.295 -6.790 1.00 0.00 C ATOM 400 CG TRP A 28 1.044 -2.504 -8.025 1.00 0.00 C ATOM 401 CD1 TRP A 28 -0.175 -2.020 -8.323 1.00 0.00 C ATOM 402 CD2 TRP A 28 1.900 -2.114 -9.142 1.00 0.00 C ATOM 403 NE1 TRP A 28 -0.155 -1.353 -9.528 1.00 0.00 N ATOM 404 CE2 TRP A 28 1.106 -1.393 -10.088 1.00 0.00 C ATOM 405 CE3 TRP A 28 3.262 -2.305 -9.458 1.00 0.00 C ATOM 406 CZ2 TRP A 28 1.641 -0.899 -11.286 1.00 0.00 C ATOM 407 CZ3 TRP A 28 3.808 -1.808 -10.658 1.00 0.00 C ATOM 408 CH2 TRP A 28 3.000 -1.108 -11.572 1.00 0.00 C ATOM 0 H TRP A 28 0.015 -4.738 -8.253 1.00 0.00 H new ATOM 0 HA TRP A 28 2.684 -4.869 -7.458 1.00 0.00 H new ATOM 0 HB2 TRP A 28 0.499 -3.235 -6.118 1.00 0.00 H new ATOM 0 HB3 TRP A 28 2.194 -2.822 -6.280 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -1.051 -2.138 -7.702 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -0.962 -0.892 -9.949 1.00 0.00 H new ATOM 0 HE3 TRP A 28 3.897 -2.841 -8.768 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 1.014 -0.363 -11.983 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 4.854 -1.966 -10.877 1.00 0.00 H new ATOM 0 HH2 TRP A 28 3.424 -0.732 -12.492 1.00 0.00 H new ATOM 419 N CYS A 29 0.706 -6.235 -5.268 1.00 0.00 N ATOM 420 CA CYS A 29 0.602 -6.769 -3.912 1.00 0.00 C ATOM 421 C CYS A 29 0.054 -8.195 -3.890 1.00 0.00 C ATOM 422 O CYS A 29 -0.680 -8.609 -4.789 1.00 0.00 O ATOM 423 CB CYS A 29 -0.295 -5.829 -3.085 1.00 0.00 C ATOM 424 SG CYS A 29 0.343 -5.301 -1.467 1.00 0.00 S ATOM 0 H CYS A 29 -0.083 -6.470 -5.870 1.00 0.00 H new ATOM 0 HA CYS A 29 1.601 -6.818 -3.479 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -0.492 -4.937 -3.680 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -1.253 -6.325 -2.927 1.00 0.00 H new ATOM 429 N GLY A 30 0.383 -8.925 -2.821 1.00 0.00 N ATOM 430 CA GLY A 30 -0.091 -10.281 -2.567 1.00 0.00 C ATOM 431 C GLY A 30 -1.602 -10.357 -2.334 1.00 0.00 C ATOM 432 O GLY A 30 -2.248 -11.185 -2.979 1.00 0.00 O ATOM 0 H GLY A 30 1.004 -8.576 -2.090 1.00 0.00 H new ATOM 0 HA2 GLY A 30 0.172 -10.916 -3.413 1.00 0.00 H new ATOM 0 HA3 GLY A 30 0.425 -10.682 -1.695 1.00 0.00 H new ATOM 436 N PRO A 31 -2.212 -9.508 -1.475 1.00 0.00 N ATOM 437 CA PRO A 31 -3.656 -9.491 -1.252 1.00 0.00 C ATOM 438 C PRO A 31 -4.504 -9.406 -2.513 1.00 0.00 C ATOM 439 O PRO A 31 -5.604 -9.947 -2.515 1.00 0.00 O ATOM 440 CB PRO A 31 -3.931 -8.306 -0.335 1.00 0.00 C ATOM 441 CG PRO A 31 -2.653 -8.233 0.496 1.00 0.00 C ATOM 442 CD PRO A 31 -1.569 -8.621 -0.512 1.00 0.00 C ATOM 0 HA PRO A 31 -3.947 -10.445 -0.812 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -4.103 -7.388 -0.897 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -4.811 -8.469 0.287 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -2.490 -7.234 0.900 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -2.682 -8.919 1.343 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -1.162 -7.739 -1.006 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -0.737 -9.121 -0.016 1.00 0.00 H new ATOM 450 N SER A 32 -4.017 -8.826 -3.607 1.00 0.00 N ATOM 451 CA SER A 32 -4.722 -8.812 -4.883 1.00 0.00 C ATOM 452 C SER A 32 -5.047 -10.209 -5.410 1.00 0.00 C ATOM 453 O SER A 32 -5.963 -10.351 -6.216 1.00 0.00 O ATOM 454 CB SER A 32 -3.854 -8.067 -5.893 1.00 0.00 C ATOM 455 OG SER A 32 -3.317 -6.895 -5.321 1.00 0.00 O ATOM 0 H SER A 32 -3.115 -8.349 -3.632 1.00 0.00 H new ATOM 0 HA SER A 32 -5.680 -8.315 -4.733 1.00 0.00 H new ATOM 0 HB2 SER A 32 -3.046 -8.715 -6.233 1.00 0.00 H new ATOM 0 HB3 SER A 32 -4.447 -7.810 -6.770 1.00 0.00 H new ATOM 0 HG SER A 32 -2.572 -6.574 -5.871 1.00 0.00 H new ATOM 461 N LYS A 33 -4.340 -11.239 -4.938 1.00 0.00 N ATOM 462 CA LYS A 33 -4.554 -12.632 -5.322 1.00 0.00 C ATOM 463 C LYS A 33 -5.136 -13.449 -4.160 1.00 0.00 C ATOM 464 O LYS A 33 -5.192 -14.675 -4.250 1.00 0.00 O ATOM 465 CB LYS A 33 -3.277 -13.286 -5.877 1.00 0.00 C ATOM 466 CG LYS A 33 -2.513 -12.505 -6.963 1.00 0.00 C ATOM 467 CD LYS A 33 -1.499 -11.505 -6.380 1.00 0.00 C ATOM 468 CE LYS A 33 -0.689 -10.761 -7.453 1.00 0.00 C ATOM 469 NZ LYS A 33 0.280 -11.639 -8.160 1.00 0.00 N ATOM 0 H LYS A 33 -3.585 -11.122 -4.262 1.00 0.00 H new ATOM 0 HA LYS A 33 -5.286 -12.627 -6.130 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -2.597 -13.464 -5.044 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -3.544 -14.261 -6.284 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -1.990 -13.209 -7.610 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -3.227 -11.968 -7.588 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -2.030 -10.777 -5.766 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -0.813 -12.037 -5.721 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -1.374 -10.325 -8.180 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -0.151 -9.936 -6.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 0.797 -11.084 -8.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 0.953 -12.036 -7.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -0.232 -12.413 -8.630 1.00 0.00 H new ATOM 483 N MET A 34 -5.582 -12.797 -3.079 1.00 0.00 N ATOM 484 CA MET A 34 -6.215 -13.440 -1.926 1.00 0.00 C ATOM 485 C MET A 34 -7.608 -12.845 -1.717 1.00 0.00 C ATOM 486 O MET A 34 -8.574 -13.586 -1.556 1.00 0.00 O ATOM 487 CB MET A 34 -5.350 -13.290 -0.663 1.00 0.00 C ATOM 488 CG MET A 34 -3.943 -13.879 -0.830 1.00 0.00 C ATOM 489 SD MET A 34 -2.983 -14.025 0.707 1.00 0.00 S ATOM 490 CE MET A 34 -2.763 -12.281 1.158 1.00 0.00 C ATOM 0 H MET A 34 -5.510 -11.784 -2.982 1.00 0.00 H new ATOM 0 HA MET A 34 -6.312 -14.508 -2.122 1.00 0.00 H new ATOM 0 HB2 MET A 34 -5.268 -12.233 -0.408 1.00 0.00 H new ATOM 0 HB3 MET A 34 -5.848 -13.782 0.173 1.00 0.00 H new ATOM 0 HG2 MET A 34 -4.031 -14.867 -1.281 1.00 0.00 H new ATOM 0 HG3 MET A 34 -3.386 -13.257 -1.531 1.00 0.00 H new ATOM 0 HE1 MET A 34 -2.191 -12.214 2.083 1.00 0.00 H new ATOM 0 HE2 MET A 34 -2.228 -11.764 0.362 1.00 0.00 H new ATOM 0 HE3 MET A 34 -3.739 -11.816 1.301 1.00 0.00 H new ATOM 500 N ILE A 35 -7.746 -11.519 -1.812 1.00 0.00 N ATOM 501 CA ILE A 35 -9.034 -10.846 -1.847 1.00 0.00 C ATOM 502 C ILE A 35 -9.804 -11.310 -3.093 1.00 0.00 C ATOM 503 O ILE A 35 -11.006 -11.537 -3.013 1.00 0.00 O ATOM 504 CB ILE A 35 -8.839 -9.306 -1.748 1.00 0.00 C ATOM 505 CG1 ILE A 35 -9.946 -8.652 -0.889 1.00 0.00 C ATOM 506 CG2 ILE A 35 -8.709 -8.598 -3.106 1.00 0.00 C ATOM 507 CD1 ILE A 35 -9.629 -8.822 0.601 1.00 0.00 C ATOM 0 H ILE A 35 -6.952 -10.881 -1.867 1.00 0.00 H new ATOM 0 HA ILE A 35 -9.643 -11.115 -0.984 1.00 0.00 H new ATOM 0 HB ILE A 35 -7.878 -9.171 -1.251 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -10.027 -7.593 -1.132 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -10.910 -9.106 -1.117 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -8.576 -7.528 -2.947 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -7.847 -8.995 -3.642 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -9.612 -8.768 -3.693 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -10.416 -8.357 1.196 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -9.571 -9.883 0.842 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -8.675 -8.346 0.827 1.00 0.00 H new ATOM 519 N ALA A 36 -9.111 -11.511 -4.225 1.00 0.00 N ATOM 520 CA ALA A 36 -9.720 -11.954 -5.475 1.00 0.00 C ATOM 521 C ALA A 36 -10.516 -13.264 -5.307 1.00 0.00 C ATOM 522 O ALA A 36 -11.726 -13.244 -5.539 1.00 0.00 O ATOM 523 CB ALA A 36 -8.663 -12.029 -6.591 1.00 0.00 C ATOM 0 H ALA A 36 -8.103 -11.367 -4.292 1.00 0.00 H new ATOM 0 HA ALA A 36 -10.457 -11.209 -5.776 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -9.134 -12.361 -7.516 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -8.222 -11.044 -6.741 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -7.883 -12.736 -6.307 1.00 0.00 H new ATOM 529 N PRO A 37 -9.908 -14.379 -4.856 1.00 0.00 N ATOM 530 CA PRO A 37 -10.644 -15.608 -4.587 1.00 0.00 C ATOM 531 C PRO A 37 -11.724 -15.405 -3.529 1.00 0.00 C ATOM 532 O PRO A 37 -12.820 -15.943 -3.673 1.00 0.00 O ATOM 533 CB PRO A 37 -9.619 -16.656 -4.135 1.00 0.00 C ATOM 534 CG PRO A 37 -8.305 -15.898 -3.957 1.00 0.00 C ATOM 535 CD PRO A 37 -8.480 -14.596 -4.730 1.00 0.00 C ATOM 0 HA PRO A 37 -11.165 -15.936 -5.487 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -9.928 -17.129 -3.203 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -9.517 -17.449 -4.876 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -8.102 -15.705 -2.903 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -7.464 -16.474 -4.343 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -8.007 -13.767 -4.204 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -8.010 -14.661 -5.711 1.00 0.00 H new ATOM 543 N VAL A 38 -11.444 -14.620 -2.487 1.00 0.00 N ATOM 544 CA VAL A 38 -12.406 -14.331 -1.435 1.00 0.00 C ATOM 545 C VAL A 38 -13.679 -13.714 -2.018 1.00 0.00 C ATOM 546 O VAL A 38 -14.771 -14.087 -1.591 1.00 0.00 O ATOM 547 CB VAL A 38 -11.714 -13.471 -0.354 1.00 0.00 C ATOM 548 CG1 VAL A 38 -12.650 -12.516 0.399 1.00 0.00 C ATOM 549 CG2 VAL A 38 -10.965 -14.407 0.605 1.00 0.00 C ATOM 0 H VAL A 38 -10.539 -14.168 -2.353 1.00 0.00 H new ATOM 0 HA VAL A 38 -12.740 -15.247 -0.948 1.00 0.00 H new ATOM 0 HB VAL A 38 -11.017 -12.805 -0.863 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -12.079 -11.953 1.137 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -13.110 -11.825 -0.307 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -13.427 -13.090 0.903 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -10.469 -13.817 1.376 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -11.673 -15.092 1.071 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -10.220 -14.977 0.049 1.00 0.00 H new ATOM 559 N LEU A 39 -13.572 -12.821 -3.005 1.00 0.00 N ATOM 560 CA LEU A 39 -14.745 -12.217 -3.625 1.00 0.00 C ATOM 561 C LEU A 39 -15.523 -13.255 -4.414 1.00 0.00 C ATOM 562 O LEU A 39 -16.748 -13.274 -4.342 1.00 0.00 O ATOM 563 CB LEU A 39 -14.368 -11.076 -4.575 1.00 0.00 C ATOM 564 CG LEU A 39 -13.811 -9.841 -3.838 1.00 0.00 C ATOM 565 CD1 LEU A 39 -13.219 -8.857 -4.847 1.00 0.00 C ATOM 566 CD2 LEU A 39 -14.833 -9.122 -2.952 1.00 0.00 C ATOM 0 H LEU A 39 -12.683 -12.503 -3.389 1.00 0.00 H new ATOM 0 HA LEU A 39 -15.355 -11.817 -2.815 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -13.625 -11.434 -5.287 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -15.246 -10.784 -5.151 1.00 0.00 H new ATOM 0 HG LEU A 39 -13.040 -10.217 -3.165 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -12.827 -7.987 -4.320 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -12.412 -9.341 -5.397 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -13.995 -8.540 -5.544 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -14.359 -8.266 -2.471 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -15.667 -8.779 -3.564 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -15.201 -9.809 -2.190 1.00 0.00 H new ATOM 578 N GLU A 40 -14.847 -14.119 -5.169 1.00 0.00 N ATOM 579 CA GLU A 40 -15.538 -15.131 -5.946 1.00 0.00 C ATOM 580 C GLU A 40 -16.250 -16.113 -5.012 1.00 0.00 C ATOM 581 O GLU A 40 -17.365 -16.540 -5.306 1.00 0.00 O ATOM 582 CB GLU A 40 -14.590 -15.835 -6.923 1.00 0.00 C ATOM 583 CG GLU A 40 -13.978 -14.878 -7.957 1.00 0.00 C ATOM 584 CD GLU A 40 -13.093 -15.632 -8.966 1.00 0.00 C ATOM 585 OE1 GLU A 40 -11.880 -15.810 -8.713 1.00 0.00 O ATOM 586 OE2 GLU A 40 -13.599 -16.044 -10.036 1.00 0.00 O ATOM 0 H GLU A 40 -13.831 -14.135 -5.255 1.00 0.00 H new ATOM 0 HA GLU A 40 -16.297 -14.645 -6.559 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -13.789 -16.315 -6.361 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -15.133 -16.624 -7.443 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -14.774 -14.356 -8.488 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -13.385 -14.119 -7.446 1.00 0.00 H new ATOM 593 N GLU A 41 -15.658 -16.452 -3.865 1.00 0.00 N ATOM 594 CA GLU A 41 -16.298 -17.276 -2.853 1.00 0.00 C ATOM 595 C GLU A 41 -17.473 -16.530 -2.213 1.00 0.00 C ATOM 596 O GLU A 41 -18.500 -17.143 -1.936 1.00 0.00 O ATOM 597 CB GLU A 41 -15.273 -17.729 -1.804 1.00 0.00 C ATOM 598 CG GLU A 41 -14.259 -18.736 -2.373 1.00 0.00 C ATOM 599 CD GLU A 41 -14.893 -20.071 -2.805 1.00 0.00 C ATOM 600 OE1 GLU A 41 -15.366 -20.835 -1.934 1.00 0.00 O ATOM 601 OE2 GLU A 41 -14.897 -20.376 -4.020 1.00 0.00 O ATOM 0 H GLU A 41 -14.714 -16.157 -3.616 1.00 0.00 H new ATOM 0 HA GLU A 41 -16.700 -18.170 -3.330 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -14.741 -16.859 -1.420 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -15.795 -18.180 -0.961 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -13.756 -18.288 -3.230 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -13.494 -18.933 -1.622 1.00 0.00 H new ATOM 608 N LEU A 42 -17.351 -15.215 -2.011 1.00 0.00 N ATOM 609 CA LEU A 42 -18.397 -14.366 -1.451 1.00 0.00 C ATOM 610 C LEU A 42 -19.608 -14.335 -2.383 1.00 0.00 C ATOM 611 O LEU A 42 -20.740 -14.482 -1.931 1.00 0.00 O ATOM 612 CB LEU A 42 -17.823 -12.954 -1.227 1.00 0.00 C ATOM 613 CG LEU A 42 -18.819 -11.916 -0.690 1.00 0.00 C ATOM 614 CD1 LEU A 42 -19.236 -12.242 0.737 1.00 0.00 C ATOM 615 CD2 LEU A 42 -18.154 -10.537 -0.683 1.00 0.00 C ATOM 0 H LEU A 42 -16.499 -14.702 -2.239 1.00 0.00 H new ATOM 0 HA LEU A 42 -18.732 -14.766 -0.494 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -16.988 -13.026 -0.530 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -17.419 -12.590 -2.172 1.00 0.00 H new ATOM 0 HG LEU A 42 -19.698 -11.927 -1.334 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -19.941 -11.490 1.091 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -19.709 -13.224 0.763 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -18.357 -12.246 1.381 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -18.857 -9.796 -0.303 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -17.272 -10.562 -0.044 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -17.859 -10.270 -1.698 1.00 0.00 H new ATOM 627 N ASP A 43 -19.393 -14.183 -3.688 1.00 0.00 N ATOM 628 CA ASP A 43 -20.489 -14.130 -4.647 1.00 0.00 C ATOM 629 C ASP A 43 -21.155 -15.493 -4.808 1.00 0.00 C ATOM 630 O ASP A 43 -22.372 -15.585 -4.943 1.00 0.00 O ATOM 631 CB ASP A 43 -19.978 -13.657 -6.006 1.00 0.00 C ATOM 632 CG ASP A 43 -21.076 -13.722 -7.081 1.00 0.00 C ATOM 633 OD1 ASP A 43 -21.984 -12.858 -7.069 1.00 0.00 O ATOM 634 OD2 ASP A 43 -21.012 -14.617 -7.952 1.00 0.00 O ATOM 0 H ASP A 43 -18.466 -14.094 -4.104 1.00 0.00 H new ATOM 0 HA ASP A 43 -21.227 -13.426 -4.264 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -19.612 -12.634 -5.921 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -19.133 -14.274 -6.312 1.00 0.00 H new ATOM 639 N GLN A 44 -20.382 -16.573 -4.725 1.00 0.00 N ATOM 640 CA GLN A 44 -20.934 -17.919 -4.690 1.00 0.00 C ATOM 641 C GLN A 44 -21.821 -18.135 -3.458 1.00 0.00 C ATOM 642 O GLN A 44 -22.729 -18.967 -3.489 1.00 0.00 O ATOM 643 CB GLN A 44 -19.786 -18.930 -4.705 1.00 0.00 C ATOM 644 CG GLN A 44 -19.218 -19.111 -6.113 1.00 0.00 C ATOM 645 CD GLN A 44 -17.946 -19.954 -6.051 1.00 0.00 C ATOM 646 OE1 GLN A 44 -17.963 -21.171 -6.225 1.00 0.00 O ATOM 647 NE2 GLN A 44 -16.830 -19.320 -5.746 1.00 0.00 N ATOM 0 H GLN A 44 -19.364 -16.538 -4.681 1.00 0.00 H new ATOM 0 HA GLN A 44 -21.563 -18.060 -5.569 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -18.996 -18.595 -4.033 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -20.140 -19.890 -4.328 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -19.955 -19.595 -6.754 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -19.000 -18.139 -6.555 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -16.839 -18.310 -5.606 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -15.958 -19.840 -5.650 1.00 0.00 H new ATOM 656 N GLU A 45 -21.563 -17.401 -2.375 1.00 0.00 N ATOM 657 CA GLU A 45 -22.185 -17.593 -1.086 1.00 0.00 C ATOM 658 C GLU A 45 -23.456 -16.758 -0.954 1.00 0.00 C ATOM 659 O GLU A 45 -24.476 -17.253 -0.472 1.00 0.00 O ATOM 660 CB GLU A 45 -21.100 -17.303 -0.026 1.00 0.00 C ATOM 661 CG GLU A 45 -21.555 -16.724 1.309 1.00 0.00 C ATOM 662 CD GLU A 45 -22.266 -17.696 2.269 1.00 0.00 C ATOM 663 OE1 GLU A 45 -22.607 -18.839 1.892 1.00 0.00 O ATOM 664 OE2 GLU A 45 -22.468 -17.302 3.440 1.00 0.00 O ATOM 0 H GLU A 45 -20.891 -16.634 -2.382 1.00 0.00 H new ATOM 0 HA GLU A 45 -22.539 -18.614 -0.945 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -20.569 -18.234 0.175 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -20.379 -16.613 -0.463 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -20.683 -16.316 1.820 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -22.227 -15.889 1.108 1.00 0.00 H new ATOM 671 N MET A 46 -23.410 -15.505 -1.402 1.00 0.00 N ATOM 672 CA MET A 46 -24.460 -14.520 -1.162 1.00 0.00 C ATOM 673 C MET A 46 -24.655 -13.587 -2.352 1.00 0.00 C ATOM 674 O MET A 46 -25.278 -12.531 -2.241 1.00 0.00 O ATOM 675 CB MET A 46 -24.149 -13.753 0.118 1.00 0.00 C ATOM 676 CG MET A 46 -22.732 -13.184 0.148 1.00 0.00 C ATOM 677 SD MET A 46 -22.477 -12.299 1.694 1.00 0.00 S ATOM 678 CE MET A 46 -23.419 -10.827 1.299 1.00 0.00 C ATOM 0 H MET A 46 -22.630 -15.141 -1.950 1.00 0.00 H new ATOM 0 HA MET A 46 -25.407 -15.044 -1.037 1.00 0.00 H new ATOM 0 HB2 MET A 46 -24.864 -12.937 0.228 1.00 0.00 H new ATOM 0 HB3 MET A 46 -24.286 -14.415 0.973 1.00 0.00 H new ATOM 0 HG2 MET A 46 -22.003 -13.989 0.052 1.00 0.00 H new ATOM 0 HG3 MET A 46 -22.579 -12.513 -0.697 1.00 0.00 H new ATOM 0 HE1 MET A 46 -23.099 -10.007 1.941 1.00 0.00 H new ATOM 0 HE2 MET A 46 -23.252 -10.557 0.256 1.00 0.00 H new ATOM 0 HE3 MET A 46 -24.480 -11.020 1.459 1.00 0.00 H new ATOM 688 N GLY A 47 -24.185 -13.990 -3.525 1.00 0.00 N ATOM 689 CA GLY A 47 -24.430 -13.266 -4.768 1.00 0.00 C ATOM 690 C GLY A 47 -25.896 -13.191 -5.171 1.00 0.00 C ATOM 691 O GLY A 47 -26.241 -12.467 -6.101 1.00 0.00 O ATOM 0 H GLY A 47 -23.621 -14.831 -3.643 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -24.041 -12.253 -4.667 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -23.869 -13.745 -5.570 1.00 0.00 H new ATOM 695 N ASP A 48 -26.765 -13.892 -4.456 1.00 0.00 N ATOM 696 CA ASP A 48 -28.211 -13.755 -4.579 1.00 0.00 C ATOM 697 C ASP A 48 -28.669 -12.358 -4.154 1.00 0.00 C ATOM 698 O ASP A 48 -29.719 -11.889 -4.597 1.00 0.00 O ATOM 699 CB ASP A 48 -28.917 -14.837 -3.755 1.00 0.00 C ATOM 700 CG ASP A 48 -30.448 -14.730 -3.862 1.00 0.00 C ATOM 701 OD1 ASP A 48 -31.003 -14.998 -4.952 1.00 0.00 O ATOM 702 OD2 ASP A 48 -31.107 -14.428 -2.843 1.00 0.00 O ATOM 0 H ASP A 48 -26.481 -14.584 -3.762 1.00 0.00 H new ATOM 0 HA ASP A 48 -28.481 -13.886 -5.627 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -28.597 -15.821 -4.097 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -28.619 -14.750 -2.710 1.00 0.00 H new ATOM 707 N LYS A 49 -27.860 -11.674 -3.333 1.00 0.00 N ATOM 708 CA LYS A 49 -28.176 -10.390 -2.739 1.00 0.00 C ATOM 709 C LYS A 49 -27.119 -9.321 -3.039 1.00 0.00 C ATOM 710 O LYS A 49 -27.357 -8.149 -2.751 1.00 0.00 O ATOM 711 CB LYS A 49 -28.314 -10.524 -1.211 1.00 0.00 C ATOM 712 CG LYS A 49 -28.842 -11.859 -0.656 1.00 0.00 C ATOM 713 CD LYS A 49 -27.704 -12.832 -0.307 1.00 0.00 C ATOM 714 CE LYS A 49 -27.998 -13.723 0.903 1.00 0.00 C ATOM 715 NZ LYS A 49 -29.137 -14.656 0.693 1.00 0.00 N ATOM 0 H LYS A 49 -26.940 -12.020 -3.062 1.00 0.00 H new ATOM 0 HA LYS A 49 -29.119 -10.073 -3.185 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -27.335 -10.340 -0.768 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -28.975 -9.731 -0.863 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -29.441 -11.669 0.234 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -29.501 -12.321 -1.391 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -27.503 -13.465 -1.171 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -26.797 -12.260 -0.113 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -27.106 -14.301 1.144 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -28.211 -13.091 1.766 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -29.280 -15.228 1.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -30.000 -14.111 0.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -28.929 -15.283 -0.110 1.00 0.00 H new ATOM 729 N LEU A 50 -25.964 -9.704 -3.592 1.00 0.00 N ATOM 730 CA LEU A 50 -24.788 -8.853 -3.720 1.00 0.00 C ATOM 731 C LEU A 50 -24.264 -8.811 -5.150 1.00 0.00 C ATOM 732 O LEU A 50 -24.339 -9.803 -5.876 1.00 0.00 O ATOM 733 CB LEU A 50 -23.705 -9.417 -2.778 1.00 0.00 C ATOM 734 CG LEU A 50 -22.348 -8.686 -2.802 1.00 0.00 C ATOM 735 CD1 LEU A 50 -22.486 -7.244 -2.309 1.00 0.00 C ATOM 736 CD2 LEU A 50 -21.332 -9.434 -1.940 1.00 0.00 C ATOM 0 H LEU A 50 -25.823 -10.640 -3.971 1.00 0.00 H new ATOM 0 HA LEU A 50 -25.053 -7.830 -3.454 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -24.090 -9.395 -1.758 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -23.537 -10.463 -3.033 1.00 0.00 H new ATOM 0 HG LEU A 50 -21.998 -8.662 -3.834 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -21.512 -6.755 -2.338 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -23.182 -6.705 -2.952 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -22.862 -7.244 -1.286 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -20.377 -8.909 -1.964 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -21.693 -9.483 -0.913 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -21.200 -10.444 -2.327 1.00 0.00 H new ATOM 748 N LYS A 51 -23.647 -7.687 -5.515 1.00 0.00 N ATOM 749 CA LYS A 51 -22.878 -7.522 -6.750 1.00 0.00 C ATOM 750 C LYS A 51 -21.479 -7.054 -6.350 1.00 0.00 C ATOM 751 O LYS A 51 -21.339 -6.383 -5.324 1.00 0.00 O ATOM 752 CB LYS A 51 -23.603 -6.512 -7.647 1.00 0.00 C ATOM 753 CG LYS A 51 -22.939 -6.285 -9.012 1.00 0.00 C ATOM 754 CD LYS A 51 -23.721 -5.212 -9.771 1.00 0.00 C ATOM 755 CE LYS A 51 -23.098 -4.951 -11.143 1.00 0.00 C ATOM 756 NZ LYS A 51 -23.766 -3.813 -11.813 1.00 0.00 N ATOM 0 H LYS A 51 -23.669 -6.842 -4.944 1.00 0.00 H new ATOM 0 HA LYS A 51 -22.788 -8.449 -7.316 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -24.625 -6.855 -7.806 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -23.664 -5.558 -7.123 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -21.903 -5.974 -8.880 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -22.923 -7.214 -9.582 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -24.757 -5.528 -9.892 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -23.735 -4.289 -9.192 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -22.035 -4.740 -11.031 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -23.182 -5.844 -11.762 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -23.475 -3.778 -12.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -24.797 -3.934 -11.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -23.496 -2.926 -11.343 1.00 0.00 H new ATOM 770 N ILE A 52 -20.454 -7.395 -7.129 1.00 0.00 N ATOM 771 CA ILE A 52 -19.067 -7.078 -6.817 1.00 0.00 C ATOM 772 C ILE A 52 -18.462 -6.468 -8.082 1.00 0.00 C ATOM 773 O ILE A 52 -18.785 -6.920 -9.180 1.00 0.00 O ATOM 774 CB ILE A 52 -18.329 -8.353 -6.343 1.00 0.00 C ATOM 775 CG1 ILE A 52 -18.996 -8.954 -5.080 1.00 0.00 C ATOM 776 CG2 ILE A 52 -16.846 -8.037 -6.079 1.00 0.00 C ATOM 777 CD1 ILE A 52 -18.378 -10.270 -4.594 1.00 0.00 C ATOM 0 H ILE A 52 -20.568 -7.905 -8.005 1.00 0.00 H new ATOM 0 HA ILE A 52 -18.978 -6.363 -5.999 1.00 0.00 H new ATOM 0 HB ILE A 52 -18.394 -9.099 -7.135 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -18.941 -8.223 -4.274 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -20.053 -9.120 -5.288 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -16.335 -8.940 -5.746 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -16.382 -7.675 -6.997 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -16.769 -7.271 -5.307 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -18.909 -10.615 -3.707 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -18.457 -11.021 -5.380 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -17.328 -10.110 -4.350 1.00 0.00 H new ATOM 789 N VAL A 53 -17.584 -5.469 -7.958 1.00 0.00 N ATOM 790 CA VAL A 53 -16.964 -4.802 -9.101 1.00 0.00 C ATOM 791 C VAL A 53 -15.481 -4.547 -8.794 1.00 0.00 C ATOM 792 O VAL A 53 -15.148 -3.894 -7.806 1.00 0.00 O ATOM 793 CB VAL A 53 -17.721 -3.496 -9.453 1.00 0.00 C ATOM 794 CG1 VAL A 53 -17.317 -3.033 -10.851 1.00 0.00 C ATOM 795 CG2 VAL A 53 -19.257 -3.607 -9.409 1.00 0.00 C ATOM 0 H VAL A 53 -17.283 -5.100 -7.056 1.00 0.00 H new ATOM 0 HA VAL A 53 -17.026 -5.444 -9.979 1.00 0.00 H new ATOM 0 HB VAL A 53 -17.436 -2.781 -8.681 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -17.850 -2.115 -11.098 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -16.243 -2.848 -10.877 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -17.570 -3.806 -11.577 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -19.699 -2.645 -9.669 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -19.588 -4.363 -10.121 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -19.573 -3.892 -8.405 1.00 0.00 H new ATOM 805 N LYS A 54 -14.571 -5.074 -9.612 1.00 0.00 N ATOM 806 CA LYS A 54 -13.134 -4.865 -9.464 1.00 0.00 C ATOM 807 C LYS A 54 -12.712 -3.577 -10.163 1.00 0.00 C ATOM 808 O LYS A 54 -13.326 -3.182 -11.153 1.00 0.00 O ATOM 809 CB LYS A 54 -12.352 -6.026 -10.112 1.00 0.00 C ATOM 810 CG LYS A 54 -12.687 -7.423 -9.573 1.00 0.00 C ATOM 811 CD LYS A 54 -12.277 -7.684 -8.113 1.00 0.00 C ATOM 812 CE LYS A 54 -10.759 -7.725 -7.847 1.00 0.00 C ATOM 813 NZ LYS A 54 -10.059 -8.772 -8.641 1.00 0.00 N ATOM 0 H LYS A 54 -14.816 -5.666 -10.406 1.00 0.00 H new ATOM 0 HA LYS A 54 -12.915 -4.809 -8.398 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -12.540 -6.014 -11.186 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -11.286 -5.847 -9.973 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -13.762 -7.581 -9.664 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -12.201 -8.165 -10.207 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -12.717 -6.909 -7.486 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -12.709 -8.633 -7.797 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -10.328 -6.751 -8.080 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -10.586 -7.905 -6.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -9.666 -9.490 -7.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -10.733 -9.222 -9.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -9.288 -8.336 -9.187 1.00 0.00 H new ATOM 827 N ILE A 55 -11.606 -2.996 -9.723 1.00 0.00 N ATOM 828 CA ILE A 55 -10.882 -1.918 -10.365 1.00 0.00 C ATOM 829 C ILE A 55 -9.459 -2.478 -10.404 1.00 0.00 C ATOM 830 O ILE A 55 -8.874 -2.756 -9.355 1.00 0.00 O ATOM 831 CB ILE A 55 -11.016 -0.585 -9.581 1.00 0.00 C ATOM 832 CG1 ILE A 55 -12.318 0.178 -9.882 1.00 0.00 C ATOM 833 CG2 ILE A 55 -9.808 0.317 -9.859 1.00 0.00 C ATOM 834 CD1 ILE A 55 -12.377 0.811 -11.278 1.00 0.00 C ATOM 0 H ILE A 55 -11.165 -3.287 -8.851 1.00 0.00 H new ATOM 0 HA ILE A 55 -11.251 -1.648 -11.355 1.00 0.00 H new ATOM 0 HB ILE A 55 -11.050 -0.855 -8.525 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -13.159 -0.507 -9.772 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -12.445 0.962 -9.136 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -9.914 1.249 -9.303 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -8.895 -0.190 -9.546 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -9.754 0.535 -10.926 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -13.329 1.328 -11.403 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -11.560 1.524 -11.389 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -12.285 0.032 -12.035 1.00 0.00 H new ATOM 846 N ASP A 56 -8.923 -2.699 -11.606 1.00 0.00 N ATOM 847 CA ASP A 56 -7.518 -3.052 -11.784 1.00 0.00 C ATOM 848 C ASP A 56 -6.704 -1.771 -11.627 1.00 0.00 C ATOM 849 O ASP A 56 -6.769 -0.899 -12.495 1.00 0.00 O ATOM 850 CB ASP A 56 -7.288 -3.688 -13.160 1.00 0.00 C ATOM 851 CG ASP A 56 -5.816 -4.097 -13.347 1.00 0.00 C ATOM 852 OD1 ASP A 56 -4.935 -3.211 -13.350 1.00 0.00 O ATOM 853 OD2 ASP A 56 -5.550 -5.306 -13.530 1.00 0.00 O ATOM 0 H ASP A 56 -9.449 -2.638 -12.477 1.00 0.00 H new ATOM 0 HA ASP A 56 -7.210 -3.788 -11.041 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -7.928 -4.564 -13.270 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -7.574 -2.984 -13.941 1.00 0.00 H new ATOM 858 N VAL A 57 -5.974 -1.609 -10.526 1.00 0.00 N ATOM 859 CA VAL A 57 -5.214 -0.400 -10.231 1.00 0.00 C ATOM 860 C VAL A 57 -3.867 -0.303 -10.969 1.00 0.00 C ATOM 861 O VAL A 57 -2.816 -0.010 -10.392 1.00 0.00 O ATOM 862 CB VAL A 57 -5.170 -0.063 -8.736 1.00 0.00 C ATOM 863 CG1 VAL A 57 -6.574 0.160 -8.178 1.00 0.00 C ATOM 864 CG2 VAL A 57 -4.465 -1.080 -7.849 1.00 0.00 C ATOM 0 H VAL A 57 -5.894 -2.325 -9.804 1.00 0.00 H new ATOM 0 HA VAL A 57 -5.787 0.417 -10.670 1.00 0.00 H new ATOM 0 HB VAL A 57 -4.574 0.849 -8.703 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -6.510 0.397 -7.116 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -7.048 0.987 -8.707 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -7.167 -0.745 -8.313 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -4.493 -0.741 -6.813 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -4.968 -2.044 -7.929 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -3.428 -1.184 -8.168 1.00 0.00 H new ATOM 874 N ASP A 58 -3.912 -0.544 -12.273 1.00 0.00 N ATOM 875 CA ASP A 58 -2.838 -0.272 -13.217 1.00 0.00 C ATOM 876 C ASP A 58 -3.450 -0.083 -14.610 1.00 0.00 C ATOM 877 O ASP A 58 -3.135 0.891 -15.293 1.00 0.00 O ATOM 878 CB ASP A 58 -1.808 -1.408 -13.251 1.00 0.00 C ATOM 879 CG ASP A 58 -0.829 -1.222 -14.425 1.00 0.00 C ATOM 880 OD1 ASP A 58 -0.053 -0.241 -14.427 1.00 0.00 O ATOM 881 OD2 ASP A 58 -0.820 -2.067 -15.348 1.00 0.00 O ATOM 0 H ASP A 58 -4.733 -0.952 -12.720 1.00 0.00 H new ATOM 0 HA ASP A 58 -2.316 0.631 -12.900 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -1.256 -1.433 -12.311 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -2.319 -2.366 -13.346 1.00 0.00 H new ATOM 886 N GLU A 59 -4.379 -0.955 -15.019 1.00 0.00 N ATOM 887 CA GLU A 59 -5.076 -0.870 -16.297 1.00 0.00 C ATOM 888 C GLU A 59 -6.237 0.135 -16.223 1.00 0.00 C ATOM 889 O GLU A 59 -6.511 0.844 -17.194 1.00 0.00 O ATOM 890 CB GLU A 59 -5.512 -2.299 -16.700 1.00 0.00 C ATOM 891 CG GLU A 59 -6.877 -2.363 -17.381 1.00 0.00 C ATOM 892 CD GLU A 59 -7.290 -3.791 -17.770 1.00 0.00 C ATOM 893 OE1 GLU A 59 -6.713 -4.363 -18.723 1.00 0.00 O ATOM 894 OE2 GLU A 59 -8.228 -4.335 -17.143 1.00 0.00 O ATOM 0 H GLU A 59 -4.669 -1.754 -14.455 1.00 0.00 H new ATOM 0 HA GLU A 59 -4.419 -0.485 -17.077 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -4.763 -2.721 -17.370 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -5.532 -2.927 -15.809 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -7.629 -1.943 -16.714 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -6.860 -1.740 -18.275 1.00 0.00 H new ATOM 901 N ASN A 60 -6.912 0.205 -15.073 1.00 0.00 N ATOM 902 CA ASN A 60 -8.168 0.931 -14.863 1.00 0.00 C ATOM 903 C ASN A 60 -8.103 1.752 -13.577 1.00 0.00 C ATOM 904 O ASN A 60 -9.112 1.994 -12.914 1.00 0.00 O ATOM 905 CB ASN A 60 -9.366 -0.052 -14.904 1.00 0.00 C ATOM 906 CG ASN A 60 -9.942 -0.197 -16.308 1.00 0.00 C ATOM 907 OD1 ASN A 60 -10.192 0.793 -16.986 1.00 0.00 O ATOM 908 ND2 ASN A 60 -10.190 -1.409 -16.778 1.00 0.00 N ATOM 0 H ASN A 60 -6.585 -0.262 -14.227 1.00 0.00 H new ATOM 0 HA ASN A 60 -8.321 1.644 -15.673 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -9.045 -1.029 -14.542 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -10.145 0.299 -14.227 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -10.591 -1.523 -17.709 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -9.980 -2.229 -16.209 1.00 0.00 H new ATOM 915 N GLN A 61 -6.898 2.202 -13.218 1.00 0.00 N ATOM 916 CA GLN A 61 -6.641 2.838 -11.934 1.00 0.00 C ATOM 917 C GLN A 61 -7.210 4.261 -11.858 1.00 0.00 C ATOM 918 O GLN A 61 -7.123 4.898 -10.812 1.00 0.00 O ATOM 919 CB GLN A 61 -5.140 2.814 -11.609 1.00 0.00 C ATOM 920 CG GLN A 61 -4.261 3.876 -12.273 1.00 0.00 C ATOM 921 CD GLN A 61 -2.777 3.585 -11.998 1.00 0.00 C ATOM 922 OE1 GLN A 61 -2.007 3.308 -12.911 1.00 0.00 O ATOM 923 NE2 GLN A 61 -2.337 3.656 -10.746 1.00 0.00 N ATOM 0 H GLN A 61 -6.074 2.133 -13.815 1.00 0.00 H new ATOM 0 HA GLN A 61 -7.166 2.258 -11.175 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -5.027 2.910 -10.529 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -4.751 1.834 -11.884 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -4.443 3.889 -13.348 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -4.522 4.864 -11.893 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -2.983 3.887 -9.991 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -1.354 3.480 -10.540 1.00 0.00 H new ATOM 932 N GLU A 62 -7.742 4.778 -12.966 1.00 0.00 N ATOM 933 CA GLU A 62 -8.256 6.133 -13.099 1.00 0.00 C ATOM 934 C GLU A 62 -9.331 6.417 -12.048 1.00 0.00 C ATOM 935 O GLU A 62 -9.242 7.435 -11.362 1.00 0.00 O ATOM 936 CB GLU A 62 -8.792 6.301 -14.527 1.00 0.00 C ATOM 937 CG GLU A 62 -7.653 6.551 -15.526 1.00 0.00 C ATOM 938 CD GLU A 62 -8.185 6.749 -16.958 1.00 0.00 C ATOM 939 OE1 GLU A 62 -8.315 5.755 -17.706 1.00 0.00 O ATOM 940 OE2 GLU A 62 -8.447 7.905 -17.360 1.00 0.00 O ATOM 0 H GLU A 62 -7.828 4.239 -13.828 1.00 0.00 H new ATOM 0 HA GLU A 62 -7.460 6.857 -12.926 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -9.344 5.407 -14.818 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -9.495 7.134 -14.558 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -7.089 7.433 -15.222 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -6.961 5.709 -15.508 1.00 0.00 H new ATOM 947 N THR A 63 -10.284 5.500 -11.843 1.00 0.00 N ATOM 948 CA THR A 63 -11.288 5.606 -10.782 1.00 0.00 C ATOM 949 C THR A 63 -10.621 5.784 -9.423 1.00 0.00 C ATOM 950 O THR A 63 -11.073 6.582 -8.603 1.00 0.00 O ATOM 951 CB THR A 63 -12.133 4.323 -10.773 1.00 0.00 C ATOM 952 OG1 THR A 63 -12.671 4.149 -12.067 1.00 0.00 O ATOM 953 CG2 THR A 63 -13.254 4.314 -9.726 1.00 0.00 C ATOM 0 H THR A 63 -10.379 4.659 -12.413 1.00 0.00 H new ATOM 0 HA THR A 63 -11.918 6.475 -10.972 1.00 0.00 H new ATOM 0 HB THR A 63 -11.477 3.499 -10.493 1.00 0.00 H new ATOM 0 HG1 THR A 63 -13.550 3.721 -12.001 1.00 0.00 H new ATOM 0 HG21 THR A 63 -13.801 3.373 -9.787 1.00 0.00 H new ATOM 0 HG22 THR A 63 -12.823 4.419 -8.730 1.00 0.00 H new ATOM 0 HG23 THR A 63 -13.935 5.143 -9.915 1.00 0.00 H new ATOM 961 N ALA A 64 -9.556 5.020 -9.187 1.00 0.00 N ATOM 962 CA ALA A 64 -8.922 4.911 -7.894 1.00 0.00 C ATOM 963 C ALA A 64 -8.242 6.240 -7.566 1.00 0.00 C ATOM 964 O ALA A 64 -8.684 6.966 -6.677 1.00 0.00 O ATOM 965 CB ALA A 64 -7.952 3.722 -7.932 1.00 0.00 C ATOM 0 H ALA A 64 -9.109 4.453 -9.908 1.00 0.00 H new ATOM 0 HA ALA A 64 -9.642 4.719 -7.098 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -7.462 3.621 -6.964 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -8.504 2.809 -8.156 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -7.201 3.890 -8.704 1.00 0.00 H new ATOM 971 N GLY A 65 -7.225 6.594 -8.352 1.00 0.00 N ATOM 972 CA GLY A 65 -6.546 7.880 -8.279 1.00 0.00 C ATOM 973 C GLY A 65 -7.504 9.069 -8.195 1.00 0.00 C ATOM 974 O GLY A 65 -7.300 9.953 -7.363 1.00 0.00 O ATOM 0 H GLY A 65 -6.845 5.979 -9.071 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -5.892 7.888 -7.407 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -5.910 7.997 -9.156 1.00 0.00 H new ATOM 978 N LYS A 66 -8.569 9.084 -9.007 1.00 0.00 N ATOM 979 CA LYS A 66 -9.555 10.158 -8.993 1.00 0.00 C ATOM 980 C LYS A 66 -10.308 10.207 -7.666 1.00 0.00 C ATOM 981 O LYS A 66 -10.492 11.300 -7.130 1.00 0.00 O ATOM 982 CB LYS A 66 -10.520 9.979 -10.173 1.00 0.00 C ATOM 983 CG LYS A 66 -11.584 11.083 -10.253 1.00 0.00 C ATOM 984 CD LYS A 66 -12.395 11.001 -11.552 1.00 0.00 C ATOM 985 CE LYS A 66 -13.190 9.692 -11.663 1.00 0.00 C ATOM 986 NZ LYS A 66 -13.764 9.510 -13.012 1.00 0.00 N ATOM 0 H LYS A 66 -8.766 8.351 -9.689 1.00 0.00 H new ATOM 0 HA LYS A 66 -9.037 11.111 -9.099 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -9.950 9.964 -11.102 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -11.015 9.011 -10.087 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -12.257 11.002 -9.399 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -11.101 12.058 -10.187 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -13.082 11.846 -11.602 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -11.721 11.087 -12.404 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -12.538 8.850 -11.429 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -13.991 9.690 -10.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -14.362 8.659 -13.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -14.339 10.341 -13.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -12.996 9.401 -13.704 1.00 0.00 H new ATOM 1000 N TYR A 67 -10.754 9.061 -7.136 1.00 0.00 N ATOM 1001 CA TYR A 67 -11.514 9.044 -5.895 1.00 0.00 C ATOM 1002 C TYR A 67 -10.611 9.417 -4.710 1.00 0.00 C ATOM 1003 O TYR A 67 -11.092 9.958 -3.712 1.00 0.00 O ATOM 1004 CB TYR A 67 -12.184 7.677 -5.681 1.00 0.00 C ATOM 1005 CG TYR A 67 -13.238 7.688 -4.586 1.00 0.00 C ATOM 1006 CD1 TYR A 67 -14.521 8.203 -4.860 1.00 0.00 C ATOM 1007 CD2 TYR A 67 -12.938 7.225 -3.289 1.00 0.00 C ATOM 1008 CE1 TYR A 67 -15.493 8.273 -3.846 1.00 0.00 C ATOM 1009 CE2 TYR A 67 -13.905 7.288 -2.271 1.00 0.00 C ATOM 1010 CZ TYR A 67 -15.186 7.822 -2.541 1.00 0.00 C ATOM 1011 OH TYR A 67 -16.105 7.910 -1.538 1.00 0.00 O ATOM 0 H TYR A 67 -10.599 8.142 -7.550 1.00 0.00 H new ATOM 0 HA TYR A 67 -12.306 9.790 -5.963 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -12.644 7.356 -6.615 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -11.420 6.941 -5.432 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -14.759 8.546 -5.856 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -11.960 6.820 -3.076 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -16.473 8.671 -4.064 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -13.669 6.928 -1.281 1.00 0.00 H new ATOM 0 HH TYR A 67 -15.721 7.552 -0.710 1.00 0.00 H new ATOM 1021 N GLY A 68 -9.304 9.160 -4.829 1.00 0.00 N ATOM 1022 CA GLY A 68 -8.330 9.330 -3.766 1.00 0.00 C ATOM 1023 C GLY A 68 -8.074 7.954 -3.163 1.00 0.00 C ATOM 1024 O GLY A 68 -8.465 7.689 -2.027 1.00 0.00 O ATOM 0 H GLY A 68 -8.891 8.818 -5.697 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -7.406 9.757 -4.156 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -8.704 10.018 -3.008 1.00 0.00 H new ATOM 1028 N VAL A 69 -7.483 7.061 -3.955 1.00 0.00 N ATOM 1029 CA VAL A 69 -7.203 5.677 -3.626 1.00 0.00 C ATOM 1030 C VAL A 69 -5.864 5.480 -4.301 1.00 0.00 C ATOM 1031 O VAL A 69 -5.697 5.862 -5.462 1.00 0.00 O ATOM 1032 CB VAL A 69 -8.275 4.714 -4.193 1.00 0.00 C ATOM 1033 CG1 VAL A 69 -7.816 3.254 -4.100 1.00 0.00 C ATOM 1034 CG2 VAL A 69 -9.645 4.883 -3.531 1.00 0.00 C ATOM 0 H VAL A 69 -7.172 7.304 -4.895 1.00 0.00 H new ATOM 0 HA VAL A 69 -7.203 5.469 -2.556 1.00 0.00 H new ATOM 0 HB VAL A 69 -8.393 4.983 -5.243 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -8.590 2.603 -4.506 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -6.897 3.125 -4.671 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -7.635 2.995 -3.057 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -10.352 4.180 -3.972 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -9.559 4.688 -2.462 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -10.001 5.901 -3.687 1.00 0.00 H new ATOM 1044 N MET A 70 -4.898 4.935 -3.571 1.00 0.00 N ATOM 1045 CA MET A 70 -3.537 4.772 -4.058 1.00 0.00 C ATOM 1046 C MET A 70 -2.923 3.527 -3.420 1.00 0.00 C ATOM 1047 O MET A 70 -1.706 3.408 -3.382 1.00 0.00 O ATOM 1048 CB MET A 70 -2.696 6.006 -3.712 1.00 0.00 C ATOM 1049 CG MET A 70 -3.341 7.362 -4.027 1.00 0.00 C ATOM 1050 SD MET A 70 -2.240 8.771 -3.787 1.00 0.00 S ATOM 1051 CE MET A 70 -1.731 8.447 -2.079 1.00 0.00 C ATOM 0 H MET A 70 -5.039 4.593 -2.621 1.00 0.00 H new ATOM 0 HA MET A 70 -3.554 4.659 -5.142 1.00 0.00 H new ATOM 0 HB2 MET A 70 -2.460 5.975 -2.648 1.00 0.00 H new ATOM 0 HB3 MET A 70 -1.750 5.941 -4.250 1.00 0.00 H new ATOM 0 HG2 MET A 70 -3.688 7.357 -5.060 1.00 0.00 H new ATOM 0 HG3 MET A 70 -4.221 7.490 -3.396 1.00 0.00 H new ATOM 0 HE1 MET A 70 -1.186 9.308 -1.692 1.00 0.00 H new ATOM 0 HE2 MET A 70 -2.613 8.269 -1.464 1.00 0.00 H new ATOM 0 HE3 MET A 70 -1.087 7.568 -2.052 1.00 0.00 H new ATOM 1061 N SER A 71 -3.739 2.588 -2.943 1.00 0.00 N ATOM 1062 CA SER A 71 -3.329 1.492 -2.090 1.00 0.00 C ATOM 1063 C SER A 71 -3.988 0.165 -2.443 1.00 0.00 C ATOM 1064 O SER A 71 -5.023 0.157 -3.118 1.00 0.00 O ATOM 1065 CB SER A 71 -3.725 1.914 -0.667 1.00 0.00 C ATOM 1066 OG SER A 71 -4.922 2.694 -0.637 1.00 0.00 O ATOM 0 H SER A 71 -4.737 2.576 -3.152 1.00 0.00 H new ATOM 0 HA SER A 71 -2.260 1.316 -2.206 1.00 0.00 H new ATOM 0 HB2 SER A 71 -3.861 1.024 -0.053 1.00 0.00 H new ATOM 0 HB3 SER A 71 -2.911 2.487 -0.222 1.00 0.00 H new ATOM 0 HG SER A 71 -5.674 2.151 -0.952 1.00 0.00 H new ATOM 1072 N ILE A 72 -3.423 -0.947 -1.953 1.00 0.00 N ATOM 1073 CA ILE A 72 -3.885 -2.292 -2.283 1.00 0.00 C ATOM 1074 C ILE A 72 -4.053 -3.111 -0.987 1.00 0.00 C ATOM 1075 O ILE A 72 -3.153 -3.065 -0.147 1.00 0.00 O ATOM 1076 CB ILE A 72 -2.888 -3.064 -3.192 1.00 0.00 C ATOM 1077 CG1 ILE A 72 -1.858 -2.220 -3.959 1.00 0.00 C ATOM 1078 CG2 ILE A 72 -3.635 -4.002 -4.155 1.00 0.00 C ATOM 1079 CD1 ILE A 72 -2.401 -1.375 -5.102 1.00 0.00 C ATOM 0 H ILE A 72 -2.629 -0.933 -1.313 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.827 -2.174 -2.818 1.00 0.00 H new ATOM 0 HB ILE A 72 -2.289 -3.636 -2.483 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -1.361 -1.558 -3.250 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -1.096 -2.889 -4.359 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.915 -4.530 -4.780 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -4.217 -4.724 -3.582 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -4.304 -3.417 -4.787 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -1.584 -0.824 -5.568 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -2.870 -2.023 -5.842 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -3.139 -0.672 -4.716 1.00 0.00 H new ATOM 1091 N PRO A 73 -5.141 -3.877 -0.797 1.00 0.00 N ATOM 1092 CA PRO A 73 -6.350 -3.871 -1.598 1.00 0.00 C ATOM 1093 C PRO A 73 -7.238 -2.761 -1.016 1.00 0.00 C ATOM 1094 O PRO A 73 -7.514 -2.753 0.189 1.00 0.00 O ATOM 1095 CB PRO A 73 -6.956 -5.264 -1.412 1.00 0.00 C ATOM 1096 CG PRO A 73 -6.549 -5.649 0.010 1.00 0.00 C ATOM 1097 CD PRO A 73 -5.238 -4.887 0.248 1.00 0.00 C ATOM 0 HA PRO A 73 -6.208 -3.677 -2.661 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -8.040 -5.248 -1.528 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -6.567 -5.971 -2.145 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -7.312 -5.363 0.734 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -6.407 -6.725 0.105 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -5.234 -4.424 1.235 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -4.385 -5.565 0.211 1.00 0.00 H new ATOM 1105 N THR A 74 -7.671 -1.811 -1.843 1.00 0.00 N ATOM 1106 CA THR A 74 -8.678 -0.856 -1.377 1.00 0.00 C ATOM 1107 C THR A 74 -10.050 -1.455 -1.671 1.00 0.00 C ATOM 1108 O THR A 74 -10.216 -2.212 -2.626 1.00 0.00 O ATOM 1109 CB THR A 74 -8.452 0.544 -1.967 1.00 0.00 C ATOM 1110 OG1 THR A 74 -7.160 0.990 -1.595 1.00 0.00 O ATOM 1111 CG2 THR A 74 -9.507 1.543 -1.465 1.00 0.00 C ATOM 0 H THR A 74 -7.356 -1.682 -2.804 1.00 0.00 H new ATOM 0 HA THR A 74 -8.601 -0.696 -0.302 1.00 0.00 H new ATOM 0 HB THR A 74 -8.540 0.485 -3.052 1.00 0.00 H new ATOM 0 HG1 THR A 74 -6.506 0.688 -2.259 1.00 0.00 H new ATOM 0 HG21 THR A 74 -9.317 2.523 -1.902 1.00 0.00 H new ATOM 0 HG22 THR A 74 -10.500 1.201 -1.758 1.00 0.00 H new ATOM 0 HG23 THR A 74 -9.453 1.614 -0.379 1.00 0.00 H new ATOM 1119 N LEU A 75 -11.042 -1.162 -0.837 1.00 0.00 N ATOM 1120 CA LEU A 75 -12.369 -1.737 -0.936 1.00 0.00 C ATOM 1121 C LEU A 75 -13.347 -0.635 -0.553 1.00 0.00 C ATOM 1122 O LEU A 75 -13.260 -0.084 0.545 1.00 0.00 O ATOM 1123 CB LEU A 75 -12.383 -2.988 -0.038 1.00 0.00 C ATOM 1124 CG LEU A 75 -13.507 -3.981 -0.359 1.00 0.00 C ATOM 1125 CD1 LEU A 75 -13.248 -5.319 0.348 1.00 0.00 C ATOM 1126 CD2 LEU A 75 -14.860 -3.422 0.076 1.00 0.00 C ATOM 0 H LEU A 75 -10.940 -0.507 -0.062 1.00 0.00 H new ATOM 0 HA LEU A 75 -12.660 -2.076 -1.930 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -11.425 -3.499 -0.131 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -12.477 -2.674 1.002 1.00 0.00 H new ATOM 0 HG LEU A 75 -13.525 -4.141 -1.437 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -14.052 -6.016 0.113 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -12.298 -5.732 0.008 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -13.209 -5.160 1.426 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -15.644 -4.141 -0.160 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -14.849 -3.237 1.150 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -15.054 -2.488 -0.451 1.00 0.00 H new ATOM 1138 N LEU A 76 -14.236 -0.279 -1.482 1.00 0.00 N ATOM 1139 CA LEU A 76 -15.246 0.751 -1.334 1.00 0.00 C ATOM 1140 C LEU A 76 -16.577 0.021 -1.482 1.00 0.00 C ATOM 1141 O LEU A 76 -16.887 -0.462 -2.567 1.00 0.00 O ATOM 1142 CB LEU A 76 -15.135 1.876 -2.395 1.00 0.00 C ATOM 1143 CG LEU A 76 -13.760 2.518 -2.676 1.00 0.00 C ATOM 1144 CD1 LEU A 76 -13.928 3.663 -3.683 1.00 0.00 C ATOM 1145 CD2 LEU A 76 -13.084 3.061 -1.416 1.00 0.00 C ATOM 0 H LEU A 76 -14.266 -0.727 -2.398 1.00 0.00 H new ATOM 0 HA LEU A 76 -15.132 1.254 -0.374 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -15.508 1.475 -3.338 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -15.814 2.675 -2.098 1.00 0.00 H new ATOM 0 HG LEU A 76 -13.120 1.732 -3.077 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -12.958 4.117 -3.882 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -14.344 3.273 -4.612 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -14.602 4.414 -3.271 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -12.122 3.499 -1.680 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -13.718 3.823 -0.963 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -12.930 2.248 -0.707 1.00 0.00 H new ATOM 1157 N VAL A 77 -17.348 -0.126 -0.415 1.00 0.00 N ATOM 1158 CA VAL A 77 -18.677 -0.739 -0.487 1.00 0.00 C ATOM 1159 C VAL A 77 -19.707 0.364 -0.709 1.00 0.00 C ATOM 1160 O VAL A 77 -19.620 1.406 -0.054 1.00 0.00 O ATOM 1161 CB VAL A 77 -19.024 -1.538 0.783 1.00 0.00 C ATOM 1162 CG1 VAL A 77 -20.090 -2.574 0.413 1.00 0.00 C ATOM 1163 CG2 VAL A 77 -17.847 -2.283 1.422 1.00 0.00 C ATOM 0 H VAL A 77 -17.077 0.172 0.522 1.00 0.00 H new ATOM 0 HA VAL A 77 -18.684 -1.447 -1.315 1.00 0.00 H new ATOM 0 HB VAL A 77 -19.361 -0.808 1.519 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -20.355 -3.155 1.296 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -20.976 -2.065 0.035 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -19.698 -3.240 -0.356 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -18.191 -2.815 2.309 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -17.437 -2.996 0.707 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -17.074 -1.568 1.705 1.00 0.00 H new ATOM 1173 N LEU A 78 -20.699 0.138 -1.578 1.00 0.00 N ATOM 1174 CA LEU A 78 -21.667 1.142 -2.003 1.00 0.00 C ATOM 1175 C LEU A 78 -23.100 0.635 -1.838 1.00 0.00 C ATOM 1176 O LEU A 78 -23.356 -0.572 -1.877 1.00 0.00 O ATOM 1177 CB LEU A 78 -21.446 1.558 -3.476 1.00 0.00 C ATOM 1178 CG LEU A 78 -20.037 2.100 -3.797 1.00 0.00 C ATOM 1179 CD1 LEU A 78 -19.136 1.022 -4.416 1.00 0.00 C ATOM 1180 CD2 LEU A 78 -20.108 3.295 -4.755 1.00 0.00 C ATOM 0 H LEU A 78 -20.850 -0.772 -2.013 1.00 0.00 H new ATOM 0 HA LEU A 78 -21.516 2.011 -1.363 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -21.641 0.696 -4.114 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -22.180 2.320 -3.736 1.00 0.00 H new ATOM 0 HG LEU A 78 -19.606 2.417 -2.847 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -18.154 1.445 -4.626 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -19.031 0.191 -3.718 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -19.583 0.663 -5.343 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -19.100 3.655 -4.963 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -20.582 2.987 -5.687 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -20.692 4.094 -4.298 1.00 0.00 H new ATOM 1192 N LYS A 79 -24.045 1.574 -1.733 1.00 0.00 N ATOM 1193 CA LYS A 79 -25.479 1.317 -1.778 1.00 0.00 C ATOM 1194 C LYS A 79 -26.118 2.402 -2.624 1.00 0.00 C ATOM 1195 O LYS A 79 -25.913 3.585 -2.350 1.00 0.00 O ATOM 1196 CB LYS A 79 -26.131 1.379 -0.386 1.00 0.00 C ATOM 1197 CG LYS A 79 -25.772 0.203 0.526 1.00 0.00 C ATOM 1198 CD LYS A 79 -26.474 0.258 1.896 1.00 0.00 C ATOM 1199 CE LYS A 79 -28.000 0.153 1.778 1.00 0.00 C ATOM 1200 NZ LYS A 79 -28.645 -0.145 3.082 1.00 0.00 N ATOM 0 H LYS A 79 -23.822 2.562 -1.611 1.00 0.00 H new ATOM 0 HA LYS A 79 -25.628 0.316 -2.184 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -25.833 2.307 0.102 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -27.214 1.415 -0.505 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -26.037 -0.729 0.027 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -24.693 0.187 0.679 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -26.104 -0.553 2.523 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -26.215 1.191 2.396 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -28.397 1.088 1.384 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -28.254 -0.628 1.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -29.665 -0.291 2.940 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -28.226 -1.006 3.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -28.497 0.652 3.733 1.00 0.00 H new ATOM 1214 N ASP A 80 -26.899 1.971 -3.611 1.00 0.00 N ATOM 1215 CA ASP A 80 -27.816 2.748 -4.446 1.00 0.00 C ATOM 1216 C ASP A 80 -27.339 4.166 -4.813 1.00 0.00 C ATOM 1217 O ASP A 80 -28.131 5.111 -4.825 1.00 0.00 O ATOM 1218 CB ASP A 80 -29.201 2.723 -3.772 1.00 0.00 C ATOM 1219 CG ASP A 80 -30.332 3.205 -4.697 1.00 0.00 C ATOM 1220 OD1 ASP A 80 -30.515 2.609 -5.781 1.00 0.00 O ATOM 1221 OD2 ASP A 80 -31.102 4.113 -4.306 1.00 0.00 O ATOM 0 H ASP A 80 -26.909 0.985 -3.871 1.00 0.00 H new ATOM 0 HA ASP A 80 -27.863 2.273 -5.426 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -29.419 1.708 -3.441 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -29.176 3.351 -2.881 1.00 0.00 H new ATOM 1226 N GLY A 81 -26.036 4.340 -5.077 1.00 0.00 N ATOM 1227 CA GLY A 81 -25.478 5.635 -5.455 1.00 0.00 C ATOM 1228 C GLY A 81 -24.136 5.980 -4.858 1.00 0.00 C ATOM 1229 O GLY A 81 -23.367 6.691 -5.508 1.00 0.00 O ATOM 0 H GLY A 81 -25.348 3.589 -5.033 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -25.388 5.666 -6.541 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -26.189 6.411 -5.171 1.00 0.00 H new ATOM 1233 N GLU A 82 -23.835 5.494 -3.650 1.00 0.00 N ATOM 1234 CA GLU A 82 -22.711 6.036 -2.916 1.00 0.00 C ATOM 1235 C GLU A 82 -22.023 5.055 -1.975 1.00 0.00 C ATOM 1236 O GLU A 82 -22.624 4.059 -1.576 1.00 0.00 O ATOM 1237 CB GLU A 82 -23.312 7.239 -2.169 1.00 0.00 C ATOM 1238 CG GLU A 82 -24.147 6.876 -0.928 1.00 0.00 C ATOM 1239 CD GLU A 82 -24.805 8.125 -0.313 1.00 0.00 C ATOM 1240 OE1 GLU A 82 -24.161 8.822 0.503 1.00 0.00 O ATOM 1241 OE2 GLU A 82 -25.982 8.418 -0.627 1.00 0.00 O ATOM 0 H GLU A 82 -24.344 4.747 -3.178 1.00 0.00 H new ATOM 0 HA GLU A 82 -21.899 6.304 -3.592 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -22.502 7.901 -1.864 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -23.940 7.801 -2.860 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -24.917 6.155 -1.203 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -23.510 6.395 -0.186 1.00 0.00 H new ATOM 1248 N VAL A 83 -20.767 5.352 -1.624 1.00 0.00 N ATOM 1249 CA VAL A 83 -19.979 4.592 -0.658 1.00 0.00 C ATOM 1250 C VAL A 83 -20.643 4.705 0.714 1.00 0.00 C ATOM 1251 O VAL A 83 -21.019 5.792 1.160 1.00 0.00 O ATOM 1252 CB VAL A 83 -18.503 5.066 -0.658 1.00 0.00 C ATOM 1253 CG1 VAL A 83 -17.614 4.264 0.310 1.00 0.00 C ATOM 1254 CG2 VAL A 83 -17.870 4.946 -2.057 1.00 0.00 C ATOM 0 H VAL A 83 -20.262 6.147 -2.015 1.00 0.00 H new ATOM 0 HA VAL A 83 -19.953 3.538 -0.934 1.00 0.00 H new ATOM 0 HB VAL A 83 -18.545 6.107 -0.336 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -16.593 4.643 0.265 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -17.995 4.369 1.326 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -17.624 3.212 0.026 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -16.835 5.287 -2.019 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -17.897 3.906 -2.381 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -18.429 5.560 -2.763 1.00 0.00 H new ATOM 1264 N VAL A 84 -20.741 3.560 1.383 1.00 0.00 N ATOM 1265 CA VAL A 84 -21.304 3.397 2.714 1.00 0.00 C ATOM 1266 C VAL A 84 -20.288 2.773 3.676 1.00 0.00 C ATOM 1267 O VAL A 84 -20.376 3.020 4.879 1.00 0.00 O ATOM 1268 CB VAL A 84 -22.591 2.555 2.644 1.00 0.00 C ATOM 1269 CG1 VAL A 84 -23.703 3.297 1.890 1.00 0.00 C ATOM 1270 CG2 VAL A 84 -22.386 1.158 2.027 1.00 0.00 C ATOM 0 H VAL A 84 -20.413 2.678 0.989 1.00 0.00 H new ATOM 0 HA VAL A 84 -21.555 4.383 3.104 1.00 0.00 H new ATOM 0 HB VAL A 84 -22.891 2.403 3.681 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -24.598 2.676 1.858 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -23.928 4.232 2.402 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -23.373 3.511 0.873 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -23.336 0.624 2.011 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -22.011 1.261 1.009 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -21.665 0.599 2.624 1.00 0.00 H new ATOM 1280 N GLU A 85 -19.303 2.019 3.173 1.00 0.00 N ATOM 1281 CA GLU A 85 -18.235 1.443 3.975 1.00 0.00 C ATOM 1282 C GLU A 85 -16.961 1.452 3.143 1.00 0.00 C ATOM 1283 O GLU A 85 -17.011 1.399 1.914 1.00 0.00 O ATOM 1284 CB GLU A 85 -18.567 0.005 4.430 1.00 0.00 C ATOM 1285 CG GLU A 85 -19.390 -0.103 5.721 1.00 0.00 C ATOM 1286 CD GLU A 85 -18.616 0.248 7.010 1.00 0.00 C ATOM 1287 OE1 GLU A 85 -17.607 0.989 6.970 1.00 0.00 O ATOM 1288 OE2 GLU A 85 -19.033 -0.226 8.093 1.00 0.00 O ATOM 0 H GLU A 85 -19.231 1.793 2.181 1.00 0.00 H new ATOM 0 HA GLU A 85 -18.109 2.038 4.879 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -19.112 -0.495 3.629 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -17.633 -0.539 4.568 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -20.254 0.556 5.641 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -19.772 -1.120 5.808 1.00 0.00 H new ATOM 1295 N THR A 86 -15.817 1.495 3.816 1.00 0.00 N ATOM 1296 CA THR A 86 -14.517 1.647 3.190 1.00 0.00 C ATOM 1297 C THR A 86 -13.521 0.804 3.990 1.00 0.00 C ATOM 1298 O THR A 86 -13.661 0.661 5.210 1.00 0.00 O ATOM 1299 CB THR A 86 -14.114 3.139 3.179 1.00 0.00 C ATOM 1300 OG1 THR A 86 -15.216 4.036 3.115 1.00 0.00 O ATOM 1301 CG2 THR A 86 -13.244 3.413 1.965 1.00 0.00 C ATOM 0 H THR A 86 -15.771 1.423 4.832 1.00 0.00 H new ATOM 0 HA THR A 86 -14.534 1.308 2.154 1.00 0.00 H new ATOM 0 HB THR A 86 -13.594 3.313 4.121 1.00 0.00 H new ATOM 0 HG1 THR A 86 -14.887 4.959 3.113 1.00 0.00 H new ATOM 0 HG21 THR A 86 -12.957 4.464 1.953 1.00 0.00 H new ATOM 0 HG22 THR A 86 -12.349 2.793 2.012 1.00 0.00 H new ATOM 0 HG23 THR A 86 -13.801 3.178 1.058 1.00 0.00 H new ATOM 1309 N SER A 87 -12.516 0.238 3.328 1.00 0.00 N ATOM 1310 CA SER A 87 -11.407 -0.466 3.956 1.00 0.00 C ATOM 1311 C SER A 87 -10.206 -0.422 3.015 1.00 0.00 C ATOM 1312 O SER A 87 -10.363 -0.304 1.797 1.00 0.00 O ATOM 1313 CB SER A 87 -11.806 -1.917 4.237 1.00 0.00 C ATOM 1314 OG SER A 87 -12.802 -1.993 5.239 1.00 0.00 O ATOM 0 H SER A 87 -12.451 0.258 2.310 1.00 0.00 H new ATOM 0 HA SER A 87 -11.149 0.011 4.902 1.00 0.00 H new ATOM 0 HB2 SER A 87 -12.173 -2.379 3.321 1.00 0.00 H new ATOM 0 HB3 SER A 87 -10.929 -2.483 4.550 1.00 0.00 H new ATOM 0 HG SER A 87 -13.182 -1.102 5.391 1.00 0.00 H new ATOM 1320 N VAL A 88 -9.002 -0.512 3.578 1.00 0.00 N ATOM 1321 CA VAL A 88 -7.752 -0.411 2.841 1.00 0.00 C ATOM 1322 C VAL A 88 -6.797 -1.459 3.421 1.00 0.00 C ATOM 1323 O VAL A 88 -5.849 -1.139 4.143 1.00 0.00 O ATOM 1324 CB VAL A 88 -7.218 1.041 2.879 1.00 0.00 C ATOM 1325 CG1 VAL A 88 -6.051 1.150 1.898 1.00 0.00 C ATOM 1326 CG2 VAL A 88 -8.253 2.110 2.493 1.00 0.00 C ATOM 0 H VAL A 88 -8.870 -0.660 4.579 1.00 0.00 H new ATOM 0 HA VAL A 88 -7.879 -0.626 1.780 1.00 0.00 H new ATOM 0 HB VAL A 88 -6.931 1.234 3.913 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -5.660 2.167 1.910 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -5.264 0.455 2.190 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -6.396 0.905 0.893 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -7.794 3.097 2.547 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -8.603 1.927 1.477 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -9.097 2.065 3.181 1.00 0.00 H new ATOM 1336 N GLY A 89 -7.089 -2.733 3.174 1.00 0.00 N ATOM 1337 CA GLY A 89 -6.358 -3.851 3.768 1.00 0.00 C ATOM 1338 C GLY A 89 -7.052 -5.182 3.508 1.00 0.00 C ATOM 1339 O GLY A 89 -8.248 -5.209 3.200 1.00 0.00 O ATOM 0 H GLY A 89 -7.844 -3.022 2.552 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -5.348 -3.882 3.361 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -6.264 -3.694 4.842 1.00 0.00 H new ATOM 1343 N PHE A 90 -6.314 -6.290 3.613 1.00 0.00 N ATOM 1344 CA PHE A 90 -6.849 -7.633 3.399 1.00 0.00 C ATOM 1345 C PHE A 90 -7.888 -7.986 4.472 1.00 0.00 C ATOM 1346 O PHE A 90 -7.718 -7.625 5.639 1.00 0.00 O ATOM 1347 CB PHE A 90 -5.707 -8.664 3.397 1.00 0.00 C ATOM 1348 CG PHE A 90 -6.191 -10.099 3.256 1.00 0.00 C ATOM 1349 CD1 PHE A 90 -6.721 -10.552 2.033 1.00 0.00 C ATOM 1350 CD2 PHE A 90 -6.198 -10.954 4.377 1.00 0.00 C ATOM 1351 CE1 PHE A 90 -7.273 -11.843 1.940 1.00 0.00 C ATOM 1352 CE2 PHE A 90 -6.733 -12.249 4.276 1.00 0.00 C ATOM 1353 CZ PHE A 90 -7.274 -12.694 3.058 1.00 0.00 C ATOM 0 H PHE A 90 -5.322 -6.278 3.851 1.00 0.00 H new ATOM 0 HA PHE A 90 -7.345 -7.655 2.429 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -5.023 -8.437 2.579 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -5.139 -8.569 4.323 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -6.704 -9.908 1.166 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -5.791 -10.612 5.317 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -7.697 -12.181 1.006 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -6.728 -12.903 5.135 1.00 0.00 H new ATOM 0 HZ PHE A 90 -7.690 -13.688 2.981 1.00 0.00 H new ATOM 1363 N LYS A 91 -8.921 -8.750 4.093 1.00 0.00 N ATOM 1364 CA LYS A 91 -9.894 -9.359 5.002 1.00 0.00 C ATOM 1365 C LYS A 91 -10.130 -10.802 4.536 1.00 0.00 C ATOM 1366 O LYS A 91 -10.227 -11.010 3.324 1.00 0.00 O ATOM 1367 CB LYS A 91 -11.243 -8.605 4.970 1.00 0.00 C ATOM 1368 CG LYS A 91 -11.473 -7.628 6.136 1.00 0.00 C ATOM 1369 CD LYS A 91 -10.857 -6.227 6.014 1.00 0.00 C ATOM 1370 CE LYS A 91 -11.540 -5.346 4.958 1.00 0.00 C ATOM 1371 NZ LYS A 91 -10.979 -5.513 3.590 1.00 0.00 N ATOM 0 H LYS A 91 -9.106 -8.967 3.114 1.00 0.00 H new ATOM 0 HA LYS A 91 -9.504 -9.320 6.019 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -11.310 -8.051 4.034 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -12.051 -9.337 4.965 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -12.548 -7.513 6.272 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -11.084 -8.089 7.044 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -10.913 -5.729 6.982 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -9.800 -6.324 5.766 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -12.605 -5.579 4.936 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -11.448 -4.301 5.254 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -11.092 -4.627 3.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -9.969 -5.751 3.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -11.484 -6.278 3.099 1.00 0.00 H new ATOM 1385 N PRO A 92 -10.279 -11.778 5.451 1.00 0.00 N ATOM 1386 CA PRO A 92 -10.719 -13.123 5.100 1.00 0.00 C ATOM 1387 C PRO A 92 -12.185 -13.109 4.645 1.00 0.00 C ATOM 1388 O PRO A 92 -12.898 -12.119 4.828 1.00 0.00 O ATOM 1389 CB PRO A 92 -10.507 -13.965 6.364 1.00 0.00 C ATOM 1390 CG PRO A 92 -10.679 -12.948 7.489 1.00 0.00 C ATOM 1391 CD PRO A 92 -10.075 -11.676 6.890 1.00 0.00 C ATOM 0 HA PRO A 92 -10.158 -13.539 4.263 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -11.234 -14.774 6.437 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -9.518 -14.423 6.382 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -11.727 -12.812 7.755 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -10.158 -13.255 8.396 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -10.560 -10.786 7.291 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -9.015 -11.596 7.130 1.00 0.00 H new ATOM 1399 N LYS A 93 -12.653 -14.232 4.089 1.00 0.00 N ATOM 1400 CA LYS A 93 -13.978 -14.362 3.471 1.00 0.00 C ATOM 1401 C LYS A 93 -15.094 -13.926 4.416 1.00 0.00 C ATOM 1402 O LYS A 93 -15.995 -13.197 4.006 1.00 0.00 O ATOM 1403 CB LYS A 93 -14.165 -15.817 2.980 1.00 0.00 C ATOM 1404 CG LYS A 93 -14.904 -15.970 1.639 1.00 0.00 C ATOM 1405 CD LYS A 93 -16.355 -15.464 1.574 1.00 0.00 C ATOM 1406 CE LYS A 93 -17.309 -16.027 2.646 1.00 0.00 C ATOM 1407 NZ LYS A 93 -17.498 -17.501 2.560 1.00 0.00 N ATOM 0 H LYS A 93 -12.110 -15.095 4.055 1.00 0.00 H new ATOM 0 HA LYS A 93 -14.038 -13.691 2.614 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -13.183 -16.281 2.890 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -14.711 -16.373 3.742 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -14.329 -15.447 0.875 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -14.902 -17.027 1.371 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -16.345 -14.377 1.658 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -16.760 -15.704 0.591 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -16.922 -15.776 3.633 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -18.279 -15.538 2.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -18.150 -17.812 3.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -17.896 -17.746 1.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -16.581 -17.976 2.680 1.00 0.00 H new ATOM 1421 N GLU A 94 -15.037 -14.355 5.676 1.00 0.00 N ATOM 1422 CA GLU A 94 -16.072 -14.042 6.649 1.00 0.00 C ATOM 1423 C GLU A 94 -16.079 -12.548 6.968 1.00 0.00 C ATOM 1424 O GLU A 94 -17.145 -11.943 7.040 1.00 0.00 O ATOM 1425 CB GLU A 94 -15.867 -14.844 7.939 1.00 0.00 C ATOM 1426 CG GLU A 94 -16.060 -16.353 7.728 1.00 0.00 C ATOM 1427 CD GLU A 94 -15.906 -17.131 9.047 1.00 0.00 C ATOM 1428 OE1 GLU A 94 -16.914 -17.331 9.764 1.00 0.00 O ATOM 1429 OE2 GLU A 94 -14.780 -17.569 9.376 1.00 0.00 O ATOM 0 H GLU A 94 -14.276 -14.925 6.045 1.00 0.00 H new ATOM 0 HA GLU A 94 -17.033 -14.316 6.213 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -14.864 -14.659 8.323 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -16.568 -14.493 8.697 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -17.048 -16.539 7.308 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -15.332 -16.716 7.003 1.00 0.00 H new ATOM 1436 N ALA A 95 -14.903 -11.935 7.127 1.00 0.00 N ATOM 1437 CA ALA A 95 -14.810 -10.511 7.403 1.00 0.00 C ATOM 1438 C ALA A 95 -15.305 -9.692 6.210 1.00 0.00 C ATOM 1439 O ALA A 95 -15.905 -8.638 6.400 1.00 0.00 O ATOM 1440 CB ALA A 95 -13.373 -10.141 7.765 1.00 0.00 C ATOM 0 H ALA A 95 -14.003 -12.410 7.068 1.00 0.00 H new ATOM 0 HA ALA A 95 -15.451 -10.277 8.253 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -13.313 -9.072 7.970 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -13.066 -10.698 8.650 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -12.713 -10.388 6.933 1.00 0.00 H new ATOM 1446 N LEU A 96 -15.087 -10.180 4.987 1.00 0.00 N ATOM 1447 CA LEU A 96 -15.588 -9.549 3.774 1.00 0.00 C ATOM 1448 C LEU A 96 -17.116 -9.566 3.772 1.00 0.00 C ATOM 1449 O LEU A 96 -17.772 -8.530 3.622 1.00 0.00 O ATOM 1450 CB LEU A 96 -15.041 -10.292 2.536 1.00 0.00 C ATOM 1451 CG LEU A 96 -14.627 -9.378 1.370 1.00 0.00 C ATOM 1452 CD1 LEU A 96 -15.654 -8.297 1.034 1.00 0.00 C ATOM 1453 CD2 LEU A 96 -13.271 -8.726 1.665 1.00 0.00 C ATOM 0 H LEU A 96 -14.553 -11.032 4.814 1.00 0.00 H new ATOM 0 HA LEU A 96 -15.250 -8.513 3.741 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -14.179 -10.887 2.837 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -15.801 -10.989 2.182 1.00 0.00 H new ATOM 0 HG LEU A 96 -14.559 -10.023 0.494 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -15.289 -7.694 0.202 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -16.598 -8.766 0.756 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -15.808 -7.659 1.904 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -12.988 -8.081 0.833 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -13.344 -8.132 2.576 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -12.516 -9.501 1.797 1.00 0.00 H new ATOM 1465 N GLN A 97 -17.683 -10.760 3.968 1.00 0.00 N ATOM 1466 CA GLN A 97 -19.120 -10.934 3.938 1.00 0.00 C ATOM 1467 C GLN A 97 -19.746 -10.121 5.063 1.00 0.00 C ATOM 1468 O GLN A 97 -20.767 -9.488 4.833 1.00 0.00 O ATOM 1469 CB GLN A 97 -19.501 -12.423 3.879 1.00 0.00 C ATOM 1470 CG GLN A 97 -19.836 -13.148 5.168 1.00 0.00 C ATOM 1471 CD GLN A 97 -20.262 -14.592 4.876 1.00 0.00 C ATOM 1472 OE1 GLN A 97 -19.527 -15.535 5.157 1.00 0.00 O ATOM 1473 NE2 GLN A 97 -21.427 -14.796 4.276 1.00 0.00 N ATOM 0 H GLN A 97 -17.159 -11.616 4.149 1.00 0.00 H new ATOM 0 HA GLN A 97 -19.546 -10.533 3.018 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -20.361 -12.517 3.216 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -18.675 -12.955 3.407 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -18.970 -13.145 5.830 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -20.637 -12.624 5.689 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -22.029 -14.005 4.048 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -21.721 -15.744 4.043 1.00 0.00 H new ATOM 1482 N GLU A 98 -19.103 -10.039 6.230 1.00 0.00 N ATOM 1483 CA GLU A 98 -19.542 -9.175 7.315 1.00 0.00 C ATOM 1484 C GLU A 98 -19.520 -7.700 6.900 1.00 0.00 C ATOM 1485 O GLU A 98 -20.510 -6.999 7.118 1.00 0.00 O ATOM 1486 CB GLU A 98 -18.693 -9.447 8.565 1.00 0.00 C ATOM 1487 CG GLU A 98 -19.088 -8.554 9.747 1.00 0.00 C ATOM 1488 CD GLU A 98 -18.331 -8.944 11.029 1.00 0.00 C ATOM 1489 OE1 GLU A 98 -17.220 -8.418 11.271 1.00 0.00 O ATOM 1490 OE2 GLU A 98 -18.847 -9.765 11.821 1.00 0.00 O ATOM 0 H GLU A 98 -18.261 -10.574 6.444 1.00 0.00 H new ATOM 0 HA GLU A 98 -20.580 -9.404 7.557 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -18.799 -10.493 8.852 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -17.641 -9.287 8.328 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -18.879 -7.512 9.503 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -20.161 -8.632 9.920 1.00 0.00 H new ATOM 1497 N LEU A 99 -18.431 -7.240 6.270 1.00 0.00 N ATOM 1498 CA LEU A 99 -18.213 -5.844 5.889 1.00 0.00 C ATOM 1499 C LEU A 99 -19.336 -5.314 4.996 1.00 0.00 C ATOM 1500 O LEU A 99 -19.633 -4.123 5.038 1.00 0.00 O ATOM 1501 CB LEU A 99 -16.854 -5.692 5.188 1.00 0.00 C ATOM 1502 CG LEU A 99 -16.516 -4.258 4.732 1.00 0.00 C ATOM 1503 CD1 LEU A 99 -16.469 -3.262 5.897 1.00 0.00 C ATOM 1504 CD2 LEU A 99 -15.168 -4.264 4.006 1.00 0.00 C ATOM 0 H LEU A 99 -17.657 -7.849 6.005 1.00 0.00 H new ATOM 0 HA LEU A 99 -18.214 -5.249 6.802 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -16.072 -6.036 5.865 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -16.835 -6.348 4.318 1.00 0.00 H new ATOM 0 HG LEU A 99 -17.312 -3.931 4.063 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -16.227 -2.269 5.517 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -17.440 -3.235 6.392 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -15.707 -3.573 6.611 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -14.925 -3.252 3.682 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -14.392 -4.625 4.682 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -15.226 -4.919 3.137 1.00 0.00 H new ATOM 1516 N VAL A 100 -19.974 -6.190 4.222 1.00 0.00 N ATOM 1517 CA VAL A 100 -21.113 -5.796 3.393 1.00 0.00 C ATOM 1518 C VAL A 100 -22.451 -6.176 4.039 1.00 0.00 C ATOM 1519 O VAL A 100 -23.374 -5.360 4.069 1.00 0.00 O ATOM 1520 CB VAL A 100 -20.918 -6.288 1.954 1.00 0.00 C ATOM 1521 CG1 VAL A 100 -20.775 -7.808 1.792 1.00 0.00 C ATOM 1522 CG2 VAL A 100 -22.014 -5.772 1.016 1.00 0.00 C ATOM 0 H VAL A 100 -19.723 -7.176 4.151 1.00 0.00 H new ATOM 0 HA VAL A 100 -21.156 -4.709 3.329 1.00 0.00 H new ATOM 0 HB VAL A 100 -19.956 -5.861 1.671 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -20.642 -8.051 0.738 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -19.909 -8.154 2.356 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -21.673 -8.300 2.167 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -21.835 -6.145 0.008 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -22.986 -6.121 1.365 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -22.002 -4.682 1.007 1.00 0.00 H new ATOM 1532 N ASN A 101 -22.568 -7.372 4.627 1.00 0.00 N ATOM 1533 CA ASN A 101 -23.803 -7.868 5.243 1.00 0.00 C ATOM 1534 C ASN A 101 -24.316 -6.932 6.338 1.00 0.00 C ATOM 1535 O ASN A 101 -25.521 -6.870 6.574 1.00 0.00 O ATOM 1536 CB ASN A 101 -23.601 -9.278 5.807 1.00 0.00 C ATOM 1537 CG ASN A 101 -24.883 -9.801 6.444 1.00 0.00 C ATOM 1538 OD1 ASN A 101 -25.774 -10.296 5.761 1.00 0.00 O ATOM 1539 ND2 ASN A 101 -25.008 -9.696 7.756 1.00 0.00 N ATOM 0 H ASN A 101 -21.794 -8.033 4.689 1.00 0.00 H new ATOM 0 HA ASN A 101 -24.558 -7.903 4.458 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -23.286 -9.951 5.009 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -22.801 -9.266 6.548 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -25.855 -10.029 8.216 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -24.257 -9.282 8.308 1.00 0.00 H new ATOM 1546 N LYS A 102 -23.424 -6.182 6.996 1.00 0.00 N ATOM 1547 CA LYS A 102 -23.811 -5.240 8.049 1.00 0.00 C ATOM 1548 C LYS A 102 -24.781 -4.156 7.559 1.00 0.00 C ATOM 1549 O LYS A 102 -25.494 -3.585 8.385 1.00 0.00 O ATOM 1550 CB LYS A 102 -22.554 -4.644 8.703 1.00 0.00 C ATOM 1551 CG LYS A 102 -21.859 -3.577 7.836 1.00 0.00 C ATOM 1552 CD LYS A 102 -20.338 -3.606 7.969 1.00 0.00 C ATOM 1553 CE LYS A 102 -19.783 -3.473 9.381 1.00 0.00 C ATOM 1554 NZ LYS A 102 -19.929 -2.102 9.928 1.00 0.00 N ATOM 0 H LYS A 102 -22.421 -6.211 6.814 1.00 0.00 H new ATOM 0 HA LYS A 102 -24.366 -5.796 8.805 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -22.827 -4.201 9.661 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -21.848 -5.447 8.913 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -22.131 -3.730 6.792 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -22.225 -2.590 8.119 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -19.975 -4.542 7.545 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -19.926 -2.800 7.362 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -20.296 -4.177 10.036 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -18.728 -3.749 9.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -19.389 -2.022 10.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -19.567 -1.413 9.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -20.933 -1.908 10.116 1.00 0.00 H new ATOM 1568 N HIS A 103 -24.820 -3.869 6.250 1.00 0.00 N ATOM 1569 CA HIS A 103 -25.637 -2.804 5.671 1.00 0.00 C ATOM 1570 C HIS A 103 -26.457 -3.255 4.451 1.00 0.00 C ATOM 1571 O HIS A 103 -27.367 -2.538 4.031 1.00 0.00 O ATOM 1572 CB HIS A 103 -24.708 -1.632 5.333 1.00 0.00 C ATOM 1573 CG HIS A 103 -23.747 -1.907 4.205 1.00 0.00 C ATOM 1574 ND1 HIS A 103 -24.078 -2.099 2.882 1.00 0.00 N ATOM 1575 CD2 HIS A 103 -22.383 -2.000 4.292 1.00 0.00 C ATOM 1576 CE1 HIS A 103 -22.946 -2.275 2.193 1.00 0.00 C ATOM 1577 NE2 HIS A 103 -21.884 -2.213 3.009 1.00 0.00 N ATOM 0 H HIS A 103 -24.275 -4.381 5.557 1.00 0.00 H new ATOM 0 HA HIS A 103 -26.385 -2.499 6.403 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -25.316 -0.765 5.074 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -24.138 -1.367 6.224 1.00 0.00 H new ATOM 0 HD1 HIS A 103 -25.022 -2.106 2.495 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -21.798 -1.922 5.196 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -22.894 -2.444 1.128 1.00 0.00 H new ATOM 1585 N LEU A 104 -26.116 -4.398 3.848 1.00 0.00 N ATOM 1586 CA LEU A 104 -26.901 -5.089 2.832 1.00 0.00 C ATOM 1587 C LEU A 104 -28.206 -5.484 3.529 1.00 0.00 C ATOM 1588 O LEU A 104 -28.158 -6.144 4.589 1.00 0.00 O ATOM 1589 CB LEU A 104 -26.083 -6.303 2.367 1.00 0.00 C ATOM 1590 CG LEU A 104 -26.881 -7.449 1.739 1.00 0.00 C ATOM 1591 CD1 LEU A 104 -27.642 -7.005 0.488 1.00 0.00 C ATOM 1592 CD2 LEU A 104 -25.911 -8.578 1.388 1.00 0.00 C ATOM 1593 OXT LEU A 104 -29.284 -5.116 3.023 1.00 0.00 O ATOM 0 H LEU A 104 -25.247 -4.884 4.067 1.00 0.00 H new ATOM 0 HA LEU A 104 -27.128 -4.492 1.949 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -25.343 -5.962 1.643 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -25.534 -6.695 3.223 1.00 0.00 H new ATOM 0 HG LEU A 104 -27.625 -7.789 2.459 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -28.193 -7.851 0.078 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -28.340 -6.210 0.750 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -26.936 -6.637 -0.256 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -26.462 -9.404 0.939 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -25.167 -8.211 0.681 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -25.412 -8.924 2.293 1.00 0.00 H new TER 1605 LEU A 104 ATOM 1606 N MET B 1 7.922 27.787 -11.323 1.00 0.00 N ATOM 1607 CA MET B 1 6.878 28.169 -10.342 1.00 0.00 C ATOM 1608 C MET B 1 7.484 28.008 -8.944 1.00 0.00 C ATOM 1609 O MET B 1 8.133 26.998 -8.670 1.00 0.00 O ATOM 1610 CB MET B 1 5.592 27.330 -10.525 1.00 0.00 C ATOM 1611 CG MET B 1 4.318 28.017 -10.009 1.00 0.00 C ATOM 1612 SD MET B 1 4.158 28.229 -8.212 1.00 0.00 S ATOM 1613 CE MET B 1 2.528 29.019 -8.139 1.00 0.00 C ATOM 0 H1 MET B 1 7.484 27.273 -12.114 1.00 0.00 H new ATOM 0 H2 MET B 1 8.390 28.643 -11.683 1.00 0.00 H new ATOM 0 H3 MET B 1 8.626 27.176 -10.861 1.00 0.00 H new ATOM 0 HA MET B 1 6.572 29.204 -10.493 1.00 0.00 H new ATOM 0 HB2 MET B 1 5.466 27.103 -11.584 1.00 0.00 H new ATOM 0 HB3 MET B 1 5.715 26.379 -10.007 1.00 0.00 H new ATOM 0 HG2 MET B 1 4.254 29.002 -10.472 1.00 0.00 H new ATOM 0 HG3 MET B 1 3.460 27.444 -10.359 1.00 0.00 H new ATOM 0 HE1 MET B 1 2.268 29.222 -7.100 1.00 0.00 H new ATOM 0 HE2 MET B 1 2.552 29.955 -8.697 1.00 0.00 H new ATOM 0 HE3 MET B 1 1.782 28.355 -8.576 1.00 0.00 H new ATOM 1625 N GLU B 2 7.326 28.991 -8.054 1.00 0.00 N ATOM 1626 CA GLU B 2 8.029 29.053 -6.766 1.00 0.00 C ATOM 1627 C GLU B 2 7.420 28.142 -5.685 1.00 0.00 C ATOM 1628 O GLU B 2 7.623 28.362 -4.492 1.00 0.00 O ATOM 1629 CB GLU B 2 8.119 30.519 -6.302 1.00 0.00 C ATOM 1630 CG GLU B 2 8.906 31.407 -7.279 1.00 0.00 C ATOM 1631 CD GLU B 2 9.048 32.844 -6.746 1.00 0.00 C ATOM 1632 OE1 GLU B 2 8.153 33.684 -6.996 1.00 0.00 O ATOM 1633 OE2 GLU B 2 10.066 33.158 -6.088 1.00 0.00 O ATOM 0 H GLU B 2 6.697 29.779 -8.208 1.00 0.00 H new ATOM 0 HA GLU B 2 9.034 28.662 -6.922 1.00 0.00 H new ATOM 0 HB2 GLU B 2 7.112 30.920 -6.184 1.00 0.00 H new ATOM 0 HB3 GLU B 2 8.594 30.556 -5.322 1.00 0.00 H new ATOM 0 HG2 GLU B 2 9.895 30.980 -7.445 1.00 0.00 H new ATOM 0 HG3 GLU B 2 8.401 31.424 -8.245 1.00 0.00 H new ATOM 1640 N ASN B 3 6.669 27.122 -6.089 1.00 0.00 N ATOM 1641 CA ASN B 3 6.168 26.020 -5.295 1.00 0.00 C ATOM 1642 C ASN B 3 5.957 24.913 -6.304 1.00 0.00 C ATOM 1643 O ASN B 3 5.322 25.061 -7.348 1.00 0.00 O ATOM 1644 CB ASN B 3 4.843 26.253 -4.552 1.00 0.00 C ATOM 1645 CG ASN B 3 4.958 26.503 -3.049 1.00 0.00 C ATOM 1646 OD1 ASN B 3 4.126 26.032 -2.279 1.00 0.00 O ATOM 1647 ND2 ASN B 3 5.962 27.220 -2.580 1.00 0.00 N ATOM 0 H ASN B 3 6.374 27.045 -7.062 1.00 0.00 H new ATOM 0 HA ASN B 3 6.883 25.823 -4.496 1.00 0.00 H new ATOM 0 HB2 ASN B 3 4.339 27.107 -5.006 1.00 0.00 H new ATOM 0 HB3 ASN B 3 4.203 25.385 -4.709 1.00 0.00 H new ATOM 0 HD21 ASN B 3 6.047 27.383 -1.577 1.00 0.00 H new ATOM 0 HD22 ASN B 3 6.653 27.611 -3.221 1.00 0.00 H new ATOM 1654 N LYS B 4 6.536 23.800 -5.920 1.00 0.00 N ATOM 1655 CA LYS B 4 6.652 22.525 -6.595 1.00 0.00 C ATOM 1656 C LYS B 4 6.662 21.498 -5.475 1.00 0.00 C ATOM 1657 O LYS B 4 7.205 21.784 -4.404 1.00 0.00 O ATOM 1658 CB LYS B 4 7.960 22.485 -7.403 1.00 0.00 C ATOM 1659 CG LYS B 4 7.945 23.519 -8.540 1.00 0.00 C ATOM 1660 CD LYS B 4 9.254 23.611 -9.315 1.00 0.00 C ATOM 1661 CE LYS B 4 10.395 24.193 -8.472 1.00 0.00 C ATOM 1662 NZ LYS B 4 11.633 24.372 -9.272 1.00 0.00 N ATOM 0 H LYS B 4 6.996 23.762 -5.010 1.00 0.00 H new ATOM 0 HA LYS B 4 5.843 22.338 -7.301 1.00 0.00 H new ATOM 0 HB2 LYS B 4 8.804 22.680 -6.742 1.00 0.00 H new ATOM 0 HB3 LYS B 4 8.104 21.487 -7.818 1.00 0.00 H new ATOM 0 HG2 LYS B 4 7.142 23.269 -9.233 1.00 0.00 H new ATOM 0 HG3 LYS B 4 7.713 24.499 -8.123 1.00 0.00 H new ATOM 0 HD2 LYS B 4 9.535 22.618 -9.666 1.00 0.00 H new ATOM 0 HD3 LYS B 4 9.106 24.231 -10.199 1.00 0.00 H new ATOM 0 HE2 LYS B 4 10.088 25.153 -8.057 1.00 0.00 H new ATOM 0 HE3 LYS B 4 10.599 23.532 -7.629 1.00 0.00 H new ATOM 0 HZ1 LYS B 4 12.421 24.621 -8.641 1.00 0.00 H new ATOM 0 HZ2 LYS B 4 11.855 23.487 -9.771 1.00 0.00 H new ATOM 0 HZ3 LYS B 4 11.491 25.134 -9.966 1.00 0.00 H new ATOM 1676 N ILE B 5 6.066 20.331 -5.685 1.00 0.00 N ATOM 1677 CA ILE B 5 5.825 19.380 -4.611 1.00 0.00 C ATOM 1678 C ILE B 5 6.499 18.067 -4.966 1.00 0.00 C ATOM 1679 O ILE B 5 6.476 17.632 -6.118 1.00 0.00 O ATOM 1680 CB ILE B 5 4.303 19.277 -4.362 1.00 0.00 C ATOM 1681 CG1 ILE B 5 3.776 20.678 -3.969 1.00 0.00 C ATOM 1682 CG2 ILE B 5 3.970 18.182 -3.332 1.00 0.00 C ATOM 1683 CD1 ILE B 5 2.479 20.695 -3.169 1.00 0.00 C ATOM 0 H ILE B 5 5.738 20.020 -6.599 1.00 0.00 H new ATOM 0 HA ILE B 5 6.262 19.704 -3.666 1.00 0.00 H new ATOM 0 HB ILE B 5 3.792 18.965 -5.273 1.00 0.00 H new ATOM 0 HG12 ILE B 5 4.546 21.186 -3.389 1.00 0.00 H new ATOM 0 HG13 ILE B 5 3.628 21.259 -4.879 1.00 0.00 H new ATOM 0 HG21 ILE B 5 2.891 18.139 -3.183 1.00 0.00 H new ATOM 0 HG22 ILE B 5 4.324 17.218 -3.698 1.00 0.00 H new ATOM 0 HG23 ILE B 5 4.458 18.412 -2.385 1.00 0.00 H new ATOM 0 HD11 ILE B 5 2.201 21.726 -2.948 1.00 0.00 H new ATOM 0 HD12 ILE B 5 1.687 20.223 -3.750 1.00 0.00 H new ATOM 0 HD13 ILE B 5 2.620 20.149 -2.236 1.00 0.00 H new ATOM 1695 N ILE B 6 7.063 17.418 -3.957 1.00 0.00 N ATOM 1696 CA ILE B 6 7.729 16.129 -4.075 1.00 0.00 C ATOM 1697 C ILE B 6 7.369 15.324 -2.824 1.00 0.00 C ATOM 1698 O ILE B 6 7.263 15.862 -1.716 1.00 0.00 O ATOM 1699 CB ILE B 6 9.247 16.321 -4.342 1.00 0.00 C ATOM 1700 CG1 ILE B 6 9.957 14.952 -4.470 1.00 0.00 C ATOM 1701 CG2 ILE B 6 9.918 17.248 -3.310 1.00 0.00 C ATOM 1702 CD1 ILE B 6 11.444 15.049 -4.825 1.00 0.00 C ATOM 0 H ILE B 6 7.070 17.785 -3.005 1.00 0.00 H new ATOM 0 HA ILE B 6 7.391 15.555 -4.938 1.00 0.00 H new ATOM 0 HB ILE B 6 9.352 16.834 -5.298 1.00 0.00 H new ATOM 0 HG12 ILE B 6 9.854 14.412 -3.529 1.00 0.00 H new ATOM 0 HG13 ILE B 6 9.450 14.362 -5.233 1.00 0.00 H new ATOM 0 HG21 ILE B 6 10.978 17.347 -3.545 1.00 0.00 H new ATOM 0 HG22 ILE B 6 9.446 18.230 -3.342 1.00 0.00 H new ATOM 0 HG23 ILE B 6 9.805 16.824 -2.312 1.00 0.00 H new ATOM 0 HD11 ILE B 6 11.867 14.047 -4.896 1.00 0.00 H new ATOM 0 HD12 ILE B 6 11.557 15.559 -5.782 1.00 0.00 H new ATOM 0 HD13 ILE B 6 11.967 15.610 -4.051 1.00 0.00 H new ATOM 1714 N TYR B 7 7.141 14.031 -3.019 1.00 0.00 N ATOM 1715 CA TYR B 7 6.584 13.140 -2.021 1.00 0.00 C ATOM 1716 C TYR B 7 7.587 12.018 -1.806 1.00 0.00 C ATOM 1717 O TYR B 7 8.170 11.522 -2.772 1.00 0.00 O ATOM 1718 CB TYR B 7 5.241 12.616 -2.559 1.00 0.00 C ATOM 1719 CG TYR B 7 4.226 12.234 -1.505 1.00 0.00 C ATOM 1720 CD1 TYR B 7 3.399 13.232 -0.955 1.00 0.00 C ATOM 1721 CD2 TYR B 7 4.051 10.891 -1.124 1.00 0.00 C ATOM 1722 CE1 TYR B 7 2.396 12.890 -0.036 1.00 0.00 C ATOM 1723 CE2 TYR B 7 3.019 10.542 -0.238 1.00 0.00 C ATOM 1724 CZ TYR B 7 2.187 11.539 0.313 1.00 0.00 C ATOM 1725 OH TYR B 7 1.172 11.197 1.153 1.00 0.00 O ATOM 0 H TYR B 7 7.346 13.565 -3.903 1.00 0.00 H new ATOM 0 HA TYR B 7 6.402 13.634 -1.066 1.00 0.00 H new ATOM 0 HB2 TYR B 7 4.803 13.380 -3.201 1.00 0.00 H new ATOM 0 HB3 TYR B 7 5.435 11.745 -3.186 1.00 0.00 H new ATOM 0 HD1 TYR B 7 3.537 14.264 -1.242 1.00 0.00 H new ATOM 0 HD2 TYR B 7 4.710 10.129 -1.513 1.00 0.00 H new ATOM 0 HE1 TYR B 7 1.783 13.662 0.405 1.00 0.00 H new ATOM 0 HE2 TYR B 7 2.862 9.506 0.023 1.00 0.00 H new ATOM 0 HH TYR B 7 0.547 11.948 1.234 1.00 0.00 H new ATOM 1735 N PHE B 8 7.775 11.600 -0.560 1.00 0.00 N ATOM 1736 CA PHE B 8 8.661 10.511 -0.182 1.00 0.00 C ATOM 1737 C PHE B 8 7.776 9.500 0.541 1.00 0.00 C ATOM 1738 O PHE B 8 6.948 9.884 1.375 1.00 0.00 O ATOM 1739 CB PHE B 8 9.832 11.050 0.646 1.00 0.00 C ATOM 1740 CG PHE B 8 10.803 11.899 -0.161 1.00 0.00 C ATOM 1741 CD1 PHE B 8 10.559 13.268 -0.379 1.00 0.00 C ATOM 1742 CD2 PHE B 8 11.934 11.304 -0.747 1.00 0.00 C ATOM 1743 CE1 PHE B 8 11.429 14.017 -1.195 1.00 0.00 C ATOM 1744 CE2 PHE B 8 12.823 12.063 -1.524 1.00 0.00 C ATOM 1745 CZ PHE B 8 12.555 13.414 -1.771 1.00 0.00 C ATOM 0 H PHE B 8 7.300 12.023 0.237 1.00 0.00 H new ATOM 0 HA PHE B 8 9.138 10.019 -1.029 1.00 0.00 H new ATOM 0 HB2 PHE B 8 9.440 11.645 1.471 1.00 0.00 H new ATOM 0 HB3 PHE B 8 10.373 10.212 1.086 1.00 0.00 H new ATOM 0 HD1 PHE B 8 9.705 13.744 0.079 1.00 0.00 H new ATOM 0 HD2 PHE B 8 12.121 10.251 -0.598 1.00 0.00 H new ATOM 0 HE1 PHE B 8 11.227 15.062 -1.378 1.00 0.00 H new ATOM 0 HE2 PHE B 8 13.713 11.605 -1.931 1.00 0.00 H new ATOM 0 HZ PHE B 8 13.214 13.990 -2.404 1.00 0.00 H new ATOM 1755 N LEU B 9 7.900 8.220 0.184 1.00 0.00 N ATOM 1756 CA LEU B 9 6.961 7.192 0.603 1.00 0.00 C ATOM 1757 C LEU B 9 7.721 5.924 0.975 1.00 0.00 C ATOM 1758 O LEU B 9 8.370 5.347 0.102 1.00 0.00 O ATOM 1759 CB LEU B 9 6.015 6.988 -0.597 1.00 0.00 C ATOM 1760 CG LEU B 9 4.905 5.940 -0.427 1.00 0.00 C ATOM 1761 CD1 LEU B 9 4.023 6.235 0.786 1.00 0.00 C ATOM 1762 CD2 LEU B 9 4.037 5.953 -1.693 1.00 0.00 C ATOM 0 H LEU B 9 8.657 7.872 -0.405 1.00 0.00 H new ATOM 0 HA LEU B 9 6.389 7.469 1.489 1.00 0.00 H new ATOM 0 HB2 LEU B 9 5.547 7.945 -0.829 1.00 0.00 H new ATOM 0 HB3 LEU B 9 6.617 6.709 -1.462 1.00 0.00 H new ATOM 0 HG LEU B 9 5.368 4.966 -0.271 1.00 0.00 H new ATOM 0 HD11 LEU B 9 3.251 5.470 0.869 1.00 0.00 H new ATOM 0 HD12 LEU B 9 4.634 6.234 1.689 1.00 0.00 H new ATOM 0 HD13 LEU B 9 3.554 7.212 0.666 1.00 0.00 H new ATOM 0 HD21 LEU B 9 3.240 5.215 -1.596 1.00 0.00 H new ATOM 0 HD22 LEU B 9 3.601 6.943 -1.825 1.00 0.00 H new ATOM 0 HD23 LEU B 9 4.653 5.710 -2.559 1.00 0.00 H new ATOM 1774 N SER B 10 7.649 5.497 2.239 1.00 0.00 N ATOM 1775 CA SER B 10 8.405 4.362 2.765 1.00 0.00 C ATOM 1776 C SER B 10 7.549 3.529 3.723 1.00 0.00 C ATOM 1777 O SER B 10 6.683 4.075 4.409 1.00 0.00 O ATOM 1778 CB SER B 10 9.698 4.836 3.462 1.00 0.00 C ATOM 1779 OG SER B 10 9.630 6.157 3.989 1.00 0.00 O ATOM 0 H SER B 10 7.052 5.940 2.937 1.00 0.00 H new ATOM 0 HA SER B 10 8.685 3.729 1.923 1.00 0.00 H new ATOM 0 HB2 SER B 10 9.934 4.146 4.272 1.00 0.00 H new ATOM 0 HB3 SER B 10 10.521 4.784 2.749 1.00 0.00 H new ATOM 0 HG SER B 10 9.713 6.125 4.965 1.00 0.00 H new ATOM 1785 N THR B 11 7.832 2.220 3.791 1.00 0.00 N ATOM 1786 CA THR B 11 7.152 1.240 4.636 1.00 0.00 C ATOM 1787 C THR B 11 6.952 1.773 6.058 1.00 0.00 C ATOM 1788 O THR B 11 7.895 1.851 6.848 1.00 0.00 O ATOM 1789 CB THR B 11 7.905 -0.107 4.589 1.00 0.00 C ATOM 1790 OG1 THR B 11 7.909 -0.648 3.275 1.00 0.00 O ATOM 1791 CG2 THR B 11 7.242 -1.151 5.484 1.00 0.00 C ATOM 0 H THR B 11 8.575 1.802 3.232 1.00 0.00 H new ATOM 0 HA THR B 11 6.150 1.062 4.246 1.00 0.00 H new ATOM 0 HB THR B 11 8.919 0.105 4.929 1.00 0.00 H new ATOM 0 HG1 THR B 11 8.754 -0.425 2.832 1.00 0.00 H new ATOM 0 HG21 THR B 11 7.799 -2.086 5.426 1.00 0.00 H new ATOM 0 HG22 THR B 11 7.236 -0.796 6.514 1.00 0.00 H new ATOM 0 HG23 THR B 11 6.217 -1.317 5.151 1.00 0.00 H new ATOM 1799 N GLY B 12 5.698 2.125 6.362 1.00 0.00 N ATOM 1800 CA GLY B 12 5.248 2.579 7.675 1.00 0.00 C ATOM 1801 C GLY B 12 6.097 3.738 8.177 1.00 0.00 C ATOM 1802 O GLY B 12 6.441 3.775 9.358 1.00 0.00 O ATOM 0 H GLY B 12 4.945 2.099 5.674 1.00 0.00 H new ATOM 0 HA2 GLY B 12 4.204 2.887 7.618 1.00 0.00 H new ATOM 0 HA3 GLY B 12 5.298 1.754 8.385 1.00 0.00 H new ATOM 1806 N ASN B 13 6.454 4.639 7.255 1.00 0.00 N ATOM 1807 CA ASN B 13 7.448 5.684 7.472 1.00 0.00 C ATOM 1808 C ASN B 13 7.439 6.353 8.845 1.00 0.00 C ATOM 1809 O ASN B 13 6.460 6.977 9.267 1.00 0.00 O ATOM 1810 CB ASN B 13 7.380 6.803 6.428 1.00 0.00 C ATOM 1811 CG ASN B 13 8.484 7.812 6.729 1.00 0.00 C ATOM 1812 OD1 ASN B 13 9.668 7.503 6.609 1.00 0.00 O ATOM 1813 ND2 ASN B 13 8.152 8.996 7.218 1.00 0.00 N ATOM 0 H ASN B 13 6.049 4.658 6.319 1.00 0.00 H new ATOM 0 HA ASN B 13 8.372 5.113 7.385 1.00 0.00 H new ATOM 0 HB2 ASN B 13 7.504 6.394 5.425 1.00 0.00 H new ATOM 0 HB3 ASN B 13 6.405 7.289 6.456 1.00 0.00 H new ATOM 0 HD21 ASN B 13 8.879 9.655 7.496 1.00 0.00 H new ATOM 0 HD22 ASN B 13 7.169 9.250 7.316 1.00 0.00 H new ATOM 1820 N SER B 14 8.617 6.313 9.453 1.00 0.00 N ATOM 1821 CA SER B 14 8.988 7.056 10.638 1.00 0.00 C ATOM 1822 C SER B 14 10.444 7.527 10.503 1.00 0.00 C ATOM 1823 O SER B 14 10.924 8.252 11.371 1.00 0.00 O ATOM 1824 CB SER B 14 8.775 6.171 11.874 1.00 0.00 C ATOM 1825 OG SER B 14 9.453 4.930 11.737 1.00 0.00 O ATOM 0 H SER B 14 9.378 5.727 9.109 1.00 0.00 H new ATOM 0 HA SER B 14 8.363 7.942 10.753 1.00 0.00 H new ATOM 0 HB2 SER B 14 9.135 6.689 12.763 1.00 0.00 H new ATOM 0 HB3 SER B 14 7.709 5.993 12.018 1.00 0.00 H new ATOM 0 HG SER B 14 9.303 4.385 12.538 1.00 0.00 H new ATOM 1831 N ALA B 15 11.151 7.153 9.425 1.00 0.00 N ATOM 1832 CA ALA B 15 12.586 7.338 9.282 1.00 0.00 C ATOM 1833 C ALA B 15 12.990 7.838 7.895 1.00 0.00 C ATOM 1834 O ALA B 15 13.214 9.037 7.758 1.00 0.00 O ATOM 1835 CB ALA B 15 13.319 6.044 9.670 1.00 0.00 C ATOM 0 H ALA B 15 10.722 6.704 8.616 1.00 0.00 H new ATOM 0 HA ALA B 15 12.889 8.129 9.968 1.00 0.00 H new ATOM 0 HB1 ALA B 15 14.394 6.188 9.561 1.00 0.00 H new ATOM 0 HB2 ALA B 15 13.090 5.792 10.705 1.00 0.00 H new ATOM 0 HB3 ALA B 15 12.994 5.232 9.019 1.00 0.00 H new ATOM 1841 N ARG B 16 13.089 6.983 6.862 1.00 0.00 N ATOM 1842 CA ARG B 16 13.699 7.401 5.587 1.00 0.00 C ATOM 1843 C ARG B 16 13.088 8.683 5.023 1.00 0.00 C ATOM 1844 O ARG B 16 13.842 9.555 4.596 1.00 0.00 O ATOM 1845 CB ARG B 16 13.682 6.287 4.516 1.00 0.00 C ATOM 1846 CG ARG B 16 14.778 5.233 4.735 1.00 0.00 C ATOM 1847 CD ARG B 16 15.148 4.387 3.497 1.00 0.00 C ATOM 1848 NE ARG B 16 15.706 5.156 2.360 1.00 0.00 N ATOM 1849 CZ ARG B 16 16.686 4.761 1.528 1.00 0.00 C ATOM 1850 NH1 ARG B 16 17.283 3.584 1.640 1.00 0.00 N ATOM 1851 NH2 ARG B 16 17.105 5.536 0.537 1.00 0.00 N ATOM 0 H ARG B 16 12.762 6.017 6.882 1.00 0.00 H new ATOM 0 HA ARG B 16 14.740 7.610 5.836 1.00 0.00 H new ATOM 0 HB2 ARG B 16 12.708 5.798 4.522 1.00 0.00 H new ATOM 0 HB3 ARG B 16 13.807 6.735 3.530 1.00 0.00 H new ATOM 0 HG2 ARG B 16 15.677 5.738 5.089 1.00 0.00 H new ATOM 0 HG3 ARG B 16 14.456 4.560 5.530 1.00 0.00 H new ATOM 0 HD2 ARG B 16 15.873 3.630 3.796 1.00 0.00 H new ATOM 0 HD3 ARG B 16 14.258 3.858 3.157 1.00 0.00 H new ATOM 0 HE ARG B 16 15.306 6.079 2.191 1.00 0.00 H new ATOM 0 HH11 ARG B 16 17.003 2.938 2.379 1.00 0.00 H new ATOM 0 HH12 ARG B 16 18.022 3.323 0.988 1.00 0.00 H new ATOM 0 HH21 ARG B 16 16.682 6.453 0.393 1.00 0.00 H new ATOM 0 HH22 ARG B 16 17.850 5.215 -0.081 1.00 0.00 H new ATOM 1865 N SER B 17 11.767 8.852 5.052 1.00 0.00 N ATOM 1866 CA SER B 17 11.173 10.052 4.474 1.00 0.00 C ATOM 1867 C SER B 17 11.361 11.281 5.381 1.00 0.00 C ATOM 1868 O SER B 17 11.428 12.392 4.858 1.00 0.00 O ATOM 1869 CB SER B 17 9.721 9.798 4.066 1.00 0.00 C ATOM 1870 OG SER B 17 9.619 8.757 3.113 1.00 0.00 O ATOM 0 H SER B 17 11.104 8.192 5.458 1.00 0.00 H new ATOM 0 HA SER B 17 11.709 10.295 3.556 1.00 0.00 H new ATOM 0 HB2 SER B 17 9.135 9.542 4.948 1.00 0.00 H new ATOM 0 HB3 SER B 17 9.294 10.712 3.653 1.00 0.00 H new ATOM 0 HG SER B 17 9.509 7.900 3.575 1.00 0.00 H new ATOM 1876 N GLN B 18 11.530 11.113 6.704 1.00 0.00 N ATOM 1877 CA GLN B 18 11.933 12.201 7.606 1.00 0.00 C ATOM 1878 C GLN B 18 13.310 12.713 7.205 1.00 0.00 C ATOM 1879 O GLN B 18 13.547 13.921 7.120 1.00 0.00 O ATOM 1880 CB GLN B 18 12.064 11.739 9.074 1.00 0.00 C ATOM 1881 CG GLN B 18 10.764 11.358 9.790 1.00 0.00 C ATOM 1882 CD GLN B 18 9.828 12.556 9.955 1.00 0.00 C ATOM 1883 OE1 GLN B 18 10.199 13.697 9.700 1.00 0.00 O ATOM 1884 NE2 GLN B 18 8.598 12.347 10.368 1.00 0.00 N ATOM 0 H GLN B 18 11.391 10.219 7.176 1.00 0.00 H new ATOM 0 HA GLN B 18 11.158 12.963 7.526 1.00 0.00 H new ATOM 0 HB2 GLN B 18 12.734 10.879 9.103 1.00 0.00 H new ATOM 0 HB3 GLN B 18 12.545 12.536 9.641 1.00 0.00 H new ATOM 0 HG2 GLN B 18 10.256 10.576 9.226 1.00 0.00 H new ATOM 0 HG3 GLN B 18 10.998 10.943 10.770 1.00 0.00 H new ATOM 0 HE21 GLN B 18 8.286 11.400 10.581 1.00 0.00 H new ATOM 0 HE22 GLN B 18 7.956 13.132 10.475 1.00 0.00 H new ATOM 1893 N MET B 19 14.226 11.768 6.997 1.00 0.00 N ATOM 1894 CA MET B 19 15.615 12.063 6.717 1.00 0.00 C ATOM 1895 C MET B 19 15.680 12.743 5.351 1.00 0.00 C ATOM 1896 O MET B 19 16.337 13.768 5.198 1.00 0.00 O ATOM 1897 CB MET B 19 16.427 10.752 6.758 1.00 0.00 C ATOM 1898 CG MET B 19 16.317 10.034 8.115 1.00 0.00 C ATOM 1899 SD MET B 19 16.329 8.219 8.048 1.00 0.00 S ATOM 1900 CE MET B 19 18.098 7.924 7.968 1.00 0.00 C ATOM 0 H MET B 19 14.015 10.770 7.020 1.00 0.00 H new ATOM 0 HA MET B 19 16.046 12.734 7.460 1.00 0.00 H new ATOM 0 HB2 MET B 19 16.077 10.087 5.969 1.00 0.00 H new ATOM 0 HB3 MET B 19 17.474 10.970 6.550 1.00 0.00 H new ATOM 0 HG2 MET B 19 17.143 10.362 8.747 1.00 0.00 H new ATOM 0 HG3 MET B 19 15.396 10.355 8.602 1.00 0.00 H new ATOM 0 HE1 MET B 19 18.294 7.056 7.338 1.00 0.00 H new ATOM 0 HE2 MET B 19 18.594 8.798 7.546 1.00 0.00 H new ATOM 0 HE3 MET B 19 18.482 7.738 8.971 1.00 0.00 H new ATOM 1910 N ALA B 20 14.940 12.217 4.373 1.00 0.00 N ATOM 1911 CA ALA B 20 14.909 12.728 3.019 1.00 0.00 C ATOM 1912 C ALA B 20 14.314 14.124 2.959 1.00 0.00 C ATOM 1913 O ALA B 20 14.874 14.960 2.261 1.00 0.00 O ATOM 1914 CB ALA B 20 14.152 11.755 2.118 1.00 0.00 C ATOM 0 H ALA B 20 14.336 11.407 4.513 1.00 0.00 H new ATOM 0 HA ALA B 20 15.934 12.812 2.657 1.00 0.00 H new ATOM 0 HB1 ALA B 20 14.131 12.143 1.100 1.00 0.00 H new ATOM 0 HB2 ALA B 20 14.652 10.787 2.127 1.00 0.00 H new ATOM 0 HB3 ALA B 20 13.132 11.640 2.483 1.00 0.00 H new ATOM 1920 N GLU B 21 13.234 14.416 3.688 1.00 0.00 N ATOM 1921 CA GLU B 21 12.670 15.758 3.656 1.00 0.00 C ATOM 1922 C GLU B 21 13.623 16.772 4.316 1.00 0.00 C ATOM 1923 O GLU B 21 13.749 17.902 3.837 1.00 0.00 O ATOM 1924 CB GLU B 21 11.231 15.762 4.200 1.00 0.00 C ATOM 1925 CG GLU B 21 11.086 15.708 5.719 1.00 0.00 C ATOM 1926 CD GLU B 21 9.629 15.960 6.148 1.00 0.00 C ATOM 1927 OE1 GLU B 21 8.768 15.079 5.931 1.00 0.00 O ATOM 1928 OE2 GLU B 21 9.339 17.056 6.684 1.00 0.00 O ATOM 0 H GLU B 21 12.746 13.756 4.293 1.00 0.00 H new ATOM 0 HA GLU B 21 12.579 16.093 2.623 1.00 0.00 H new ATOM 0 HB2 GLU B 21 10.731 16.661 3.840 1.00 0.00 H new ATOM 0 HB3 GLU B 21 10.701 14.910 3.774 1.00 0.00 H new ATOM 0 HG2 GLU B 21 11.412 14.734 6.084 1.00 0.00 H new ATOM 0 HG3 GLU B 21 11.737 16.454 6.176 1.00 0.00 H new ATOM 1935 N GLY B 22 14.366 16.353 5.351 1.00 0.00 N ATOM 1936 CA GLY B 22 15.385 17.184 5.982 1.00 0.00 C ATOM 1937 C GLY B 22 16.542 17.443 5.017 1.00 0.00 C ATOM 1938 O GLY B 22 16.923 18.594 4.799 1.00 0.00 O ATOM 0 H GLY B 22 14.272 15.427 5.769 1.00 0.00 H new ATOM 0 HA2 GLY B 22 14.947 18.132 6.295 1.00 0.00 H new ATOM 0 HA3 GLY B 22 15.757 16.693 6.881 1.00 0.00 H new ATOM 1942 N TRP B 23 17.060 16.384 4.387 1.00 0.00 N ATOM 1943 CA TRP B 23 18.088 16.466 3.357 1.00 0.00 C ATOM 1944 C TRP B 23 17.647 17.362 2.208 1.00 0.00 C ATOM 1945 O TRP B 23 18.451 18.150 1.708 1.00 0.00 O ATOM 1946 CB TRP B 23 18.417 15.062 2.827 1.00 0.00 C ATOM 1947 CG TRP B 23 19.563 14.401 3.516 1.00 0.00 C ATOM 1948 CD1 TRP B 23 19.489 13.353 4.361 1.00 0.00 C ATOM 1949 CD2 TRP B 23 20.982 14.720 3.405 1.00 0.00 C ATOM 1950 NE1 TRP B 23 20.747 13.031 4.814 1.00 0.00 N ATOM 1951 CE2 TRP B 23 21.714 13.814 4.229 1.00 0.00 C ATOM 1952 CE3 TRP B 23 21.729 15.636 2.632 1.00 0.00 C ATOM 1953 CZ2 TRP B 23 23.114 13.826 4.295 1.00 0.00 C ATOM 1954 CZ3 TRP B 23 23.137 15.625 2.659 1.00 0.00 C ATOM 1955 CH2 TRP B 23 23.830 14.732 3.497 1.00 0.00 C ATOM 0 H TRP B 23 16.767 15.428 4.587 1.00 0.00 H new ATOM 0 HA TRP B 23 18.980 16.902 3.806 1.00 0.00 H new ATOM 0 HB2 TRP B 23 17.534 14.431 2.929 1.00 0.00 H new ATOM 0 HB3 TRP B 23 18.639 15.131 1.762 1.00 0.00 H new ATOM 0 HD1 TRP B 23 18.579 12.843 4.640 1.00 0.00 H new ATOM 0 HE1 TRP B 23 20.939 12.301 5.500 1.00 0.00 H new ATOM 0 HE3 TRP B 23 21.214 16.354 2.012 1.00 0.00 H new ATOM 0 HZ2 TRP B 23 23.636 13.146 4.952 1.00 0.00 H new ATOM 0 HZ3 TRP B 23 23.690 16.308 2.031 1.00 0.00 H new ATOM 0 HH2 TRP B 23 24.910 14.744 3.526 1.00 0.00 H new ATOM 1966 N ALA B 24 16.382 17.262 1.797 1.00 0.00 N ATOM 1967 CA ALA B 24 15.872 18.003 0.664 1.00 0.00 C ATOM 1968 C ALA B 24 16.024 19.492 0.923 1.00 0.00 C ATOM 1969 O ALA B 24 16.506 20.232 0.068 1.00 0.00 O ATOM 1970 CB ALA B 24 14.387 17.684 0.436 1.00 0.00 C ATOM 0 H ALA B 24 15.690 16.663 2.246 1.00 0.00 H new ATOM 0 HA ALA B 24 16.438 17.716 -0.222 1.00 0.00 H new ATOM 0 HB1 ALA B 24 14.020 18.250 -0.420 1.00 0.00 H new ATOM 0 HB2 ALA B 24 14.269 16.618 0.243 1.00 0.00 H new ATOM 0 HB3 ALA B 24 13.816 17.957 1.323 1.00 0.00 H new ATOM 1976 N LYS B 25 15.629 19.942 2.115 1.00 0.00 N ATOM 1977 CA LYS B 25 15.527 21.364 2.392 1.00 0.00 C ATOM 1978 C LYS B 25 16.887 22.061 2.376 1.00 0.00 C ATOM 1979 O LYS B 25 16.914 23.276 2.180 1.00 0.00 O ATOM 1980 CB LYS B 25 14.752 21.587 3.705 1.00 0.00 C ATOM 1981 CG LYS B 25 13.229 21.526 3.472 1.00 0.00 C ATOM 1982 CD LYS B 25 12.710 22.835 2.853 1.00 0.00 C ATOM 1983 CE LYS B 25 11.277 22.703 2.311 1.00 0.00 C ATOM 1984 NZ LYS B 25 10.828 23.950 1.646 1.00 0.00 N ATOM 0 H LYS B 25 15.376 19.339 2.898 1.00 0.00 H new ATOM 0 HA LYS B 25 14.961 21.832 1.586 1.00 0.00 H new ATOM 0 HB2 LYS B 25 15.041 20.830 4.434 1.00 0.00 H new ATOM 0 HB3 LYS B 25 15.019 22.555 4.128 1.00 0.00 H new ATOM 0 HG2 LYS B 25 12.992 20.690 2.814 1.00 0.00 H new ATOM 0 HG3 LYS B 25 12.720 21.341 4.418 1.00 0.00 H new ATOM 0 HD2 LYS B 25 12.740 23.625 3.604 1.00 0.00 H new ATOM 0 HD3 LYS B 25 13.374 23.139 2.044 1.00 0.00 H new ATOM 0 HE2 LYS B 25 11.230 21.875 1.603 1.00 0.00 H new ATOM 0 HE3 LYS B 25 10.599 22.462 3.129 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 10.053 23.733 0.987 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 10.494 24.625 2.363 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 11.622 24.368 1.120 1.00 0.00 H new ATOM 1998 N GLN B 26 18.006 21.335 2.525 1.00 0.00 N ATOM 1999 CA GLN B 26 19.322 21.952 2.459 1.00 0.00 C ATOM 2000 C GLN B 26 19.789 22.248 1.025 1.00 0.00 C ATOM 2001 O GLN B 26 20.727 23.031 0.864 1.00 0.00 O ATOM 2002 CB GLN B 26 20.364 21.174 3.281 1.00 0.00 C ATOM 2003 CG GLN B 26 20.929 19.889 2.641 1.00 0.00 C ATOM 2004 CD GLN B 26 22.460 19.815 2.726 1.00 0.00 C ATOM 2005 OE1 GLN B 26 23.173 20.754 2.382 1.00 0.00 O ATOM 2006 NE2 GLN B 26 23.012 18.700 3.168 1.00 0.00 N ATOM 0 H GLN B 26 18.017 20.329 2.690 1.00 0.00 H new ATOM 0 HA GLN B 26 19.220 22.931 2.928 1.00 0.00 H new ATOM 0 HB2 GLN B 26 21.198 21.843 3.495 1.00 0.00 H new ATOM 0 HB3 GLN B 26 19.914 20.909 4.238 1.00 0.00 H new ATOM 0 HG2 GLN B 26 20.498 19.020 3.138 1.00 0.00 H new ATOM 0 HG3 GLN B 26 20.624 19.843 1.596 1.00 0.00 H new ATOM 0 HE21 GLN B 26 22.423 17.918 3.455 1.00 0.00 H new ATOM 0 HE22 GLN B 26 24.027 18.621 3.223 1.00 0.00 H new ATOM 2015 N TYR B 27 19.168 21.653 -0.006 1.00 0.00 N ATOM 2016 CA TYR B 27 19.610 21.802 -1.400 1.00 0.00 C ATOM 2017 C TYR B 27 18.483 22.181 -2.366 1.00 0.00 C ATOM 2018 O TYR B 27 18.771 22.645 -3.470 1.00 0.00 O ATOM 2019 CB TYR B 27 20.354 20.539 -1.879 1.00 0.00 C ATOM 2020 CG TYR B 27 21.808 20.813 -2.209 1.00 0.00 C ATOM 2021 CD1 TYR B 27 22.771 20.821 -1.184 1.00 0.00 C ATOM 2022 CD2 TYR B 27 22.192 21.112 -3.531 1.00 0.00 C ATOM 2023 CE1 TYR B 27 24.116 21.116 -1.472 1.00 0.00 C ATOM 2024 CE2 TYR B 27 23.536 21.398 -3.831 1.00 0.00 C ATOM 2025 CZ TYR B 27 24.506 21.400 -2.803 1.00 0.00 C ATOM 2026 OH TYR B 27 25.805 21.684 -3.103 1.00 0.00 O ATOM 0 H TYR B 27 18.348 21.057 0.104 1.00 0.00 H new ATOM 0 HA TYR B 27 20.303 22.644 -1.409 1.00 0.00 H new ATOM 0 HB2 TYR B 27 20.298 19.773 -1.106 1.00 0.00 H new ATOM 0 HB3 TYR B 27 19.854 20.139 -2.761 1.00 0.00 H new ATOM 0 HD1 TYR B 27 22.476 20.599 -0.169 1.00 0.00 H new ATOM 0 HD2 TYR B 27 21.452 21.122 -4.317 1.00 0.00 H new ATOM 0 HE1 TYR B 27 24.850 21.126 -0.679 1.00 0.00 H new ATOM 0 HE2 TYR B 27 23.827 21.616 -4.848 1.00 0.00 H new ATOM 0 HH TYR B 27 25.889 21.852 -4.065 1.00 0.00 H new ATOM 2036 N LEU B 28 17.218 22.015 -1.968 1.00 0.00 N ATOM 2037 CA LEU B 28 16.060 22.519 -2.684 1.00 0.00 C ATOM 2038 C LEU B 28 15.856 23.952 -2.179 1.00 0.00 C ATOM 2039 O LEU B 28 16.744 24.789 -2.360 1.00 0.00 O ATOM 2040 CB LEU B 28 14.865 21.551 -2.503 1.00 0.00 C ATOM 2041 CG LEU B 28 15.081 20.119 -3.042 1.00 0.00 C ATOM 2042 CD1 LEU B 28 13.740 19.374 -3.080 1.00 0.00 C ATOM 2043 CD2 LEU B 28 15.714 20.065 -4.437 1.00 0.00 C ATOM 0 H LEU B 28 16.973 21.512 -1.115 1.00 0.00 H new ATOM 0 HA LEU B 28 16.183 22.562 -3.766 1.00 0.00 H new ATOM 0 HB2 LEU B 28 14.628 21.489 -1.441 1.00 0.00 H new ATOM 0 HB3 LEU B 28 13.994 21.980 -2.999 1.00 0.00 H new ATOM 0 HG LEU B 28 15.783 19.644 -2.357 1.00 0.00 H new ATOM 0 HD11 LEU B 28 13.895 18.364 -3.461 1.00 0.00 H new ATOM 0 HD12 LEU B 28 13.324 19.323 -2.074 1.00 0.00 H new ATOM 0 HD13 LEU B 28 13.047 19.905 -3.733 1.00 0.00 H new ATOM 0 HD21 LEU B 28 15.832 19.026 -4.743 1.00 0.00 H new ATOM 0 HD22 LEU B 28 15.070 20.582 -5.149 1.00 0.00 H new ATOM 0 HD23 LEU B 28 16.690 20.549 -4.413 1.00 0.00 H new ATOM 2055 N GLY B 29 14.737 24.256 -1.523 1.00 0.00 N ATOM 2056 CA GLY B 29 14.510 25.561 -0.911 1.00 0.00 C ATOM 2057 C GLY B 29 13.039 25.762 -0.592 1.00 0.00 C ATOM 2058 O GLY B 29 12.250 24.818 -0.670 1.00 0.00 O ATOM 0 H GLY B 29 13.963 23.603 -1.402 1.00 0.00 H new ATOM 0 HA2 GLY B 29 15.099 25.646 0.002 1.00 0.00 H new ATOM 0 HA3 GLY B 29 14.851 26.347 -1.585 1.00 0.00 H new ATOM 2062 N ASP B 30 12.652 26.995 -0.261 1.00 0.00 N ATOM 2063 CA ASP B 30 11.249 27.416 -0.138 1.00 0.00 C ATOM 2064 C ASP B 30 10.501 27.270 -1.475 1.00 0.00 C ATOM 2065 O ASP B 30 9.278 27.149 -1.509 1.00 0.00 O ATOM 2066 CB ASP B 30 11.193 28.870 0.343 1.00 0.00 C ATOM 2067 CG ASP B 30 9.746 29.367 0.497 1.00 0.00 C ATOM 2068 OD1 ASP B 30 9.036 28.896 1.414 1.00 0.00 O ATOM 2069 OD2 ASP B 30 9.332 30.275 -0.258 1.00 0.00 O ATOM 0 H ASP B 30 13.315 27.746 -0.067 1.00 0.00 H new ATOM 0 HA ASP B 30 10.757 26.770 0.589 1.00 0.00 H new ATOM 0 HB2 ASP B 30 11.710 28.957 1.298 1.00 0.00 H new ATOM 0 HB3 ASP B 30 11.723 29.507 -0.365 1.00 0.00 H new ATOM 2074 N GLU B 31 11.265 27.224 -2.571 1.00 0.00 N ATOM 2075 CA GLU B 31 10.842 26.889 -3.925 1.00 0.00 C ATOM 2076 C GLU B 31 10.119 25.530 -3.999 1.00 0.00 C ATOM 2077 O GLU B 31 9.313 25.312 -4.907 1.00 0.00 O ATOM 2078 CB GLU B 31 12.117 26.921 -4.791 1.00 0.00 C ATOM 2079 CG GLU B 31 11.908 26.517 -6.253 1.00 0.00 C ATOM 2080 CD GLU B 31 13.220 26.517 -7.056 1.00 0.00 C ATOM 2081 OE1 GLU B 31 13.867 27.579 -7.197 1.00 0.00 O ATOM 2082 OE2 GLU B 31 13.576 25.443 -7.596 1.00 0.00 O ATOM 0 H GLU B 31 12.262 27.435 -2.527 1.00 0.00 H new ATOM 0 HA GLU B 31 10.106 27.606 -4.288 1.00 0.00 H new ATOM 0 HB2 GLU B 31 12.534 27.928 -4.763 1.00 0.00 H new ATOM 0 HB3 GLU B 31 12.858 26.256 -4.347 1.00 0.00 H new ATOM 0 HG2 GLU B 31 11.462 25.523 -6.292 1.00 0.00 H new ATOM 0 HG3 GLU B 31 11.200 27.203 -6.719 1.00 0.00 H new ATOM 2089 N TRP B 32 10.375 24.626 -3.049 1.00 0.00 N ATOM 2090 CA TRP B 32 9.812 23.284 -3.019 1.00 0.00 C ATOM 2091 C TRP B 32 9.075 23.038 -1.708 1.00 0.00 C ATOM 2092 O TRP B 32 9.383 23.639 -0.677 1.00 0.00 O ATOM 2093 CB TRP B 32 10.933 22.255 -3.205 1.00 0.00 C ATOM 2094 CG TRP B 32 11.661 22.336 -4.511 1.00 0.00 C ATOM 2095 CD1 TRP B 32 12.658 23.200 -4.808 1.00 0.00 C ATOM 2096 CD2 TRP B 32 11.455 21.543 -5.718 1.00 0.00 C ATOM 2097 NE1 TRP B 32 13.083 22.998 -6.102 1.00 0.00 N ATOM 2098 CE2 TRP B 32 12.399 21.965 -6.700 1.00 0.00 C ATOM 2099 CE3 TRP B 32 10.562 20.514 -6.088 1.00 0.00 C ATOM 2100 CZ2 TRP B 32 12.468 21.390 -7.974 1.00 0.00 C ATOM 2101 CZ3 TRP B 32 10.601 19.947 -7.377 1.00 0.00 C ATOM 2102 CH2 TRP B 32 11.556 20.378 -8.318 1.00 0.00 C ATOM 0 H TRP B 32 10.996 24.817 -2.262 1.00 0.00 H new ATOM 0 HA TRP B 32 9.094 23.183 -3.832 1.00 0.00 H new ATOM 0 HB2 TRP B 32 11.654 22.377 -2.397 1.00 0.00 H new ATOM 0 HB3 TRP B 32 10.508 21.256 -3.105 1.00 0.00 H new ATOM 0 HD1 TRP B 32 13.061 23.939 -4.131 1.00 0.00 H new ATOM 0 HE1 TRP B 32 13.813 23.545 -6.559 1.00 0.00 H new ATOM 0 HE3 TRP B 32 9.838 20.156 -5.372 1.00 0.00 H new ATOM 0 HZ2 TRP B 32 13.212 21.720 -8.683 1.00 0.00 H new ATOM 0 HZ3 TRP B 32 9.894 19.176 -7.645 1.00 0.00 H new ATOM 0 HH2 TRP B 32 11.587 19.932 -9.301 1.00 0.00 H new ATOM 2113 N LYS B 33 8.141 22.089 -1.730 1.00 0.00 N ATOM 2114 CA LYS B 33 7.450 21.570 -0.556 1.00 0.00 C ATOM 2115 C LYS B 33 7.636 20.063 -0.583 1.00 0.00 C ATOM 2116 O LYS B 33 7.582 19.456 -1.655 1.00 0.00 O ATOM 2117 CB LYS B 33 5.973 21.968 -0.580 1.00 0.00 C ATOM 2118 CG LYS B 33 5.836 23.500 -0.492 1.00 0.00 C ATOM 2119 CD LYS B 33 4.813 23.924 0.559 1.00 0.00 C ATOM 2120 CE LYS B 33 3.382 23.529 0.162 1.00 0.00 C ATOM 2121 NZ LYS B 33 2.382 23.967 1.167 1.00 0.00 N ATOM 0 H LYS B 33 7.836 21.646 -2.597 1.00 0.00 H new ATOM 0 HA LYS B 33 7.856 21.984 0.367 1.00 0.00 H new ATOM 0 HB2 LYS B 33 5.505 21.605 -1.495 1.00 0.00 H new ATOM 0 HB3 LYS B 33 5.449 21.500 0.253 1.00 0.00 H new ATOM 0 HG2 LYS B 33 6.805 23.937 -0.252 1.00 0.00 H new ATOM 0 HG3 LYS B 33 5.541 23.894 -1.465 1.00 0.00 H new ATOM 0 HD2 LYS B 33 5.064 23.465 1.515 1.00 0.00 H new ATOM 0 HD3 LYS B 33 4.865 25.003 0.701 1.00 0.00 H new ATOM 0 HE2 LYS B 33 3.140 23.970 -0.805 1.00 0.00 H new ATOM 0 HE3 LYS B 33 3.325 22.447 0.043 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 1.431 23.680 0.859 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 2.596 23.527 2.085 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 2.417 25.002 1.263 1.00 0.00 H new ATOM 2135 N VAL B 34 7.877 19.466 0.579 1.00 0.00 N ATOM 2136 CA VAL B 34 8.289 18.076 0.678 1.00 0.00 C ATOM 2137 C VAL B 34 7.419 17.402 1.738 1.00 0.00 C ATOM 2138 O VAL B 34 7.112 18.018 2.763 1.00 0.00 O ATOM 2139 CB VAL B 34 9.808 17.994 0.972 1.00 0.00 C ATOM 2140 CG1 VAL B 34 10.262 16.542 0.814 1.00 0.00 C ATOM 2141 CG2 VAL B 34 10.647 18.889 0.039 1.00 0.00 C ATOM 0 H VAL B 34 7.791 19.936 1.480 1.00 0.00 H new ATOM 0 HA VAL B 34 8.142 17.543 -0.261 1.00 0.00 H new ATOM 0 HB VAL B 34 9.966 18.352 1.990 1.00 0.00 H new ATOM 0 HG11 VAL B 34 11.330 16.471 1.018 1.00 0.00 H new ATOM 0 HG12 VAL B 34 9.715 15.912 1.515 1.00 0.00 H new ATOM 0 HG13 VAL B 34 10.064 16.208 -0.204 1.00 0.00 H new ATOM 0 HG21 VAL B 34 11.703 18.790 0.292 1.00 0.00 H new ATOM 0 HG22 VAL B 34 10.492 18.583 -0.995 1.00 0.00 H new ATOM 0 HG23 VAL B 34 10.341 19.928 0.160 1.00 0.00 H new ATOM 2151 N TYR B 35 7.007 16.156 1.485 1.00 0.00 N ATOM 2152 CA TYR B 35 6.098 15.413 2.357 1.00 0.00 C ATOM 2153 C TYR B 35 6.592 13.973 2.519 1.00 0.00 C ATOM 2154 O TYR B 35 7.316 13.468 1.656 1.00 0.00 O ATOM 2155 CB TYR B 35 4.684 15.460 1.757 1.00 0.00 C ATOM 2156 CG TYR B 35 3.563 15.292 2.764 1.00 0.00 C ATOM 2157 CD1 TYR B 35 3.027 16.432 3.395 1.00 0.00 C ATOM 2158 CD2 TYR B 35 3.041 14.019 3.063 1.00 0.00 C ATOM 2159 CE1 TYR B 35 1.967 16.307 4.310 1.00 0.00 C ATOM 2160 CE2 TYR B 35 1.982 13.884 3.978 1.00 0.00 C ATOM 2161 CZ TYR B 35 1.435 15.030 4.602 1.00 0.00 C ATOM 2162 OH TYR B 35 0.400 14.899 5.477 1.00 0.00 O ATOM 0 H TYR B 35 7.299 15.631 0.660 1.00 0.00 H new ATOM 0 HA TYR B 35 6.071 15.865 3.348 1.00 0.00 H new ATOM 0 HB2 TYR B 35 4.553 16.413 1.244 1.00 0.00 H new ATOM 0 HB3 TYR B 35 4.598 14.677 1.003 1.00 0.00 H new ATOM 0 HD1 TYR B 35 3.433 17.408 3.174 1.00 0.00 H new ATOM 0 HD2 TYR B 35 3.456 13.143 2.587 1.00 0.00 H new ATOM 0 HE1 TYR B 35 1.560 17.185 4.789 1.00 0.00 H new ATOM 0 HE2 TYR B 35 1.586 12.905 4.205 1.00 0.00 H new ATOM 0 HH TYR B 35 -0.142 14.121 5.229 1.00 0.00 H new ATOM 2172 N SER B 36 6.179 13.308 3.598 1.00 0.00 N ATOM 2173 CA SER B 36 6.651 11.992 4.004 1.00 0.00 C ATOM 2174 C SER B 36 5.452 11.130 4.409 1.00 0.00 C ATOM 2175 O SER B 36 4.590 11.596 5.164 1.00 0.00 O ATOM 2176 CB SER B 36 7.650 12.160 5.160 1.00 0.00 C ATOM 2177 OG SER B 36 7.204 13.050 6.161 1.00 0.00 O ATOM 0 H SER B 36 5.480 13.689 4.235 1.00 0.00 H new ATOM 0 HA SER B 36 7.161 11.490 3.182 1.00 0.00 H new ATOM 0 HB2 SER B 36 7.841 11.186 5.610 1.00 0.00 H new ATOM 0 HB3 SER B 36 8.599 12.519 4.761 1.00 0.00 H new ATOM 0 HG SER B 36 7.753 13.862 6.145 1.00 0.00 H new ATOM 2183 N ALA B 37 5.368 9.892 3.904 1.00 0.00 N ATOM 2184 CA ALA B 37 4.192 9.054 4.081 1.00 0.00 C ATOM 2185 C ALA B 37 4.522 7.560 4.075 1.00 0.00 C ATOM 2186 O ALA B 37 5.655 7.173 3.785 1.00 0.00 O ATOM 2187 CB ALA B 37 3.212 9.378 2.957 1.00 0.00 C ATOM 0 H ALA B 37 6.114 9.452 3.365 1.00 0.00 H new ATOM 0 HA ALA B 37 3.759 9.267 5.058 1.00 0.00 H new ATOM 0 HB1 ALA B 37 2.319 8.763 3.065 1.00 0.00 H new ATOM 0 HB2 ALA B 37 2.936 10.431 3.008 1.00 0.00 H new ATOM 0 HB3 ALA B 37 3.681 9.172 1.995 1.00 0.00 H new ATOM 2193 N GLY B 38 3.515 6.729 4.361 1.00 0.00 N ATOM 2194 CA GLY B 38 3.586 5.274 4.386 1.00 0.00 C ATOM 2195 C GLY B 38 2.276 4.685 4.913 1.00 0.00 C ATOM 2196 O GLY B 38 1.333 5.435 5.180 1.00 0.00 O ATOM 0 H GLY B 38 2.584 7.075 4.592 1.00 0.00 H new ATOM 0 HA2 GLY B 38 3.785 4.896 3.383 1.00 0.00 H new ATOM 0 HA3 GLY B 38 4.415 4.955 5.017 1.00 0.00 H new ATOM 2200 N ILE B 39 2.219 3.359 5.075 1.00 0.00 N ATOM 2201 CA ILE B 39 1.024 2.613 5.495 1.00 0.00 C ATOM 2202 C ILE B 39 0.383 3.154 6.785 1.00 0.00 C ATOM 2203 O ILE B 39 -0.814 3.437 6.805 1.00 0.00 O ATOM 2204 CB ILE B 39 1.329 1.097 5.579 1.00 0.00 C ATOM 2205 CG1 ILE B 39 0.183 0.355 6.292 1.00 0.00 C ATOM 2206 CG2 ILE B 39 2.660 0.741 6.264 1.00 0.00 C ATOM 2207 CD1 ILE B 39 0.103 -1.112 5.879 1.00 0.00 C ATOM 0 H ILE B 39 3.026 2.756 4.913 1.00 0.00 H new ATOM 0 HA ILE B 39 0.270 2.765 4.723 1.00 0.00 H new ATOM 0 HB ILE B 39 1.421 0.774 4.542 1.00 0.00 H new ATOM 0 HG12 ILE B 39 0.326 0.420 7.371 1.00 0.00 H new ATOM 0 HG13 ILE B 39 -0.763 0.847 6.065 1.00 0.00 H new ATOM 0 HG21 ILE B 39 2.785 -0.342 6.275 1.00 0.00 H new ATOM 0 HG22 ILE B 39 3.485 1.196 5.715 1.00 0.00 H new ATOM 0 HG23 ILE B 39 2.654 1.116 7.287 1.00 0.00 H new ATOM 0 HD11 ILE B 39 -0.719 -1.594 6.407 1.00 0.00 H new ATOM 0 HD12 ILE B 39 -0.067 -1.179 4.804 1.00 0.00 H new ATOM 0 HD13 ILE B 39 1.038 -1.612 6.130 1.00 0.00 H new ATOM 2219 N GLU B 40 1.170 3.281 7.855 1.00 0.00 N ATOM 2220 CA GLU B 40 0.727 3.673 9.200 1.00 0.00 C ATOM 2221 C GLU B 40 1.640 4.793 9.723 1.00 0.00 C ATOM 2222 O GLU B 40 1.872 4.951 10.921 1.00 0.00 O ATOM 2223 CB GLU B 40 0.633 2.440 10.122 1.00 0.00 C ATOM 2224 CG GLU B 40 1.963 1.711 10.381 1.00 0.00 C ATOM 2225 CD GLU B 40 1.779 0.555 11.381 1.00 0.00 C ATOM 2226 OE1 GLU B 40 1.458 -0.580 10.961 1.00 0.00 O ATOM 2227 OE2 GLU B 40 1.973 0.761 12.602 1.00 0.00 O ATOM 0 H GLU B 40 2.174 3.107 7.809 1.00 0.00 H new ATOM 0 HA GLU B 40 -0.283 4.081 9.173 1.00 0.00 H new ATOM 0 HB2 GLU B 40 0.217 2.753 11.079 1.00 0.00 H new ATOM 0 HB3 GLU B 40 -0.071 1.732 9.685 1.00 0.00 H new ATOM 0 HG2 GLU B 40 2.357 1.323 9.442 1.00 0.00 H new ATOM 0 HG3 GLU B 40 2.698 2.417 10.768 1.00 0.00 H new ATOM 2234 N ALA B 41 2.219 5.527 8.772 1.00 0.00 N ATOM 2235 CA ALA B 41 3.214 6.558 8.970 1.00 0.00 C ATOM 2236 C ALA B 41 2.680 7.726 9.799 1.00 0.00 C ATOM 2237 O ALA B 41 1.510 8.087 9.677 1.00 0.00 O ATOM 2238 CB ALA B 41 3.597 7.036 7.575 1.00 0.00 C ATOM 0 H ALA B 41 1.985 5.403 7.787 1.00 0.00 H new ATOM 0 HA ALA B 41 4.066 6.162 9.523 1.00 0.00 H new ATOM 0 HB1 ALA B 41 4.350 7.820 7.653 1.00 0.00 H new ATOM 0 HB2 ALA B 41 4.001 6.201 7.002 1.00 0.00 H new ATOM 0 HB3 ALA B 41 2.715 7.429 7.070 1.00 0.00 H new ATOM 2244 N HIS B 42 3.574 8.338 10.582 1.00 0.00 N ATOM 2245 CA HIS B 42 3.405 9.597 11.321 1.00 0.00 C ATOM 2246 C HIS B 42 4.619 9.873 12.215 1.00 0.00 C ATOM 2247 O HIS B 42 4.802 10.999 12.676 1.00 0.00 O ATOM 2248 CB HIS B 42 2.126 9.654 12.184 1.00 0.00 C ATOM 2249 CG HIS B 42 2.024 8.574 13.235 1.00 0.00 C ATOM 2250 ND1 HIS B 42 2.540 8.623 14.512 1.00 0.00 N ATOM 2251 CD2 HIS B 42 1.372 7.375 13.109 1.00 0.00 C ATOM 2252 CE1 HIS B 42 2.211 7.480 15.138 1.00 0.00 C ATOM 2253 NE2 HIS B 42 1.495 6.682 14.323 1.00 0.00 N ATOM 0 H HIS B 42 4.502 7.940 10.728 1.00 0.00 H new ATOM 0 HA HIS B 42 3.311 10.365 10.553 1.00 0.00 H new ATOM 0 HB2 HIS B 42 2.079 10.626 12.676 1.00 0.00 H new ATOM 0 HB3 HIS B 42 1.258 9.586 11.528 1.00 0.00 H new ATOM 0 HD2 HIS B 42 0.854 7.025 12.229 1.00 0.00 H new ATOM 0 HE1 HIS B 42 2.483 7.235 16.154 1.00 0.00 H new ATOM 0 HE2 HIS B 42 1.118 5.760 14.544 1.00 0.00 H new ATOM 2261 N GLY B 43 5.427 8.843 12.476 1.00 0.00 N ATOM 2262 CA GLY B 43 6.480 8.883 13.463 1.00 0.00 C ATOM 2263 C GLY B 43 7.657 9.753 13.043 1.00 0.00 C ATOM 2264 O GLY B 43 7.843 10.073 11.867 1.00 0.00 O ATOM 0 H GLY B 43 5.357 7.947 11.993 1.00 0.00 H new ATOM 0 HA2 GLY B 43 6.075 9.258 14.403 1.00 0.00 H new ATOM 0 HA3 GLY B 43 6.833 7.869 13.650 1.00 0.00 H new ATOM 2268 N LEU B 44 8.488 10.059 14.034 1.00 0.00 N ATOM 2269 CA LEU B 44 9.789 10.694 13.897 1.00 0.00 C ATOM 2270 C LEU B 44 10.730 9.825 14.724 1.00 0.00 C ATOM 2271 O LEU B 44 10.880 10.019 15.932 1.00 0.00 O ATOM 2272 CB LEU B 44 9.740 12.167 14.350 1.00 0.00 C ATOM 2273 CG LEU B 44 11.129 12.840 14.424 1.00 0.00 C ATOM 2274 CD1 LEU B 44 11.871 12.804 13.085 1.00 0.00 C ATOM 2275 CD2 LEU B 44 10.993 14.295 14.877 1.00 0.00 C ATOM 0 H LEU B 44 8.257 9.858 15.007 1.00 0.00 H new ATOM 0 HA LEU B 44 10.132 10.751 12.864 1.00 0.00 H new ATOM 0 HB2 LEU B 44 9.110 12.729 13.661 1.00 0.00 H new ATOM 0 HB3 LEU B 44 9.267 12.221 15.331 1.00 0.00 H new ATOM 0 HG LEU B 44 11.711 12.271 15.149 1.00 0.00 H new ATOM 0 HD11 LEU B 44 12.841 13.290 13.193 1.00 0.00 H new ATOM 0 HD12 LEU B 44 12.016 11.768 12.777 1.00 0.00 H new ATOM 0 HD13 LEU B 44 11.285 13.328 12.330 1.00 0.00 H new ATOM 0 HD21 LEU B 44 11.980 14.755 14.924 1.00 0.00 H new ATOM 0 HD22 LEU B 44 10.372 14.841 14.167 1.00 0.00 H new ATOM 0 HD23 LEU B 44 10.530 14.327 15.863 1.00 0.00 H new ATOM 2287 N ASN B 45 11.258 8.781 14.085 1.00 0.00 N ATOM 2288 CA ASN B 45 12.162 7.822 14.703 1.00 0.00 C ATOM 2289 C ASN B 45 13.397 8.584 15.212 1.00 0.00 C ATOM 2290 O ASN B 45 13.958 9.376 14.445 1.00 0.00 O ATOM 2291 CB ASN B 45 12.519 6.762 13.640 1.00 0.00 C ATOM 2292 CG ASN B 45 13.336 5.582 14.154 1.00 0.00 C ATOM 2293 OD1 ASN B 45 14.139 5.706 15.069 1.00 0.00 O ATOM 2294 ND2 ASN B 45 13.180 4.416 13.551 1.00 0.00 N ATOM 0 H ASN B 45 11.063 8.578 13.105 1.00 0.00 H new ATOM 0 HA ASN B 45 11.712 7.313 15.555 1.00 0.00 H new ATOM 0 HB2 ASN B 45 11.595 6.382 13.203 1.00 0.00 H new ATOM 0 HB3 ASN B 45 13.075 7.247 12.838 1.00 0.00 H new ATOM 0 HD21 ASN B 45 13.731 3.611 13.848 1.00 0.00 H new ATOM 0 HD22 ASN B 45 12.508 4.322 12.789 1.00 0.00 H new ATOM 2301 N PRO B 46 13.871 8.366 16.454 1.00 0.00 N ATOM 2302 CA PRO B 46 15.085 9.014 16.937 1.00 0.00 C ATOM 2303 C PRO B 46 16.304 8.699 16.062 1.00 0.00 C ATOM 2304 O PRO B 46 17.240 9.499 16.043 1.00 0.00 O ATOM 2305 CB PRO B 46 15.250 8.594 18.398 1.00 0.00 C ATOM 2306 CG PRO B 46 14.426 7.312 18.506 1.00 0.00 C ATOM 2307 CD PRO B 46 13.299 7.530 17.499 1.00 0.00 C ATOM 0 HA PRO B 46 15.002 10.099 16.874 1.00 0.00 H new ATOM 0 HB2 PRO B 46 16.296 8.419 18.648 1.00 0.00 H new ATOM 0 HB3 PRO B 46 14.884 9.363 19.079 1.00 0.00 H new ATOM 0 HG2 PRO B 46 15.019 6.431 18.261 1.00 0.00 H new ATOM 0 HG3 PRO B 46 14.041 7.166 19.515 1.00 0.00 H new ATOM 0 HD2 PRO B 46 12.945 6.582 17.094 1.00 0.00 H new ATOM 0 HD3 PRO B 46 12.443 8.016 17.967 1.00 0.00 H new ATOM 2315 N ASN B 47 16.293 7.592 15.300 1.00 0.00 N ATOM 2316 CA ASN B 47 17.300 7.352 14.272 1.00 0.00 C ATOM 2317 C ASN B 47 17.290 8.538 13.320 1.00 0.00 C ATOM 2318 O ASN B 47 18.327 9.151 13.147 1.00 0.00 O ATOM 2319 CB ASN B 47 17.046 6.072 13.452 1.00 0.00 C ATOM 2320 CG ASN B 47 17.750 6.150 12.090 1.00 0.00 C ATOM 2321 OD1 ASN B 47 18.849 6.661 11.944 1.00 0.00 O ATOM 2322 ND2 ASN B 47 17.101 5.769 11.011 1.00 0.00 N ATOM 0 H ASN B 47 15.594 6.854 15.383 1.00 0.00 H new ATOM 0 HA ASN B 47 18.258 7.225 14.776 1.00 0.00 H new ATOM 0 HB2 ASN B 47 17.406 5.204 14.004 1.00 0.00 H new ATOM 0 HB3 ASN B 47 15.975 5.935 13.306 1.00 0.00 H new ATOM 0 HD21 ASN B 47 17.519 5.904 10.090 1.00 0.00 H new ATOM 0 HD22 ASN B 47 16.180 5.338 11.095 1.00 0.00 H new ATOM 2329 N ALA B 48 16.148 8.881 12.714 1.00 0.00 N ATOM 2330 CA ALA B 48 16.115 9.939 11.712 1.00 0.00 C ATOM 2331 C ALA B 48 16.640 11.246 12.300 1.00 0.00 C ATOM 2332 O ALA B 48 17.357 11.976 11.624 1.00 0.00 O ATOM 2333 CB ALA B 48 14.692 10.161 11.202 1.00 0.00 C ATOM 0 H ALA B 48 15.246 8.443 12.901 1.00 0.00 H new ATOM 0 HA ALA B 48 16.750 9.629 10.882 1.00 0.00 H new ATOM 0 HB1 ALA B 48 14.693 10.955 10.455 1.00 0.00 H new ATOM 0 HB2 ALA B 48 14.319 9.241 10.753 1.00 0.00 H new ATOM 0 HB3 ALA B 48 14.048 10.446 12.034 1.00 0.00 H new ATOM 2339 N VAL B 49 16.311 11.528 13.562 1.00 0.00 N ATOM 2340 CA VAL B 49 16.849 12.704 14.242 1.00 0.00 C ATOM 2341 C VAL B 49 18.382 12.619 14.232 1.00 0.00 C ATOM 2342 O VAL B 49 19.041 13.503 13.685 1.00 0.00 O ATOM 2343 CB VAL B 49 16.251 12.857 15.659 1.00 0.00 C ATOM 2344 CG1 VAL B 49 16.673 14.192 16.291 1.00 0.00 C ATOM 2345 CG2 VAL B 49 14.714 12.807 15.644 1.00 0.00 C ATOM 0 H VAL B 49 15.679 10.962 14.129 1.00 0.00 H new ATOM 0 HA VAL B 49 16.559 13.611 13.712 1.00 0.00 H new ATOM 0 HB VAL B 49 16.634 12.020 16.243 1.00 0.00 H new ATOM 0 HG11 VAL B 49 16.240 14.276 17.288 1.00 0.00 H new ATOM 0 HG12 VAL B 49 17.760 14.233 16.363 1.00 0.00 H new ATOM 0 HG13 VAL B 49 16.319 15.016 15.671 1.00 0.00 H new ATOM 0 HG21 VAL B 49 14.336 12.918 16.660 1.00 0.00 H new ATOM 0 HG22 VAL B 49 14.330 13.616 15.023 1.00 0.00 H new ATOM 0 HG23 VAL B 49 14.385 11.851 15.237 1.00 0.00 H new ATOM 2355 N LYS B 50 18.959 11.527 14.744 1.00 0.00 N ATOM 2356 CA LYS B 50 20.411 11.327 14.801 1.00 0.00 C ATOM 2357 C LYS B 50 21.031 11.433 13.405 1.00 0.00 C ATOM 2358 O LYS B 50 22.026 12.130 13.223 1.00 0.00 O ATOM 2359 CB LYS B 50 20.708 9.968 15.467 1.00 0.00 C ATOM 2360 CG LYS B 50 22.201 9.602 15.471 1.00 0.00 C ATOM 2361 CD LYS B 50 22.451 8.281 16.215 1.00 0.00 C ATOM 2362 CE LYS B 50 23.913 7.810 16.118 1.00 0.00 C ATOM 2363 NZ LYS B 50 24.858 8.677 16.869 1.00 0.00 N ATOM 0 H LYS B 50 18.426 10.750 15.134 1.00 0.00 H new ATOM 0 HA LYS B 50 20.867 12.112 15.404 1.00 0.00 H new ATOM 0 HB2 LYS B 50 20.344 9.988 16.494 1.00 0.00 H new ATOM 0 HB3 LYS B 50 20.152 9.188 14.947 1.00 0.00 H new ATOM 0 HG2 LYS B 50 22.559 9.517 14.445 1.00 0.00 H new ATOM 0 HG3 LYS B 50 22.772 10.401 15.943 1.00 0.00 H new ATOM 0 HD2 LYS B 50 22.182 8.404 17.264 1.00 0.00 H new ATOM 0 HD3 LYS B 50 21.798 7.510 15.807 1.00 0.00 H new ATOM 0 HE2 LYS B 50 23.986 6.791 16.497 1.00 0.00 H new ATOM 0 HE3 LYS B 50 24.210 7.782 15.070 1.00 0.00 H new ATOM 0 HZ1 LYS B 50 25.825 8.308 16.765 1.00 0.00 H new ATOM 0 HZ2 LYS B 50 24.814 9.646 16.493 1.00 0.00 H new ATOM 0 HZ3 LYS B 50 24.597 8.685 17.876 1.00 0.00 H new ATOM 2377 N ALA B 51 20.419 10.781 12.424 1.00 0.00 N ATOM 2378 CA ALA B 51 20.841 10.692 11.041 1.00 0.00 C ATOM 2379 C ALA B 51 21.040 12.079 10.430 1.00 0.00 C ATOM 2380 O ALA B 51 21.964 12.277 9.644 1.00 0.00 O ATOM 2381 CB ALA B 51 19.774 9.937 10.258 1.00 0.00 C ATOM 0 H ALA B 51 19.555 10.266 12.591 1.00 0.00 H new ATOM 0 HA ALA B 51 21.795 10.168 10.995 1.00 0.00 H new ATOM 0 HB1 ALA B 51 20.075 9.860 9.213 1.00 0.00 H new ATOM 0 HB2 ALA B 51 19.655 8.937 10.676 1.00 0.00 H new ATOM 0 HB3 ALA B 51 18.827 10.473 10.324 1.00 0.00 H new ATOM 2387 N MET B 52 20.178 13.036 10.786 1.00 0.00 N ATOM 2388 CA MET B 52 20.220 14.384 10.252 1.00 0.00 C ATOM 2389 C MET B 52 21.129 15.262 11.105 1.00 0.00 C ATOM 2390 O MET B 52 21.839 16.106 10.560 1.00 0.00 O ATOM 2391 CB MET B 52 18.788 14.930 10.150 1.00 0.00 C ATOM 2392 CG MET B 52 17.909 14.119 9.186 1.00 0.00 C ATOM 2393 SD MET B 52 18.649 13.704 7.588 1.00 0.00 S ATOM 2394 CE MET B 52 19.016 15.380 7.031 1.00 0.00 C ATOM 0 H MET B 52 19.427 12.887 11.460 1.00 0.00 H new ATOM 0 HA MET B 52 20.645 14.382 9.248 1.00 0.00 H new ATOM 0 HB2 MET B 52 18.332 14.927 11.140 1.00 0.00 H new ATOM 0 HB3 MET B 52 18.822 15.967 9.818 1.00 0.00 H new ATOM 0 HG2 MET B 52 17.622 13.192 9.682 1.00 0.00 H new ATOM 0 HG3 MET B 52 16.992 14.680 9.004 1.00 0.00 H new ATOM 0 HE1 MET B 52 18.780 15.471 5.971 1.00 0.00 H new ATOM 0 HE2 MET B 52 18.416 16.092 7.598 1.00 0.00 H new ATOM 0 HE3 MET B 52 20.074 15.592 7.187 1.00 0.00 H new ATOM 2404 N LYS B 53 21.217 15.014 12.418 1.00 0.00 N ATOM 2405 CA LYS B 53 22.217 15.657 13.268 1.00 0.00 C ATOM 2406 C LYS B 53 23.637 15.293 12.815 1.00 0.00 C ATOM 2407 O LYS B 53 24.532 16.113 13.011 1.00 0.00 O ATOM 2408 CB LYS B 53 22.006 15.283 14.750 1.00 0.00 C ATOM 2409 CG LYS B 53 20.661 15.739 15.344 1.00 0.00 C ATOM 2410 CD LYS B 53 20.601 17.212 15.765 1.00 0.00 C ATOM 2411 CE LYS B 53 19.158 17.513 16.201 1.00 0.00 C ATOM 2412 NZ LYS B 53 18.978 18.885 16.730 1.00 0.00 N ATOM 0 H LYS B 53 20.602 14.368 12.913 1.00 0.00 H new ATOM 0 HA LYS B 53 22.094 16.736 13.170 1.00 0.00 H new ATOM 0 HB2 LYS B 53 22.084 14.201 14.852 1.00 0.00 H new ATOM 0 HB3 LYS B 53 22.814 15.718 15.339 1.00 0.00 H new ATOM 0 HG2 LYS B 53 19.876 15.555 14.610 1.00 0.00 H new ATOM 0 HG3 LYS B 53 20.437 15.120 16.212 1.00 0.00 H new ATOM 0 HD2 LYS B 53 21.296 17.405 16.582 1.00 0.00 H new ATOM 0 HD3 LYS B 53 20.894 17.859 14.938 1.00 0.00 H new ATOM 0 HE2 LYS B 53 18.492 17.369 15.350 1.00 0.00 H new ATOM 0 HE3 LYS B 53 18.860 16.795 16.965 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 18.045 19.247 16.446 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 19.041 18.868 17.768 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 19.721 19.505 16.348 1.00 0.00 H new ATOM 2426 N GLU B 54 23.862 14.143 12.155 1.00 0.00 N ATOM 2427 CA GLU B 54 25.184 13.791 11.620 1.00 0.00 C ATOM 2428 C GLU B 54 25.673 14.833 10.604 1.00 0.00 C ATOM 2429 O GLU B 54 26.880 15.038 10.467 1.00 0.00 O ATOM 2430 CB GLU B 54 25.226 12.402 10.950 1.00 0.00 C ATOM 2431 CG GLU B 54 25.016 11.206 11.892 1.00 0.00 C ATOM 2432 CD GLU B 54 25.662 9.912 11.364 1.00 0.00 C ATOM 2433 OE1 GLU B 54 25.753 9.706 10.133 1.00 0.00 O ATOM 2434 OE2 GLU B 54 26.117 9.082 12.177 1.00 0.00 O ATOM 0 H GLU B 54 23.142 13.442 11.980 1.00 0.00 H new ATOM 0 HA GLU B 54 25.842 13.770 12.489 1.00 0.00 H new ATOM 0 HB2 GLU B 54 24.462 12.369 10.174 1.00 0.00 H new ATOM 0 HB3 GLU B 54 26.190 12.286 10.454 1.00 0.00 H new ATOM 0 HG2 GLU B 54 25.433 11.442 12.871 1.00 0.00 H new ATOM 0 HG3 GLU B 54 23.947 11.043 12.032 1.00 0.00 H new ATOM 2441 N VAL B 55 24.746 15.513 9.923 1.00 0.00 N ATOM 2442 CA VAL B 55 25.026 16.541 8.924 1.00 0.00 C ATOM 2443 C VAL B 55 24.504 17.914 9.385 1.00 0.00 C ATOM 2444 O VAL B 55 24.419 18.851 8.590 1.00 0.00 O ATOM 2445 CB VAL B 55 24.509 16.074 7.545 1.00 0.00 C ATOM 2446 CG1 VAL B 55 25.304 14.840 7.085 1.00 0.00 C ATOM 2447 CG2 VAL B 55 23.005 15.744 7.529 1.00 0.00 C ATOM 0 H VAL B 55 23.747 15.356 10.059 1.00 0.00 H new ATOM 0 HA VAL B 55 26.101 16.683 8.811 1.00 0.00 H new ATOM 0 HB VAL B 55 24.656 16.911 6.862 1.00 0.00 H new ATOM 0 HG11 VAL B 55 24.937 14.513 6.112 1.00 0.00 H new ATOM 0 HG12 VAL B 55 26.361 15.096 7.007 1.00 0.00 H new ATOM 0 HG13 VAL B 55 25.178 14.035 7.809 1.00 0.00 H new ATOM 0 HG21 VAL B 55 22.713 15.423 6.529 1.00 0.00 H new ATOM 0 HG22 VAL B 55 22.800 14.944 8.241 1.00 0.00 H new ATOM 0 HG23 VAL B 55 22.435 16.631 7.806 1.00 0.00 H new ATOM 2457 N GLY B 56 24.192 18.053 10.680 1.00 0.00 N ATOM 2458 CA GLY B 56 23.808 19.311 11.297 1.00 0.00 C ATOM 2459 C GLY B 56 22.478 19.852 10.771 1.00 0.00 C ATOM 2460 O GLY B 56 22.354 21.069 10.615 1.00 0.00 O ATOM 0 H GLY B 56 24.202 17.271 11.335 1.00 0.00 H new ATOM 0 HA2 GLY B 56 23.737 19.174 12.376 1.00 0.00 H new ATOM 0 HA3 GLY B 56 24.590 20.050 11.121 1.00 0.00 H new ATOM 2464 N ILE B 57 21.495 18.987 10.494 1.00 0.00 N ATOM 2465 CA ILE B 57 20.155 19.407 10.094 1.00 0.00 C ATOM 2466 C ILE B 57 19.257 18.961 11.245 1.00 0.00 C ATOM 2467 O ILE B 57 19.074 17.765 11.472 1.00 0.00 O ATOM 2468 CB ILE B 57 19.770 18.826 8.708 1.00 0.00 C ATOM 2469 CG1 ILE B 57 20.746 19.330 7.617 1.00 0.00 C ATOM 2470 CG2 ILE B 57 18.318 19.197 8.334 1.00 0.00 C ATOM 2471 CD1 ILE B 57 20.523 18.734 6.220 1.00 0.00 C ATOM 0 H ILE B 57 21.611 17.975 10.542 1.00 0.00 H new ATOM 0 HA ILE B 57 20.063 20.483 9.942 1.00 0.00 H new ATOM 0 HB ILE B 57 19.841 17.740 8.770 1.00 0.00 H new ATOM 0 HG12 ILE B 57 20.663 20.415 7.550 1.00 0.00 H new ATOM 0 HG13 ILE B 57 21.765 19.107 7.932 1.00 0.00 H new ATOM 0 HG21 ILE B 57 18.075 18.777 7.358 1.00 0.00 H new ATOM 0 HG22 ILE B 57 17.635 18.795 9.082 1.00 0.00 H new ATOM 0 HG23 ILE B 57 18.218 20.282 8.297 1.00 0.00 H new ATOM 0 HD11 ILE B 57 21.255 19.148 5.527 1.00 0.00 H new ATOM 0 HD12 ILE B 57 20.637 17.651 6.264 1.00 0.00 H new ATOM 0 HD13 ILE B 57 19.518 18.979 5.876 1.00 0.00 H new ATOM 2483 N ASP B 58 18.747 19.916 12.024 1.00 0.00 N ATOM 2484 CA ASP B 58 17.743 19.607 13.033 1.00 0.00 C ATOM 2485 C ASP B 58 16.432 19.243 12.339 1.00 0.00 C ATOM 2486 O ASP B 58 16.027 19.925 11.393 1.00 0.00 O ATOM 2487 CB ASP B 58 17.502 20.791 13.977 1.00 0.00 C ATOM 2488 CG ASP B 58 16.377 20.448 14.963 1.00 0.00 C ATOM 2489 OD1 ASP B 58 16.446 19.350 15.565 1.00 0.00 O ATOM 2490 OD2 ASP B 58 15.429 21.248 15.116 1.00 0.00 O ATOM 0 H ASP B 58 19.012 20.900 11.974 1.00 0.00 H new ATOM 0 HA ASP B 58 18.109 18.771 13.629 1.00 0.00 H new ATOM 0 HB2 ASP B 58 18.416 21.026 14.522 1.00 0.00 H new ATOM 0 HB3 ASP B 58 17.237 21.678 13.402 1.00 0.00 H new ATOM 2495 N ILE B 59 15.750 18.214 12.845 1.00 0.00 N ATOM 2496 CA ILE B 59 14.409 17.836 12.412 1.00 0.00 C ATOM 2497 C ILE B 59 13.502 17.543 13.606 1.00 0.00 C ATOM 2498 O ILE B 59 12.459 16.920 13.429 1.00 0.00 O ATOM 2499 CB ILE B 59 14.427 16.644 11.432 1.00 0.00 C ATOM 2500 CG1 ILE B 59 14.946 15.337 12.071 1.00 0.00 C ATOM 2501 CG2 ILE B 59 15.241 16.972 10.169 1.00 0.00 C ATOM 2502 CD1 ILE B 59 14.615 14.105 11.224 1.00 0.00 C ATOM 0 H ILE B 59 16.123 17.612 13.579 1.00 0.00 H new ATOM 0 HA ILE B 59 14.000 18.691 11.874 1.00 0.00 H new ATOM 0 HB ILE B 59 13.387 16.474 11.155 1.00 0.00 H new ATOM 0 HG12 ILE B 59 16.026 15.404 12.204 1.00 0.00 H new ATOM 0 HG13 ILE B 59 14.509 15.221 13.063 1.00 0.00 H new ATOM 0 HG21 ILE B 59 15.235 16.113 9.499 1.00 0.00 H new ATOM 0 HG22 ILE B 59 14.798 17.830 9.663 1.00 0.00 H new ATOM 0 HG23 ILE B 59 16.268 17.206 10.449 1.00 0.00 H new ATOM 0 HD11 ILE B 59 15.001 13.212 11.715 1.00 0.00 H new ATOM 0 HD12 ILE B 59 13.534 14.020 11.112 1.00 0.00 H new ATOM 0 HD13 ILE B 59 15.074 14.205 10.241 1.00 0.00 H new ATOM 2514 N SER B 60 13.870 17.955 14.821 1.00 0.00 N ATOM 2515 CA SER B 60 13.140 17.574 16.027 1.00 0.00 C ATOM 2516 C SER B 60 11.669 18.052 16.025 1.00 0.00 C ATOM 2517 O SER B 60 10.869 17.585 16.836 1.00 0.00 O ATOM 2518 CB SER B 60 13.899 18.081 17.261 1.00 0.00 C ATOM 2519 OG SER B 60 15.270 17.718 17.207 1.00 0.00 O ATOM 0 H SER B 60 14.675 18.557 14.994 1.00 0.00 H new ATOM 0 HA SER B 60 13.088 16.486 16.055 1.00 0.00 H new ATOM 0 HB2 SER B 60 13.810 19.165 17.326 1.00 0.00 H new ATOM 0 HB3 SER B 60 13.447 17.670 18.163 1.00 0.00 H new ATOM 0 HG SER B 60 15.786 18.449 16.808 1.00 0.00 H new ATOM 2525 N ASN B 61 11.307 18.966 15.114 1.00 0.00 N ATOM 2526 CA ASN B 61 9.962 19.492 14.919 1.00 0.00 C ATOM 2527 C ASN B 61 9.169 18.737 13.835 1.00 0.00 C ATOM 2528 O ASN B 61 7.958 18.931 13.724 1.00 0.00 O ATOM 2529 CB ASN B 61 10.075 20.981 14.551 1.00 0.00 C ATOM 2530 CG ASN B 61 8.710 21.648 14.392 1.00 0.00 C ATOM 2531 OD1 ASN B 61 7.964 21.800 15.356 1.00 0.00 O ATOM 2532 ND2 ASN B 61 8.359 22.071 13.188 1.00 0.00 N ATOM 0 H ASN B 61 11.981 19.374 14.466 1.00 0.00 H new ATOM 0 HA ASN B 61 9.409 19.357 15.848 1.00 0.00 H new ATOM 0 HB2 ASN B 61 10.642 21.501 15.323 1.00 0.00 H new ATOM 0 HB3 ASN B 61 10.635 21.081 13.621 1.00 0.00 H new ATOM 0 HD21 ASN B 61 7.459 22.530 13.051 1.00 0.00 H new ATOM 0 HD22 ASN B 61 8.989 21.938 12.397 1.00 0.00 H new ATOM 2539 N GLN B 62 9.824 17.912 13.004 1.00 0.00 N ATOM 2540 CA GLN B 62 9.190 17.231 11.884 1.00 0.00 C ATOM 2541 C GLN B 62 8.150 16.203 12.363 1.00 0.00 C ATOM 2542 O GLN B 62 8.092 15.820 13.534 1.00 0.00 O ATOM 2543 CB GLN B 62 10.219 16.598 10.935 1.00 0.00 C ATOM 2544 CG GLN B 62 11.022 17.646 10.145 1.00 0.00 C ATOM 2545 CD GLN B 62 11.925 17.068 9.040 1.00 0.00 C ATOM 2546 OE1 GLN B 62 12.627 17.820 8.370 1.00 0.00 O ATOM 2547 NE2 GLN B 62 11.968 15.759 8.829 1.00 0.00 N ATOM 0 H GLN B 62 10.818 17.702 13.098 1.00 0.00 H new ATOM 0 HA GLN B 62 8.658 17.990 11.310 1.00 0.00 H new ATOM 0 HB2 GLN B 62 10.906 15.979 11.512 1.00 0.00 H new ATOM 0 HB3 GLN B 62 9.705 15.938 10.236 1.00 0.00 H new ATOM 0 HG2 GLN B 62 10.325 18.352 9.693 1.00 0.00 H new ATOM 0 HG3 GLN B 62 11.641 18.211 10.842 1.00 0.00 H new ATOM 0 HE21 GLN B 62 11.385 15.133 9.385 1.00 0.00 H new ATOM 0 HE22 GLN B 62 12.584 15.378 8.111 1.00 0.00 H new ATOM 2556 N THR B 63 7.335 15.746 11.418 1.00 0.00 N ATOM 2557 CA THR B 63 6.283 14.751 11.587 1.00 0.00 C ATOM 2558 C THR B 63 6.028 14.109 10.209 1.00 0.00 C ATOM 2559 O THR B 63 6.717 14.446 9.243 1.00 0.00 O ATOM 2560 CB THR B 63 5.047 15.430 12.221 1.00 0.00 C ATOM 2561 OG1 THR B 63 4.099 14.458 12.609 1.00 0.00 O ATOM 2562 CG2 THR B 63 4.369 16.462 11.309 1.00 0.00 C ATOM 0 H THR B 63 7.395 16.081 10.456 1.00 0.00 H new ATOM 0 HA THR B 63 6.560 13.948 12.270 1.00 0.00 H new ATOM 0 HB THR B 63 5.421 15.972 13.090 1.00 0.00 H new ATOM 0 HG1 THR B 63 3.322 14.901 13.010 1.00 0.00 H new ATOM 0 HG21 THR B 63 3.511 16.894 11.824 1.00 0.00 H new ATOM 0 HG22 THR B 63 5.079 17.251 11.062 1.00 0.00 H new ATOM 0 HG23 THR B 63 4.035 15.974 10.393 1.00 0.00 H new ATOM 2570 N SER B 64 5.087 13.174 10.115 1.00 0.00 N ATOM 2571 CA SER B 64 4.631 12.543 8.878 1.00 0.00 C ATOM 2572 C SER B 64 3.119 12.309 9.004 1.00 0.00 C ATOM 2573 O SER B 64 2.502 12.686 10.005 1.00 0.00 O ATOM 2574 CB SER B 64 5.383 11.217 8.632 1.00 0.00 C ATOM 2575 OG SER B 64 6.749 11.416 8.348 1.00 0.00 O ATOM 0 H SER B 64 4.598 12.818 10.937 1.00 0.00 H new ATOM 0 HA SER B 64 4.838 13.187 8.023 1.00 0.00 H new ATOM 0 HB2 SER B 64 5.287 10.580 9.511 1.00 0.00 H new ATOM 0 HB3 SER B 64 4.916 10.687 7.802 1.00 0.00 H new ATOM 0 HG SER B 64 6.840 12.050 7.606 1.00 0.00 H new ATOM 2581 N ASP B 65 2.523 11.637 8.025 1.00 0.00 N ATOM 2582 CA ASP B 65 1.152 11.139 8.065 1.00 0.00 C ATOM 2583 C ASP B 65 1.088 9.894 7.187 1.00 0.00 C ATOM 2584 O ASP B 65 2.054 9.603 6.484 1.00 0.00 O ATOM 2585 CB ASP B 65 0.194 12.207 7.524 1.00 0.00 C ATOM 2586 CG ASP B 65 -1.286 11.856 7.755 1.00 0.00 C ATOM 2587 OD1 ASP B 65 -1.597 11.096 8.698 1.00 0.00 O ATOM 2588 OD2 ASP B 65 -2.155 12.375 7.019 1.00 0.00 O ATOM 0 H ASP B 65 2.998 11.416 7.150 1.00 0.00 H new ATOM 0 HA ASP B 65 0.860 10.902 9.088 1.00 0.00 H new ATOM 0 HB2 ASP B 65 0.415 13.161 8.002 1.00 0.00 H new ATOM 0 HB3 ASP B 65 0.369 12.337 6.456 1.00 0.00 H new ATOM 2593 N ILE B 66 -0.018 9.154 7.194 1.00 0.00 N ATOM 2594 CA ILE B 66 -0.251 8.078 6.246 1.00 0.00 C ATOM 2595 C ILE B 66 -0.311 8.618 4.813 1.00 0.00 C ATOM 2596 O ILE B 66 -0.353 9.835 4.606 1.00 0.00 O ATOM 2597 CB ILE B 66 -1.535 7.326 6.633 1.00 0.00 C ATOM 2598 CG1 ILE B 66 -2.740 8.275 6.770 1.00 0.00 C ATOM 2599 CG2 ILE B 66 -1.260 6.545 7.923 1.00 0.00 C ATOM 2600 CD1 ILE B 66 -4.072 7.551 6.962 1.00 0.00 C ATOM 0 H ILE B 66 -0.778 9.288 7.861 1.00 0.00 H new ATOM 0 HA ILE B 66 0.581 7.374 6.282 1.00 0.00 H new ATOM 0 HB ILE B 66 -1.806 6.630 5.840 1.00 0.00 H new ATOM 0 HG12 ILE B 66 -2.573 8.941 7.617 1.00 0.00 H new ATOM 0 HG13 ILE B 66 -2.802 8.901 5.880 1.00 0.00 H new ATOM 0 HG21 ILE B 66 -2.158 6.002 8.218 1.00 0.00 H new ATOM 0 HG22 ILE B 66 -0.448 5.838 7.754 1.00 0.00 H new ATOM 0 HG23 ILE B 66 -0.978 7.239 8.715 1.00 0.00 H new ATOM 0 HD11 ILE B 66 -4.875 8.283 7.051 1.00 0.00 H new ATOM 0 HD12 ILE B 66 -4.263 6.906 6.104 1.00 0.00 H new ATOM 0 HD13 ILE B 66 -4.030 6.947 7.868 1.00 0.00 H new ATOM 2612 N ILE B 67 -0.329 7.709 3.827 1.00 0.00 N ATOM 2613 CA ILE B 67 -0.517 8.079 2.429 1.00 0.00 C ATOM 2614 C ILE B 67 -1.724 9.019 2.321 1.00 0.00 C ATOM 2615 O ILE B 67 -2.787 8.758 2.896 1.00 0.00 O ATOM 2616 CB ILE B 67 -0.567 6.862 1.463 1.00 0.00 C ATOM 2617 CG1 ILE B 67 -1.990 6.324 1.168 1.00 0.00 C ATOM 2618 CG2 ILE B 67 0.388 5.735 1.903 1.00 0.00 C ATOM 2619 CD1 ILE B 67 -2.061 5.271 0.055 1.00 0.00 C ATOM 0 H ILE B 67 -0.214 6.707 3.981 1.00 0.00 H new ATOM 0 HA ILE B 67 0.365 8.621 2.088 1.00 0.00 H new ATOM 0 HB ILE B 67 -0.213 7.255 0.510 1.00 0.00 H new ATOM 0 HG12 ILE B 67 -2.397 5.894 2.083 1.00 0.00 H new ATOM 0 HG13 ILE B 67 -2.631 7.163 0.897 1.00 0.00 H new ATOM 0 HG21 ILE B 67 0.320 4.905 1.199 1.00 0.00 H new ATOM 0 HG22 ILE B 67 1.411 6.112 1.922 1.00 0.00 H new ATOM 0 HG23 ILE B 67 0.109 5.390 2.899 1.00 0.00 H new ATOM 0 HD11 ILE B 67 -3.095 4.954 -0.080 1.00 0.00 H new ATOM 0 HD12 ILE B 67 -1.688 5.699 -0.875 1.00 0.00 H new ATOM 0 HD13 ILE B 67 -1.450 4.411 0.329 1.00 0.00 H new ATOM 2631 N ASP B 68 -1.543 10.119 1.601 1.00 0.00 N ATOM 2632 CA ASP B 68 -2.533 11.178 1.493 1.00 0.00 C ATOM 2633 C ASP B 68 -2.519 11.704 0.070 1.00 0.00 C ATOM 2634 O ASP B 68 -1.676 12.515 -0.324 1.00 0.00 O ATOM 2635 CB ASP B 68 -2.313 12.294 2.523 1.00 0.00 C ATOM 2636 CG ASP B 68 -3.507 13.272 2.551 1.00 0.00 C ATOM 2637 OD1 ASP B 68 -4.240 13.392 1.545 1.00 0.00 O ATOM 2638 OD2 ASP B 68 -3.741 13.896 3.610 1.00 0.00 O ATOM 0 H ASP B 68 -0.692 10.301 1.069 1.00 0.00 H new ATOM 0 HA ASP B 68 -3.518 10.770 1.720 1.00 0.00 H new ATOM 0 HB2 ASP B 68 -2.174 11.857 3.512 1.00 0.00 H new ATOM 0 HB3 ASP B 68 -1.399 12.838 2.284 1.00 0.00 H new ATOM 2643 N SER B 69 -3.466 11.194 -0.705 1.00 0.00 N ATOM 2644 CA SER B 69 -3.746 11.559 -2.077 1.00 0.00 C ATOM 2645 C SER B 69 -3.813 13.065 -2.330 1.00 0.00 C ATOM 2646 O SER B 69 -3.510 13.496 -3.442 1.00 0.00 O ATOM 2647 CB SER B 69 -5.084 10.909 -2.447 1.00 0.00 C ATOM 2648 OG SER B 69 -5.168 9.579 -1.942 1.00 0.00 O ATOM 0 H SER B 69 -4.097 10.468 -0.365 1.00 0.00 H new ATOM 0 HA SER B 69 -2.920 11.206 -2.695 1.00 0.00 H new ATOM 0 HB2 SER B 69 -5.904 11.505 -2.047 1.00 0.00 H new ATOM 0 HB3 SER B 69 -5.198 10.897 -3.531 1.00 0.00 H new ATOM 0 HG SER B 69 -6.108 9.303 -1.901 1.00 0.00 H new ATOM 2654 N ASP B 70 -4.180 13.883 -1.339 1.00 0.00 N ATOM 2655 CA ASP B 70 -4.401 15.309 -1.552 1.00 0.00 C ATOM 2656 C ASP B 70 -3.075 16.028 -1.773 1.00 0.00 C ATOM 2657 O ASP B 70 -3.044 17.074 -2.420 1.00 0.00 O ATOM 2658 CB ASP B 70 -5.158 15.942 -0.382 1.00 0.00 C ATOM 2659 CG ASP B 70 -5.472 17.424 -0.653 1.00 0.00 C ATOM 2660 OD1 ASP B 70 -6.304 17.716 -1.543 1.00 0.00 O ATOM 2661 OD2 ASP B 70 -4.932 18.302 0.056 1.00 0.00 O ATOM 0 H ASP B 70 -4.330 13.576 -0.378 1.00 0.00 H new ATOM 0 HA ASP B 70 -5.016 15.417 -2.446 1.00 0.00 H new ATOM 0 HB2 ASP B 70 -6.086 15.397 -0.210 1.00 0.00 H new ATOM 0 HB3 ASP B 70 -4.564 15.855 0.528 1.00 0.00 H new ATOM 2666 N ILE B 71 -1.975 15.429 -1.310 1.00 0.00 N ATOM 2667 CA ILE B 71 -0.635 15.922 -1.549 1.00 0.00 C ATOM 2668 C ILE B 71 0.087 14.997 -2.527 1.00 0.00 C ATOM 2669 O ILE B 71 0.754 15.513 -3.421 1.00 0.00 O ATOM 2670 CB ILE B 71 0.184 16.127 -0.252 1.00 0.00 C ATOM 2671 CG1 ILE B 71 -0.302 15.495 1.067 1.00 0.00 C ATOM 2672 CG2 ILE B 71 0.522 17.616 -0.070 1.00 0.00 C ATOM 2673 CD1 ILE B 71 -1.546 16.089 1.738 1.00 0.00 C ATOM 0 H ILE B 71 -2.001 14.576 -0.751 1.00 0.00 H new ATOM 0 HA ILE B 71 -0.728 16.914 -1.991 1.00 0.00 H new ATOM 0 HB ILE B 71 1.070 15.523 -0.445 1.00 0.00 H new ATOM 0 HG12 ILE B 71 -0.497 14.439 0.879 1.00 0.00 H new ATOM 0 HG13 ILE B 71 0.519 15.545 1.783 1.00 0.00 H new ATOM 0 HG21 ILE B 71 1.098 17.749 0.846 1.00 0.00 H new ATOM 0 HG22 ILE B 71 1.108 17.963 -0.921 1.00 0.00 H new ATOM 0 HG23 ILE B 71 -0.400 18.193 -0.005 1.00 0.00 H new ATOM 0 HD11 ILE B 71 -1.763 15.539 2.654 1.00 0.00 H new ATOM 0 HD12 ILE B 71 -1.365 17.137 1.978 1.00 0.00 H new ATOM 0 HD13 ILE B 71 -2.396 16.014 1.060 1.00 0.00 H new ATOM 2685 N LEU B 72 -0.063 13.666 -2.420 1.00 0.00 N ATOM 2686 CA LEU B 72 0.644 12.748 -3.311 1.00 0.00 C ATOM 2687 C LEU B 72 0.214 13.004 -4.748 1.00 0.00 C ATOM 2688 O LEU B 72 1.070 13.277 -5.581 1.00 0.00 O ATOM 2689 CB LEU B 72 0.441 11.274 -2.912 1.00 0.00 C ATOM 2690 CG LEU B 72 1.381 10.302 -3.673 1.00 0.00 C ATOM 2691 CD1 LEU B 72 1.488 8.930 -2.995 1.00 0.00 C ATOM 2692 CD2 LEU B 72 0.957 10.052 -5.131 1.00 0.00 C ATOM 0 H LEU B 72 -0.662 13.211 -1.731 1.00 0.00 H new ATOM 0 HA LEU B 72 1.713 12.939 -3.221 1.00 0.00 H new ATOM 0 HB2 LEU B 72 0.609 11.168 -1.840 1.00 0.00 H new ATOM 0 HB3 LEU B 72 -0.595 10.992 -3.102 1.00 0.00 H new ATOM 0 HG LEU B 72 2.344 10.813 -3.655 1.00 0.00 H new ATOM 0 HD11 LEU B 72 2.158 8.291 -3.570 1.00 0.00 H new ATOM 0 HD12 LEU B 72 1.881 9.053 -1.986 1.00 0.00 H new ATOM 0 HD13 LEU B 72 0.501 8.470 -2.947 1.00 0.00 H new ATOM 0 HD21 LEU B 72 1.659 9.364 -5.601 1.00 0.00 H new ATOM 0 HD22 LEU B 72 -0.043 9.619 -5.150 1.00 0.00 H new ATOM 0 HD23 LEU B 72 0.954 10.996 -5.676 1.00 0.00 H new ATOM 2704 N ASN B 73 -1.091 12.971 -5.052 1.00 0.00 N ATOM 2705 CA ASN B 73 -1.554 13.116 -6.434 1.00 0.00 C ATOM 2706 C ASN B 73 -1.225 14.512 -7.002 1.00 0.00 C ATOM 2707 O ASN B 73 -1.146 14.676 -8.217 1.00 0.00 O ATOM 2708 CB ASN B 73 -3.048 12.750 -6.597 1.00 0.00 C ATOM 2709 CG ASN B 73 -3.939 13.959 -6.874 1.00 0.00 C ATOM 2710 OD1 ASN B 73 -4.349 14.188 -8.008 1.00 0.00 O ATOM 2711 ND2 ASN B 73 -4.232 14.756 -5.861 1.00 0.00 N ATOM 0 H ASN B 73 -1.835 12.846 -4.366 1.00 0.00 H new ATOM 0 HA ASN B 73 -0.999 12.392 -7.031 1.00 0.00 H new ATOM 0 HB2 ASN B 73 -3.153 12.035 -7.413 1.00 0.00 H new ATOM 0 HB3 ASN B 73 -3.394 12.252 -5.691 1.00 0.00 H new ATOM 0 HD21 ASN B 73 -4.811 15.582 -6.013 1.00 0.00 H new ATOM 0 HD22 ASN B 73 -3.880 14.545 -4.927 1.00 0.00 H new ATOM 2718 N ASN B 74 -1.033 15.513 -6.129 1.00 0.00 N ATOM 2719 CA ASN B 74 -0.624 16.866 -6.492 1.00 0.00 C ATOM 2720 C ASN B 74 0.895 17.016 -6.644 1.00 0.00 C ATOM 2721 O ASN B 74 1.344 18.053 -7.137 1.00 0.00 O ATOM 2722 CB ASN B 74 -1.137 17.884 -5.453 1.00 0.00 C ATOM 2723 CG ASN B 74 -2.522 18.418 -5.808 1.00 0.00 C ATOM 2724 OD1 ASN B 74 -2.750 18.912 -6.909 1.00 0.00 O ATOM 2725 ND2 ASN B 74 -3.475 18.339 -4.896 1.00 0.00 N ATOM 0 H ASN B 74 -1.163 15.393 -5.124 1.00 0.00 H new ATOM 0 HA ASN B 74 -1.070 17.066 -7.466 1.00 0.00 H new ATOM 0 HB2 ASN B 74 -1.171 17.413 -4.471 1.00 0.00 H new ATOM 0 HB3 ASN B 74 -0.435 18.715 -5.383 1.00 0.00 H new ATOM 0 HD21 ASN B 74 -4.410 18.690 -5.104 1.00 0.00 H new ATOM 0 HD22 ASN B 74 -3.276 17.927 -3.984 1.00 0.00 H new ATOM 2732 N ALA B 75 1.696 16.040 -6.203 1.00 0.00 N ATOM 2733 CA ALA B 75 3.142 16.083 -6.313 1.00 0.00 C ATOM 2734 C ALA B 75 3.571 16.012 -7.779 1.00 0.00 C ATOM 2735 O ALA B 75 2.790 15.671 -8.671 1.00 0.00 O ATOM 2736 CB ALA B 75 3.781 14.969 -5.471 1.00 0.00 C ATOM 0 H ALA B 75 1.346 15.193 -5.756 1.00 0.00 H new ATOM 0 HA ALA B 75 3.498 17.034 -5.916 1.00 0.00 H new ATOM 0 HB1 ALA B 75 4.866 15.018 -5.566 1.00 0.00 H new ATOM 0 HB2 ALA B 75 3.503 15.098 -4.425 1.00 0.00 H new ATOM 0 HB3 ALA B 75 3.429 13.999 -5.823 1.00 0.00 H new ATOM 2742 N ASP B 76 4.844 16.313 -8.010 1.00 0.00 N ATOM 2743 CA ASP B 76 5.506 16.102 -9.298 1.00 0.00 C ATOM 2744 C ASP B 76 6.124 14.703 -9.367 1.00 0.00 C ATOM 2745 O ASP B 76 6.088 14.065 -10.420 1.00 0.00 O ATOM 2746 CB ASP B 76 6.603 17.151 -9.509 1.00 0.00 C ATOM 2747 CG ASP B 76 7.309 16.935 -10.858 1.00 0.00 C ATOM 2748 OD1 ASP B 76 6.712 17.251 -11.911 1.00 0.00 O ATOM 2749 OD2 ASP B 76 8.477 16.488 -10.868 1.00 0.00 O ATOM 0 H ASP B 76 5.456 16.716 -7.300 1.00 0.00 H new ATOM 0 HA ASP B 76 4.755 16.198 -10.083 1.00 0.00 H new ATOM 0 HB2 ASP B 76 6.169 18.150 -9.476 1.00 0.00 H new ATOM 0 HB3 ASP B 76 7.330 17.092 -8.699 1.00 0.00 H new ATOM 2754 N LEU B 77 6.639 14.199 -8.238 1.00 0.00 N ATOM 2755 CA LEU B 77 7.403 12.965 -8.145 1.00 0.00 C ATOM 2756 C LEU B 77 7.123 12.282 -6.807 1.00 0.00 C ATOM 2757 O LEU B 77 7.134 12.937 -5.763 1.00 0.00 O ATOM 2758 CB LEU B 77 8.904 13.299 -8.303 1.00 0.00 C ATOM 2759 CG LEU B 77 9.910 12.195 -7.904 1.00 0.00 C ATOM 2760 CD1 LEU B 77 9.806 10.885 -8.689 1.00 0.00 C ATOM 2761 CD2 LEU B 77 11.332 12.746 -8.039 1.00 0.00 C ATOM 0 H LEU B 77 6.527 14.662 -7.336 1.00 0.00 H new ATOM 0 HA LEU B 77 7.110 12.276 -8.937 1.00 0.00 H new ATOM 0 HB2 LEU B 77 9.085 13.563 -9.345 1.00 0.00 H new ATOM 0 HB3 LEU B 77 9.119 14.186 -7.707 1.00 0.00 H new ATOM 0 HG LEU B 77 9.659 11.934 -6.876 1.00 0.00 H new ATOM 0 HD11 LEU B 77 10.557 10.183 -8.327 1.00 0.00 H new ATOM 0 HD12 LEU B 77 8.813 10.456 -8.552 1.00 0.00 H new ATOM 0 HD13 LEU B 77 9.973 11.081 -9.748 1.00 0.00 H new ATOM 0 HD21 LEU B 77 12.049 11.974 -7.760 1.00 0.00 H new ATOM 0 HD22 LEU B 77 11.508 13.049 -9.071 1.00 0.00 H new ATOM 0 HD23 LEU B 77 11.452 13.608 -7.382 1.00 0.00 H new ATOM 2773 N VAL B 78 6.923 10.964 -6.854 1.00 0.00 N ATOM 2774 CA VAL B 78 6.855 10.075 -5.702 1.00 0.00 C ATOM 2775 C VAL B 78 8.169 9.320 -5.685 1.00 0.00 C ATOM 2776 O VAL B 78 8.427 8.448 -6.515 1.00 0.00 O ATOM 2777 CB VAL B 78 5.618 9.163 -5.733 1.00 0.00 C ATOM 2778 CG1 VAL B 78 5.481 8.446 -4.380 1.00 0.00 C ATOM 2779 CG2 VAL B 78 4.343 9.962 -6.024 1.00 0.00 C ATOM 0 H VAL B 78 6.799 10.469 -7.737 1.00 0.00 H new ATOM 0 HA VAL B 78 6.729 10.633 -4.774 1.00 0.00 H new ATOM 0 HB VAL B 78 5.749 8.434 -6.532 1.00 0.00 H new ATOM 0 HG11 VAL B 78 4.605 7.798 -4.399 1.00 0.00 H new ATOM 0 HG12 VAL B 78 6.372 7.846 -4.194 1.00 0.00 H new ATOM 0 HG13 VAL B 78 5.369 9.185 -3.586 1.00 0.00 H new ATOM 0 HG21 VAL B 78 3.487 9.288 -6.039 1.00 0.00 H new ATOM 0 HG22 VAL B 78 4.199 10.714 -5.248 1.00 0.00 H new ATOM 0 HG23 VAL B 78 4.435 10.454 -6.992 1.00 0.00 H new ATOM 2789 N VAL B 79 9.029 9.708 -4.759 1.00 0.00 N ATOM 2790 CA VAL B 79 10.229 8.977 -4.470 1.00 0.00 C ATOM 2791 C VAL B 79 9.844 7.830 -3.548 1.00 0.00 C ATOM 2792 O VAL B 79 9.485 8.051 -2.385 1.00 0.00 O ATOM 2793 CB VAL B 79 11.261 9.895 -3.807 1.00 0.00 C ATOM 2794 CG1 VAL B 79 12.502 9.066 -3.462 1.00 0.00 C ATOM 2795 CG2 VAL B 79 11.633 11.065 -4.722 1.00 0.00 C ATOM 0 H VAL B 79 8.905 10.545 -4.189 1.00 0.00 H new ATOM 0 HA VAL B 79 10.682 8.590 -5.383 1.00 0.00 H new ATOM 0 HB VAL B 79 10.833 10.319 -2.899 1.00 0.00 H new ATOM 0 HG11 VAL B 79 13.247 9.706 -2.989 1.00 0.00 H new ATOM 0 HG12 VAL B 79 12.225 8.264 -2.778 1.00 0.00 H new ATOM 0 HG13 VAL B 79 12.918 8.637 -4.374 1.00 0.00 H new ATOM 0 HG21 VAL B 79 12.367 11.698 -4.223 1.00 0.00 H new ATOM 0 HG22 VAL B 79 12.056 10.681 -5.650 1.00 0.00 H new ATOM 0 HG23 VAL B 79 10.741 11.650 -4.945 1.00 0.00 H new ATOM 2805 N THR B 80 9.882 6.605 -4.058 1.00 0.00 N ATOM 2806 CA THR B 80 9.783 5.466 -3.173 1.00 0.00 C ATOM 2807 C THR B 80 11.076 5.463 -2.367 1.00 0.00 C ATOM 2808 O THR B 80 12.172 5.546 -2.934 1.00 0.00 O ATOM 2809 CB THR B 80 9.658 4.138 -3.925 1.00 0.00 C ATOM 2810 OG1 THR B 80 8.837 4.243 -5.075 1.00 0.00 O ATOM 2811 CG2 THR B 80 9.094 3.059 -3.012 1.00 0.00 C ATOM 0 H THR B 80 9.978 6.384 -5.049 1.00 0.00 H new ATOM 0 HA THR B 80 8.888 5.553 -2.558 1.00 0.00 H new ATOM 0 HB THR B 80 10.664 3.869 -4.249 1.00 0.00 H new ATOM 0 HG1 THR B 80 8.902 3.418 -5.600 1.00 0.00 H new ATOM 0 HG21 THR B 80 9.012 2.122 -3.563 1.00 0.00 H new ATOM 0 HG22 THR B 80 9.758 2.921 -2.159 1.00 0.00 H new ATOM 0 HG23 THR B 80 8.107 3.360 -2.659 1.00 0.00 H new ATOM 2819 N LEU B 81 10.948 5.319 -1.056 1.00 0.00 N ATOM 2820 CA LEU B 81 12.056 5.085 -0.165 1.00 0.00 C ATOM 2821 C LEU B 81 11.817 3.745 0.506 1.00 0.00 C ATOM 2822 O LEU B 81 10.692 3.269 0.653 1.00 0.00 O ATOM 2823 CB LEU B 81 12.188 6.206 0.875 1.00 0.00 C ATOM 2824 CG LEU B 81 12.634 7.569 0.324 1.00 0.00 C ATOM 2825 CD1 LEU B 81 12.861 8.516 1.502 1.00 0.00 C ATOM 2826 CD2 LEU B 81 13.930 7.521 -0.496 1.00 0.00 C ATOM 0 H LEU B 81 10.047 5.364 -0.580 1.00 0.00 H new ATOM 0 HA LEU B 81 12.992 5.074 -0.723 1.00 0.00 H new ATOM 0 HB2 LEU B 81 11.226 6.332 1.372 1.00 0.00 H new ATOM 0 HB3 LEU B 81 12.902 5.890 1.636 1.00 0.00 H new ATOM 0 HG LEU B 81 11.843 7.905 -0.346 1.00 0.00 H new ATOM 0 HD11 LEU B 81 13.179 9.490 1.130 1.00 0.00 H new ATOM 0 HD12 LEU B 81 11.933 8.627 2.064 1.00 0.00 H new ATOM 0 HD13 LEU B 81 13.633 8.107 2.154 1.00 0.00 H new ATOM 0 HD21 LEU B 81 14.175 8.523 -0.848 1.00 0.00 H new ATOM 0 HD22 LEU B 81 14.742 7.147 0.128 1.00 0.00 H new ATOM 0 HD23 LEU B 81 13.795 6.859 -1.351 1.00 0.00 H new ATOM 2838 N SER B 82 12.934 3.129 0.843 1.00 0.00 N ATOM 2839 CA SER B 82 13.105 1.889 1.596 1.00 0.00 C ATOM 2840 C SER B 82 12.843 0.659 0.724 1.00 0.00 C ATOM 2841 O SER B 82 13.478 -0.378 0.915 1.00 0.00 O ATOM 2842 CB SER B 82 12.169 1.781 2.818 1.00 0.00 C ATOM 2843 OG SER B 82 12.252 2.869 3.711 1.00 0.00 O ATOM 0 H SER B 82 13.837 3.519 0.572 1.00 0.00 H new ATOM 0 HA SER B 82 14.140 1.918 1.935 1.00 0.00 H new ATOM 0 HB2 SER B 82 11.141 1.692 2.467 1.00 0.00 H new ATOM 0 HB3 SER B 82 12.401 0.864 3.359 1.00 0.00 H new ATOM 0 HG SER B 82 12.432 2.537 4.615 1.00 0.00 H new ATOM 2849 N GLY B 83 11.918 0.788 -0.228 1.00 0.00 N ATOM 2850 CA GLY B 83 11.369 -0.303 -1.000 1.00 0.00 C ATOM 2851 C GLY B 83 10.104 -0.719 -0.260 1.00 0.00 C ATOM 2852 O GLY B 83 10.039 -0.630 0.972 1.00 0.00 O ATOM 0 H GLY B 83 11.523 1.693 -0.484 1.00 0.00 H new ATOM 0 HA2 GLY B 83 11.144 0.010 -2.019 1.00 0.00 H new ATOM 0 HA3 GLY B 83 12.075 -1.131 -1.069 1.00 0.00 H new ATOM 2856 N ASP B 84 9.076 -1.148 -0.991 1.00 0.00 N ATOM 2857 CA ASP B 84 7.905 -1.707 -0.331 1.00 0.00 C ATOM 2858 C ASP B 84 8.319 -3.026 0.322 1.00 0.00 C ATOM 2859 O ASP B 84 8.857 -3.911 -0.351 1.00 0.00 O ATOM 2860 CB ASP B 84 6.747 -1.946 -1.307 1.00 0.00 C ATOM 2861 CG ASP B 84 5.703 -2.877 -0.666 1.00 0.00 C ATOM 2862 OD1 ASP B 84 5.062 -2.460 0.324 1.00 0.00 O ATOM 2863 OD2 ASP B 84 5.558 -4.026 -1.137 1.00 0.00 O ATOM 0 H ASP B 84 9.031 -1.120 -2.010 1.00 0.00 H new ATOM 0 HA ASP B 84 7.546 -0.995 0.412 1.00 0.00 H new ATOM 0 HB2 ASP B 84 6.284 -0.996 -1.575 1.00 0.00 H new ATOM 0 HB3 ASP B 84 7.123 -2.388 -2.229 1.00 0.00 H new ATOM 2868 N ALA B 85 8.051 -3.155 1.619 1.00 0.00 N ATOM 2869 CA ALA B 85 8.207 -4.395 2.370 1.00 0.00 C ATOM 2870 C ALA B 85 6.922 -4.726 3.135 1.00 0.00 C ATOM 2871 O ALA B 85 6.627 -5.906 3.341 1.00 0.00 O ATOM 2872 CB ALA B 85 9.404 -4.272 3.319 1.00 0.00 C ATOM 0 H ALA B 85 7.711 -2.381 2.189 1.00 0.00 H new ATOM 0 HA ALA B 85 8.396 -5.215 1.677 1.00 0.00 H new ATOM 0 HB1 ALA B 85 9.520 -5.199 3.880 1.00 0.00 H new ATOM 0 HB2 ALA B 85 10.308 -4.082 2.741 1.00 0.00 H new ATOM 0 HB3 ALA B 85 9.236 -3.447 4.012 1.00 0.00 H new ATOM 2878 N ALA B 86 6.148 -3.707 3.525 1.00 0.00 N ATOM 2879 CA ALA B 86 4.858 -3.846 4.194 1.00 0.00 C ATOM 2880 C ALA B 86 4.020 -2.570 3.994 1.00 0.00 C ATOM 2881 O ALA B 86 3.130 -2.290 4.791 1.00 0.00 O ATOM 2882 CB ALA B 86 5.103 -4.132 5.692 1.00 0.00 C ATOM 0 H ALA B 86 6.414 -2.734 3.377 1.00 0.00 H new ATOM 0 HA ALA B 86 4.298 -4.677 3.765 1.00 0.00 H new ATOM 0 HB1 ALA B 86 4.146 -4.238 6.203 1.00 0.00 H new ATOM 0 HB2 ALA B 86 5.675 -5.054 5.798 1.00 0.00 H new ATOM 0 HB3 ALA B 86 5.661 -3.306 6.134 1.00 0.00 H new ATOM 2888 N ASP B 87 4.300 -1.761 2.965 1.00 0.00 N ATOM 2889 CA ASP B 87 3.737 -0.416 2.796 1.00 0.00 C ATOM 2890 C ASP B 87 2.361 -0.401 2.108 1.00 0.00 C ATOM 2891 O ASP B 87 1.959 0.629 1.576 1.00 0.00 O ATOM 2892 CB ASP B 87 4.720 0.465 2.007 1.00 0.00 C ATOM 2893 CG ASP B 87 4.504 1.957 2.319 1.00 0.00 C ATOM 2894 OD1 ASP B 87 4.242 2.284 3.503 1.00 0.00 O ATOM 2895 OD2 ASP B 87 4.683 2.785 1.398 1.00 0.00 O ATOM 0 H ASP B 87 4.936 -2.028 2.213 1.00 0.00 H new ATOM 0 HA ASP B 87 3.585 -0.020 3.800 1.00 0.00 H new ATOM 0 HB2 ASP B 87 5.744 0.184 2.254 1.00 0.00 H new ATOM 0 HB3 ASP B 87 4.591 0.292 0.939 1.00 0.00 H new ATOM 2900 N LYS B 88 1.641 -1.532 2.075 1.00 0.00 N ATOM 2901 CA LYS B 88 0.418 -1.762 1.280 1.00 0.00 C ATOM 2902 C LYS B 88 0.592 -1.449 -0.220 1.00 0.00 C ATOM 2903 O LYS B 88 -0.358 -1.016 -0.878 1.00 0.00 O ATOM 2904 CB LYS B 88 -0.865 -1.188 1.936 1.00 0.00 C ATOM 2905 CG LYS B 88 -0.959 0.345 2.056 1.00 0.00 C ATOM 2906 CD LYS B 88 -2.359 0.873 2.411 1.00 0.00 C ATOM 2907 CE LYS B 88 -2.704 0.881 3.910 1.00 0.00 C ATOM 2908 NZ LYS B 88 -3.143 -0.435 4.451 1.00 0.00 N ATOM 0 H LYS B 88 1.904 -2.350 2.625 1.00 0.00 H new ATOM 0 HA LYS B 88 0.250 -2.839 1.297 1.00 0.00 H new ATOM 0 HB2 LYS B 88 -1.724 -1.537 1.363 1.00 0.00 H new ATOM 0 HB3 LYS B 88 -0.954 -1.613 2.936 1.00 0.00 H new ATOM 0 HG2 LYS B 88 -0.254 0.681 2.817 1.00 0.00 H new ATOM 0 HG3 LYS B 88 -0.645 0.790 1.112 1.00 0.00 H new ATOM 0 HD2 LYS B 88 -2.452 1.890 2.029 1.00 0.00 H new ATOM 0 HD3 LYS B 88 -3.100 0.267 1.889 1.00 0.00 H new ATOM 0 HE2 LYS B 88 -1.830 1.216 4.469 1.00 0.00 H new ATOM 0 HE3 LYS B 88 -3.493 1.612 4.084 1.00 0.00 H new ATOM 0 HZ1 LYS B 88 -2.816 -0.533 5.433 1.00 0.00 H new ATOM 0 HZ2 LYS B 88 -4.181 -0.493 4.424 1.00 0.00 H new ATOM 0 HZ3 LYS B 88 -2.739 -1.200 3.874 1.00 0.00 H new ATOM 2922 N CYS B 89 1.793 -1.730 -0.751 1.00 0.00 N ATOM 2923 CA CYS B 89 2.181 -1.684 -2.168 1.00 0.00 C ATOM 2924 C CYS B 89 1.542 -0.522 -2.963 1.00 0.00 C ATOM 2925 O CYS B 89 0.914 -0.787 -3.990 1.00 0.00 O ATOM 2926 CB CYS B 89 1.864 -3.044 -2.825 1.00 0.00 C ATOM 2927 SG CYS B 89 2.200 -4.549 -1.866 1.00 0.00 S ATOM 0 H CYS B 89 2.573 -2.015 -0.158 1.00 0.00 H new ATOM 0 HA CYS B 89 3.253 -1.488 -2.197 1.00 0.00 H new ATOM 0 HB2 CYS B 89 0.808 -3.048 -3.094 1.00 0.00 H new ATOM 0 HB3 CYS B 89 2.430 -3.106 -3.755 1.00 0.00 H new ATOM 2932 N PRO B 90 1.641 0.747 -2.518 1.00 0.00 N ATOM 2933 CA PRO B 90 0.872 1.849 -3.087 1.00 0.00 C ATOM 2934 C PRO B 90 1.006 1.956 -4.606 1.00 0.00 C ATOM 2935 O PRO B 90 2.131 1.956 -5.118 1.00 0.00 O ATOM 2936 CB PRO B 90 1.355 3.122 -2.384 1.00 0.00 C ATOM 2937 CG PRO B 90 1.946 2.593 -1.079 1.00 0.00 C ATOM 2938 CD PRO B 90 2.563 1.270 -1.525 1.00 0.00 C ATOM 0 HA PRO B 90 -0.192 1.682 -2.921 1.00 0.00 H new ATOM 0 HB2 PRO B 90 2.099 3.653 -2.978 1.00 0.00 H new ATOM 0 HB3 PRO B 90 0.536 3.818 -2.203 1.00 0.00 H new ATOM 0 HG2 PRO B 90 2.691 3.272 -0.664 1.00 0.00 H new ATOM 0 HG3 PRO B 90 1.183 2.450 -0.314 1.00 0.00 H new ATOM 0 HD2 PRO B 90 3.557 1.419 -1.948 1.00 0.00 H new ATOM 0 HD3 PRO B 90 2.673 0.582 -0.687 1.00 0.00 H new ATOM 2946 N MET B 91 -0.117 2.066 -5.326 1.00 0.00 N ATOM 2947 CA MET B 91 -0.092 2.078 -6.790 1.00 0.00 C ATOM 2948 C MET B 91 0.169 3.449 -7.426 1.00 0.00 C ATOM 2949 O MET B 91 0.228 3.485 -8.655 1.00 0.00 O ATOM 2950 CB MET B 91 -1.317 1.375 -7.377 1.00 0.00 C ATOM 2951 CG MET B 91 -2.617 1.902 -6.819 1.00 0.00 C ATOM 2952 SD MET B 91 -3.138 3.441 -7.592 1.00 0.00 S ATOM 2953 CE MET B 91 -4.779 3.289 -6.917 1.00 0.00 C ATOM 0 H MET B 91 -1.049 2.147 -4.919 1.00 0.00 H new ATOM 0 HA MET B 91 0.789 1.498 -7.064 1.00 0.00 H new ATOM 0 HB2 MET B 91 -1.316 1.497 -8.460 1.00 0.00 H new ATOM 0 HB3 MET B 91 -1.248 0.306 -7.176 1.00 0.00 H new ATOM 0 HG2 MET B 91 -3.396 1.151 -6.955 1.00 0.00 H new ATOM 0 HG3 MET B 91 -2.509 2.059 -5.746 1.00 0.00 H new ATOM 0 HE1 MET B 91 -5.315 4.229 -7.049 1.00 0.00 H new ATOM 0 HE2 MET B 91 -5.312 2.491 -7.434 1.00 0.00 H new ATOM 0 HE3 MET B 91 -4.715 3.054 -5.855 1.00 0.00 H new ATOM 2963 N THR B 92 0.365 4.531 -6.643 1.00 0.00 N ATOM 2964 CA THR B 92 0.829 5.847 -7.121 1.00 0.00 C ATOM 2965 C THR B 92 0.088 6.338 -8.390 1.00 0.00 C ATOM 2966 O THR B 92 0.537 6.063 -9.508 1.00 0.00 O ATOM 2967 CB THR B 92 2.365 5.862 -7.297 1.00 0.00 C ATOM 2968 OG1 THR B 92 2.822 4.695 -7.955 1.00 0.00 O ATOM 2969 CG2 THR B 92 3.104 5.954 -5.955 1.00 0.00 C ATOM 0 H THR B 92 0.200 4.511 -5.637 1.00 0.00 H new ATOM 0 HA THR B 92 0.573 6.568 -6.345 1.00 0.00 H new ATOM 0 HB THR B 92 2.581 6.747 -7.895 1.00 0.00 H new ATOM 0 HG1 THR B 92 2.219 4.481 -8.698 1.00 0.00 H new ATOM 0 HG21 THR B 92 4.180 5.961 -6.132 1.00 0.00 H new ATOM 0 HG22 THR B 92 2.814 6.871 -5.442 1.00 0.00 H new ATOM 0 HG23 THR B 92 2.844 5.095 -5.337 1.00 0.00 H new ATOM 2977 N PRO B 93 -1.041 7.059 -8.250 1.00 0.00 N ATOM 2978 CA PRO B 93 -1.924 7.382 -9.365 1.00 0.00 C ATOM 2979 C PRO B 93 -1.144 8.133 -10.472 1.00 0.00 C ATOM 2980 O PRO B 93 -0.282 8.959 -10.156 1.00 0.00 O ATOM 2981 CB PRO B 93 -3.092 8.161 -8.734 1.00 0.00 C ATOM 2982 CG PRO B 93 -2.471 8.802 -7.500 1.00 0.00 C ATOM 2983 CD PRO B 93 -1.518 7.703 -7.037 1.00 0.00 C ATOM 0 HA PRO B 93 -2.321 6.510 -9.885 1.00 0.00 H new ATOM 0 HB2 PRO B 93 -3.490 8.911 -9.418 1.00 0.00 H new ATOM 0 HB3 PRO B 93 -3.918 7.501 -8.470 1.00 0.00 H new ATOM 0 HG2 PRO B 93 -1.946 9.727 -7.738 1.00 0.00 H new ATOM 0 HG3 PRO B 93 -3.217 9.044 -6.743 1.00 0.00 H new ATOM 0 HD2 PRO B 93 -0.690 8.119 -6.463 1.00 0.00 H new ATOM 0 HD3 PRO B 93 -2.028 6.990 -6.390 1.00 0.00 H new ATOM 2991 N PRO B 94 -1.444 7.892 -11.765 1.00 0.00 N ATOM 2992 CA PRO B 94 -0.651 8.347 -12.915 1.00 0.00 C ATOM 2993 C PRO B 94 -0.576 9.867 -13.129 1.00 0.00 C ATOM 2994 O PRO B 94 0.030 10.316 -14.105 1.00 0.00 O ATOM 2995 CB PRO B 94 -1.238 7.619 -14.135 1.00 0.00 C ATOM 2996 CG PRO B 94 -2.673 7.313 -13.718 1.00 0.00 C ATOM 2997 CD PRO B 94 -2.509 7.018 -12.233 1.00 0.00 C ATOM 0 HA PRO B 94 0.395 8.100 -12.735 1.00 0.00 H new ATOM 0 HB2 PRO B 94 -1.205 8.243 -15.028 1.00 0.00 H new ATOM 0 HB3 PRO B 94 -0.684 6.708 -14.362 1.00 0.00 H new ATOM 0 HG2 PRO B 94 -3.339 8.157 -13.896 1.00 0.00 H new ATOM 0 HG3 PRO B 94 -3.084 6.462 -14.261 1.00 0.00 H new ATOM 0 HD2 PRO B 94 -3.436 7.209 -11.693 1.00 0.00 H new ATOM 0 HD3 PRO B 94 -2.255 5.971 -12.069 1.00 0.00 H new ATOM 3005 N HIS B 95 -1.147 10.675 -12.233 1.00 0.00 N ATOM 3006 CA HIS B 95 -0.965 12.121 -12.223 1.00 0.00 C ATOM 3007 C HIS B 95 0.482 12.518 -11.857 1.00 0.00 C ATOM 3008 O HIS B 95 0.816 13.701 -11.942 1.00 0.00 O ATOM 3009 CB HIS B 95 -1.943 12.758 -11.214 1.00 0.00 C ATOM 3010 CG HIS B 95 -3.417 12.465 -11.412 1.00 0.00 C ATOM 3011 ND1 HIS B 95 -4.419 12.785 -10.521 1.00 0.00 N ATOM 3012 CD2 HIS B 95 -4.022 11.865 -12.488 1.00 0.00 C ATOM 3013 CE1 HIS B 95 -5.590 12.377 -11.038 1.00 0.00 C ATOM 3014 NE2 HIS B 95 -5.400 11.806 -12.242 1.00 0.00 N ATOM 0 H HIS B 95 -1.755 10.336 -11.487 1.00 0.00 H new ATOM 0 HA HIS B 95 -1.168 12.488 -13.229 1.00 0.00 H new ATOM 0 HB2 HIS B 95 -1.662 12.427 -10.214 1.00 0.00 H new ATOM 0 HB3 HIS B 95 -1.805 13.839 -11.243 1.00 0.00 H new ATOM 0 HD1 HIS B 95 -4.293 13.252 -9.623 1.00 0.00 H new ATOM 0 HD2 HIS B 95 -3.521 11.501 -13.373 1.00 0.00 H new ATOM 0 HE1 HIS B 95 -6.549 12.491 -10.555 1.00 0.00 H new ATOM 3022 N VAL B 96 1.341 11.569 -11.453 1.00 0.00 N ATOM 3023 CA VAL B 96 2.651 11.846 -10.864 1.00 0.00 C ATOM 3024 C VAL B 96 3.727 10.928 -11.457 1.00 0.00 C ATOM 3025 O VAL B 96 3.438 9.791 -11.845 1.00 0.00 O ATOM 3026 CB VAL B 96 2.547 11.651 -9.329 1.00 0.00 C ATOM 3027 CG1 VAL B 96 3.676 12.395 -8.611 1.00 0.00 C ATOM 3028 CG2 VAL B 96 1.221 12.140 -8.726 1.00 0.00 C ATOM 0 H VAL B 96 1.137 10.573 -11.530 1.00 0.00 H new ATOM 0 HA VAL B 96 2.944 12.871 -11.089 1.00 0.00 H new ATOM 0 HB VAL B 96 2.615 10.573 -9.180 1.00 0.00 H new ATOM 0 HG11 VAL B 96 3.584 12.245 -7.535 1.00 0.00 H new ATOM 0 HG12 VAL B 96 4.638 12.011 -8.950 1.00 0.00 H new ATOM 0 HG13 VAL B 96 3.611 13.460 -8.836 1.00 0.00 H new ATOM 0 HG21 VAL B 96 1.226 11.969 -7.650 1.00 0.00 H new ATOM 0 HG22 VAL B 96 1.102 13.205 -8.924 1.00 0.00 H new ATOM 0 HG23 VAL B 96 0.393 11.593 -9.177 1.00 0.00 H new ATOM 3038 N LYS B 97 4.975 11.413 -11.518 1.00 0.00 N ATOM 3039 CA LYS B 97 6.153 10.612 -11.849 1.00 0.00 C ATOM 3040 C LYS B 97 6.511 9.760 -10.628 1.00 0.00 C ATOM 3041 O LYS B 97 6.180 10.136 -9.502 1.00 0.00 O ATOM 3042 CB LYS B 97 7.271 11.592 -12.263 1.00 0.00 C ATOM 3043 CG LYS B 97 8.426 10.937 -13.037 1.00 0.00 C ATOM 3044 CD LYS B 97 9.712 10.804 -12.221 1.00 0.00 C ATOM 3045 CE LYS B 97 10.423 12.140 -11.910 1.00 0.00 C ATOM 3046 NZ LYS B 97 10.759 12.929 -13.120 1.00 0.00 N ATOM 0 H LYS B 97 5.194 12.392 -11.334 1.00 0.00 H new ATOM 0 HA LYS B 97 5.985 9.925 -12.678 1.00 0.00 H new ATOM 0 HB2 LYS B 97 6.838 12.381 -12.877 1.00 0.00 H new ATOM 0 HB3 LYS B 97 7.672 12.068 -11.368 1.00 0.00 H new ATOM 0 HG2 LYS B 97 8.114 9.948 -13.371 1.00 0.00 H new ATOM 0 HG3 LYS B 97 8.632 11.525 -13.931 1.00 0.00 H new ATOM 0 HD2 LYS B 97 9.479 10.305 -11.280 1.00 0.00 H new ATOM 0 HD3 LYS B 97 10.404 10.158 -12.762 1.00 0.00 H new ATOM 0 HE2 LYS B 97 9.784 12.739 -11.261 1.00 0.00 H new ATOM 0 HE3 LYS B 97 11.338 11.934 -11.355 1.00 0.00 H new ATOM 0 HZ1 LYS B 97 11.233 13.811 -12.839 1.00 0.00 H new ATOM 0 HZ2 LYS B 97 11.393 12.375 -13.731 1.00 0.00 H new ATOM 0 HZ3 LYS B 97 9.887 13.155 -13.640 1.00 0.00 H new ATOM 3060 N ARG B 98 7.238 8.654 -10.791 1.00 0.00 N ATOM 3061 CA ARG B 98 7.723 7.863 -9.658 1.00 0.00 C ATOM 3062 C ARG B 98 9.105 7.319 -9.984 1.00 0.00 C ATOM 3063 O ARG B 98 9.382 7.002 -11.141 1.00 0.00 O ATOM 3064 CB ARG B 98 6.724 6.731 -9.343 1.00 0.00 C ATOM 3065 CG ARG B 98 7.050 5.967 -8.047 1.00 0.00 C ATOM 3066 CD ARG B 98 6.174 4.723 -7.909 1.00 0.00 C ATOM 3067 NE ARG B 98 6.440 4.041 -6.633 1.00 0.00 N ATOM 3068 CZ ARG B 98 5.637 3.202 -5.976 1.00 0.00 C ATOM 3069 NH1 ARG B 98 4.405 2.950 -6.402 1.00 0.00 N ATOM 3070 NH2 ARG B 98 6.102 2.626 -4.874 1.00 0.00 N ATOM 0 H ARG B 98 7.506 8.283 -11.703 1.00 0.00 H new ATOM 0 HA ARG B 98 7.802 8.489 -8.769 1.00 0.00 H new ATOM 0 HB2 ARG B 98 5.722 7.153 -9.264 1.00 0.00 H new ATOM 0 HB3 ARG B 98 6.709 6.028 -10.176 1.00 0.00 H new ATOM 0 HG2 ARG B 98 8.101 5.678 -8.046 1.00 0.00 H new ATOM 0 HG3 ARG B 98 6.898 6.620 -7.188 1.00 0.00 H new ATOM 0 HD2 ARG B 98 5.122 5.004 -7.965 1.00 0.00 H new ATOM 0 HD3 ARG B 98 6.366 4.042 -8.738 1.00 0.00 H new ATOM 0 HE ARG B 98 7.344 4.232 -6.200 1.00 0.00 H new ATOM 0 HH11 ARG B 98 4.055 3.401 -7.247 1.00 0.00 H new ATOM 0 HH12 ARG B 98 3.808 2.305 -5.884 1.00 0.00 H new ATOM 0 HH21 ARG B 98 7.048 2.830 -4.552 1.00 0.00 H new ATOM 0 HH22 ARG B 98 5.513 1.980 -4.349 1.00 0.00 H new ATOM 3084 N GLU B 99 9.950 7.189 -8.966 1.00 0.00 N ATOM 3085 CA GLU B 99 11.229 6.497 -9.030 1.00 0.00 C ATOM 3086 C GLU B 99 11.516 5.985 -7.613 1.00 0.00 C ATOM 3087 O GLU B 99 11.050 6.579 -6.641 1.00 0.00 O ATOM 3088 CB GLU B 99 12.312 7.469 -9.537 1.00 0.00 C ATOM 3089 CG GLU B 99 13.636 6.761 -9.849 1.00 0.00 C ATOM 3090 CD GLU B 99 14.642 7.708 -10.520 1.00 0.00 C ATOM 3091 OE1 GLU B 99 15.228 8.555 -9.807 1.00 0.00 O ATOM 3092 OE2 GLU B 99 14.868 7.587 -11.746 1.00 0.00 O ATOM 0 H GLU B 99 9.755 7.577 -8.043 1.00 0.00 H new ATOM 0 HA GLU B 99 11.217 5.657 -9.725 1.00 0.00 H new ATOM 0 HB2 GLU B 99 11.953 7.973 -10.434 1.00 0.00 H new ATOM 0 HB3 GLU B 99 12.484 8.240 -8.786 1.00 0.00 H new ATOM 0 HG2 GLU B 99 14.065 6.368 -8.927 1.00 0.00 H new ATOM 0 HG3 GLU B 99 13.448 5.908 -10.501 1.00 0.00 H new ATOM 3099 N HIS B 100 12.254 4.886 -7.466 1.00 0.00 N ATOM 3100 CA HIS B 100 12.705 4.368 -6.181 1.00 0.00 C ATOM 3101 C HIS B 100 14.162 4.766 -5.950 1.00 0.00 C ATOM 3102 O HIS B 100 15.000 4.589 -6.836 1.00 0.00 O ATOM 3103 CB HIS B 100 12.514 2.838 -6.149 1.00 0.00 C ATOM 3104 CG HIS B 100 12.895 2.123 -7.428 1.00 0.00 C ATOM 3105 ND1 HIS B 100 12.020 1.655 -8.386 1.00 0.00 N ATOM 3106 CD2 HIS B 100 14.160 1.849 -7.879 1.00 0.00 C ATOM 3107 CE1 HIS B 100 12.740 1.112 -9.382 1.00 0.00 C ATOM 3108 NE2 HIS B 100 14.057 1.207 -9.121 1.00 0.00 N ATOM 0 H HIS B 100 12.561 4.320 -8.257 1.00 0.00 H new ATOM 0 HA HIS B 100 12.113 4.796 -5.372 1.00 0.00 H new ATOM 0 HB2 HIS B 100 13.107 2.429 -5.331 1.00 0.00 H new ATOM 0 HB3 HIS B 100 11.469 2.621 -5.926 1.00 0.00 H new ATOM 0 HD2 HIS B 100 15.080 2.087 -7.365 1.00 0.00 H new ATOM 0 HE1 HIS B 100 12.320 0.662 -10.269 1.00 0.00 H new ATOM 0 HE2 HIS B 100 14.824 0.879 -9.708 1.00 0.00 H new ATOM 3116 N TRP B 101 14.469 5.299 -4.762 1.00 0.00 N ATOM 3117 CA TRP B 101 15.804 5.792 -4.403 1.00 0.00 C ATOM 3118 C TRP B 101 16.416 4.969 -3.254 1.00 0.00 C ATOM 3119 O TRP B 101 17.448 5.361 -2.706 1.00 0.00 O ATOM 3120 CB TRP B 101 15.762 7.302 -4.084 1.00 0.00 C ATOM 3121 CG TRP B 101 15.375 8.273 -5.171 1.00 0.00 C ATOM 3122 CD1 TRP B 101 15.031 7.981 -6.445 1.00 0.00 C ATOM 3123 CD2 TRP B 101 15.282 9.732 -5.085 1.00 0.00 C ATOM 3124 NE1 TRP B 101 14.674 9.123 -7.120 1.00 0.00 N ATOM 3125 CE2 TRP B 101 14.826 10.241 -6.340 1.00 0.00 C ATOM 3126 CE3 TRP B 101 15.525 10.680 -4.068 1.00 0.00 C ATOM 3127 CZ2 TRP B 101 14.623 11.608 -6.574 1.00 0.00 C ATOM 3128 CZ3 TRP B 101 15.283 12.050 -4.281 1.00 0.00 C ATOM 3129 CH2 TRP B 101 14.819 12.513 -5.522 1.00 0.00 C ATOM 0 H TRP B 101 13.786 5.402 -4.011 1.00 0.00 H new ATOM 0 HA TRP B 101 16.460 5.661 -5.264 1.00 0.00 H new ATOM 0 HB2 TRP B 101 15.068 7.443 -3.256 1.00 0.00 H new ATOM 0 HB3 TRP B 101 16.750 7.589 -3.724 1.00 0.00 H new ATOM 0 HD1 TRP B 101 15.036 6.989 -6.872 1.00 0.00 H new ATOM 0 HE1 TRP B 101 14.337 9.138 -8.083 1.00 0.00 H new ATOM 0 HE3 TRP B 101 15.902 10.349 -3.112 1.00 0.00 H new ATOM 0 HZ2 TRP B 101 14.320 11.958 -7.550 1.00 0.00 H new ATOM 0 HZ3 TRP B 101 15.456 12.753 -3.480 1.00 0.00 H new ATOM 0 HH2 TRP B 101 14.614 13.563 -5.666 1.00 0.00 H new ATOM 3140 N GLY B 102 15.819 3.829 -2.880 1.00 0.00 N ATOM 3141 CA GLY B 102 16.432 2.883 -1.961 1.00 0.00 C ATOM 3142 C GLY B 102 15.662 1.567 -1.906 1.00 0.00 C ATOM 3143 O GLY B 102 14.492 1.508 -2.290 1.00 0.00 O ATOM 0 H GLY B 102 14.897 3.544 -3.211 1.00 0.00 H new ATOM 0 HA2 GLY B 102 17.460 2.690 -2.269 1.00 0.00 H new ATOM 0 HA3 GLY B 102 16.475 3.321 -0.964 1.00 0.00 H new ATOM 3147 N PHE B 103 16.334 0.537 -1.391 1.00 0.00 N ATOM 3148 CA PHE B 103 15.851 -0.832 -1.188 1.00 0.00 C ATOM 3149 C PHE B 103 16.482 -1.372 0.113 1.00 0.00 C ATOM 3150 O PHE B 103 16.877 -2.536 0.212 1.00 0.00 O ATOM 3151 CB PHE B 103 16.199 -1.708 -2.406 1.00 0.00 C ATOM 3152 CG PHE B 103 15.409 -1.409 -3.666 1.00 0.00 C ATOM 3153 CD1 PHE B 103 14.027 -1.678 -3.706 1.00 0.00 C ATOM 3154 CD2 PHE B 103 16.058 -0.919 -4.817 1.00 0.00 C ATOM 3155 CE1 PHE B 103 13.295 -1.454 -4.886 1.00 0.00 C ATOM 3156 CE2 PHE B 103 15.328 -0.708 -6.000 1.00 0.00 C ATOM 3157 CZ PHE B 103 13.947 -0.976 -6.035 1.00 0.00 C ATOM 0 H PHE B 103 17.300 0.644 -1.082 1.00 0.00 H new ATOM 0 HA PHE B 103 14.765 -0.849 -1.091 1.00 0.00 H new ATOM 0 HB2 PHE B 103 17.260 -1.591 -2.626 1.00 0.00 H new ATOM 0 HB3 PHE B 103 16.042 -2.753 -2.138 1.00 0.00 H new ATOM 0 HD1 PHE B 103 13.527 -2.058 -2.827 1.00 0.00 H new ATOM 0 HD2 PHE B 103 17.116 -0.706 -4.790 1.00 0.00 H new ATOM 0 HE1 PHE B 103 12.233 -1.649 -4.909 1.00 0.00 H new ATOM 0 HE2 PHE B 103 15.828 -0.340 -6.883 1.00 0.00 H new ATOM 0 HZ PHE B 103 13.388 -0.814 -6.945 1.00 0.00 H new ATOM 3167 N ASP B 104 16.664 -0.485 1.092 1.00 0.00 N ATOM 3168 CA ASP B 104 17.421 -0.679 2.324 1.00 0.00 C ATOM 3169 C ASP B 104 16.767 0.231 3.360 1.00 0.00 C ATOM 3170 O ASP B 104 16.380 1.346 2.996 1.00 0.00 O ATOM 3171 CB ASP B 104 18.869 -0.247 2.042 1.00 0.00 C ATOM 3172 CG ASP B 104 19.808 -0.350 3.248 1.00 0.00 C ATOM 3173 OD1 ASP B 104 19.566 -1.152 4.170 1.00 0.00 O ATOM 3174 OD2 ASP B 104 20.870 0.311 3.235 1.00 0.00 O ATOM 0 H ASP B 104 16.258 0.449 1.039 1.00 0.00 H new ATOM 0 HA ASP B 104 17.427 -1.709 2.680 1.00 0.00 H new ATOM 0 HB2 ASP B 104 19.267 -0.861 1.234 1.00 0.00 H new ATOM 0 HB3 ASP B 104 18.865 0.784 1.687 1.00 0.00 H new ATOM 3179 N ASP B 105 16.593 -0.198 4.613 1.00 0.00 N ATOM 3180 CA ASP B 105 15.803 0.551 5.593 1.00 0.00 C ATOM 3181 C ASP B 105 16.504 0.590 6.959 1.00 0.00 C ATOM 3182 O ASP B 105 16.856 -0.461 7.506 1.00 0.00 O ATOM 3183 CB ASP B 105 14.386 -0.009 5.729 1.00 0.00 C ATOM 3184 CG ASP B 105 13.536 0.950 6.579 1.00 0.00 C ATOM 3185 OD1 ASP B 105 13.763 1.031 7.807 1.00 0.00 O ATOM 3186 OD2 ASP B 105 12.688 1.661 5.995 1.00 0.00 O ATOM 0 H ASP B 105 16.991 -1.065 4.974 1.00 0.00 H new ATOM 0 HA ASP B 105 15.720 1.573 5.222 1.00 0.00 H new ATOM 0 HB2 ASP B 105 13.937 -0.134 4.744 1.00 0.00 H new ATOM 0 HB3 ASP B 105 14.416 -0.995 6.193 1.00 0.00 H new ATOM 3191 N PRO B 106 16.732 1.787 7.525 1.00 0.00 N ATOM 3192 CA PRO B 106 17.565 1.974 8.697 1.00 0.00 C ATOM 3193 C PRO B 106 16.841 1.709 10.011 1.00 0.00 C ATOM 3194 O PRO B 106 17.489 1.396 11.007 1.00 0.00 O ATOM 3195 CB PRO B 106 18.011 3.428 8.611 1.00 0.00 C ATOM 3196 CG PRO B 106 16.804 4.131 7.989 1.00 0.00 C ATOM 3197 CD PRO B 106 16.244 3.069 7.051 1.00 0.00 C ATOM 0 HA PRO B 106 18.391 1.263 8.699 1.00 0.00 H new ATOM 0 HB2 PRO B 106 18.250 3.834 9.594 1.00 0.00 H new ATOM 0 HB3 PRO B 106 18.903 3.539 7.994 1.00 0.00 H new ATOM 0 HG2 PRO B 106 16.076 4.429 8.743 1.00 0.00 H new ATOM 0 HG3 PRO B 106 17.094 5.034 7.451 1.00 0.00 H new ATOM 0 HD2 PRO B 106 15.154 3.091 7.050 1.00 0.00 H new ATOM 0 HD3 PRO B 106 16.567 3.250 6.026 1.00 0.00 H new ATOM 3205 N ALA B 107 15.508 1.797 10.032 1.00 0.00 N ATOM 3206 CA ALA B 107 14.729 1.433 11.192 1.00 0.00 C ATOM 3207 C ALA B 107 14.793 -0.081 11.406 1.00 0.00 C ATOM 3208 O ALA B 107 14.488 -0.552 12.504 1.00 0.00 O ATOM 3209 CB ALA B 107 13.282 1.914 11.030 1.00 0.00 C ATOM 0 H ALA B 107 14.951 2.123 9.242 1.00 0.00 H new ATOM 0 HA ALA B 107 15.145 1.919 12.075 1.00 0.00 H new ATOM 0 HB1 ALA B 107 12.705 1.634 11.911 1.00 0.00 H new ATOM 0 HB2 ALA B 107 13.269 2.998 10.918 1.00 0.00 H new ATOM 0 HB3 ALA B 107 12.842 1.453 10.146 1.00 0.00 H new ATOM 3215 N ARG B 108 15.210 -0.846 10.388 1.00 0.00 N ATOM 3216 CA ARG B 108 15.227 -2.302 10.464 1.00 0.00 C ATOM 3217 C ARG B 108 16.607 -2.714 10.947 1.00 0.00 C ATOM 3218 O ARG B 108 16.740 -3.165 12.086 1.00 0.00 O ATOM 3219 CB ARG B 108 14.861 -2.944 9.106 1.00 0.00 C ATOM 3220 CG ARG B 108 13.517 -2.500 8.500 1.00 0.00 C ATOM 3221 CD ARG B 108 12.313 -2.727 9.417 1.00 0.00 C ATOM 3222 NE ARG B 108 12.145 -4.144 9.792 1.00 0.00 N ATOM 3223 CZ ARG B 108 11.450 -4.599 10.844 1.00 0.00 C ATOM 3224 NH1 ARG B 108 10.819 -3.754 11.657 1.00 0.00 N ATOM 3225 NH2 ARG B 108 11.390 -5.905 11.078 1.00 0.00 N ATOM 0 H ARG B 108 15.541 -0.471 9.499 1.00 0.00 H new ATOM 0 HA ARG B 108 14.472 -2.659 11.165 1.00 0.00 H new ATOM 0 HB2 ARG B 108 15.653 -2.718 8.392 1.00 0.00 H new ATOM 0 HB3 ARG B 108 14.843 -4.027 9.230 1.00 0.00 H new ATOM 0 HG2 ARG B 108 13.575 -1.441 8.250 1.00 0.00 H new ATOM 0 HG3 ARG B 108 13.356 -3.039 7.566 1.00 0.00 H new ATOM 0 HD2 ARG B 108 12.430 -2.127 10.320 1.00 0.00 H new ATOM 0 HD3 ARG B 108 11.409 -2.378 8.917 1.00 0.00 H new ATOM 0 HE ARG B 108 12.598 -4.839 9.198 1.00 0.00 H new ATOM 0 HH11 ARG B 108 10.862 -2.750 11.482 1.00 0.00 H new ATOM 0 HH12 ARG B 108 10.293 -4.111 12.455 1.00 0.00 H new ATOM 0 HH21 ARG B 108 11.871 -6.557 10.459 1.00 0.00 H new ATOM 0 HH22 ARG B 108 10.862 -6.256 11.877 1.00 0.00 H new ATOM 3239 N ALA B 109 17.627 -2.429 10.131 1.00 0.00 N ATOM 3240 CA ALA B 109 19.004 -2.884 10.284 1.00 0.00 C ATOM 3241 C ALA B 109 19.148 -4.382 10.598 1.00 0.00 C ATOM 3242 O ALA B 109 18.173 -5.137 10.615 1.00 0.00 O ATOM 3243 CB ALA B 109 19.723 -1.995 11.302 1.00 0.00 C ATOM 0 H ALA B 109 17.503 -1.844 9.305 1.00 0.00 H new ATOM 0 HA ALA B 109 19.488 -2.780 9.313 1.00 0.00 H new ATOM 0 HB1 ALA B 109 20.753 -2.334 11.418 1.00 0.00 H new ATOM 0 HB2 ALA B 109 19.718 -0.963 10.952 1.00 0.00 H new ATOM 0 HB3 ALA B 109 19.211 -2.055 12.263 1.00 0.00 H new ATOM 3249 N GLN B 110 20.393 -4.822 10.819 1.00 0.00 N ATOM 3250 CA GLN B 110 20.639 -6.165 11.346 1.00 0.00 C ATOM 3251 C GLN B 110 20.177 -6.235 12.800 1.00 0.00 C ATOM 3252 O GLN B 110 19.615 -7.253 13.208 1.00 0.00 O ATOM 3253 CB GLN B 110 22.115 -6.579 11.230 1.00 0.00 C ATOM 3254 CG GLN B 110 22.288 -8.092 11.469 1.00 0.00 C ATOM 3255 CD GLN B 110 22.909 -8.439 12.824 1.00 0.00 C ATOM 3256 OE1 GLN B 110 24.119 -8.614 12.947 1.00 0.00 O ATOM 3257 NE2 GLN B 110 22.100 -8.565 13.865 1.00 0.00 N ATOM 0 H GLN B 110 21.235 -4.273 10.643 1.00 0.00 H new ATOM 0 HA GLN B 110 20.067 -6.869 10.742 1.00 0.00 H new ATOM 0 HB2 GLN B 110 22.492 -6.319 10.241 1.00 0.00 H new ATOM 0 HB3 GLN B 110 22.710 -6.023 11.955 1.00 0.00 H new ATOM 0 HG2 GLN B 110 21.314 -8.576 11.392 1.00 0.00 H new ATOM 0 HG3 GLN B 110 22.913 -8.506 10.677 1.00 0.00 H new ATOM 0 HE21 GLN B 110 21.097 -8.418 13.752 1.00 0.00 H new ATOM 0 HE22 GLN B 110 22.480 -8.809 14.780 1.00 0.00 H new ATOM 3266 N GLY B 111 20.428 -5.172 13.574 1.00 0.00 N ATOM 3267 CA GLY B 111 19.860 -5.013 14.905 1.00 0.00 C ATOM 3268 C GLY B 111 20.843 -4.664 16.014 1.00 0.00 C ATOM 3269 O GLY B 111 20.420 -4.181 17.066 1.00 0.00 O ATOM 0 H GLY B 111 21.032 -4.401 13.289 1.00 0.00 H new ATOM 0 HA2 GLY B 111 19.099 -4.234 14.863 1.00 0.00 H new ATOM 0 HA3 GLY B 111 19.353 -5.939 15.175 1.00 0.00 H new ATOM 3273 N THR B 112 22.128 -4.933 15.806 1.00 0.00 N ATOM 3274 CA THR B 112 23.158 -4.642 16.801 1.00 0.00 C ATOM 3275 C THR B 112 23.353 -3.136 16.901 1.00 0.00 C ATOM 3276 O THR B 112 22.928 -2.387 16.020 1.00 0.00 O ATOM 3277 CB THR B 112 24.484 -5.340 16.469 1.00 0.00 C ATOM 3278 OG1 THR B 112 25.033 -4.823 15.283 1.00 0.00 O ATOM 3279 CG2 THR B 112 24.284 -6.831 16.271 1.00 0.00 C ATOM 0 H THR B 112 22.485 -5.356 14.949 1.00 0.00 H new ATOM 0 HA THR B 112 22.825 -5.031 17.764 1.00 0.00 H new ATOM 0 HB THR B 112 25.155 -5.163 17.310 1.00 0.00 H new ATOM 0 HG1 THR B 112 25.879 -5.279 15.088 1.00 0.00 H new ATOM 0 HG21 THR B 112 25.240 -7.299 16.037 1.00 0.00 H new ATOM 0 HG22 THR B 112 23.880 -7.268 17.184 1.00 0.00 H new ATOM 0 HG23 THR B 112 23.588 -6.999 15.449 1.00 0.00 H new ATOM 3287 N GLU B 113 24.049 -2.683 17.940 1.00 0.00 N ATOM 3288 CA GLU B 113 24.274 -1.264 18.151 1.00 0.00 C ATOM 3289 C GLU B 113 25.017 -0.646 16.965 1.00 0.00 C ATOM 3290 O GLU B 113 24.686 0.449 16.502 1.00 0.00 O ATOM 3291 CB GLU B 113 25.094 -1.064 19.433 1.00 0.00 C ATOM 3292 CG GLU B 113 24.370 -1.615 20.667 1.00 0.00 C ATOM 3293 CD GLU B 113 25.135 -1.303 21.964 1.00 0.00 C ATOM 3294 OE1 GLU B 113 25.997 -2.112 22.381 1.00 0.00 O ATOM 3295 OE2 GLU B 113 24.875 -0.254 22.597 1.00 0.00 O ATOM 0 H GLU B 113 24.467 -3.285 18.650 1.00 0.00 H new ATOM 0 HA GLU B 113 23.308 -0.769 18.246 1.00 0.00 H new ATOM 0 HB2 GLU B 113 26.059 -1.559 19.327 1.00 0.00 H new ATOM 0 HB3 GLU B 113 25.294 -0.002 19.574 1.00 0.00 H new ATOM 0 HG2 GLU B 113 23.369 -1.186 20.723 1.00 0.00 H new ATOM 0 HG3 GLU B 113 24.250 -2.694 20.566 1.00 0.00 H new ATOM 3302 N GLU B 114 26.013 -1.376 16.463 1.00 0.00 N ATOM 3303 CA GLU B 114 26.821 -0.985 15.340 1.00 0.00 C ATOM 3304 C GLU B 114 26.023 -1.133 14.062 1.00 0.00 C ATOM 3305 O GLU B 114 26.111 -0.235 13.237 1.00 0.00 O ATOM 3306 CB GLU B 114 28.130 -1.793 15.276 1.00 0.00 C ATOM 3307 CG GLU B 114 27.983 -3.299 15.521 1.00 0.00 C ATOM 3308 CD GLU B 114 29.351 -4.004 15.542 1.00 0.00 C ATOM 3309 OE1 GLU B 114 29.887 -4.351 14.464 1.00 0.00 O ATOM 3310 OE2 GLU B 114 29.907 -4.232 16.641 1.00 0.00 O ATOM 0 H GLU B 114 26.277 -2.282 16.849 1.00 0.00 H new ATOM 0 HA GLU B 114 27.100 0.061 15.462 1.00 0.00 H new ATOM 0 HB2 GLU B 114 28.582 -1.644 14.296 1.00 0.00 H new ATOM 0 HB3 GLU B 114 28.824 -1.388 16.012 1.00 0.00 H new ATOM 0 HG2 GLU B 114 27.472 -3.466 16.469 1.00 0.00 H new ATOM 0 HG3 GLU B 114 27.359 -3.736 14.741 1.00 0.00 H new ATOM 3317 N GLU B 115 25.230 -2.194 13.874 1.00 0.00 N ATOM 3318 CA GLU B 115 24.589 -2.399 12.587 1.00 0.00 C ATOM 3319 C GLU B 115 23.410 -1.445 12.437 1.00 0.00 C ATOM 3320 O GLU B 115 23.156 -0.978 11.332 1.00 0.00 O ATOM 3321 CB GLU B 115 24.200 -3.861 12.384 1.00 0.00 C ATOM 3322 CG GLU B 115 25.448 -4.743 12.187 1.00 0.00 C ATOM 3323 CD GLU B 115 25.985 -4.681 10.745 1.00 0.00 C ATOM 3324 OE1 GLU B 115 26.845 -3.823 10.444 1.00 0.00 O ATOM 3325 OE2 GLU B 115 25.571 -5.511 9.903 1.00 0.00 O ATOM 0 H GLU B 115 25.025 -2.901 14.580 1.00 0.00 H new ATOM 0 HA GLU B 115 25.300 -2.168 11.794 1.00 0.00 H new ATOM 0 HB2 GLU B 115 23.634 -4.213 13.246 1.00 0.00 H new ATOM 0 HB3 GLU B 115 23.547 -3.950 11.516 1.00 0.00 H new ATOM 0 HG2 GLU B 115 26.229 -4.423 12.877 1.00 0.00 H new ATOM 0 HG3 GLU B 115 25.204 -5.775 12.438 1.00 0.00 H new ATOM 3332 N LYS B 116 22.726 -1.089 13.530 1.00 0.00 N ATOM 3333 CA LYS B 116 21.733 -0.025 13.517 1.00 0.00 C ATOM 3334 C LYS B 116 22.401 1.256 13.050 1.00 0.00 C ATOM 3335 O LYS B 116 22.017 1.776 12.005 1.00 0.00 O ATOM 3336 CB LYS B 116 21.039 0.145 14.882 1.00 0.00 C ATOM 3337 CG LYS B 116 20.202 -1.067 15.342 1.00 0.00 C ATOM 3338 CD LYS B 116 18.713 -0.785 15.604 1.00 0.00 C ATOM 3339 CE LYS B 116 17.848 -0.809 14.332 1.00 0.00 C ATOM 3340 NZ LYS B 116 16.400 -0.718 14.658 1.00 0.00 N ATOM 0 H LYS B 116 22.849 -1.532 14.441 1.00 0.00 H new ATOM 0 HA LYS B 116 20.937 -0.289 12.821 1.00 0.00 H new ATOM 0 HB2 LYS B 116 21.799 0.350 15.636 1.00 0.00 H new ATOM 0 HB3 LYS B 116 20.390 1.020 14.837 1.00 0.00 H new ATOM 0 HG2 LYS B 116 20.278 -1.847 14.584 1.00 0.00 H new ATOM 0 HG3 LYS B 116 20.644 -1.466 16.255 1.00 0.00 H new ATOM 0 HD2 LYS B 116 18.330 -1.524 16.308 1.00 0.00 H new ATOM 0 HD3 LYS B 116 18.615 0.190 16.081 1.00 0.00 H new ATOM 0 HE2 LYS B 116 18.129 0.021 13.683 1.00 0.00 H new ATOM 0 HE3 LYS B 116 18.040 -1.727 13.777 1.00 0.00 H new ATOM 0 HZ1 LYS B 116 15.847 -0.686 13.778 1.00 0.00 H new ATOM 0 HZ2 LYS B 116 16.116 -1.550 15.214 1.00 0.00 H new ATOM 0 HZ3 LYS B 116 16.222 0.145 15.210 1.00 0.00 H new ATOM 3354 N TRP B 117 23.443 1.715 13.745 1.00 0.00 N ATOM 3355 CA TRP B 117 24.109 2.964 13.382 1.00 0.00 C ATOM 3356 C TRP B 117 24.649 2.891 11.947 1.00 0.00 C ATOM 3357 O TRP B 117 24.513 3.832 11.172 1.00 0.00 O ATOM 3358 CB TRP B 117 25.204 3.303 14.407 1.00 0.00 C ATOM 3359 CG TRP B 117 25.828 4.663 14.312 1.00 0.00 C ATOM 3360 CD1 TRP B 117 25.492 5.645 13.445 1.00 0.00 C ATOM 3361 CD2 TRP B 117 26.907 5.220 15.124 1.00 0.00 C ATOM 3362 NE1 TRP B 117 26.298 6.742 13.633 1.00 0.00 N ATOM 3363 CE2 TRP B 117 27.180 6.542 14.666 1.00 0.00 C ATOM 3364 CE3 TRP B 117 27.683 4.747 16.205 1.00 0.00 C ATOM 3365 CZ2 TRP B 117 28.164 7.350 15.244 1.00 0.00 C ATOM 3366 CZ3 TRP B 117 28.677 5.552 16.797 1.00 0.00 C ATOM 3367 CH2 TRP B 117 28.919 6.853 16.318 1.00 0.00 C ATOM 0 H TRP B 117 23.841 1.243 14.557 1.00 0.00 H new ATOM 0 HA TRP B 117 23.384 3.777 13.406 1.00 0.00 H new ATOM 0 HB2 TRP B 117 24.779 3.194 15.405 1.00 0.00 H new ATOM 0 HB3 TRP B 117 25.996 2.560 14.315 1.00 0.00 H new ATOM 0 HD1 TRP B 117 24.703 5.577 12.710 1.00 0.00 H new ATOM 0 HE1 TRP B 117 26.247 7.595 13.077 1.00 0.00 H new ATOM 0 HE3 TRP B 117 27.512 3.751 16.585 1.00 0.00 H new ATOM 0 HZ2 TRP B 117 28.341 8.347 14.868 1.00 0.00 H new ATOM 0 HZ3 TRP B 117 29.257 5.168 17.623 1.00 0.00 H new ATOM 0 HH2 TRP B 117 29.682 7.466 16.775 1.00 0.00 H new ATOM 3378 N ALA B 118 25.207 1.753 11.556 1.00 0.00 N ATOM 3379 CA ALA B 118 25.747 1.536 10.228 1.00 0.00 C ATOM 3380 C ALA B 118 24.668 1.672 9.151 1.00 0.00 C ATOM 3381 O ALA B 118 24.898 2.347 8.146 1.00 0.00 O ATOM 3382 CB ALA B 118 26.422 0.158 10.206 1.00 0.00 C ATOM 0 H ALA B 118 25.297 0.942 12.168 1.00 0.00 H new ATOM 0 HA ALA B 118 26.488 2.302 9.998 1.00 0.00 H new ATOM 0 HB1 ALA B 118 26.837 -0.028 9.215 1.00 0.00 H new ATOM 0 HB2 ALA B 118 27.223 0.133 10.945 1.00 0.00 H new ATOM 0 HB3 ALA B 118 25.687 -0.611 10.442 1.00 0.00 H new ATOM 3388 N PHE B 119 23.484 1.094 9.364 1.00 0.00 N ATOM 3389 CA PHE B 119 22.363 1.261 8.452 1.00 0.00 C ATOM 3390 C PHE B 119 21.888 2.716 8.471 1.00 0.00 C ATOM 3391 O PHE B 119 21.634 3.263 7.400 1.00 0.00 O ATOM 3392 CB PHE B 119 21.215 0.285 8.765 1.00 0.00 C ATOM 3393 CG PHE B 119 21.341 -1.104 8.154 1.00 0.00 C ATOM 3394 CD1 PHE B 119 22.467 -1.918 8.394 1.00 0.00 C ATOM 3395 CD2 PHE B 119 20.302 -1.601 7.338 1.00 0.00 C ATOM 3396 CE1 PHE B 119 22.539 -3.216 7.860 1.00 0.00 C ATOM 3397 CE2 PHE B 119 20.371 -2.903 6.809 1.00 0.00 C ATOM 3398 CZ PHE B 119 21.487 -3.714 7.073 1.00 0.00 C ATOM 0 H PHE B 119 23.281 0.502 10.169 1.00 0.00 H new ATOM 0 HA PHE B 119 22.704 1.020 7.445 1.00 0.00 H new ATOM 0 HB2 PHE B 119 21.138 0.180 9.847 1.00 0.00 H new ATOM 0 HB3 PHE B 119 20.281 0.730 8.421 1.00 0.00 H new ATOM 0 HD1 PHE B 119 23.282 -1.540 8.994 1.00 0.00 H new ATOM 0 HD2 PHE B 119 19.448 -0.977 7.118 1.00 0.00 H new ATOM 0 HE1 PHE B 119 23.405 -3.832 8.055 1.00 0.00 H new ATOM 0 HE2 PHE B 119 19.564 -3.280 6.198 1.00 0.00 H new ATOM 0 HZ PHE B 119 21.536 -4.716 6.673 1.00 0.00 H new ATOM 3408 N PHE B 120 21.821 3.370 9.642 1.00 0.00 N ATOM 3409 CA PHE B 120 21.425 4.775 9.752 1.00 0.00 C ATOM 3410 C PHE B 120 22.324 5.622 8.848 1.00 0.00 C ATOM 3411 O PHE B 120 21.842 6.382 8.005 1.00 0.00 O ATOM 3412 CB PHE B 120 21.552 5.319 11.192 1.00 0.00 C ATOM 3413 CG PHE B 120 20.841 4.650 12.366 1.00 0.00 C ATOM 3414 CD1 PHE B 120 19.850 3.658 12.207 1.00 0.00 C ATOM 3415 CD2 PHE B 120 21.146 5.106 13.666 1.00 0.00 C ATOM 3416 CE1 PHE B 120 19.196 3.121 13.330 1.00 0.00 C ATOM 3417 CE2 PHE B 120 20.494 4.566 14.789 1.00 0.00 C ATOM 3418 CZ PHE B 120 19.517 3.573 14.621 1.00 0.00 C ATOM 0 H PHE B 120 22.041 2.935 10.538 1.00 0.00 H new ATOM 0 HA PHE B 120 20.378 4.835 9.455 1.00 0.00 H new ATOM 0 HB2 PHE B 120 22.615 5.333 11.432 1.00 0.00 H new ATOM 0 HB3 PHE B 120 21.217 6.356 11.169 1.00 0.00 H new ATOM 0 HD1 PHE B 120 19.593 3.309 11.218 1.00 0.00 H new ATOM 0 HD2 PHE B 120 21.889 5.879 13.800 1.00 0.00 H new ATOM 0 HE1 PHE B 120 18.443 2.357 13.200 1.00 0.00 H new ATOM 0 HE2 PHE B 120 20.745 4.915 15.780 1.00 0.00 H new ATOM 0 HZ PHE B 120 19.013 3.157 15.481 1.00 0.00 H new ATOM 3428 N GLN B 121 23.640 5.466 9.020 1.00 0.00 N ATOM 3429 CA GLN B 121 24.636 6.275 8.360 1.00 0.00 C ATOM 3430 C GLN B 121 24.646 6.012 6.857 1.00 0.00 C ATOM 3431 O GLN B 121 24.656 6.954 6.062 1.00 0.00 O ATOM 3432 CB GLN B 121 25.994 6.008 9.011 1.00 0.00 C ATOM 3433 CG GLN B 121 27.052 6.945 8.424 1.00 0.00 C ATOM 3434 CD GLN B 121 28.258 7.055 9.353 1.00 0.00 C ATOM 3435 OE1 GLN B 121 29.331 6.519 9.082 1.00 0.00 O ATOM 3436 NE2 GLN B 121 28.104 7.744 10.474 1.00 0.00 N ATOM 0 H GLN B 121 24.037 4.757 9.636 1.00 0.00 H new ATOM 0 HA GLN B 121 24.398 7.332 8.479 1.00 0.00 H new ATOM 0 HB2 GLN B 121 25.925 6.155 10.089 1.00 0.00 H new ATOM 0 HB3 GLN B 121 26.286 4.970 8.849 1.00 0.00 H new ATOM 0 HG2 GLN B 121 27.371 6.575 7.450 1.00 0.00 H new ATOM 0 HG3 GLN B 121 26.620 7.933 8.264 1.00 0.00 H new ATOM 0 HE21 GLN B 121 27.207 8.183 10.684 1.00 0.00 H new ATOM 0 HE22 GLN B 121 28.882 7.836 11.127 1.00 0.00 H new ATOM 3445 N ARG B 122 24.616 4.739 6.450 1.00 0.00 N ATOM 3446 CA ARG B 122 24.647 4.394 5.037 1.00 0.00 C ATOM 3447 C ARG B 122 23.415 4.968 4.340 1.00 0.00 C ATOM 3448 O ARG B 122 23.529 5.567 3.270 1.00 0.00 O ATOM 3449 CB ARG B 122 24.719 2.863 4.892 1.00 0.00 C ATOM 3450 CG ARG B 122 24.747 2.396 3.426 1.00 0.00 C ATOM 3451 CD ARG B 122 24.826 0.868 3.313 1.00 0.00 C ATOM 3452 NE ARG B 122 23.614 0.211 3.841 1.00 0.00 N ATOM 3453 CZ ARG B 122 23.530 -0.661 4.849 1.00 0.00 C ATOM 3454 NH1 ARG B 122 24.596 -1.021 5.562 1.00 0.00 N ATOM 3455 NH2 ARG B 122 22.341 -1.166 5.135 1.00 0.00 N ATOM 0 H ARG B 122 24.571 3.938 7.080 1.00 0.00 H new ATOM 0 HA ARG B 122 25.529 4.825 4.562 1.00 0.00 H new ATOM 0 HB2 ARG B 122 25.611 2.497 5.401 1.00 0.00 H new ATOM 0 HB3 ARG B 122 23.861 2.416 5.393 1.00 0.00 H new ATOM 0 HG2 ARG B 122 23.853 2.752 2.915 1.00 0.00 H new ATOM 0 HG3 ARG B 122 25.603 2.842 2.919 1.00 0.00 H new ATOM 0 HD2 ARG B 122 24.964 0.588 2.269 1.00 0.00 H new ATOM 0 HD3 ARG B 122 25.699 0.509 3.857 1.00 0.00 H new ATOM 0 HE ARG B 122 22.736 0.452 3.381 1.00 0.00 H new ATOM 0 HH11 ARG B 122 25.512 -0.628 5.344 1.00 0.00 H new ATOM 0 HH12 ARG B 122 24.497 -1.690 6.326 1.00 0.00 H new ATOM 0 HH21 ARG B 122 21.524 -0.887 4.592 1.00 0.00 H new ATOM 0 HH22 ARG B 122 22.241 -1.835 5.899 1.00 0.00 H new ATOM 3469 N VAL B 123 22.237 4.805 4.944 1.00 0.00 N ATOM 3470 CA VAL B 123 20.993 5.251 4.342 1.00 0.00 C ATOM 3471 C VAL B 123 20.942 6.779 4.272 1.00 0.00 C ATOM 3472 O VAL B 123 20.541 7.303 3.234 1.00 0.00 O ATOM 3473 CB VAL B 123 19.803 4.634 5.098 1.00 0.00 C ATOM 3474 CG1 VAL B 123 18.488 5.292 4.686 1.00 0.00 C ATOM 3475 CG2 VAL B 123 19.706 3.123 4.814 1.00 0.00 C ATOM 0 H VAL B 123 22.125 4.363 5.857 1.00 0.00 H new ATOM 0 HA VAL B 123 20.933 4.903 3.311 1.00 0.00 H new ATOM 0 HB VAL B 123 19.973 4.802 6.162 1.00 0.00 H new ATOM 0 HG11 VAL B 123 17.665 4.836 5.236 1.00 0.00 H new ATOM 0 HG12 VAL B 123 18.528 6.358 4.911 1.00 0.00 H new ATOM 0 HG13 VAL B 123 18.331 5.153 3.616 1.00 0.00 H new ATOM 0 HG21 VAL B 123 18.859 2.704 5.357 1.00 0.00 H new ATOM 0 HG22 VAL B 123 19.567 2.962 3.745 1.00 0.00 H new ATOM 0 HG23 VAL B 123 20.623 2.632 5.139 1.00 0.00 H new ATOM 3485 N ARG B 124 21.343 7.518 5.316 1.00 0.00 N ATOM 3486 CA ARG B 124 21.275 8.981 5.238 1.00 0.00 C ATOM 3487 C ARG B 124 22.213 9.515 4.162 1.00 0.00 C ATOM 3488 O ARG B 124 21.860 10.472 3.482 1.00 0.00 O ATOM 3489 CB ARG B 124 21.441 9.643 6.617 1.00 0.00 C ATOM 3490 CG ARG B 124 22.812 9.615 7.306 1.00 0.00 C ATOM 3491 CD ARG B 124 23.774 10.729 6.874 1.00 0.00 C ATOM 3492 NE ARG B 124 25.036 10.622 7.618 1.00 0.00 N ATOM 3493 CZ ARG B 124 26.266 10.957 7.216 1.00 0.00 C ATOM 3494 NH1 ARG B 124 26.495 11.479 6.014 1.00 0.00 N ATOM 3495 NH2 ARG B 124 27.261 10.749 8.066 1.00 0.00 N ATOM 0 H ARG B 124 21.705 7.143 6.193 1.00 0.00 H new ATOM 0 HA ARG B 124 20.271 9.264 4.921 1.00 0.00 H new ATOM 0 HB2 ARG B 124 21.147 10.688 6.516 1.00 0.00 H new ATOM 0 HB3 ARG B 124 20.726 9.175 7.293 1.00 0.00 H new ATOM 0 HG2 ARG B 124 22.662 9.682 8.384 1.00 0.00 H new ATOM 0 HG3 ARG B 124 23.282 8.652 7.108 1.00 0.00 H new ATOM 0 HD2 ARG B 124 23.967 10.659 5.803 1.00 0.00 H new ATOM 0 HD3 ARG B 124 23.319 11.703 7.053 1.00 0.00 H new ATOM 0 HE ARG B 124 24.965 10.244 8.562 1.00 0.00 H new ATOM 0 HH11 ARG B 124 25.720 11.634 5.369 1.00 0.00 H new ATOM 0 HH12 ARG B 124 27.446 11.724 5.737 1.00 0.00 H new ATOM 0 HH21 ARG B 124 27.072 10.348 8.985 1.00 0.00 H new ATOM 0 HH22 ARG B 124 28.216 10.990 7.802 1.00 0.00 H new ATOM 3509 N ASP B 125 23.373 8.886 3.976 1.00 0.00 N ATOM 3510 CA ASP B 125 24.286 9.246 2.891 1.00 0.00 C ATOM 3511 C ASP B 125 23.651 8.996 1.519 1.00 0.00 C ATOM 3512 O ASP B 125 23.708 9.871 0.655 1.00 0.00 O ATOM 3513 CB ASP B 125 25.606 8.483 3.016 1.00 0.00 C ATOM 3514 CG ASP B 125 26.538 8.822 1.842 1.00 0.00 C ATOM 3515 OD1 ASP B 125 27.120 9.930 1.831 1.00 0.00 O ATOM 3516 OD2 ASP B 125 26.721 7.974 0.940 1.00 0.00 O ATOM 0 H ASP B 125 23.704 8.122 4.565 1.00 0.00 H new ATOM 0 HA ASP B 125 24.492 10.313 2.976 1.00 0.00 H new ATOM 0 HB2 ASP B 125 26.092 8.737 3.958 1.00 0.00 H new ATOM 0 HB3 ASP B 125 25.412 7.411 3.036 1.00 0.00 H new ATOM 3521 N GLU B 126 23.001 7.840 1.328 1.00 0.00 N ATOM 3522 CA GLU B 126 22.305 7.496 0.086 1.00 0.00 C ATOM 3523 C GLU B 126 21.208 8.528 -0.210 1.00 0.00 C ATOM 3524 O GLU B 126 21.154 9.089 -1.308 1.00 0.00 O ATOM 3525 CB GLU B 126 21.731 6.068 0.204 1.00 0.00 C ATOM 3526 CG GLU B 126 20.908 5.633 -1.019 1.00 0.00 C ATOM 3527 CD GLU B 126 20.368 4.200 -0.857 1.00 0.00 C ATOM 3528 OE1 GLU B 126 19.314 4.026 -0.202 1.00 0.00 O ATOM 3529 OE2 GLU B 126 20.987 3.253 -1.395 1.00 0.00 O ATOM 0 H GLU B 126 22.945 7.112 2.040 1.00 0.00 H new ATOM 0 HA GLU B 126 23.004 7.516 -0.750 1.00 0.00 H new ATOM 0 HB2 GLU B 126 22.552 5.366 0.347 1.00 0.00 H new ATOM 0 HB3 GLU B 126 21.103 6.010 1.093 1.00 0.00 H new ATOM 0 HG2 GLU B 126 20.076 6.322 -1.162 1.00 0.00 H new ATOM 0 HG3 GLU B 126 21.527 5.690 -1.914 1.00 0.00 H new ATOM 3536 N ILE B 127 20.361 8.797 0.787 1.00 0.00 N ATOM 3537 CA ILE B 127 19.260 9.746 0.708 1.00 0.00 C ATOM 3538 C ILE B 127 19.803 11.120 0.314 1.00 0.00 C ATOM 3539 O ILE B 127 19.323 11.711 -0.653 1.00 0.00 O ATOM 3540 CB ILE B 127 18.507 9.743 2.063 1.00 0.00 C ATOM 3541 CG1 ILE B 127 17.580 8.510 2.133 1.00 0.00 C ATOM 3542 CG2 ILE B 127 17.674 11.006 2.289 1.00 0.00 C ATOM 3543 CD1 ILE B 127 16.956 8.253 3.508 1.00 0.00 C ATOM 0 H ILE B 127 20.429 8.343 1.698 1.00 0.00 H new ATOM 0 HA ILE B 127 18.542 9.465 -0.062 1.00 0.00 H new ATOM 0 HB ILE B 127 19.265 9.710 2.846 1.00 0.00 H new ATOM 0 HG12 ILE B 127 16.779 8.633 1.404 1.00 0.00 H new ATOM 0 HG13 ILE B 127 18.148 7.628 1.837 1.00 0.00 H new ATOM 0 HG21 ILE B 127 17.172 10.943 3.254 1.00 0.00 H new ATOM 0 HG22 ILE B 127 18.326 11.879 2.276 1.00 0.00 H new ATOM 0 HG23 ILE B 127 16.930 11.097 1.498 1.00 0.00 H new ATOM 0 HD11 ILE B 127 16.322 7.368 3.460 1.00 0.00 H new ATOM 0 HD12 ILE B 127 17.746 8.094 4.242 1.00 0.00 H new ATOM 0 HD13 ILE B 127 16.356 9.114 3.802 1.00 0.00 H new ATOM 3555 N GLY B 128 20.805 11.624 1.035 1.00 0.00 N ATOM 3556 CA GLY B 128 21.315 12.962 0.818 1.00 0.00 C ATOM 3557 C GLY B 128 21.934 13.110 -0.557 1.00 0.00 C ATOM 3558 O GLY B 128 21.664 14.105 -1.228 1.00 0.00 O ATOM 0 H GLY B 128 21.278 11.113 1.780 1.00 0.00 H new ATOM 0 HA2 GLY B 128 20.505 13.683 0.932 1.00 0.00 H new ATOM 0 HA3 GLY B 128 22.059 13.196 1.579 1.00 0.00 H new ATOM 3562 N ASN B 129 22.700 12.115 -1.018 1.00 0.00 N ATOM 3563 CA ASN B 129 23.252 12.150 -2.363 1.00 0.00 C ATOM 3564 C ASN B 129 22.141 12.235 -3.404 1.00 0.00 C ATOM 3565 O ASN B 129 22.217 13.060 -4.313 1.00 0.00 O ATOM 3566 CB ASN B 129 24.152 10.941 -2.651 1.00 0.00 C ATOM 3567 CG ASN B 129 24.601 10.999 -4.111 1.00 0.00 C ATOM 3568 OD1 ASN B 129 25.466 11.792 -4.470 1.00 0.00 O ATOM 3569 ND2 ASN B 129 23.993 10.209 -4.982 1.00 0.00 N ATOM 0 H ASN B 129 22.946 11.285 -0.479 1.00 0.00 H new ATOM 0 HA ASN B 129 23.870 13.046 -2.428 1.00 0.00 H new ATOM 0 HB2 ASN B 129 25.018 10.949 -1.989 1.00 0.00 H new ATOM 0 HB3 ASN B 129 23.612 10.014 -2.459 1.00 0.00 H new ATOM 0 HD21 ASN B 129 24.241 10.253 -5.970 1.00 0.00 H new ATOM 0 HD22 ASN B 129 23.276 9.556 -4.665 1.00 0.00 H new ATOM 3576 N ARG B 130 21.099 11.411 -3.273 1.00 0.00 N ATOM 3577 CA ARG B 130 20.006 11.430 -4.240 1.00 0.00 C ATOM 3578 C ARG B 130 19.232 12.743 -4.183 1.00 0.00 C ATOM 3579 O ARG B 130 18.878 13.249 -5.246 1.00 0.00 O ATOM 3580 CB ARG B 130 19.071 10.221 -4.067 1.00 0.00 C ATOM 3581 CG ARG B 130 19.641 8.896 -4.614 1.00 0.00 C ATOM 3582 CD ARG B 130 20.083 8.936 -6.089 1.00 0.00 C ATOM 3583 NE ARG B 130 19.086 9.579 -6.973 1.00 0.00 N ATOM 3584 CZ ARG B 130 18.186 8.975 -7.761 1.00 0.00 C ATOM 3585 NH1 ARG B 130 18.095 7.649 -7.821 1.00 0.00 N ATOM 3586 NH2 ARG B 130 17.375 9.718 -8.504 1.00 0.00 N ATOM 0 H ARG B 130 20.992 10.733 -2.518 1.00 0.00 H new ATOM 0 HA ARG B 130 20.453 11.355 -5.231 1.00 0.00 H new ATOM 0 HB2 ARG B 130 18.848 10.097 -3.007 1.00 0.00 H new ATOM 0 HB3 ARG B 130 18.127 10.432 -4.569 1.00 0.00 H new ATOM 0 HG2 ARG B 130 20.495 8.606 -4.002 1.00 0.00 H new ATOM 0 HG3 ARG B 130 18.886 8.118 -4.498 1.00 0.00 H new ATOM 0 HD2 ARG B 130 21.028 9.473 -6.165 1.00 0.00 H new ATOM 0 HD3 ARG B 130 20.266 7.919 -6.436 1.00 0.00 H new ATOM 0 HE ARG B 130 19.083 10.599 -6.984 1.00 0.00 H new ATOM 0 HH11 ARG B 130 18.719 7.069 -7.259 1.00 0.00 H new ATOM 0 HH12 ARG B 130 17.402 7.212 -8.428 1.00 0.00 H new ATOM 0 HH21 ARG B 130 17.442 10.735 -8.471 1.00 0.00 H new ATOM 0 HH22 ARG B 130 16.685 9.272 -9.108 1.00 0.00 H new ATOM 3600 N LEU B 131 19.011 13.335 -3.006 1.00 0.00 N ATOM 3601 CA LEU B 131 18.361 14.643 -2.916 1.00 0.00 C ATOM 3602 C LEU B 131 19.219 15.722 -3.563 1.00 0.00 C ATOM 3603 O LEU B 131 18.696 16.583 -4.271 1.00 0.00 O ATOM 3604 CB LEU B 131 18.066 15.044 -1.454 1.00 0.00 C ATOM 3605 CG LEU B 131 16.632 14.767 -0.976 1.00 0.00 C ATOM 3606 CD1 LEU B 131 15.576 15.409 -1.889 1.00 0.00 C ATOM 3607 CD2 LEU B 131 16.379 13.273 -0.780 1.00 0.00 C ATOM 0 H LEU B 131 19.272 12.931 -2.107 1.00 0.00 H new ATOM 0 HA LEU B 131 17.414 14.557 -3.450 1.00 0.00 H new ATOM 0 HB2 LEU B 131 18.758 14.512 -0.801 1.00 0.00 H new ATOM 0 HB3 LEU B 131 18.272 16.108 -1.337 1.00 0.00 H new ATOM 0 HG LEU B 131 16.531 15.244 -0.001 1.00 0.00 H new ATOM 0 HD11 LEU B 131 14.580 15.184 -1.508 1.00 0.00 H new ATOM 0 HD12 LEU B 131 15.721 16.489 -1.909 1.00 0.00 H new ATOM 0 HD13 LEU B 131 15.677 15.010 -2.898 1.00 0.00 H new ATOM 0 HD21 LEU B 131 15.354 13.119 -0.442 1.00 0.00 H new ATOM 0 HD22 LEU B 131 16.532 12.751 -1.725 1.00 0.00 H new ATOM 0 HD23 LEU B 131 17.070 12.882 -0.033 1.00 0.00 H new ATOM 3619 N LYS B 132 20.530 15.693 -3.326 1.00 0.00 N ATOM 3620 CA LYS B 132 21.434 16.679 -3.883 1.00 0.00 C ATOM 3621 C LYS B 132 21.464 16.536 -5.401 1.00 0.00 C ATOM 3622 O LYS B 132 21.338 17.542 -6.090 1.00 0.00 O ATOM 3623 CB LYS B 132 22.800 16.486 -3.216 1.00 0.00 C ATOM 3624 CG LYS B 132 23.807 17.586 -3.565 1.00 0.00 C ATOM 3625 CD LYS B 132 25.128 17.386 -2.807 1.00 0.00 C ATOM 3626 CE LYS B 132 24.995 17.625 -1.294 1.00 0.00 C ATOM 3627 NZ LYS B 132 26.302 17.509 -0.597 1.00 0.00 N ATOM 0 H LYS B 132 20.985 14.988 -2.746 1.00 0.00 H new ATOM 0 HA LYS B 132 21.108 17.700 -3.684 1.00 0.00 H new ATOM 0 HB2 LYS B 132 22.667 16.455 -2.135 1.00 0.00 H new ATOM 0 HB3 LYS B 132 23.209 15.521 -3.515 1.00 0.00 H new ATOM 0 HG2 LYS B 132 23.996 17.583 -4.638 1.00 0.00 H new ATOM 0 HG3 LYS B 132 23.386 18.561 -3.318 1.00 0.00 H new ATOM 0 HD2 LYS B 132 25.489 16.372 -2.979 1.00 0.00 H new ATOM 0 HD3 LYS B 132 25.879 18.064 -3.212 1.00 0.00 H new ATOM 0 HE2 LYS B 132 24.577 18.616 -1.119 1.00 0.00 H new ATOM 0 HE3 LYS B 132 24.294 16.904 -0.873 1.00 0.00 H new ATOM 0 HZ1 LYS B 132 26.169 17.677 0.421 1.00 0.00 H new ATOM 0 HZ2 LYS B 132 26.690 16.555 -0.743 1.00 0.00 H new ATOM 0 HZ3 LYS B 132 26.964 18.214 -0.980 1.00 0.00 H new ATOM 3641 N GLU B 133 21.536 15.312 -5.936 1.00 0.00 N ATOM 3642 CA GLU B 133 21.383 15.104 -7.368 1.00 0.00 C ATOM 3643 C GLU B 133 20.027 15.581 -7.834 1.00 0.00 C ATOM 3644 O GLU B 133 19.978 16.179 -8.892 1.00 0.00 O ATOM 3645 CB GLU B 133 21.564 13.640 -7.803 1.00 0.00 C ATOM 3646 CG GLU B 133 23.034 13.340 -8.098 1.00 0.00 C ATOM 3647 CD GLU B 133 23.263 11.864 -8.471 1.00 0.00 C ATOM 3648 OE1 GLU B 133 22.964 11.470 -9.623 1.00 0.00 O ATOM 3649 OE2 GLU B 133 23.776 11.090 -7.631 1.00 0.00 O ATOM 0 H GLU B 133 21.698 14.461 -5.398 1.00 0.00 H new ATOM 0 HA GLU B 133 22.179 15.686 -7.832 1.00 0.00 H new ATOM 0 HB2 GLU B 133 21.203 12.975 -7.018 1.00 0.00 H new ATOM 0 HB3 GLU B 133 20.962 13.442 -8.690 1.00 0.00 H new ATOM 0 HG2 GLU B 133 23.376 13.976 -8.914 1.00 0.00 H new ATOM 0 HG3 GLU B 133 23.636 13.590 -7.225 1.00 0.00 H new ATOM 3656 N PHE B 134 18.926 15.377 -7.117 1.00 0.00 N ATOM 3657 CA PHE B 134 17.630 15.832 -7.607 1.00 0.00 C ATOM 3658 C PHE B 134 17.613 17.349 -7.807 1.00 0.00 C ATOM 3659 O PHE B 134 17.103 17.828 -8.821 1.00 0.00 O ATOM 3660 CB PHE B 134 16.524 15.372 -6.657 1.00 0.00 C ATOM 3661 CG PHE B 134 15.158 15.930 -7.006 1.00 0.00 C ATOM 3662 CD1 PHE B 134 14.552 15.566 -8.219 1.00 0.00 C ATOM 3663 CD2 PHE B 134 14.522 16.854 -6.157 1.00 0.00 C ATOM 3664 CE1 PHE B 134 13.325 16.133 -8.601 1.00 0.00 C ATOM 3665 CE2 PHE B 134 13.305 17.443 -6.548 1.00 0.00 C ATOM 3666 CZ PHE B 134 12.706 17.078 -7.767 1.00 0.00 C ATOM 0 H PHE B 134 18.904 14.908 -6.211 1.00 0.00 H new ATOM 0 HA PHE B 134 17.448 15.385 -8.584 1.00 0.00 H new ATOM 0 HB2 PHE B 134 16.477 14.283 -6.667 1.00 0.00 H new ATOM 0 HB3 PHE B 134 16.781 15.670 -5.641 1.00 0.00 H new ATOM 0 HD1 PHE B 134 15.033 14.845 -8.863 1.00 0.00 H new ATOM 0 HD2 PHE B 134 14.967 17.111 -5.207 1.00 0.00 H new ATOM 0 HE1 PHE B 134 12.860 15.844 -9.532 1.00 0.00 H new ATOM 0 HE2 PHE B 134 12.831 18.176 -5.912 1.00 0.00 H new ATOM 0 HZ PHE B 134 11.768 17.525 -8.062 1.00 0.00 H new ATOM 3676 N ALA B 135 18.239 18.094 -6.895 1.00 0.00 N ATOM 3677 CA ALA B 135 18.386 19.537 -7.011 1.00 0.00 C ATOM 3678 C ALA B 135 19.201 19.942 -8.253 1.00 0.00 C ATOM 3679 O ALA B 135 18.996 21.025 -8.801 1.00 0.00 O ATOM 3680 CB ALA B 135 19.054 20.080 -5.746 1.00 0.00 C ATOM 0 H ALA B 135 18.660 17.706 -6.051 1.00 0.00 H new ATOM 0 HA ALA B 135 17.391 19.967 -7.126 1.00 0.00 H new ATOM 0 HB1 ALA B 135 19.166 21.161 -5.829 1.00 0.00 H new ATOM 0 HB2 ALA B 135 18.437 19.845 -4.879 1.00 0.00 H new ATOM 0 HB3 ALA B 135 20.036 19.622 -5.628 1.00 0.00 H new ATOM 3686 N GLU B 136 20.131 19.087 -8.683 1.00 0.00 N ATOM 3687 CA GLU B 136 21.079 19.337 -9.761 1.00 0.00 C ATOM 3688 C GLU B 136 20.513 18.895 -11.114 1.00 0.00 C ATOM 3689 O GLU B 136 20.624 19.602 -12.117 1.00 0.00 O ATOM 3690 CB GLU B 136 22.387 18.567 -9.492 1.00 0.00 C ATOM 3691 CG GLU B 136 23.187 19.065 -8.280 1.00 0.00 C ATOM 3692 CD GLU B 136 24.069 20.277 -8.624 1.00 0.00 C ATOM 3693 OE1 GLU B 136 23.566 21.423 -8.644 1.00 0.00 O ATOM 3694 OE2 GLU B 136 25.284 20.098 -8.870 1.00 0.00 O ATOM 0 H GLU B 136 20.246 18.162 -8.269 1.00 0.00 H new ATOM 0 HA GLU B 136 21.271 20.409 -9.796 1.00 0.00 H new ATOM 0 HB2 GLU B 136 22.149 17.514 -9.345 1.00 0.00 H new ATOM 0 HB3 GLU B 136 23.019 18.630 -10.378 1.00 0.00 H new ATOM 0 HG2 GLU B 136 22.499 19.334 -7.479 1.00 0.00 H new ATOM 0 HG3 GLU B 136 23.814 18.257 -7.904 1.00 0.00 H new ATOM 3701 N THR B 137 19.914 17.709 -11.126 1.00 0.00 N ATOM 3702 CA THR B 137 19.483 16.974 -12.305 1.00 0.00 C ATOM 3703 C THR B 137 18.058 17.376 -12.701 1.00 0.00 C ATOM 3704 O THR B 137 17.696 17.258 -13.874 1.00 0.00 O ATOM 3705 CB THR B 137 19.618 15.457 -12.018 1.00 0.00 C ATOM 3706 OG1 THR B 137 18.793 15.048 -10.945 1.00 0.00 O ATOM 3707 CG2 THR B 137 21.074 15.064 -11.722 1.00 0.00 C ATOM 0 H THR B 137 19.705 17.208 -10.262 1.00 0.00 H new ATOM 0 HA THR B 137 20.115 17.219 -13.158 1.00 0.00 H new ATOM 0 HB THR B 137 19.291 14.945 -12.923 1.00 0.00 H new ATOM 0 HG1 THR B 137 19.217 15.291 -10.095 1.00 0.00 H new ATOM 0 HG21 THR B 137 21.129 13.993 -11.526 1.00 0.00 H new ATOM 0 HG22 THR B 137 21.699 15.308 -12.581 1.00 0.00 H new ATOM 0 HG23 THR B 137 21.428 15.612 -10.849 1.00 0.00 H new ATOM 3715 N GLY B 138 17.262 17.876 -11.742 1.00 0.00 N ATOM 3716 CA GLY B 138 15.832 18.108 -11.899 1.00 0.00 C ATOM 3717 C GLY B 138 15.155 16.876 -12.478 1.00 0.00 C ATOM 3718 O GLY B 138 14.486 16.983 -13.509 1.00 0.00 O ATOM 0 H GLY B 138 17.610 18.133 -10.819 1.00 0.00 H new ATOM 0 HA2 GLY B 138 15.389 18.354 -10.934 1.00 0.00 H new ATOM 0 HA3 GLY B 138 15.666 18.963 -12.554 1.00 0.00 H new ATOM 3722 N LYS B 139 15.422 15.725 -11.843 1.00 0.00 N ATOM 3723 CA LYS B 139 15.016 14.397 -12.298 1.00 0.00 C ATOM 3724 C LYS B 139 13.636 14.403 -12.951 1.00 0.00 C ATOM 3725 O LYS B 139 13.527 13.963 -14.114 1.00 0.00 O ATOM 3726 CB LYS B 139 15.058 13.412 -11.120 1.00 0.00 C ATOM 3727 CG LYS B 139 15.000 11.945 -11.555 1.00 0.00 C ATOM 3728 CD LYS B 139 16.380 11.282 -11.693 1.00 0.00 C ATOM 3729 CE LYS B 139 17.257 11.913 -12.785 1.00 0.00 C ATOM 3730 NZ LYS B 139 18.533 11.177 -12.978 1.00 0.00 N ATOM 3731 OXT LYS B 139 12.645 14.774 -12.287 1.00 0.00 O ATOM 0 H LYS B 139 15.945 15.698 -10.968 1.00 0.00 H new ATOM 0 HA LYS B 139 15.722 14.077 -13.065 1.00 0.00 H new ATOM 0 HB2 LYS B 139 15.971 13.578 -10.549 1.00 0.00 H new ATOM 0 HB3 LYS B 139 14.222 13.619 -10.452 1.00 0.00 H new ATOM 0 HG2 LYS B 139 14.409 11.384 -10.831 1.00 0.00 H new ATOM 0 HG3 LYS B 139 14.479 11.880 -12.510 1.00 0.00 H new ATOM 0 HD2 LYS B 139 16.902 11.345 -10.738 1.00 0.00 H new ATOM 0 HD3 LYS B 139 16.245 10.223 -11.913 1.00 0.00 H new ATOM 0 HE2 LYS B 139 16.705 11.932 -13.725 1.00 0.00 H new ATOM 0 HE3 LYS B 139 17.473 12.948 -12.521 1.00 0.00 H new ATOM 0 HZ1 LYS B 139 19.091 11.639 -13.724 1.00 0.00 H new ATOM 0 HZ2 LYS B 139 19.073 11.180 -12.089 1.00 0.00 H new ATOM 0 HZ3 LYS B 139 18.329 10.196 -13.256 1.00 0.00 H new TER 3745 LYS B 139