USER MOD reduce.3.24.130724 H: found=0, std=0, add=1857, rem=0, adj=56 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= 1.05 K(o=2.2,f=1.1) USER MOD Set 1.2: B 74 ASN : amide:sc= 1.11 K(o=2.2,f=1) USER MOD Set 2.1: A 70 MET CE :methyl -162:sc= -1.13 (180deg=-2.51) USER MOD Set 2.2: B 69 SER OG : rot -179:sc= 0.292 USER MOD Set 3.1: B 13 ASN : amide:sc= -0.621 K(o=0.72,f=-2.4!) USER MOD Set 3.2: B 17 SER OG : rot -110:sc= 0.0737 USER MOD Set 3.3: B 18 GLN : amide:sc= 1.78 K(o=0.72,f=-1.5) USER MOD Set 3.4: B 62 GLN : amide:sc= -1.52 X(o=0.72,f=0.78) USER MOD Set 3.5: B 64 SER OG : rot -60:sc= 1.01 USER MOD Set 4.1: A 102 LYS NZ :NH3+ 165:sc= 2.52 (180deg=1.23) USER MOD Set 4.2: A 103 HIS : no HE2:sc= 0.977 K(o=3.5,f=-6.9!) USER MOD Set 5.1: A 93 LYS NZ :NH3+ 144:sc= 2.34 (180deg=0.392) USER MOD Set 5.2: A 97 GLN : amide:sc= 0.861 K(o=3.2,f=-0.23!) USER MOD Set 6.1: A 71 SER OG : rot -65:sc= 1.19 USER MOD Set 6.2: A 74 THR OG1 : rot 109:sc= 1.24 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -124:sc= 2.26 (180deg=0.421) USER MOD Single : A 5 LYS NZ :NH3+ 165:sc= 1.29 (180deg=1.25) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.197 USER MOD Single : A 9 GLN : amide:sc= 1.13 K(o=1.1,f=0) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0.0182 USER MOD Single : A 15 THR OG1 : rot -65:sc= 1.26 USER MOD Single : A 16 SER OG : rot 49:sc= 1.23 USER MOD Single : A 32 SER OG : rot 169:sc= 1.12 USER MOD Single : A 33 LYS NZ :NH3+ -154:sc= 1.63 (180deg=1.31) USER MOD Single : A 34 MET CE :methyl -179:sc= 0 (180deg=-0.0007) USER MOD Single : A 44 GLN : amide:sc= 0.594 K(o=0.59,f=0) USER MOD Single : A 46 MET CE :methyl -108:sc= -0.509 (180deg=-1.03) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 LYS NZ :NH3+ -176:sc= 2.34 (180deg=2.23) USER MOD Single : A 54 LYS NZ :NH3+ 165:sc= 0.0773 (180deg=0.0434) USER MOD Single : A 60 ASN : amide:sc= 0.361 K(o=0.36,f=-4.6!) USER MOD Single : A 61 GLN : amide:sc= 0.285 K(o=0.28,f=-1.8) USER MOD Single : A 63 THR OG1 : rot 170:sc= 0.00632 USER MOD Single : A 66 LYS NZ :NH3+ 178:sc= 1.53 (180deg=1.48) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ -172:sc= 1.17 (180deg=1.11) USER MOD Single : A 86 THR OG1 : rot 180:sc= -0.239 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 152:sc= 0.682 (180deg=-0.325!) USER MOD Single : A 101 ASN : amide:sc= -0.0514 X(o=-0.051,f=0) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 3 ASN : amide:sc= 1.66 K(o=1.7,f=0) USER MOD Single : B 4 LYS NZ :NH3+ 146:sc= 1.35 (180deg=0.979) USER MOD Single : B 7 TYR OH : rot -156:sc= 0.771 USER MOD Single : B 10 SER OG : rot -170:sc= 0.397 USER MOD Single : B 11 THR OG1 : rot -167:sc= 1.28 USER MOD Single : B 14 SER OG : rot 180:sc= 0.0936 USER MOD Single : B 19 MET CE :methyl -161:sc= -0.305 (180deg=-1.6) USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 GLN : amide:sc= 0.402 K(o=0.4,f=-0.68) USER MOD Single : B 27 TYR OH : rot 180:sc= 0 USER MOD Single : B 33 LYS NZ :NH3+ 171:sc= 1.02 (180deg=0.945) USER MOD Single : B 35 TYR OH : rot 180:sc= 0 USER MOD Single : B 36 SER OG : rot 147:sc= 1.26 USER MOD Single : B 42 HIS : no HD1:sc= -0.116 K(o=-0.12,f=-0.72) USER MOD Single : B 45 ASN : amide:sc= -1.13 K(o=-1.1,f=-9!) USER MOD Single : B 47 ASN : amide:sc= -0.787! C(o=-0.79!,f=-2.9!) USER MOD Single : B 50 LYS NZ :NH3+ -162:sc= 0.0059 (180deg=0.00111) USER MOD Single : B 52 MET CE :methyl 174:sc= -0.776 (180deg=-1.06) USER MOD Single : B 53 LYS NZ :NH3+ 152:sc= 0.975 (180deg=0.19) USER MOD Single : B 60 SER OG : rot 77:sc= 1.17 USER MOD Single : B 61 ASN : amide:sc= -0.203 X(o=-0.2,f=-0.2) USER MOD Single : B 63 THR OG1 : rot 180:sc= 0 USER MOD Single : B 80 THR OG1 : rot -50:sc= 0.875 USER MOD Single : B 82 SER OG : rot 7:sc= 0.529 USER MOD Single : B 88 LYS NZ :NH3+ -135:sc= 0.752 (180deg=0.016) USER MOD Single : B 91 MET CE :methyl 168:sc= -2.3 (180deg=-3.18) USER MOD Single : B 92 THR OG1 : rot 40:sc= -0.211 USER MOD Single : B 95 HIS : no HE2:sc= -0.973 K(o=-0.97,f=-2.4!) USER MOD Single : B 97 LYS NZ :NH3+ -155:sc= 1.29 (180deg=0.537) USER MOD Single : B 100 HIS : no HE2:sc= 0.645 K(o=0.65,f=-2.4!) USER MOD Single : B 110 GLN : amide:sc= 0.804 K(o=0.8,f=-0.019) USER MOD Single : B 112 THR OG1 : rot -170:sc= 0.429 USER MOD Single : B 116 LYS NZ :NH3+ -171:sc= 0.879 (180deg=0.821) USER MOD Single : B 121 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 129 ASN : amide:sc= 0.785 K(o=0.78,f=0) USER MOD Single : B 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 137 THR OG1 : rot -86:sc= 1.34 USER MOD Single : B 139 LYS NZ :NH3+ -156:sc= 1.27 (180deg=0.687!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -23.974 -11.482 -7.946 1.00 0.00 N ATOM 2 CA MET A 1 -24.315 -11.902 -9.320 1.00 0.00 C ATOM 3 C MET A 1 -23.060 -12.425 -10.016 1.00 0.00 C ATOM 4 O MET A 1 -23.021 -13.601 -10.389 1.00 0.00 O ATOM 5 CB MET A 1 -25.020 -10.793 -10.128 1.00 0.00 C ATOM 6 CG MET A 1 -26.398 -10.422 -9.558 1.00 0.00 C ATOM 7 SD MET A 1 -27.586 -11.790 -9.388 1.00 0.00 S ATOM 8 CE MET A 1 -27.947 -12.147 -11.132 1.00 0.00 C ATOM 0 H1 MET A 1 -24.579 -11.988 -7.268 1.00 0.00 H new ATOM 0 H2 MET A 1 -22.976 -11.703 -7.753 1.00 0.00 H new ATOM 0 H3 MET A 1 -24.127 -10.458 -7.848 1.00 0.00 H new ATOM 0 HA MET A 1 -25.044 -12.711 -9.260 1.00 0.00 H new ATOM 0 HB2 MET A 1 -24.388 -9.905 -10.145 1.00 0.00 H new ATOM 0 HB3 MET A 1 -25.136 -11.121 -11.161 1.00 0.00 H new ATOM 0 HG2 MET A 1 -26.253 -9.969 -8.577 1.00 0.00 H new ATOM 0 HG3 MET A 1 -26.841 -9.660 -10.199 1.00 0.00 H new ATOM 0 HE1 MET A 1 -28.663 -12.966 -11.195 1.00 0.00 H new ATOM 0 HE2 MET A 1 -28.368 -11.260 -11.605 1.00 0.00 H new ATOM 0 HE3 MET A 1 -27.027 -12.429 -11.644 1.00 0.00 H new ATOM 20 N ALA A 2 -22.039 -11.578 -10.197 1.00 0.00 N ATOM 21 CA ALA A 2 -20.707 -11.955 -10.645 1.00 0.00 C ATOM 22 C ALA A 2 -19.733 -10.902 -10.127 1.00 0.00 C ATOM 23 O ALA A 2 -20.145 -9.815 -9.707 1.00 0.00 O ATOM 24 CB ALA A 2 -20.667 -12.002 -12.181 1.00 0.00 C ATOM 0 H ALA A 2 -22.129 -10.576 -10.027 1.00 0.00 H new ATOM 0 HA ALA A 2 -20.438 -12.941 -10.268 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -19.667 -12.285 -12.510 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -21.389 -12.735 -12.542 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -20.917 -11.020 -12.582 1.00 0.00 H new ATOM 30 N ILE A 3 -18.442 -11.224 -10.166 1.00 0.00 N ATOM 31 CA ILE A 3 -17.379 -10.272 -9.936 1.00 0.00 C ATOM 32 C ILE A 3 -17.270 -9.538 -11.281 1.00 0.00 C ATOM 33 O ILE A 3 -16.763 -10.089 -12.262 1.00 0.00 O ATOM 34 CB ILE A 3 -16.095 -10.994 -9.440 1.00 0.00 C ATOM 35 CG1 ILE A 3 -16.152 -11.366 -7.940 1.00 0.00 C ATOM 36 CG2 ILE A 3 -14.863 -10.095 -9.616 1.00 0.00 C ATOM 37 CD1 ILE A 3 -17.115 -12.474 -7.543 1.00 0.00 C ATOM 0 H ILE A 3 -18.109 -12.168 -10.362 1.00 0.00 H new ATOM 0 HA ILE A 3 -17.559 -9.552 -9.138 1.00 0.00 H new ATOM 0 HB ILE A 3 -16.027 -11.901 -10.041 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -15.150 -11.658 -7.624 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -16.415 -10.470 -7.378 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -13.976 -10.620 -9.262 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -14.742 -9.847 -10.670 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -14.996 -9.179 -9.040 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -17.058 -12.637 -6.467 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -18.131 -12.187 -7.814 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -16.847 -13.393 -8.064 1.00 0.00 H new ATOM 49 N VAL A 4 -17.844 -8.337 -11.354 1.00 0.00 N ATOM 50 CA VAL A 4 -17.793 -7.465 -12.518 1.00 0.00 C ATOM 51 C VAL A 4 -16.409 -6.804 -12.507 1.00 0.00 C ATOM 52 O VAL A 4 -15.704 -6.827 -11.494 1.00 0.00 O ATOM 53 CB VAL A 4 -18.979 -6.471 -12.444 1.00 0.00 C ATOM 54 CG1 VAL A 4 -19.107 -5.519 -13.647 1.00 0.00 C ATOM 55 CG2 VAL A 4 -20.325 -7.208 -12.306 1.00 0.00 C ATOM 0 H VAL A 4 -18.372 -7.936 -10.579 1.00 0.00 H new ATOM 0 HA VAL A 4 -17.906 -7.990 -13.466 1.00 0.00 H new ATOM 0 HB VAL A 4 -18.751 -5.873 -11.562 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -19.965 -4.863 -13.502 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -18.202 -4.918 -13.733 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -19.245 -6.101 -14.558 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -21.135 -6.480 -12.257 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -20.474 -7.859 -13.168 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -20.320 -7.807 -11.396 1.00 0.00 H new ATOM 65 N LYS A 5 -16.023 -6.170 -13.613 1.00 0.00 N ATOM 66 CA LYS A 5 -14.834 -5.341 -13.699 1.00 0.00 C ATOM 67 C LYS A 5 -15.291 -3.955 -14.131 1.00 0.00 C ATOM 68 O LYS A 5 -15.756 -3.770 -15.258 1.00 0.00 O ATOM 69 CB LYS A 5 -13.779 -5.984 -14.611 1.00 0.00 C ATOM 70 CG LYS A 5 -12.450 -5.212 -14.539 1.00 0.00 C ATOM 71 CD LYS A 5 -11.295 -5.923 -15.259 1.00 0.00 C ATOM 72 CE LYS A 5 -11.568 -6.102 -16.759 1.00 0.00 C ATOM 73 NZ LYS A 5 -10.379 -6.618 -17.478 1.00 0.00 N ATOM 0 H LYS A 5 -16.542 -6.223 -14.489 1.00 0.00 H new ATOM 0 HA LYS A 5 -14.327 -5.248 -12.739 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -13.619 -7.021 -14.315 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -14.141 -5.999 -15.639 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -12.588 -4.223 -14.977 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -12.180 -5.063 -13.493 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -10.378 -5.350 -15.124 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -11.131 -6.899 -14.803 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -12.403 -6.789 -16.897 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -11.867 -5.147 -17.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -10.664 -6.964 -18.417 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -9.681 -5.855 -17.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -9.957 -7.398 -16.935 1.00 0.00 H new ATOM 87 N ALA A 6 -15.254 -3.019 -13.187 1.00 0.00 N ATOM 88 CA ALA A 6 -15.550 -1.615 -13.411 1.00 0.00 C ATOM 89 C ALA A 6 -14.425 -0.974 -14.259 1.00 0.00 C ATOM 90 O ALA A 6 -13.401 -1.604 -14.531 1.00 0.00 O ATOM 91 CB ALA A 6 -15.677 -0.926 -12.050 1.00 0.00 C ATOM 0 H ALA A 6 -15.010 -3.227 -12.219 1.00 0.00 H new ATOM 0 HA ALA A 6 -16.486 -1.502 -13.958 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -15.900 0.131 -12.197 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -16.482 -1.391 -11.481 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -14.740 -1.027 -11.502 1.00 0.00 H new ATOM 97 N THR A 7 -14.589 0.295 -14.635 1.00 0.00 N ATOM 98 CA THR A 7 -13.569 1.148 -15.246 1.00 0.00 C ATOM 99 C THR A 7 -14.012 2.612 -15.027 1.00 0.00 C ATOM 100 O THR A 7 -14.991 2.850 -14.314 1.00 0.00 O ATOM 101 CB THR A 7 -13.293 0.720 -16.712 1.00 0.00 C ATOM 102 OG1 THR A 7 -12.310 1.537 -17.319 1.00 0.00 O ATOM 103 CG2 THR A 7 -14.528 0.719 -17.612 1.00 0.00 C ATOM 0 H THR A 7 -15.479 0.779 -14.516 1.00 0.00 H new ATOM 0 HA THR A 7 -12.590 1.040 -14.778 1.00 0.00 H new ATOM 0 HB THR A 7 -12.942 -0.308 -16.624 1.00 0.00 H new ATOM 0 HG1 THR A 7 -12.160 1.238 -18.240 1.00 0.00 H new ATOM 0 HG21 THR A 7 -14.245 0.408 -18.618 1.00 0.00 H new ATOM 0 HG22 THR A 7 -15.269 0.026 -17.213 1.00 0.00 H new ATOM 0 HG23 THR A 7 -14.952 1.722 -17.648 1.00 0.00 H new ATOM 111 N ASP A 8 -13.307 3.573 -15.632 1.00 0.00 N ATOM 112 CA ASP A 8 -13.373 5.032 -15.443 1.00 0.00 C ATOM 113 C ASP A 8 -14.773 5.617 -15.221 1.00 0.00 C ATOM 114 O ASP A 8 -14.949 6.494 -14.371 1.00 0.00 O ATOM 115 CB ASP A 8 -12.729 5.696 -16.672 1.00 0.00 C ATOM 116 CG ASP A 8 -12.913 7.223 -16.703 1.00 0.00 C ATOM 117 OD1 ASP A 8 -12.543 7.908 -15.724 1.00 0.00 O ATOM 118 OD2 ASP A 8 -13.419 7.738 -17.724 1.00 0.00 O ATOM 0 H ASP A 8 -12.608 3.329 -16.334 1.00 0.00 H new ATOM 0 HA ASP A 8 -12.840 5.242 -14.516 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -11.664 5.465 -16.685 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -13.160 5.266 -17.576 1.00 0.00 H new ATOM 123 N GLN A 9 -15.766 5.139 -15.976 1.00 0.00 N ATOM 124 CA GLN A 9 -17.151 5.593 -15.930 1.00 0.00 C ATOM 125 C GLN A 9 -18.109 4.416 -15.764 1.00 0.00 C ATOM 126 O GLN A 9 -19.168 4.569 -15.154 1.00 0.00 O ATOM 127 CB GLN A 9 -17.477 6.381 -17.207 1.00 0.00 C ATOM 128 CG GLN A 9 -16.874 7.794 -17.177 1.00 0.00 C ATOM 129 CD GLN A 9 -16.851 8.433 -18.566 1.00 0.00 C ATOM 130 OE1 GLN A 9 -17.887 8.776 -19.133 1.00 0.00 O ATOM 131 NE2 GLN A 9 -15.675 8.604 -19.147 1.00 0.00 N ATOM 0 H GLN A 9 -15.618 4.397 -16.660 1.00 0.00 H new ATOM 0 HA GLN A 9 -17.277 6.245 -15.066 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -17.095 5.842 -18.074 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -18.558 6.450 -17.325 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -17.452 8.421 -16.498 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -15.859 7.747 -16.782 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -14.822 8.316 -18.667 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -15.621 9.024 -20.075 1.00 0.00 H new ATOM 140 N SER A 10 -17.734 3.223 -16.233 1.00 0.00 N ATOM 141 CA SER A 10 -18.507 2.019 -15.975 1.00 0.00 C ATOM 142 C SER A 10 -18.593 1.706 -14.478 1.00 0.00 C ATOM 143 O SER A 10 -19.556 1.060 -14.085 1.00 0.00 O ATOM 144 CB SER A 10 -17.949 0.834 -16.763 1.00 0.00 C ATOM 145 OG SER A 10 -17.671 1.215 -18.103 1.00 0.00 O ATOM 0 H SER A 10 -16.896 3.071 -16.795 1.00 0.00 H new ATOM 0 HA SER A 10 -19.525 2.202 -16.319 1.00 0.00 H new ATOM 0 HB2 SER A 10 -17.039 0.469 -16.286 1.00 0.00 H new ATOM 0 HB3 SER A 10 -18.666 0.013 -16.753 1.00 0.00 H new ATOM 0 HG SER A 10 -17.313 0.446 -18.594 1.00 0.00 H new ATOM 151 N PHE A 11 -17.662 2.172 -13.626 1.00 0.00 N ATOM 152 CA PHE A 11 -17.825 2.087 -12.176 1.00 0.00 C ATOM 153 C PHE A 11 -19.152 2.744 -11.813 1.00 0.00 C ATOM 154 O PHE A 11 -20.010 2.093 -11.226 1.00 0.00 O ATOM 155 CB PHE A 11 -16.651 2.753 -11.432 1.00 0.00 C ATOM 156 CG PHE A 11 -16.852 2.965 -9.934 1.00 0.00 C ATOM 157 CD1 PHE A 11 -17.414 4.185 -9.505 1.00 0.00 C ATOM 158 CD2 PHE A 11 -16.424 2.021 -8.964 1.00 0.00 C ATOM 159 CE1 PHE A 11 -17.546 4.472 -8.138 1.00 0.00 C ATOM 160 CE2 PHE A 11 -16.529 2.336 -7.597 1.00 0.00 C ATOM 161 CZ PHE A 11 -17.082 3.558 -7.184 1.00 0.00 C ATOM 0 H PHE A 11 -16.791 2.611 -13.924 1.00 0.00 H new ATOM 0 HA PHE A 11 -17.828 1.041 -11.868 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -15.760 2.143 -11.578 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -16.454 3.720 -11.894 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -17.746 4.906 -10.237 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -16.021 1.068 -9.273 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -18.005 5.397 -7.822 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -16.180 1.630 -6.858 1.00 0.00 H new ATOM 0 HZ PHE A 11 -17.150 3.793 -6.132 1.00 0.00 H new ATOM 171 N SER A 12 -19.373 3.994 -12.222 1.00 0.00 N ATOM 172 CA SER A 12 -20.605 4.709 -11.933 1.00 0.00 C ATOM 173 C SER A 12 -21.801 3.941 -12.482 1.00 0.00 C ATOM 174 O SER A 12 -22.773 3.709 -11.762 1.00 0.00 O ATOM 175 CB SER A 12 -20.550 6.104 -12.563 1.00 0.00 C ATOM 176 OG SER A 12 -19.280 6.709 -12.351 1.00 0.00 O ATOM 0 H SER A 12 -18.699 4.535 -12.763 1.00 0.00 H new ATOM 0 HA SER A 12 -20.715 4.804 -10.853 1.00 0.00 H new ATOM 0 HB2 SER A 12 -20.749 6.032 -13.632 1.00 0.00 H new ATOM 0 HB3 SER A 12 -21.332 6.731 -12.135 1.00 0.00 H new ATOM 0 HG SER A 12 -19.268 7.598 -12.764 1.00 0.00 H new ATOM 182 N ALA A 13 -21.719 3.500 -13.740 1.00 0.00 N ATOM 183 CA ALA A 13 -22.849 2.863 -14.392 1.00 0.00 C ATOM 184 C ALA A 13 -23.246 1.565 -13.677 1.00 0.00 C ATOM 185 O ALA A 13 -24.432 1.287 -13.497 1.00 0.00 O ATOM 186 CB ALA A 13 -22.517 2.609 -15.864 1.00 0.00 C ATOM 0 H ALA A 13 -20.883 3.575 -14.319 1.00 0.00 H new ATOM 0 HA ALA A 13 -23.708 3.532 -14.337 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -23.367 2.131 -16.351 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -22.302 3.557 -16.357 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -21.645 1.958 -15.933 1.00 0.00 H new ATOM 192 N GLU A 14 -22.254 0.788 -13.240 1.00 0.00 N ATOM 193 CA GLU A 14 -22.435 -0.491 -12.572 1.00 0.00 C ATOM 194 C GLU A 14 -22.786 -0.324 -11.084 1.00 0.00 C ATOM 195 O GLU A 14 -23.266 -1.287 -10.482 1.00 0.00 O ATOM 196 CB GLU A 14 -21.185 -1.374 -12.747 1.00 0.00 C ATOM 197 CG GLU A 14 -20.954 -1.813 -14.206 1.00 0.00 C ATOM 198 CD GLU A 14 -22.023 -2.761 -14.781 1.00 0.00 C ATOM 199 OE1 GLU A 14 -22.798 -3.369 -14.009 1.00 0.00 O ATOM 200 OE2 GLU A 14 -22.092 -2.907 -16.023 1.00 0.00 O ATOM 0 H GLU A 14 -21.273 1.045 -13.347 1.00 0.00 H new ATOM 0 HA GLU A 14 -23.282 -0.988 -13.044 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -20.310 -0.828 -12.395 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -21.282 -2.259 -12.119 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -20.905 -0.923 -14.833 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -19.983 -2.303 -14.272 1.00 0.00 H new ATOM 207 N THR A 15 -22.581 0.860 -10.492 1.00 0.00 N ATOM 208 CA THR A 15 -22.778 1.109 -9.060 1.00 0.00 C ATOM 209 C THR A 15 -24.030 1.947 -8.774 1.00 0.00 C ATOM 210 O THR A 15 -24.423 2.063 -7.613 1.00 0.00 O ATOM 211 CB THR A 15 -21.531 1.785 -8.443 1.00 0.00 C ATOM 212 OG1 THR A 15 -21.276 3.009 -9.088 1.00 0.00 O ATOM 213 CG2 THR A 15 -20.225 0.971 -8.501 1.00 0.00 C ATOM 0 H THR A 15 -22.268 1.685 -11.004 1.00 0.00 H new ATOM 0 HA THR A 15 -22.926 0.136 -8.592 1.00 0.00 H new ATOM 0 HB THR A 15 -21.793 1.897 -7.391 1.00 0.00 H new ATOM 0 HG1 THR A 15 -21.033 2.842 -10.023 1.00 0.00 H new ATOM 0 HG21 THR A 15 -19.419 1.542 -8.040 1.00 0.00 H new ATOM 0 HG22 THR A 15 -20.357 0.032 -7.964 1.00 0.00 H new ATOM 0 HG23 THR A 15 -19.973 0.762 -9.541 1.00 0.00 H new ATOM 221 N SER A 16 -24.680 2.509 -9.802 1.00 0.00 N ATOM 222 CA SER A 16 -25.826 3.403 -9.641 1.00 0.00 C ATOM 223 C SER A 16 -27.091 2.676 -9.178 1.00 0.00 C ATOM 224 O SER A 16 -28.105 3.324 -8.923 1.00 0.00 O ATOM 225 CB SER A 16 -26.081 4.198 -10.921 1.00 0.00 C ATOM 226 OG SER A 16 -24.987 5.046 -11.224 1.00 0.00 O ATOM 0 H SER A 16 -24.420 2.352 -10.776 1.00 0.00 H new ATOM 0 HA SER A 16 -25.567 4.101 -8.845 1.00 0.00 H new ATOM 0 HB2 SER A 16 -26.253 3.512 -11.750 1.00 0.00 H new ATOM 0 HB3 SER A 16 -26.986 4.794 -10.808 1.00 0.00 H new ATOM 0 HG SER A 16 -24.153 4.533 -11.178 1.00 0.00 H new ATOM 232 N GLU A 17 -27.039 1.352 -9.039 1.00 0.00 N ATOM 233 CA GLU A 17 -28.121 0.519 -8.571 1.00 0.00 C ATOM 234 C GLU A 17 -27.522 -0.614 -7.735 1.00 0.00 C ATOM 235 O GLU A 17 -26.363 -0.994 -7.936 1.00 0.00 O ATOM 236 CB GLU A 17 -28.887 -0.062 -9.773 1.00 0.00 C ATOM 237 CG GLU A 17 -29.745 0.968 -10.523 1.00 0.00 C ATOM 238 CD GLU A 17 -30.584 0.302 -11.630 1.00 0.00 C ATOM 239 OE1 GLU A 17 -30.108 0.193 -12.783 1.00 0.00 O ATOM 240 OE2 GLU A 17 -31.738 -0.105 -11.365 1.00 0.00 O ATOM 0 H GLU A 17 -26.200 0.817 -9.262 1.00 0.00 H new ATOM 0 HA GLU A 17 -28.816 1.103 -7.968 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -28.172 -0.500 -10.469 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -29.530 -0.871 -9.425 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -30.405 1.475 -9.819 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -29.101 1.730 -10.961 1.00 0.00 H new ATOM 247 N GLY A 18 -28.328 -1.178 -6.833 1.00 0.00 N ATOM 248 CA GLY A 18 -27.959 -2.324 -6.023 1.00 0.00 C ATOM 249 C GLY A 18 -26.973 -1.963 -4.923 1.00 0.00 C ATOM 250 O GLY A 18 -26.736 -0.787 -4.634 1.00 0.00 O ATOM 0 H GLY A 18 -29.272 -0.839 -6.647 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -28.856 -2.754 -5.577 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -27.522 -3.091 -6.662 1.00 0.00 H new ATOM 254 N VAL A 19 -26.395 -2.994 -4.315 1.00 0.00 N ATOM 255 CA VAL A 19 -25.316 -2.872 -3.343 1.00 0.00 C ATOM 256 C VAL A 19 -24.132 -3.631 -3.909 1.00 0.00 C ATOM 257 O VAL A 19 -24.231 -4.820 -4.228 1.00 0.00 O ATOM 258 CB VAL A 19 -25.757 -3.302 -1.926 1.00 0.00 C ATOM 259 CG1 VAL A 19 -24.619 -3.024 -0.927 1.00 0.00 C ATOM 260 CG2 VAL A 19 -27.076 -2.602 -1.544 1.00 0.00 C ATOM 0 H VAL A 19 -26.671 -3.960 -4.489 1.00 0.00 H new ATOM 0 HA VAL A 19 -25.021 -1.833 -3.195 1.00 0.00 H new ATOM 0 HB VAL A 19 -25.955 -4.374 -1.902 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -24.930 -3.327 0.073 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -23.733 -3.588 -1.218 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -24.387 -1.959 -0.927 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -27.376 -2.913 -0.543 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -26.933 -1.522 -1.560 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -27.853 -2.876 -2.258 1.00 0.00 H new ATOM 270 N VAL A 20 -23.029 -2.904 -4.082 1.00 0.00 N ATOM 271 CA VAL A 20 -21.861 -3.378 -4.783 1.00 0.00 C ATOM 272 C VAL A 20 -20.639 -3.076 -3.929 1.00 0.00 C ATOM 273 O VAL A 20 -20.382 -1.946 -3.509 1.00 0.00 O ATOM 274 CB VAL A 20 -21.804 -2.830 -6.226 1.00 0.00 C ATOM 275 CG1 VAL A 20 -21.774 -1.307 -6.301 1.00 0.00 C ATOM 276 CG2 VAL A 20 -20.613 -3.406 -7.018 1.00 0.00 C ATOM 0 H VAL A 20 -22.931 -1.952 -3.728 1.00 0.00 H new ATOM 0 HA VAL A 20 -21.898 -4.458 -4.922 1.00 0.00 H new ATOM 0 HB VAL A 20 -22.735 -3.163 -6.684 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -21.734 -0.995 -7.345 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -22.672 -0.902 -5.835 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -20.894 -0.934 -5.777 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -20.613 -2.993 -8.027 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -19.681 -3.142 -6.518 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -20.702 -4.491 -7.070 1.00 0.00 H new ATOM 286 N LEU A 21 -19.896 -4.138 -3.658 1.00 0.00 N ATOM 287 CA LEU A 21 -18.584 -4.073 -3.053 1.00 0.00 C ATOM 288 C LEU A 21 -17.584 -3.800 -4.179 1.00 0.00 C ATOM 289 O LEU A 21 -17.252 -4.715 -4.933 1.00 0.00 O ATOM 290 CB LEU A 21 -18.329 -5.414 -2.346 1.00 0.00 C ATOM 291 CG LEU A 21 -16.984 -5.495 -1.612 1.00 0.00 C ATOM 292 CD1 LEU A 21 -16.876 -4.381 -0.566 1.00 0.00 C ATOM 293 CD2 LEU A 21 -16.858 -6.857 -0.918 1.00 0.00 C ATOM 0 H LEU A 21 -20.201 -5.090 -3.860 1.00 0.00 H new ATOM 0 HA LEU A 21 -18.490 -3.282 -2.309 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -19.132 -5.592 -1.630 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -18.376 -6.215 -3.084 1.00 0.00 H new ATOM 0 HG LEU A 21 -16.182 -5.375 -2.340 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -15.916 -4.454 -0.055 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -16.953 -3.411 -1.058 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -17.682 -4.484 0.160 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -15.902 -6.913 -0.397 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -17.670 -6.976 -0.200 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -16.912 -7.651 -1.663 1.00 0.00 H new ATOM 305 N ALA A 22 -17.138 -2.555 -4.355 1.00 0.00 N ATOM 306 CA ALA A 22 -16.072 -2.273 -5.303 1.00 0.00 C ATOM 307 C ALA A 22 -14.747 -2.639 -4.643 1.00 0.00 C ATOM 308 O ALA A 22 -14.565 -2.399 -3.448 1.00 0.00 O ATOM 309 CB ALA A 22 -16.111 -0.817 -5.788 1.00 0.00 C ATOM 0 H ALA A 22 -17.496 -1.739 -3.858 1.00 0.00 H new ATOM 0 HA ALA A 22 -16.201 -2.875 -6.202 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -15.299 -0.647 -6.495 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -17.065 -0.622 -6.278 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -15.997 -0.147 -4.936 1.00 0.00 H new ATOM 315 N ASP A 23 -13.828 -3.214 -5.412 1.00 0.00 N ATOM 316 CA ASP A 23 -12.567 -3.761 -4.921 1.00 0.00 C ATOM 317 C ASP A 23 -11.439 -3.345 -5.856 1.00 0.00 C ATOM 318 O ASP A 23 -11.634 -3.222 -7.064 1.00 0.00 O ATOM 319 CB ASP A 23 -12.635 -5.289 -4.820 1.00 0.00 C ATOM 320 CG ASP A 23 -11.235 -5.878 -4.560 1.00 0.00 C ATOM 321 OD1 ASP A 23 -10.740 -5.765 -3.418 1.00 0.00 O ATOM 322 OD2 ASP A 23 -10.630 -6.425 -5.508 1.00 0.00 O ATOM 0 H ASP A 23 -13.942 -3.315 -6.421 1.00 0.00 H new ATOM 0 HA ASP A 23 -12.378 -3.367 -3.922 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -13.311 -5.576 -4.015 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -13.044 -5.702 -5.742 1.00 0.00 H new ATOM 327 N PHE A 24 -10.264 -3.106 -5.292 1.00 0.00 N ATOM 328 CA PHE A 24 -9.128 -2.522 -5.972 1.00 0.00 C ATOM 329 C PHE A 24 -7.956 -3.442 -5.669 1.00 0.00 C ATOM 330 O PHE A 24 -7.498 -3.509 -4.522 1.00 0.00 O ATOM 331 CB PHE A 24 -8.928 -1.083 -5.479 1.00 0.00 C ATOM 332 CG PHE A 24 -10.060 -0.137 -5.860 1.00 0.00 C ATOM 333 CD1 PHE A 24 -11.310 -0.196 -5.207 1.00 0.00 C ATOM 334 CD2 PHE A 24 -9.884 0.772 -6.917 1.00 0.00 C ATOM 335 CE1 PHE A 24 -12.379 0.603 -5.641 1.00 0.00 C ATOM 336 CE2 PHE A 24 -10.944 1.607 -7.319 1.00 0.00 C ATOM 337 CZ PHE A 24 -12.194 1.518 -6.690 1.00 0.00 C ATOM 0 H PHE A 24 -10.074 -3.323 -4.314 1.00 0.00 H new ATOM 0 HA PHE A 24 -9.255 -2.445 -7.052 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -8.825 -1.092 -4.394 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -7.993 -0.697 -5.885 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -11.445 -0.861 -4.367 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -8.932 0.830 -7.423 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -13.346 0.514 -5.167 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -10.793 2.320 -8.116 1.00 0.00 H new ATOM 0 HZ PHE A 24 -13.010 2.149 -7.010 1.00 0.00 H new ATOM 347 N TRP A 25 -7.517 -4.170 -6.696 1.00 0.00 N ATOM 348 CA TRP A 25 -6.517 -5.228 -6.615 1.00 0.00 C ATOM 349 C TRP A 25 -5.367 -4.853 -7.551 1.00 0.00 C ATOM 350 O TRP A 25 -5.561 -4.054 -8.476 1.00 0.00 O ATOM 351 CB TRP A 25 -7.122 -6.582 -7.017 1.00 0.00 C ATOM 352 CG TRP A 25 -7.216 -6.806 -8.497 1.00 0.00 C ATOM 353 CD1 TRP A 25 -8.018 -6.112 -9.329 1.00 0.00 C ATOM 354 CD2 TRP A 25 -6.400 -7.658 -9.358 1.00 0.00 C ATOM 355 NE1 TRP A 25 -7.794 -6.494 -10.632 1.00 0.00 N ATOM 356 CE2 TRP A 25 -6.768 -7.414 -10.717 1.00 0.00 C ATOM 357 CE3 TRP A 25 -5.368 -8.595 -9.130 1.00 0.00 C ATOM 358 CZ2 TRP A 25 -6.121 -8.051 -11.787 1.00 0.00 C ATOM 359 CZ3 TRP A 25 -4.711 -9.235 -10.198 1.00 0.00 C ATOM 360 CH2 TRP A 25 -5.083 -8.961 -11.525 1.00 0.00 C ATOM 0 H TRP A 25 -7.864 -4.031 -7.645 1.00 0.00 H new ATOM 0 HA TRP A 25 -6.156 -5.327 -5.591 1.00 0.00 H new ATOM 0 HB2 TRP A 25 -6.521 -7.379 -6.579 1.00 0.00 H new ATOM 0 HB3 TRP A 25 -8.120 -6.662 -6.586 1.00 0.00 H new ATOM 0 HD1 TRP A 25 -8.733 -5.364 -9.018 1.00 0.00 H new ATOM 0 HE1 TRP A 25 -8.319 -6.142 -11.433 1.00 0.00 H new ATOM 0 HE3 TRP A 25 -5.077 -8.825 -8.116 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 -6.419 -7.843 -12.804 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 -3.918 -9.940 -9.997 1.00 0.00 H new ATOM 0 HH2 TRP A 25 -4.572 -9.449 -12.342 1.00 0.00 H new ATOM 371 N ALA A 26 -4.181 -5.437 -7.350 1.00 0.00 N ATOM 372 CA ALA A 26 -3.050 -5.171 -8.226 1.00 0.00 C ATOM 373 C ALA A 26 -1.924 -6.188 -8.101 1.00 0.00 C ATOM 374 O ALA A 26 -1.751 -6.768 -7.027 1.00 0.00 O ATOM 375 CB ALA A 26 -2.439 -3.839 -7.812 1.00 0.00 C ATOM 0 H ALA A 26 -3.986 -6.091 -6.592 1.00 0.00 H new ATOM 0 HA ALA A 26 -3.437 -5.196 -9.245 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -1.587 -3.614 -8.454 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -3.185 -3.050 -7.910 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -2.107 -3.898 -6.775 1.00 0.00 H new ATOM 381 N PRO A 27 -1.052 -6.299 -9.115 1.00 0.00 N ATOM 382 CA PRO A 27 0.182 -7.063 -8.998 1.00 0.00 C ATOM 383 C PRO A 27 1.048 -6.631 -7.799 1.00 0.00 C ATOM 384 O PRO A 27 1.775 -7.474 -7.267 1.00 0.00 O ATOM 385 CB PRO A 27 0.911 -6.867 -10.332 1.00 0.00 C ATOM 386 CG PRO A 27 -0.216 -6.552 -11.316 1.00 0.00 C ATOM 387 CD PRO A 27 -1.196 -5.757 -10.462 1.00 0.00 C ATOM 0 HA PRO A 27 -0.032 -8.114 -8.804 1.00 0.00 H new ATOM 0 HB2 PRO A 27 1.634 -6.054 -10.278 1.00 0.00 H new ATOM 0 HB3 PRO A 27 1.460 -7.762 -10.624 1.00 0.00 H new ATOM 0 HG2 PRO A 27 0.141 -5.973 -12.168 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -0.670 -7.459 -11.715 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -0.965 -4.692 -10.485 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -2.217 -5.870 -10.825 1.00 0.00 H new ATOM 395 N TRP A 28 0.955 -5.368 -7.344 1.00 0.00 N ATOM 396 CA TRP A 28 1.802 -4.793 -6.295 1.00 0.00 C ATOM 397 C TRP A 28 1.760 -5.509 -4.946 1.00 0.00 C ATOM 398 O TRP A 28 2.731 -5.380 -4.200 1.00 0.00 O ATOM 399 CB TRP A 28 1.447 -3.315 -6.085 1.00 0.00 C ATOM 400 CG TRP A 28 1.393 -2.471 -7.320 1.00 0.00 C ATOM 401 CD1 TRP A 28 0.275 -1.904 -7.810 1.00 0.00 C ATOM 402 CD2 TRP A 28 2.469 -2.068 -8.223 1.00 0.00 C ATOM 403 NE1 TRP A 28 0.565 -1.196 -8.958 1.00 0.00 N ATOM 404 CE2 TRP A 28 1.910 -1.256 -9.257 1.00 0.00 C ATOM 405 CE3 TRP A 28 3.861 -2.301 -8.274 1.00 0.00 C ATOM 406 CZ2 TRP A 28 2.691 -0.710 -10.287 1.00 0.00 C ATOM 407 CZ3 TRP A 28 4.655 -1.756 -9.303 1.00 0.00 C ATOM 408 CH2 TRP A 28 4.073 -0.963 -10.308 1.00 0.00 C ATOM 0 H TRP A 28 0.270 -4.706 -7.708 1.00 0.00 H new ATOM 0 HA TRP A 28 2.820 -4.917 -6.665 1.00 0.00 H new ATOM 0 HB2 TRP A 28 0.477 -3.262 -5.590 1.00 0.00 H new ATOM 0 HB3 TRP A 28 2.178 -2.880 -5.403 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -0.707 -1.991 -7.368 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -0.126 -0.693 -9.514 1.00 0.00 H new ATOM 0 HE3 TRP A 28 4.325 -2.908 -7.511 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 2.235 -0.102 -11.055 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 5.718 -1.949 -9.320 1.00 0.00 H new ATOM 0 HH2 TRP A 28 4.687 -0.549 -11.094 1.00 0.00 H new ATOM 419 N CYS A 29 0.685 -6.234 -4.607 1.00 0.00 N ATOM 420 CA CYS A 29 0.493 -6.744 -3.250 1.00 0.00 C ATOM 421 C CYS A 29 0.043 -8.200 -3.249 1.00 0.00 C ATOM 422 O CYS A 29 -0.623 -8.651 -4.181 1.00 0.00 O ATOM 423 CB CYS A 29 -0.530 -5.854 -2.523 1.00 0.00 C ATOM 424 SG CYS A 29 -0.046 -5.290 -0.866 1.00 0.00 S ATOM 0 H CYS A 29 -0.063 -6.478 -5.257 1.00 0.00 H new ATOM 0 HA CYS A 29 1.448 -6.712 -2.726 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -0.727 -4.978 -3.142 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -1.468 -6.403 -2.440 1.00 0.00 H new ATOM 429 N GLY A 30 0.388 -8.925 -2.183 1.00 0.00 N ATOM 430 CA GLY A 30 -0.036 -10.304 -1.957 1.00 0.00 C ATOM 431 C GLY A 30 -1.551 -10.429 -1.774 1.00 0.00 C ATOM 432 O GLY A 30 -2.154 -11.254 -2.461 1.00 0.00 O ATOM 0 H GLY A 30 0.982 -8.560 -1.439 1.00 0.00 H new ATOM 0 HA2 GLY A 30 0.277 -10.920 -2.800 1.00 0.00 H new ATOM 0 HA3 GLY A 30 0.467 -10.695 -1.073 1.00 0.00 H new ATOM 436 N PRO A 31 -2.205 -9.612 -0.919 1.00 0.00 N ATOM 437 CA PRO A 31 -3.654 -9.622 -0.747 1.00 0.00 C ATOM 438 C PRO A 31 -4.466 -9.531 -2.031 1.00 0.00 C ATOM 439 O PRO A 31 -5.558 -10.085 -2.071 1.00 0.00 O ATOM 440 CB PRO A 31 -3.976 -8.448 0.164 1.00 0.00 C ATOM 441 CG PRO A 31 -2.741 -8.380 1.057 1.00 0.00 C ATOM 442 CD PRO A 31 -1.612 -8.741 0.090 1.00 0.00 C ATOM 0 HA PRO A 31 -3.939 -10.588 -0.330 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -4.123 -7.526 -0.398 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -4.885 -8.618 0.740 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -2.605 -7.388 1.487 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -2.803 -9.082 1.889 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -1.190 -7.846 -0.367 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -0.799 -9.246 0.612 1.00 0.00 H new ATOM 450 N SER A 32 -3.958 -8.927 -3.102 1.00 0.00 N ATOM 451 CA SER A 32 -4.632 -8.906 -4.395 1.00 0.00 C ATOM 452 C SER A 32 -4.909 -10.296 -4.964 1.00 0.00 C ATOM 453 O SER A 32 -5.769 -10.431 -5.831 1.00 0.00 O ATOM 454 CB SER A 32 -3.744 -8.146 -5.368 1.00 0.00 C ATOM 455 OG SER A 32 -3.265 -6.948 -4.790 1.00 0.00 O ATOM 0 H SER A 32 -3.064 -8.437 -3.096 1.00 0.00 H new ATOM 0 HA SER A 32 -5.602 -8.429 -4.254 1.00 0.00 H new ATOM 0 HB2 SER A 32 -2.903 -8.773 -5.663 1.00 0.00 H new ATOM 0 HB3 SER A 32 -4.305 -7.917 -6.274 1.00 0.00 H new ATOM 0 HG SER A 32 -2.559 -6.571 -5.356 1.00 0.00 H new ATOM 461 N LYS A 33 -4.214 -11.322 -4.470 1.00 0.00 N ATOM 462 CA LYS A 33 -4.406 -12.717 -4.869 1.00 0.00 C ATOM 463 C LYS A 33 -4.998 -13.554 -3.725 1.00 0.00 C ATOM 464 O LYS A 33 -5.025 -14.781 -3.824 1.00 0.00 O ATOM 465 CB LYS A 33 -3.121 -13.349 -5.432 1.00 0.00 C ATOM 466 CG LYS A 33 -2.376 -12.537 -6.510 1.00 0.00 C ATOM 467 CD LYS A 33 -1.337 -11.586 -5.898 1.00 0.00 C ATOM 468 CE LYS A 33 -0.549 -10.824 -6.974 1.00 0.00 C ATOM 469 NZ LYS A 33 0.521 -9.992 -6.369 1.00 0.00 N ATOM 0 H LYS A 33 -3.486 -11.203 -3.766 1.00 0.00 H new ATOM 0 HA LYS A 33 -5.131 -12.714 -5.683 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -2.436 -13.527 -4.603 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -3.374 -14.323 -5.851 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -1.880 -13.220 -7.200 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -3.096 -11.962 -7.092 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -1.839 -10.873 -5.244 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -0.645 -12.156 -5.278 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -0.109 -11.532 -7.676 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -1.228 -10.190 -7.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 0.735 -9.191 -6.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 0.202 -9.633 -5.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 1.377 -10.568 -6.239 1.00 0.00 H new ATOM 483 N MET A 34 -5.485 -12.919 -2.652 1.00 0.00 N ATOM 484 CA MET A 34 -6.143 -13.580 -1.521 1.00 0.00 C ATOM 485 C MET A 34 -7.546 -13.000 -1.335 1.00 0.00 C ATOM 486 O MET A 34 -8.509 -13.752 -1.215 1.00 0.00 O ATOM 487 CB MET A 34 -5.310 -13.438 -0.235 1.00 0.00 C ATOM 488 CG MET A 34 -3.900 -14.028 -0.371 1.00 0.00 C ATOM 489 SD MET A 34 -2.973 -14.174 1.186 1.00 0.00 S ATOM 490 CE MET A 34 -2.748 -12.429 1.630 1.00 0.00 C ATOM 0 H MET A 34 -5.430 -11.906 -2.545 1.00 0.00 H new ATOM 0 HA MET A 34 -6.227 -14.645 -1.736 1.00 0.00 H new ATOM 0 HB2 MET A 34 -5.234 -12.383 0.028 1.00 0.00 H new ATOM 0 HB3 MET A 34 -5.829 -13.934 0.585 1.00 0.00 H new ATOM 0 HG2 MET A 34 -3.979 -15.017 -0.823 1.00 0.00 H new ATOM 0 HG3 MET A 34 -3.328 -13.407 -1.060 1.00 0.00 H new ATOM 0 HE1 MET A 34 -2.179 -12.360 2.557 1.00 0.00 H new ATOM 0 HE2 MET A 34 -2.208 -11.918 0.833 1.00 0.00 H new ATOM 0 HE3 MET A 34 -3.722 -11.960 1.767 1.00 0.00 H new ATOM 500 N ILE A 35 -7.696 -11.673 -1.410 1.00 0.00 N ATOM 501 CA ILE A 35 -8.993 -11.015 -1.463 1.00 0.00 C ATOM 502 C ILE A 35 -9.733 -11.451 -2.737 1.00 0.00 C ATOM 503 O ILE A 35 -10.945 -11.632 -2.705 1.00 0.00 O ATOM 504 CB ILE A 35 -8.826 -9.476 -1.333 1.00 0.00 C ATOM 505 CG1 ILE A 35 -9.978 -8.864 -0.507 1.00 0.00 C ATOM 506 CG2 ILE A 35 -8.680 -8.739 -2.673 1.00 0.00 C ATOM 507 CD1 ILE A 35 -9.693 -8.992 0.993 1.00 0.00 C ATOM 0 H ILE A 35 -6.909 -11.025 -1.435 1.00 0.00 H new ATOM 0 HA ILE A 35 -9.610 -11.319 -0.617 1.00 0.00 H new ATOM 0 HB ILE A 35 -7.881 -9.333 -0.809 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -10.104 -7.814 -0.770 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -10.914 -9.368 -0.749 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -8.568 -7.670 -2.490 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -7.801 -9.111 -3.199 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -9.567 -8.912 -3.282 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -10.516 -8.555 1.558 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -9.591 -10.045 1.255 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -8.769 -8.467 1.234 1.00 0.00 H new ATOM 519 N ALA A 36 -9.003 -11.653 -3.845 1.00 0.00 N ATOM 520 CA ALA A 36 -9.571 -12.068 -5.120 1.00 0.00 C ATOM 521 C ALA A 36 -10.360 -13.385 -4.999 1.00 0.00 C ATOM 522 O ALA A 36 -11.561 -13.373 -5.276 1.00 0.00 O ATOM 523 CB ALA A 36 -8.479 -12.115 -6.203 1.00 0.00 C ATOM 0 H ALA A 36 -7.991 -11.529 -3.872 1.00 0.00 H new ATOM 0 HA ALA A 36 -10.301 -11.321 -5.431 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -8.919 -12.427 -7.150 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -8.037 -11.125 -6.317 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -7.707 -12.826 -5.910 1.00 0.00 H new ATOM 529 N PRO A 37 -9.761 -14.499 -4.535 1.00 0.00 N ATOM 530 CA PRO A 37 -10.509 -15.723 -4.290 1.00 0.00 C ATOM 531 C PRO A 37 -11.607 -15.509 -3.252 1.00 0.00 C ATOM 532 O PRO A 37 -12.709 -16.006 -3.446 1.00 0.00 O ATOM 533 CB PRO A 37 -9.502 -16.785 -3.837 1.00 0.00 C ATOM 534 CG PRO A 37 -8.187 -16.039 -3.613 1.00 0.00 C ATOM 535 CD PRO A 37 -8.338 -14.723 -4.371 1.00 0.00 C ATOM 0 HA PRO A 37 -11.017 -16.047 -5.198 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -9.835 -17.275 -2.922 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -9.387 -17.563 -4.592 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -8.010 -15.864 -2.552 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -7.340 -16.614 -3.987 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -7.878 -13.903 -3.819 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -7.840 -14.774 -5.339 1.00 0.00 H new ATOM 543 N VAL A 38 -11.346 -14.753 -2.184 1.00 0.00 N ATOM 544 CA VAL A 38 -12.327 -14.473 -1.140 1.00 0.00 C ATOM 545 C VAL A 38 -13.594 -13.830 -1.726 1.00 0.00 C ATOM 546 O VAL A 38 -14.698 -14.179 -1.307 1.00 0.00 O ATOM 547 CB VAL A 38 -11.625 -13.647 -0.040 1.00 0.00 C ATOM 548 CG1 VAL A 38 -12.533 -12.708 0.753 1.00 0.00 C ATOM 549 CG2 VAL A 38 -10.875 -14.602 0.902 1.00 0.00 C ATOM 0 H VAL A 38 -10.439 -14.315 -2.020 1.00 0.00 H new ATOM 0 HA VAL A 38 -12.691 -15.390 -0.677 1.00 0.00 H new ATOM 0 HB VAL A 38 -10.935 -12.980 -0.557 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -11.943 -12.175 1.499 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -12.995 -11.990 0.075 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -13.310 -13.288 1.251 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -10.376 -14.027 1.682 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -11.583 -15.294 1.358 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -10.133 -15.164 0.335 1.00 0.00 H new ATOM 559 N LEU A 39 -13.461 -12.944 -2.716 1.00 0.00 N ATOM 560 CA LEU A 39 -14.599 -12.309 -3.372 1.00 0.00 C ATOM 561 C LEU A 39 -15.401 -13.346 -4.149 1.00 0.00 C ATOM 562 O LEU A 39 -16.621 -13.407 -4.010 1.00 0.00 O ATOM 563 CB LEU A 39 -14.121 -11.200 -4.327 1.00 0.00 C ATOM 564 CG LEU A 39 -13.674 -9.933 -3.571 1.00 0.00 C ATOM 565 CD1 LEU A 39 -12.716 -9.102 -4.423 1.00 0.00 C ATOM 566 CD2 LEU A 39 -14.854 -9.051 -3.147 1.00 0.00 C ATOM 0 H LEU A 39 -12.557 -12.648 -3.084 1.00 0.00 H new ATOM 0 HA LEU A 39 -15.234 -11.864 -2.606 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -13.292 -11.573 -4.929 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -14.926 -10.945 -5.016 1.00 0.00 H new ATOM 0 HG LEU A 39 -13.169 -10.280 -2.670 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -12.414 -8.213 -3.869 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -11.835 -9.696 -4.664 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -13.215 -8.803 -5.345 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -14.481 -8.173 -2.619 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -15.408 -8.735 -4.031 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -15.513 -9.617 -2.489 1.00 0.00 H new ATOM 578 N GLU A 40 -14.735 -14.173 -4.956 1.00 0.00 N ATOM 579 CA GLU A 40 -15.409 -15.165 -5.783 1.00 0.00 C ATOM 580 C GLU A 40 -16.068 -16.238 -4.903 1.00 0.00 C ATOM 581 O GLU A 40 -17.172 -16.704 -5.196 1.00 0.00 O ATOM 582 CB GLU A 40 -14.432 -15.778 -6.795 1.00 0.00 C ATOM 583 CG GLU A 40 -13.856 -14.749 -7.780 1.00 0.00 C ATOM 584 CD GLU A 40 -12.936 -15.418 -8.817 1.00 0.00 C ATOM 585 OE1 GLU A 40 -13.429 -15.850 -9.885 1.00 0.00 O ATOM 586 OE2 GLU A 40 -11.708 -15.507 -8.590 1.00 0.00 O ATOM 0 H GLU A 40 -13.720 -14.172 -5.052 1.00 0.00 H new ATOM 0 HA GLU A 40 -16.199 -14.673 -6.350 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -13.613 -16.254 -6.257 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -14.943 -16.561 -7.355 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -14.671 -14.237 -8.291 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -13.297 -13.991 -7.231 1.00 0.00 H new ATOM 593 N GLU A 41 -15.423 -16.604 -3.794 1.00 0.00 N ATOM 594 CA GLU A 41 -15.947 -17.498 -2.775 1.00 0.00 C ATOM 595 C GLU A 41 -17.141 -16.886 -2.046 1.00 0.00 C ATOM 596 O GLU A 41 -17.968 -17.629 -1.517 1.00 0.00 O ATOM 597 CB GLU A 41 -14.845 -17.877 -1.772 1.00 0.00 C ATOM 598 CG GLU A 41 -13.809 -18.856 -2.353 1.00 0.00 C ATOM 599 CD GLU A 41 -14.382 -20.255 -2.651 1.00 0.00 C ATOM 600 OE1 GLU A 41 -14.973 -20.888 -1.748 1.00 0.00 O ATOM 601 OE2 GLU A 41 -14.204 -20.754 -3.785 1.00 0.00 O ATOM 0 H GLU A 41 -14.484 -16.269 -3.578 1.00 0.00 H new ATOM 0 HA GLU A 41 -16.294 -18.401 -3.278 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -14.335 -16.972 -1.442 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -15.303 -18.324 -0.890 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -13.401 -18.436 -3.272 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -12.980 -18.954 -1.652 1.00 0.00 H new ATOM 608 N LEU A 42 -17.260 -15.554 -2.014 1.00 0.00 N ATOM 609 CA LEU A 42 -18.395 -14.906 -1.382 1.00 0.00 C ATOM 610 C LEU A 42 -19.572 -14.817 -2.338 1.00 0.00 C ATOM 611 O LEU A 42 -20.717 -15.016 -1.933 1.00 0.00 O ATOM 612 CB LEU A 42 -18.021 -13.498 -0.884 1.00 0.00 C ATOM 613 CG LEU A 42 -19.165 -12.882 -0.061 1.00 0.00 C ATOM 614 CD1 LEU A 42 -19.493 -13.777 1.137 1.00 0.00 C ATOM 615 CD2 LEU A 42 -18.802 -11.480 0.434 1.00 0.00 C ATOM 0 H LEU A 42 -16.580 -14.911 -2.420 1.00 0.00 H new ATOM 0 HA LEU A 42 -18.684 -15.515 -0.525 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -17.118 -13.552 -0.275 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -17.794 -12.856 -1.735 1.00 0.00 H new ATOM 0 HG LEU A 42 -20.037 -12.803 -0.710 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -20.304 -13.331 1.713 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -19.798 -14.762 0.783 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -18.611 -13.876 1.770 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -19.631 -11.072 1.012 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -17.913 -11.535 1.063 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -18.602 -10.833 -0.420 1.00 0.00 H new ATOM 627 N ASP A 43 -19.316 -14.519 -3.609 1.00 0.00 N ATOM 628 CA ASP A 43 -20.384 -14.281 -4.568 1.00 0.00 C ATOM 629 C ASP A 43 -21.133 -15.574 -4.863 1.00 0.00 C ATOM 630 O ASP A 43 -22.350 -15.573 -5.012 1.00 0.00 O ATOM 631 CB ASP A 43 -19.810 -13.696 -5.860 1.00 0.00 C ATOM 632 CG ASP A 43 -20.875 -13.609 -6.964 1.00 0.00 C ATOM 633 OD1 ASP A 43 -21.720 -12.686 -6.918 1.00 0.00 O ATOM 634 OD2 ASP A 43 -20.846 -14.450 -7.887 1.00 0.00 O ATOM 0 H ASP A 43 -18.376 -14.437 -3.996 1.00 0.00 H new ATOM 0 HA ASP A 43 -21.085 -13.566 -4.138 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -19.408 -12.702 -5.663 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -18.980 -14.314 -6.202 1.00 0.00 H new ATOM 639 N GLN A 44 -20.433 -16.704 -4.842 1.00 0.00 N ATOM 640 CA GLN A 44 -21.067 -18.004 -4.970 1.00 0.00 C ATOM 641 C GLN A 44 -21.894 -18.399 -3.730 1.00 0.00 C ATOM 642 O GLN A 44 -22.538 -19.449 -3.747 1.00 0.00 O ATOM 643 CB GLN A 44 -20.018 -19.041 -5.385 1.00 0.00 C ATOM 644 CG GLN A 44 -19.031 -19.422 -4.277 1.00 0.00 C ATOM 645 CD GLN A 44 -17.872 -20.241 -4.842 1.00 0.00 C ATOM 646 OE1 GLN A 44 -17.833 -21.464 -4.728 1.00 0.00 O ATOM 647 NE2 GLN A 44 -16.918 -19.582 -5.480 1.00 0.00 N ATOM 0 H GLN A 44 -19.419 -16.741 -4.737 1.00 0.00 H new ATOM 0 HA GLN A 44 -21.813 -17.956 -5.763 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -20.530 -19.942 -5.724 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -19.458 -18.653 -6.236 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -18.647 -18.520 -3.800 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -19.546 -19.996 -3.506 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -16.968 -18.567 -5.564 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -16.133 -20.089 -5.888 1.00 0.00 H new ATOM 656 N GLU A 45 -21.892 -17.588 -2.662 1.00 0.00 N ATOM 657 CA GLU A 45 -22.559 -17.848 -1.406 1.00 0.00 C ATOM 658 C GLU A 45 -23.704 -16.858 -1.159 1.00 0.00 C ATOM 659 O GLU A 45 -24.791 -17.281 -0.763 1.00 0.00 O ATOM 660 CB GLU A 45 -21.489 -17.922 -0.294 1.00 0.00 C ATOM 661 CG GLU A 45 -21.984 -17.427 1.066 1.00 0.00 C ATOM 662 CD GLU A 45 -21.004 -17.745 2.208 1.00 0.00 C ATOM 663 OE1 GLU A 45 -20.836 -18.935 2.562 1.00 0.00 O ATOM 664 OE2 GLU A 45 -20.428 -16.795 2.784 1.00 0.00 O ATOM 0 H GLU A 45 -21.399 -16.695 -2.664 1.00 0.00 H new ATOM 0 HA GLU A 45 -23.065 -18.813 -1.421 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -21.151 -18.953 -0.195 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -20.624 -17.330 -0.594 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -22.144 -16.350 1.019 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -22.950 -17.883 1.284 1.00 0.00 H new ATOM 671 N MET A 46 -23.505 -15.569 -1.442 1.00 0.00 N ATOM 672 CA MET A 46 -24.502 -14.520 -1.212 1.00 0.00 C ATOM 673 C MET A 46 -24.609 -13.552 -2.390 1.00 0.00 C ATOM 674 O MET A 46 -25.207 -12.481 -2.279 1.00 0.00 O ATOM 675 CB MET A 46 -24.225 -13.801 0.104 1.00 0.00 C ATOM 676 CG MET A 46 -22.807 -13.261 0.204 1.00 0.00 C ATOM 677 SD MET A 46 -22.628 -12.299 1.723 1.00 0.00 S ATOM 678 CE MET A 46 -23.386 -10.764 1.184 1.00 0.00 C ATOM 0 H MET A 46 -22.635 -15.219 -1.843 1.00 0.00 H new ATOM 0 HA MET A 46 -25.478 -14.999 -1.132 1.00 0.00 H new ATOM 0 HB2 MET A 46 -24.930 -12.977 0.216 1.00 0.00 H new ATOM 0 HB3 MET A 46 -24.405 -14.488 0.931 1.00 0.00 H new ATOM 0 HG2 MET A 46 -22.093 -14.084 0.197 1.00 0.00 H new ATOM 0 HG3 MET A 46 -22.583 -12.637 -0.661 1.00 0.00 H new ATOM 0 HE1 MET A 46 -22.616 -10.004 1.054 1.00 0.00 H new ATOM 0 HE2 MET A 46 -23.900 -10.925 0.237 1.00 0.00 H new ATOM 0 HE3 MET A 46 -24.103 -10.429 1.934 1.00 0.00 H new ATOM 688 N GLY A 47 -24.099 -13.927 -3.556 1.00 0.00 N ATOM 689 CA GLY A 47 -24.265 -13.155 -4.783 1.00 0.00 C ATOM 690 C GLY A 47 -25.700 -13.057 -5.268 1.00 0.00 C ATOM 691 O GLY A 47 -25.978 -12.326 -6.214 1.00 0.00 O ATOM 0 H GLY A 47 -23.555 -14.781 -3.679 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -23.879 -12.149 -4.621 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -23.658 -13.607 -5.568 1.00 0.00 H new ATOM 695 N ASP A 48 -26.616 -13.756 -4.611 1.00 0.00 N ATOM 696 CA ASP A 48 -28.045 -13.589 -4.824 1.00 0.00 C ATOM 697 C ASP A 48 -28.511 -12.198 -4.401 1.00 0.00 C ATOM 698 O ASP A 48 -29.507 -11.686 -4.914 1.00 0.00 O ATOM 699 CB ASP A 48 -28.821 -14.677 -4.076 1.00 0.00 C ATOM 700 CG ASP A 48 -30.340 -14.527 -4.266 1.00 0.00 C ATOM 701 OD1 ASP A 48 -30.844 -14.787 -5.382 1.00 0.00 O ATOM 702 OD2 ASP A 48 -31.041 -14.195 -3.285 1.00 0.00 O ATOM 0 H ASP A 48 -26.385 -14.460 -3.910 1.00 0.00 H new ATOM 0 HA ASP A 48 -28.245 -13.689 -5.891 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -28.505 -15.658 -4.431 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -28.581 -14.630 -3.014 1.00 0.00 H new ATOM 707 N LYS A 49 -27.752 -11.567 -3.499 1.00 0.00 N ATOM 708 CA LYS A 49 -28.021 -10.256 -2.955 1.00 0.00 C ATOM 709 C LYS A 49 -26.909 -9.272 -3.322 1.00 0.00 C ATOM 710 O LYS A 49 -27.167 -8.085 -3.508 1.00 0.00 O ATOM 711 CB LYS A 49 -28.150 -10.332 -1.422 1.00 0.00 C ATOM 712 CG LYS A 49 -28.769 -11.617 -0.843 1.00 0.00 C ATOM 713 CD LYS A 49 -27.699 -12.670 -0.515 1.00 0.00 C ATOM 714 CE LYS A 49 -28.026 -13.531 0.708 1.00 0.00 C ATOM 715 NZ LYS A 49 -29.250 -14.359 0.543 1.00 0.00 N ATOM 0 H LYS A 49 -26.901 -11.983 -3.120 1.00 0.00 H new ATOM 0 HA LYS A 49 -28.959 -9.902 -3.383 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -27.157 -10.208 -0.990 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -28.750 -9.485 -1.089 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -29.329 -11.375 0.060 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -29.480 -12.032 -1.558 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -27.567 -13.321 -1.380 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -26.747 -12.166 -0.347 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -27.180 -14.186 0.918 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -28.150 -12.883 1.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -29.412 -14.915 1.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -30.068 -13.740 0.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -29.128 -15.002 -0.265 1.00 0.00 H new ATOM 729 N LEU A 50 -25.674 -9.770 -3.422 1.00 0.00 N ATOM 730 CA LEU A 50 -24.459 -8.974 -3.532 1.00 0.00 C ATOM 731 C LEU A 50 -24.005 -8.831 -4.979 1.00 0.00 C ATOM 732 O LEU A 50 -24.190 -9.739 -5.789 1.00 0.00 O ATOM 733 CB LEU A 50 -23.361 -9.664 -2.693 1.00 0.00 C ATOM 734 CG LEU A 50 -21.948 -9.047 -2.750 1.00 0.00 C ATOM 735 CD1 LEU A 50 -21.930 -7.640 -2.150 1.00 0.00 C ATOM 736 CD2 LEU A 50 -20.937 -9.920 -1.999 1.00 0.00 C ATOM 0 H LEU A 50 -25.491 -10.773 -3.428 1.00 0.00 H new ATOM 0 HA LEU A 50 -24.655 -7.968 -3.161 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -23.685 -9.674 -1.652 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -23.291 -10.703 -3.015 1.00 0.00 H new ATOM 0 HG LEU A 50 -21.668 -8.990 -3.802 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -20.920 -7.234 -2.206 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -22.611 -6.998 -2.708 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -22.246 -7.685 -1.108 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -19.949 -9.463 -2.055 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -21.238 -10.009 -0.955 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -20.904 -10.911 -2.452 1.00 0.00 H new ATOM 748 N LYS A 51 -23.324 -7.725 -5.275 1.00 0.00 N ATOM 749 CA LYS A 51 -22.602 -7.492 -6.523 1.00 0.00 C ATOM 750 C LYS A 51 -21.187 -7.064 -6.134 1.00 0.00 C ATOM 751 O LYS A 51 -20.991 -6.513 -5.050 1.00 0.00 O ATOM 752 CB LYS A 51 -23.357 -6.428 -7.336 1.00 0.00 C ATOM 753 CG LYS A 51 -22.804 -6.219 -8.754 1.00 0.00 C ATOM 754 CD LYS A 51 -23.627 -5.139 -9.462 1.00 0.00 C ATOM 755 CE LYS A 51 -23.122 -4.918 -10.890 1.00 0.00 C ATOM 756 NZ LYS A 51 -23.897 -3.854 -11.564 1.00 0.00 N ATOM 0 H LYS A 51 -23.258 -6.939 -4.628 1.00 0.00 H new ATOM 0 HA LYS A 51 -22.537 -8.378 -7.155 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -24.406 -6.714 -7.405 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -23.320 -5.480 -6.799 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -21.756 -5.923 -8.708 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -22.847 -7.152 -9.315 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -24.677 -5.432 -9.484 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -23.568 -4.206 -8.902 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -22.066 -4.647 -10.869 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -23.202 -5.846 -11.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -23.583 -3.768 -12.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -24.909 -4.095 -11.542 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -23.746 -2.950 -11.073 1.00 0.00 H new ATOM 770 N ILE A 52 -20.199 -7.286 -6.995 1.00 0.00 N ATOM 771 CA ILE A 52 -18.819 -6.862 -6.772 1.00 0.00 C ATOM 772 C ILE A 52 -18.362 -6.232 -8.085 1.00 0.00 C ATOM 773 O ILE A 52 -18.719 -6.745 -9.146 1.00 0.00 O ATOM 774 CB ILE A 52 -17.960 -8.088 -6.367 1.00 0.00 C ATOM 775 CG1 ILE A 52 -18.287 -8.575 -4.935 1.00 0.00 C ATOM 776 CG2 ILE A 52 -16.446 -7.808 -6.479 1.00 0.00 C ATOM 777 CD1 ILE A 52 -18.035 -10.071 -4.742 1.00 0.00 C ATOM 0 H ILE A 52 -20.335 -7.773 -7.881 1.00 0.00 H new ATOM 0 HA ILE A 52 -18.720 -6.141 -5.961 1.00 0.00 H new ATOM 0 HB ILE A 52 -18.218 -8.875 -7.076 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -17.684 -8.015 -4.220 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -19.331 -8.356 -4.712 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -15.889 -8.697 -6.184 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -16.199 -7.549 -7.509 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -16.180 -6.979 -5.823 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -18.282 -10.353 -3.718 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -18.658 -10.637 -5.435 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -16.985 -10.291 -4.935 1.00 0.00 H new ATOM 789 N VAL A 53 -17.552 -5.173 -8.039 1.00 0.00 N ATOM 790 CA VAL A 53 -16.949 -4.565 -9.206 1.00 0.00 C ATOM 791 C VAL A 53 -15.451 -4.374 -8.909 1.00 0.00 C ATOM 792 O VAL A 53 -15.084 -3.567 -8.058 1.00 0.00 O ATOM 793 CB VAL A 53 -17.682 -3.241 -9.524 1.00 0.00 C ATOM 794 CG1 VAL A 53 -18.991 -3.415 -10.308 1.00 0.00 C ATOM 795 CG2 VAL A 53 -17.786 -2.201 -8.404 1.00 0.00 C ATOM 0 H VAL A 53 -17.297 -4.711 -7.166 1.00 0.00 H new ATOM 0 HA VAL A 53 -17.041 -5.191 -10.093 1.00 0.00 H new ATOM 0 HB VAL A 53 -16.969 -2.777 -10.205 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -19.440 -2.438 -10.488 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -18.782 -3.900 -11.261 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -19.681 -4.030 -9.731 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -18.324 -1.326 -8.769 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -18.323 -2.630 -7.558 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -16.786 -1.906 -8.087 1.00 0.00 H new ATOM 805 N LYS A 54 -14.561 -5.135 -9.552 1.00 0.00 N ATOM 806 CA LYS A 54 -13.122 -4.960 -9.368 1.00 0.00 C ATOM 807 C LYS A 54 -12.621 -3.830 -10.264 1.00 0.00 C ATOM 808 O LYS A 54 -13.219 -3.549 -11.302 1.00 0.00 O ATOM 809 CB LYS A 54 -12.367 -6.273 -9.639 1.00 0.00 C ATOM 810 CG LYS A 54 -12.521 -7.233 -8.446 1.00 0.00 C ATOM 811 CD LYS A 54 -11.702 -8.528 -8.557 1.00 0.00 C ATOM 812 CE LYS A 54 -10.184 -8.280 -8.533 1.00 0.00 C ATOM 813 NZ LYS A 54 -9.414 -9.513 -8.842 1.00 0.00 N ATOM 0 H LYS A 54 -14.814 -5.877 -10.204 1.00 0.00 H new ATOM 0 HA LYS A 54 -12.928 -4.688 -8.330 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -12.753 -6.742 -10.544 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -11.311 -6.064 -9.813 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -12.228 -6.710 -7.536 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -13.574 -7.493 -8.339 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -11.970 -9.193 -7.736 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -11.967 -9.041 -9.481 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -9.932 -7.504 -9.256 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -9.893 -7.907 -7.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -8.430 -9.261 -9.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -9.430 -10.148 -8.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -9.842 -9.994 -9.658 1.00 0.00 H new ATOM 827 N ILE A 55 -11.490 -3.237 -9.897 1.00 0.00 N ATOM 828 CA ILE A 55 -10.736 -2.252 -10.644 1.00 0.00 C ATOM 829 C ILE A 55 -9.303 -2.789 -10.624 1.00 0.00 C ATOM 830 O ILE A 55 -8.749 -3.044 -9.550 1.00 0.00 O ATOM 831 CB ILE A 55 -10.867 -0.870 -9.955 1.00 0.00 C ATOM 832 CG1 ILE A 55 -12.212 -0.160 -10.212 1.00 0.00 C ATOM 833 CG2 ILE A 55 -9.694 0.045 -10.334 1.00 0.00 C ATOM 834 CD1 ILE A 55 -12.386 0.408 -11.625 1.00 0.00 C ATOM 0 H ILE A 55 -11.049 -3.452 -9.003 1.00 0.00 H new ATOM 0 HA ILE A 55 -11.084 -2.106 -11.667 1.00 0.00 H new ATOM 0 HB ILE A 55 -10.838 -1.075 -8.885 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -13.020 -0.865 -10.018 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -12.319 0.653 -9.494 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -9.809 1.009 -9.838 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -8.757 -0.415 -10.020 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -9.682 0.192 -11.414 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -13.362 0.887 -11.707 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -11.604 1.142 -11.821 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -12.316 -0.400 -12.353 1.00 0.00 H new ATOM 846 N ASP A 56 -8.718 -2.971 -11.806 1.00 0.00 N ATOM 847 CA ASP A 56 -7.303 -3.268 -11.977 1.00 0.00 C ATOM 848 C ASP A 56 -6.582 -1.926 -11.996 1.00 0.00 C ATOM 849 O ASP A 56 -6.734 -1.135 -12.932 1.00 0.00 O ATOM 850 CB ASP A 56 -7.063 -4.040 -13.282 1.00 0.00 C ATOM 851 CG ASP A 56 -5.572 -4.357 -13.509 1.00 0.00 C ATOM 852 OD1 ASP A 56 -4.724 -3.442 -13.419 1.00 0.00 O ATOM 853 OD2 ASP A 56 -5.255 -5.526 -13.821 1.00 0.00 O ATOM 0 H ASP A 56 -9.227 -2.914 -12.688 1.00 0.00 H new ATOM 0 HA ASP A 56 -6.932 -3.899 -11.169 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -7.631 -4.970 -13.261 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -7.440 -3.456 -14.122 1.00 0.00 H new ATOM 858 N VAL A 57 -5.826 -1.646 -10.939 1.00 0.00 N ATOM 859 CA VAL A 57 -5.206 -0.349 -10.715 1.00 0.00 C ATOM 860 C VAL A 57 -4.005 -0.039 -11.632 1.00 0.00 C ATOM 861 O VAL A 57 -3.305 0.954 -11.402 1.00 0.00 O ATOM 862 CB VAL A 57 -4.861 -0.163 -9.234 1.00 0.00 C ATOM 863 CG1 VAL A 57 -6.079 -0.410 -8.327 1.00 0.00 C ATOM 864 CG2 VAL A 57 -3.693 -1.083 -8.886 1.00 0.00 C ATOM 0 H VAL A 57 -5.625 -2.325 -10.205 1.00 0.00 H new ATOM 0 HA VAL A 57 -5.956 0.390 -10.998 1.00 0.00 H new ATOM 0 HB VAL A 57 -4.566 0.872 -9.059 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -5.792 -0.268 -7.285 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -6.872 0.292 -8.584 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -6.437 -1.430 -8.469 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -3.435 -0.962 -7.834 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -3.977 -2.119 -9.073 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -2.831 -0.826 -9.502 1.00 0.00 H new ATOM 874 N ASP A 58 -3.747 -0.842 -12.662 1.00 0.00 N ATOM 875 CA ASP A 58 -2.783 -0.516 -13.711 1.00 0.00 C ATOM 876 C ASP A 58 -3.479 -0.414 -15.071 1.00 0.00 C ATOM 877 O ASP A 58 -3.105 0.439 -15.876 1.00 0.00 O ATOM 878 CB ASP A 58 -1.679 -1.575 -13.770 1.00 0.00 C ATOM 879 CG ASP A 58 -0.674 -1.255 -14.889 1.00 0.00 C ATOM 880 OD1 ASP A 58 0.129 -0.307 -14.732 1.00 0.00 O ATOM 881 OD2 ASP A 58 -0.655 -1.968 -15.917 1.00 0.00 O ATOM 0 H ASP A 58 -4.204 -1.744 -12.793 1.00 0.00 H new ATOM 0 HA ASP A 58 -2.336 0.449 -13.473 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -1.161 -1.620 -12.812 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -2.120 -2.557 -13.941 1.00 0.00 H new ATOM 886 N GLU A 59 -4.511 -1.225 -15.331 1.00 0.00 N ATOM 887 CA GLU A 59 -5.191 -1.263 -16.617 1.00 0.00 C ATOM 888 C GLU A 59 -6.307 -0.212 -16.693 1.00 0.00 C ATOM 889 O GLU A 59 -6.449 0.460 -17.717 1.00 0.00 O ATOM 890 CB GLU A 59 -5.675 -2.708 -16.860 1.00 0.00 C ATOM 891 CG GLU A 59 -7.012 -2.794 -17.592 1.00 0.00 C ATOM 892 CD GLU A 59 -7.383 -4.235 -17.979 1.00 0.00 C ATOM 893 OE1 GLU A 59 -6.832 -4.763 -18.973 1.00 0.00 O ATOM 894 OE2 GLU A 59 -8.257 -4.840 -17.319 1.00 0.00 O ATOM 0 H GLU A 59 -4.895 -1.875 -14.646 1.00 0.00 H new ATOM 0 HA GLU A 59 -4.508 -0.994 -17.423 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -4.920 -3.242 -17.437 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -5.763 -3.218 -15.901 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -7.796 -2.379 -16.959 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -6.970 -2.180 -18.491 1.00 0.00 H new ATOM 901 N ASN A 60 -7.096 -0.071 -15.626 1.00 0.00 N ATOM 902 CA ASN A 60 -8.325 0.727 -15.607 1.00 0.00 C ATOM 903 C ASN A 60 -8.477 1.457 -14.276 1.00 0.00 C ATOM 904 O ASN A 60 -9.558 1.561 -13.695 1.00 0.00 O ATOM 905 CB ASN A 60 -9.565 -0.090 -16.015 1.00 0.00 C ATOM 906 CG ASN A 60 -9.915 -1.309 -15.164 1.00 0.00 C ATOM 907 OD1 ASN A 60 -9.695 -1.381 -13.961 1.00 0.00 O ATOM 908 ND2 ASN A 60 -10.482 -2.327 -15.787 1.00 0.00 N ATOM 0 H ASN A 60 -6.895 -0.518 -14.731 1.00 0.00 H new ATOM 0 HA ASN A 60 -8.240 1.497 -16.374 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -10.425 0.580 -16.014 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -9.424 -0.426 -17.042 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -10.734 -3.167 -15.266 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -10.668 -2.273 -16.789 1.00 0.00 H new ATOM 915 N GLN A 61 -7.359 2.014 -13.812 1.00 0.00 N ATOM 916 CA GLN A 61 -7.201 2.559 -12.482 1.00 0.00 C ATOM 917 C GLN A 61 -7.832 3.926 -12.301 1.00 0.00 C ATOM 918 O GLN A 61 -7.747 4.477 -11.211 1.00 0.00 O ATOM 919 CB GLN A 61 -5.705 2.612 -12.174 1.00 0.00 C ATOM 920 CG GLN A 61 -4.907 3.898 -12.428 1.00 0.00 C ATOM 921 CD GLN A 61 -4.383 4.432 -11.092 1.00 0.00 C ATOM 922 OE1 GLN A 61 -4.852 5.434 -10.560 1.00 0.00 O ATOM 923 NE2 GLN A 61 -3.420 3.739 -10.505 1.00 0.00 N ATOM 0 H GLN A 61 -6.515 2.097 -14.378 1.00 0.00 H new ATOM 0 HA GLN A 61 -7.729 1.908 -11.785 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -5.583 2.360 -11.121 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -5.229 1.818 -12.749 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -4.077 3.698 -13.105 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -5.539 4.644 -12.910 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -3.040 2.908 -10.959 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -3.058 4.036 -9.599 1.00 0.00 H new ATOM 932 N GLU A 62 -8.371 4.507 -13.368 1.00 0.00 N ATOM 933 CA GLU A 62 -8.819 5.887 -13.408 1.00 0.00 C ATOM 934 C GLU A 62 -9.770 6.171 -12.245 1.00 0.00 C ATOM 935 O GLU A 62 -9.587 7.159 -11.540 1.00 0.00 O ATOM 936 CB GLU A 62 -9.471 6.117 -14.776 1.00 0.00 C ATOM 937 CG GLU A 62 -8.459 6.278 -15.921 1.00 0.00 C ATOM 938 CD GLU A 62 -7.617 7.562 -15.798 1.00 0.00 C ATOM 939 OE1 GLU A 62 -8.085 8.646 -16.217 1.00 0.00 O ATOM 940 OE2 GLU A 62 -6.470 7.496 -15.305 1.00 0.00 O ATOM 0 H GLU A 62 -8.510 4.014 -14.250 1.00 0.00 H new ATOM 0 HA GLU A 62 -7.986 6.580 -13.290 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -10.130 5.279 -15.000 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -10.095 7.009 -14.726 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -7.795 5.414 -15.937 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -8.992 6.288 -16.872 1.00 0.00 H new ATOM 947 N THR A 63 -10.710 5.267 -11.968 1.00 0.00 N ATOM 948 CA THR A 63 -11.612 5.341 -10.825 1.00 0.00 C ATOM 949 C THR A 63 -10.859 5.394 -9.489 1.00 0.00 C ATOM 950 O THR A 63 -11.263 6.112 -8.578 1.00 0.00 O ATOM 951 CB THR A 63 -12.529 4.110 -10.887 1.00 0.00 C ATOM 952 OG1 THR A 63 -13.078 4.027 -12.190 1.00 0.00 O ATOM 953 CG2 THR A 63 -13.653 4.140 -9.852 1.00 0.00 C ATOM 0 H THR A 63 -10.867 4.443 -12.549 1.00 0.00 H new ATOM 0 HA THR A 63 -12.190 6.263 -10.877 1.00 0.00 H new ATOM 0 HB THR A 63 -11.924 3.234 -10.654 1.00 0.00 H new ATOM 0 HG1 THR A 63 -13.534 3.166 -12.299 1.00 0.00 H new ATOM 0 HG21 THR A 63 -14.263 3.242 -9.951 1.00 0.00 H new ATOM 0 HG22 THR A 63 -13.224 4.179 -8.851 1.00 0.00 H new ATOM 0 HG23 THR A 63 -14.275 5.020 -10.015 1.00 0.00 H new ATOM 961 N ALA A 64 -9.769 4.640 -9.362 1.00 0.00 N ATOM 962 CA ALA A 64 -9.016 4.490 -8.129 1.00 0.00 C ATOM 963 C ALA A 64 -8.351 5.819 -7.785 1.00 0.00 C ATOM 964 O ALA A 64 -8.694 6.450 -6.789 1.00 0.00 O ATOM 965 CB ALA A 64 -8.015 3.334 -8.300 1.00 0.00 C ATOM 0 H ALA A 64 -9.379 4.104 -10.137 1.00 0.00 H new ATOM 0 HA ALA A 64 -9.664 4.235 -7.291 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -7.442 3.210 -7.381 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -8.556 2.413 -8.517 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -7.337 3.559 -9.123 1.00 0.00 H new ATOM 971 N GLY A 65 -7.431 6.269 -8.632 1.00 0.00 N ATOM 972 CA GLY A 65 -6.863 7.610 -8.571 1.00 0.00 C ATOM 973 C GLY A 65 -7.914 8.717 -8.418 1.00 0.00 C ATOM 974 O GLY A 65 -7.714 9.622 -7.609 1.00 0.00 O ATOM 0 H GLY A 65 -7.054 5.703 -9.392 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -6.167 7.663 -7.733 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -6.285 7.792 -9.477 1.00 0.00 H new ATOM 978 N LYS A 66 -9.051 8.644 -9.124 1.00 0.00 N ATOM 979 CA LYS A 66 -10.128 9.635 -9.034 1.00 0.00 C ATOM 980 C LYS A 66 -10.714 9.685 -7.624 1.00 0.00 C ATOM 981 O LYS A 66 -10.923 10.778 -7.097 1.00 0.00 O ATOM 982 CB LYS A 66 -11.191 9.301 -10.094 1.00 0.00 C ATOM 983 CG LYS A 66 -12.392 10.255 -10.192 1.00 0.00 C ATOM 984 CD LYS A 66 -13.446 9.739 -11.194 1.00 0.00 C ATOM 985 CE LYS A 66 -12.856 9.471 -12.591 1.00 0.00 C ATOM 986 NZ LYS A 66 -13.864 9.010 -13.573 1.00 0.00 N ATOM 0 H LYS A 66 -9.249 7.888 -9.779 1.00 0.00 H new ATOM 0 HA LYS A 66 -9.734 10.631 -9.234 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -10.702 9.268 -11.068 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -11.568 8.298 -9.893 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -12.849 10.369 -9.209 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -12.049 11.243 -10.500 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -13.889 8.821 -10.809 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -14.250 10.470 -11.278 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -12.388 10.383 -12.962 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -12.070 8.721 -12.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -13.411 8.880 -14.500 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -14.270 8.106 -13.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -14.620 9.720 -13.653 1.00 0.00 H new ATOM 1000 N TYR A 67 -10.943 8.528 -6.995 1.00 0.00 N ATOM 1001 CA TYR A 67 -11.405 8.448 -5.618 1.00 0.00 C ATOM 1002 C TYR A 67 -10.282 8.724 -4.606 1.00 0.00 C ATOM 1003 O TYR A 67 -10.571 8.881 -3.418 1.00 0.00 O ATOM 1004 CB TYR A 67 -12.108 7.105 -5.356 1.00 0.00 C ATOM 1005 CG TYR A 67 -13.606 7.176 -5.603 1.00 0.00 C ATOM 1006 CD1 TYR A 67 -14.134 6.956 -6.890 1.00 0.00 C ATOM 1007 CD2 TYR A 67 -14.469 7.524 -4.546 1.00 0.00 C ATOM 1008 CE1 TYR A 67 -15.513 7.087 -7.122 1.00 0.00 C ATOM 1009 CE2 TYR A 67 -15.851 7.657 -4.770 1.00 0.00 C ATOM 1010 CZ TYR A 67 -16.381 7.440 -6.063 1.00 0.00 C ATOM 1011 OH TYR A 67 -17.715 7.585 -6.302 1.00 0.00 O ATOM 0 H TYR A 67 -10.810 7.618 -7.436 1.00 0.00 H new ATOM 0 HA TYR A 67 -12.139 9.240 -5.472 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -11.673 6.339 -5.998 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -11.927 6.798 -4.326 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -13.476 6.685 -7.702 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -14.067 7.690 -3.557 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -15.911 6.918 -8.111 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -16.507 7.925 -3.955 1.00 0.00 H new ATOM 0 HH TYR A 67 -18.172 7.828 -5.470 1.00 0.00 H new ATOM 1021 N GLY A 68 -9.021 8.810 -5.045 1.00 0.00 N ATOM 1022 CA GLY A 68 -7.870 8.941 -4.164 1.00 0.00 C ATOM 1023 C GLY A 68 -7.718 7.653 -3.360 1.00 0.00 C ATOM 1024 O GLY A 68 -7.848 7.677 -2.136 1.00 0.00 O ATOM 0 H GLY A 68 -8.775 8.790 -6.035 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -6.968 9.131 -4.746 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -8.002 9.791 -3.494 1.00 0.00 H new ATOM 1028 N VAL A 69 -7.521 6.526 -4.054 1.00 0.00 N ATOM 1029 CA VAL A 69 -7.494 5.206 -3.411 1.00 0.00 C ATOM 1030 C VAL A 69 -6.037 4.959 -3.059 1.00 0.00 C ATOM 1031 O VAL A 69 -5.645 4.933 -1.894 1.00 0.00 O ATOM 1032 CB VAL A 69 -8.159 4.135 -4.321 1.00 0.00 C ATOM 1033 CG1 VAL A 69 -7.660 2.710 -4.049 1.00 0.00 C ATOM 1034 CG2 VAL A 69 -9.684 4.193 -4.193 1.00 0.00 C ATOM 0 H VAL A 69 -7.378 6.501 -5.064 1.00 0.00 H new ATOM 0 HA VAL A 69 -8.086 5.151 -2.497 1.00 0.00 H new ATOM 0 HB VAL A 69 -7.866 4.379 -5.342 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -8.165 2.014 -4.718 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -6.585 2.662 -4.220 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -7.875 2.440 -3.015 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -10.132 3.436 -4.837 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -9.970 4.004 -3.158 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -10.037 5.180 -4.493 1.00 0.00 H new ATOM 1044 N MET A 70 -5.225 4.870 -4.108 1.00 0.00 N ATOM 1045 CA MET A 70 -3.778 4.795 -4.118 1.00 0.00 C ATOM 1046 C MET A 70 -3.196 3.625 -3.338 1.00 0.00 C ATOM 1047 O MET A 70 -1.980 3.532 -3.252 1.00 0.00 O ATOM 1048 CB MET A 70 -3.146 6.111 -3.670 1.00 0.00 C ATOM 1049 CG MET A 70 -3.901 7.385 -4.068 1.00 0.00 C ATOM 1050 SD MET A 70 -2.954 8.899 -3.798 1.00 0.00 S ATOM 1051 CE MET A 70 -2.289 8.529 -2.147 1.00 0.00 C ATOM 0 H MET A 70 -5.603 4.847 -5.055 1.00 0.00 H new ATOM 0 HA MET A 70 -3.519 4.609 -5.160 1.00 0.00 H new ATOM 0 HB2 MET A 70 -3.048 6.094 -2.585 1.00 0.00 H new ATOM 0 HB3 MET A 70 -2.138 6.166 -4.080 1.00 0.00 H new ATOM 0 HG2 MET A 70 -4.176 7.321 -5.121 1.00 0.00 H new ATOM 0 HG3 MET A 70 -4.829 7.440 -3.499 1.00 0.00 H new ATOM 0 HE1 MET A 70 -1.949 9.452 -1.677 1.00 0.00 H new ATOM 0 HE2 MET A 70 -3.068 8.075 -1.534 1.00 0.00 H new ATOM 0 HE3 MET A 70 -1.451 7.838 -2.239 1.00 0.00 H new ATOM 1061 N SER A 71 -4.015 2.724 -2.809 1.00 0.00 N ATOM 1062 CA SER A 71 -3.595 1.696 -1.876 1.00 0.00 C ATOM 1063 C SER A 71 -4.299 0.375 -2.143 1.00 0.00 C ATOM 1064 O SER A 71 -5.367 0.361 -2.759 1.00 0.00 O ATOM 1065 CB SER A 71 -3.833 2.186 -0.451 1.00 0.00 C ATOM 1066 OG SER A 71 -5.088 2.809 -0.253 1.00 0.00 O ATOM 0 H SER A 71 -5.011 2.691 -3.024 1.00 0.00 H new ATOM 0 HA SER A 71 -2.530 1.507 -2.011 1.00 0.00 H new ATOM 0 HB2 SER A 71 -3.749 1.340 0.231 1.00 0.00 H new ATOM 0 HB3 SER A 71 -3.045 2.890 -0.185 1.00 0.00 H new ATOM 0 HG SER A 71 -5.130 3.634 -0.780 1.00 0.00 H new ATOM 1072 N ILE A 72 -3.693 -0.730 -1.695 1.00 0.00 N ATOM 1073 CA ILE A 72 -4.121 -2.076 -2.052 1.00 0.00 C ATOM 1074 C ILE A 72 -4.043 -2.964 -0.796 1.00 0.00 C ATOM 1075 O ILE A 72 -3.067 -2.851 -0.049 1.00 0.00 O ATOM 1076 CB ILE A 72 -3.206 -2.639 -3.167 1.00 0.00 C ATOM 1077 CG1 ILE A 72 -3.050 -1.713 -4.392 1.00 0.00 C ATOM 1078 CG2 ILE A 72 -3.658 -4.017 -3.681 1.00 0.00 C ATOM 1079 CD1 ILE A 72 -4.340 -1.555 -5.201 1.00 0.00 C ATOM 0 H ILE A 72 -2.887 -0.709 -1.071 1.00 0.00 H new ATOM 0 HA ILE A 72 -5.145 -2.058 -2.425 1.00 0.00 H new ATOM 0 HB ILE A 72 -2.242 -2.723 -2.666 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -2.718 -0.731 -4.056 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -2.269 -2.109 -5.041 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.976 -4.356 -4.461 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -3.653 -4.732 -2.858 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -4.666 -3.940 -4.089 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -4.160 -0.892 -6.047 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -4.662 -2.530 -5.566 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -5.118 -1.130 -4.566 1.00 0.00 H new ATOM 1091 N PRO A 73 -5.015 -3.861 -0.551 1.00 0.00 N ATOM 1092 CA PRO A 73 -6.286 -3.950 -1.250 1.00 0.00 C ATOM 1093 C PRO A 73 -7.214 -2.872 -0.676 1.00 0.00 C ATOM 1094 O PRO A 73 -7.271 -2.684 0.545 1.00 0.00 O ATOM 1095 CB PRO A 73 -6.800 -5.360 -0.957 1.00 0.00 C ATOM 1096 CG PRO A 73 -6.282 -5.626 0.454 1.00 0.00 C ATOM 1097 CD PRO A 73 -4.954 -4.858 0.508 1.00 0.00 C ATOM 0 HA PRO A 73 -6.218 -3.788 -2.326 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -7.888 -5.411 -1.004 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -6.415 -6.087 -1.672 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -6.981 -5.270 1.210 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -6.135 -6.691 0.632 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -4.818 -4.385 1.480 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -4.109 -5.531 0.360 1.00 0.00 H new ATOM 1105 N THR A 74 -7.968 -2.196 -1.535 1.00 0.00 N ATOM 1106 CA THR A 74 -8.993 -1.251 -1.082 1.00 0.00 C ATOM 1107 C THR A 74 -10.379 -1.782 -1.440 1.00 0.00 C ATOM 1108 O THR A 74 -10.574 -2.369 -2.504 1.00 0.00 O ATOM 1109 CB THR A 74 -8.707 0.157 -1.631 1.00 0.00 C ATOM 1110 OG1 THR A 74 -7.492 0.614 -1.085 1.00 0.00 O ATOM 1111 CG2 THR A 74 -9.807 1.174 -1.293 1.00 0.00 C ATOM 0 H THR A 74 -7.892 -2.281 -2.549 1.00 0.00 H new ATOM 0 HA THR A 74 -8.966 -1.158 0.004 1.00 0.00 H new ATOM 0 HB THR A 74 -8.663 0.077 -2.717 1.00 0.00 H new ATOM 0 HG1 THR A 74 -6.804 0.626 -1.783 1.00 0.00 H new ATOM 0 HG21 THR A 74 -9.544 2.146 -1.709 1.00 0.00 H new ATOM 0 HG22 THR A 74 -10.754 0.841 -1.719 1.00 0.00 H new ATOM 0 HG23 THR A 74 -9.906 1.257 -0.211 1.00 0.00 H new ATOM 1119 N LEU A 75 -11.342 -1.538 -0.549 1.00 0.00 N ATOM 1120 CA LEU A 75 -12.763 -1.801 -0.732 1.00 0.00 C ATOM 1121 C LEU A 75 -13.496 -0.475 -0.583 1.00 0.00 C ATOM 1122 O LEU A 75 -13.332 0.212 0.427 1.00 0.00 O ATOM 1123 CB LEU A 75 -13.270 -2.802 0.325 1.00 0.00 C ATOM 1124 CG LEU A 75 -12.723 -4.237 0.203 1.00 0.00 C ATOM 1125 CD1 LEU A 75 -13.263 -5.105 1.346 1.00 0.00 C ATOM 1126 CD2 LEU A 75 -13.087 -4.904 -1.124 1.00 0.00 C ATOM 0 H LEU A 75 -11.137 -1.131 0.364 1.00 0.00 H new ATOM 0 HA LEU A 75 -12.942 -2.236 -1.715 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -13.016 -2.419 1.313 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -14.358 -2.842 0.269 1.00 0.00 H new ATOM 0 HG LEU A 75 -11.637 -4.156 0.253 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -12.871 -6.117 1.251 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -12.951 -4.683 2.302 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -14.352 -5.132 1.299 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -12.674 -5.912 -1.150 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -14.172 -4.954 -1.221 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -12.676 -4.322 -1.949 1.00 0.00 H new ATOM 1138 N LEU A 76 -14.326 -0.132 -1.567 1.00 0.00 N ATOM 1139 CA LEU A 76 -15.260 0.977 -1.494 1.00 0.00 C ATOM 1140 C LEU A 76 -16.632 0.315 -1.584 1.00 0.00 C ATOM 1141 O LEU A 76 -16.944 -0.315 -2.596 1.00 0.00 O ATOM 1142 CB LEU A 76 -15.068 2.037 -2.606 1.00 0.00 C ATOM 1143 CG LEU A 76 -13.651 2.559 -2.938 1.00 0.00 C ATOM 1144 CD1 LEU A 76 -13.746 3.622 -4.041 1.00 0.00 C ATOM 1145 CD2 LEU A 76 -12.961 3.161 -1.722 1.00 0.00 C ATOM 0 H LEU A 76 -14.364 -0.632 -2.455 1.00 0.00 H new ATOM 0 HA LEU A 76 -15.114 1.546 -0.576 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -15.485 1.623 -3.524 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -15.678 2.900 -2.340 1.00 0.00 H new ATOM 0 HG LEU A 76 -13.056 1.709 -3.272 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -12.748 3.992 -4.277 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -14.190 3.181 -4.934 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -14.367 4.449 -3.697 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -11.969 3.514 -2.004 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -13.550 3.997 -1.346 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -12.869 2.403 -0.944 1.00 0.00 H new ATOM 1157 N VAL A 77 -17.433 0.385 -0.527 1.00 0.00 N ATOM 1158 CA VAL A 77 -18.749 -0.259 -0.495 1.00 0.00 C ATOM 1159 C VAL A 77 -19.781 0.798 -0.894 1.00 0.00 C ATOM 1160 O VAL A 77 -19.850 1.853 -0.249 1.00 0.00 O ATOM 1161 CB VAL A 77 -19.055 -0.892 0.884 1.00 0.00 C ATOM 1162 CG1 VAL A 77 -20.095 -2.006 0.723 1.00 0.00 C ATOM 1163 CG2 VAL A 77 -17.814 -1.469 1.592 1.00 0.00 C ATOM 0 H VAL A 77 -17.194 0.886 0.329 1.00 0.00 H new ATOM 0 HA VAL A 77 -18.779 -1.092 -1.197 1.00 0.00 H new ATOM 0 HB VAL A 77 -19.434 -0.084 1.510 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -20.307 -2.449 1.696 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -21.012 -1.590 0.306 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -19.706 -2.773 0.053 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -18.108 -1.895 2.551 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -17.369 -2.246 0.971 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -17.086 -0.674 1.755 1.00 0.00 H new ATOM 1173 N LEU A 78 -20.557 0.539 -1.956 1.00 0.00 N ATOM 1174 CA LEU A 78 -21.498 1.497 -2.530 1.00 0.00 C ATOM 1175 C LEU A 78 -22.909 0.918 -2.521 1.00 0.00 C ATOM 1176 O LEU A 78 -23.094 -0.297 -2.625 1.00 0.00 O ATOM 1177 CB LEU A 78 -21.119 1.891 -3.976 1.00 0.00 C ATOM 1178 CG LEU A 78 -20.007 2.951 -4.096 1.00 0.00 C ATOM 1179 CD1 LEU A 78 -18.602 2.355 -3.977 1.00 0.00 C ATOM 1180 CD2 LEU A 78 -20.121 3.723 -5.414 1.00 0.00 C ATOM 0 H LEU A 78 -20.544 -0.357 -2.444 1.00 0.00 H new ATOM 0 HA LEU A 78 -21.457 2.395 -1.913 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -20.803 0.994 -4.509 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -22.011 2.264 -4.480 1.00 0.00 H new ATOM 0 HG LEU A 78 -20.152 3.633 -3.258 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -17.861 3.149 -4.069 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -18.494 1.869 -3.008 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -18.449 1.622 -4.769 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -19.324 4.464 -5.472 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -20.033 3.030 -6.251 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -21.087 4.225 -5.459 1.00 0.00 H new ATOM 1192 N LYS A 79 -23.907 1.804 -2.475 1.00 0.00 N ATOM 1193 CA LYS A 79 -25.323 1.493 -2.562 1.00 0.00 C ATOM 1194 C LYS A 79 -25.947 2.524 -3.477 1.00 0.00 C ATOM 1195 O LYS A 79 -25.751 3.717 -3.265 1.00 0.00 O ATOM 1196 CB LYS A 79 -26.022 1.606 -1.197 1.00 0.00 C ATOM 1197 CG LYS A 79 -25.600 0.503 -0.228 1.00 0.00 C ATOM 1198 CD LYS A 79 -26.445 0.416 1.051 1.00 0.00 C ATOM 1199 CE LYS A 79 -27.950 0.240 0.786 1.00 0.00 C ATOM 1200 NZ LYS A 79 -28.705 -0.055 2.029 1.00 0.00 N ATOM 0 H LYS A 79 -23.734 2.804 -2.371 1.00 0.00 H new ATOM 0 HA LYS A 79 -25.437 0.471 -2.924 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -25.796 2.577 -0.757 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -27.102 1.564 -1.341 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -25.649 -0.455 -0.746 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -24.558 0.662 0.051 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -26.091 -0.420 1.654 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -26.292 1.321 1.639 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -28.346 1.147 0.329 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -28.100 -0.569 0.071 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -29.687 -0.299 1.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -28.260 -0.854 2.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -28.697 0.782 2.647 1.00 0.00 H new ATOM 1214 N ASP A 80 -26.724 2.055 -4.447 1.00 0.00 N ATOM 1215 CA ASP A 80 -27.601 2.833 -5.319 1.00 0.00 C ATOM 1216 C ASP A 80 -26.979 4.153 -5.829 1.00 0.00 C ATOM 1217 O ASP A 80 -27.659 5.173 -5.955 1.00 0.00 O ATOM 1218 CB ASP A 80 -28.947 3.027 -4.597 1.00 0.00 C ATOM 1219 CG ASP A 80 -30.064 3.534 -5.526 1.00 0.00 C ATOM 1220 OD1 ASP A 80 -30.399 2.829 -6.503 1.00 0.00 O ATOM 1221 OD2 ASP A 80 -30.681 4.584 -5.231 1.00 0.00 O ATOM 0 H ASP A 80 -26.762 1.058 -4.660 1.00 0.00 H new ATOM 0 HA ASP A 80 -27.762 2.273 -6.240 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -29.254 2.080 -4.153 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -28.815 3.735 -3.778 1.00 0.00 H new ATOM 1226 N GLY A 81 -25.665 4.151 -6.086 1.00 0.00 N ATOM 1227 CA GLY A 81 -24.919 5.264 -6.670 1.00 0.00 C ATOM 1228 C GLY A 81 -23.884 5.934 -5.778 1.00 0.00 C ATOM 1229 O GLY A 81 -23.128 6.766 -6.281 1.00 0.00 O ATOM 0 H GLY A 81 -25.075 3.344 -5.885 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -24.414 4.903 -7.566 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -25.634 6.022 -6.991 1.00 0.00 H new ATOM 1233 N GLU A 82 -23.822 5.608 -4.488 1.00 0.00 N ATOM 1234 CA GLU A 82 -23.020 6.339 -3.521 1.00 0.00 C ATOM 1235 C GLU A 82 -22.295 5.426 -2.539 1.00 0.00 C ATOM 1236 O GLU A 82 -22.758 4.329 -2.245 1.00 0.00 O ATOM 1237 CB GLU A 82 -23.920 7.350 -2.804 1.00 0.00 C ATOM 1238 CG GLU A 82 -24.862 6.754 -1.750 1.00 0.00 C ATOM 1239 CD GLU A 82 -25.758 7.837 -1.122 1.00 0.00 C ATOM 1240 OE1 GLU A 82 -25.349 8.472 -0.123 1.00 0.00 O ATOM 1241 OE2 GLU A 82 -26.889 8.064 -1.611 1.00 0.00 O ATOM 0 H GLU A 82 -24.333 4.822 -4.086 1.00 0.00 H new ATOM 0 HA GLU A 82 -22.229 6.866 -4.054 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -23.289 8.097 -2.323 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -24.519 7.872 -3.550 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -25.484 5.986 -2.209 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -24.277 6.267 -0.970 1.00 0.00 H new ATOM 1248 N VAL A 83 -21.159 5.891 -2.023 1.00 0.00 N ATOM 1249 CA VAL A 83 -20.372 5.214 -0.995 1.00 0.00 C ATOM 1250 C VAL A 83 -21.153 5.241 0.314 1.00 0.00 C ATOM 1251 O VAL A 83 -21.782 6.245 0.657 1.00 0.00 O ATOM 1252 CB VAL A 83 -18.986 5.892 -0.880 1.00 0.00 C ATOM 1253 CG1 VAL A 83 -18.050 5.117 0.053 1.00 0.00 C ATOM 1254 CG2 VAL A 83 -18.272 6.007 -2.240 1.00 0.00 C ATOM 0 H VAL A 83 -20.748 6.777 -2.318 1.00 0.00 H new ATOM 0 HA VAL A 83 -20.196 4.170 -1.255 1.00 0.00 H new ATOM 0 HB VAL A 83 -19.190 6.886 -0.482 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -17.087 5.625 0.107 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -18.490 5.066 1.049 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -17.906 4.108 -0.332 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -17.304 6.490 -2.103 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -18.125 5.012 -2.659 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -18.881 6.601 -2.921 1.00 0.00 H new ATOM 1264 N VAL A 84 -21.066 4.138 1.057 1.00 0.00 N ATOM 1265 CA VAL A 84 -21.667 3.990 2.369 1.00 0.00 C ATOM 1266 C VAL A 84 -20.616 3.493 3.359 1.00 0.00 C ATOM 1267 O VAL A 84 -20.746 3.753 4.555 1.00 0.00 O ATOM 1268 CB VAL A 84 -22.906 3.077 2.299 1.00 0.00 C ATOM 1269 CG1 VAL A 84 -23.996 3.683 1.401 1.00 0.00 C ATOM 1270 CG2 VAL A 84 -22.598 1.643 1.835 1.00 0.00 C ATOM 0 H VAL A 84 -20.562 3.306 0.750 1.00 0.00 H new ATOM 0 HA VAL A 84 -22.021 4.957 2.726 1.00 0.00 H new ATOM 0 HB VAL A 84 -23.266 3.010 3.325 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -24.857 3.015 1.372 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -24.300 4.650 1.801 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -23.605 3.814 0.392 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -23.520 1.062 1.812 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -22.160 1.670 0.837 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -21.895 1.180 2.527 1.00 0.00 H new ATOM 1280 N GLU A 85 -19.543 2.845 2.885 1.00 0.00 N ATOM 1281 CA GLU A 85 -18.435 2.436 3.694 1.00 0.00 C ATOM 1282 C GLU A 85 -17.207 2.356 2.796 1.00 0.00 C ATOM 1283 O GLU A 85 -17.280 2.397 1.567 1.00 0.00 O ATOM 1284 CB GLU A 85 -18.775 1.085 4.300 1.00 0.00 C ATOM 1285 CG GLU A 85 -17.859 0.641 5.404 1.00 0.00 C ATOM 1286 CD GLU A 85 -17.778 1.563 6.629 1.00 0.00 C ATOM 1287 OE1 GLU A 85 -17.100 2.611 6.552 1.00 0.00 O ATOM 1288 OE2 GLU A 85 -18.346 1.203 7.685 1.00 0.00 O ATOM 0 H GLU A 85 -19.439 2.595 1.902 1.00 0.00 H new ATOM 0 HA GLU A 85 -18.230 3.138 4.502 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -19.794 1.122 4.685 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -18.760 0.334 3.510 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -18.179 -0.346 5.738 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -16.856 0.529 4.993 1.00 0.00 H new ATOM 1295 N THR A 86 -16.055 2.266 3.426 1.00 0.00 N ATOM 1296 CA THR A 86 -14.747 2.329 2.815 1.00 0.00 C ATOM 1297 C THR A 86 -13.774 1.647 3.785 1.00 0.00 C ATOM 1298 O THR A 86 -13.797 1.954 4.982 1.00 0.00 O ATOM 1299 CB THR A 86 -14.390 3.812 2.614 1.00 0.00 C ATOM 1300 OG1 THR A 86 -15.429 4.543 1.988 1.00 0.00 O ATOM 1301 CG2 THR A 86 -13.179 3.902 1.707 1.00 0.00 C ATOM 0 H THR A 86 -16.005 2.140 4.437 1.00 0.00 H new ATOM 0 HA THR A 86 -14.706 1.831 1.846 1.00 0.00 H new ATOM 0 HB THR A 86 -14.209 4.234 3.603 1.00 0.00 H new ATOM 0 HG1 THR A 86 -15.155 5.478 1.884 1.00 0.00 H new ATOM 0 HG21 THR A 86 -12.915 4.949 1.556 1.00 0.00 H new ATOM 0 HG22 THR A 86 -12.341 3.379 2.167 1.00 0.00 H new ATOM 0 HG23 THR A 86 -13.410 3.444 0.745 1.00 0.00 H new ATOM 1309 N SER A 87 -12.925 0.750 3.280 1.00 0.00 N ATOM 1310 CA SER A 87 -11.975 -0.016 4.079 1.00 0.00 C ATOM 1311 C SER A 87 -10.722 -0.279 3.247 1.00 0.00 C ATOM 1312 O SER A 87 -10.800 -0.425 2.026 1.00 0.00 O ATOM 1313 CB SER A 87 -12.611 -1.346 4.512 1.00 0.00 C ATOM 1314 OG SER A 87 -13.812 -1.137 5.237 1.00 0.00 O ATOM 0 H SER A 87 -12.880 0.534 2.284 1.00 0.00 H new ATOM 0 HA SER A 87 -11.706 0.548 4.972 1.00 0.00 H new ATOM 0 HB2 SER A 87 -12.818 -1.955 3.632 1.00 0.00 H new ATOM 0 HB3 SER A 87 -11.906 -1.904 5.128 1.00 0.00 H new ATOM 0 HG SER A 87 -14.192 -2.002 5.496 1.00 0.00 H new ATOM 1320 N VAL A 88 -9.563 -0.361 3.900 1.00 0.00 N ATOM 1321 CA VAL A 88 -8.288 -0.613 3.244 1.00 0.00 C ATOM 1322 C VAL A 88 -7.556 -1.660 4.079 1.00 0.00 C ATOM 1323 O VAL A 88 -7.371 -1.479 5.285 1.00 0.00 O ATOM 1324 CB VAL A 88 -7.489 0.702 3.092 1.00 0.00 C ATOM 1325 CG1 VAL A 88 -6.191 0.451 2.316 1.00 0.00 C ATOM 1326 CG2 VAL A 88 -8.279 1.801 2.362 1.00 0.00 C ATOM 0 H VAL A 88 -9.486 -0.252 4.911 1.00 0.00 H new ATOM 0 HA VAL A 88 -8.424 -0.993 2.231 1.00 0.00 H new ATOM 0 HB VAL A 88 -7.278 1.046 4.105 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -5.640 1.386 2.217 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -5.581 -0.275 2.853 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -6.429 0.063 1.325 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -7.667 2.700 2.286 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -8.543 1.456 1.362 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -9.188 2.028 2.920 1.00 0.00 H new ATOM 1336 N GLY A 89 -7.173 -2.764 3.439 1.00 0.00 N ATOM 1337 CA GLY A 89 -6.390 -3.842 4.039 1.00 0.00 C ATOM 1338 C GLY A 89 -7.102 -5.179 3.876 1.00 0.00 C ATOM 1339 O GLY A 89 -8.326 -5.217 3.715 1.00 0.00 O ATOM 0 H GLY A 89 -7.406 -2.937 2.461 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -5.407 -3.888 3.571 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -6.230 -3.636 5.097 1.00 0.00 H new ATOM 1343 N PHE A 90 -6.351 -6.281 3.913 1.00 0.00 N ATOM 1344 CA PHE A 90 -6.905 -7.624 3.761 1.00 0.00 C ATOM 1345 C PHE A 90 -7.874 -7.956 4.900 1.00 0.00 C ATOM 1346 O PHE A 90 -7.691 -7.491 6.029 1.00 0.00 O ATOM 1347 CB PHE A 90 -5.768 -8.662 3.738 1.00 0.00 C ATOM 1348 CG PHE A 90 -6.258 -10.096 3.619 1.00 0.00 C ATOM 1349 CD1 PHE A 90 -6.788 -10.568 2.402 1.00 0.00 C ATOM 1350 CD2 PHE A 90 -6.279 -10.931 4.755 1.00 0.00 C ATOM 1351 CE1 PHE A 90 -7.353 -11.854 2.330 1.00 0.00 C ATOM 1352 CE2 PHE A 90 -6.834 -12.220 4.677 1.00 0.00 C ATOM 1353 CZ PHE A 90 -7.375 -12.682 3.466 1.00 0.00 C ATOM 0 H PHE A 90 -5.340 -6.266 4.049 1.00 0.00 H new ATOM 0 HA PHE A 90 -7.453 -7.656 2.820 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -5.104 -8.443 2.902 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -5.178 -8.563 4.649 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -6.760 -9.941 1.523 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -5.867 -10.579 5.689 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -7.771 -12.207 1.399 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -6.844 -12.856 5.550 1.00 0.00 H new ATOM 0 HZ PHE A 90 -7.807 -13.670 3.408 1.00 0.00 H new ATOM 1363 N LYS A 91 -8.889 -8.780 4.616 1.00 0.00 N ATOM 1364 CA LYS A 91 -9.754 -9.378 5.635 1.00 0.00 C ATOM 1365 C LYS A 91 -10.331 -10.694 5.082 1.00 0.00 C ATOM 1366 O LYS A 91 -10.505 -10.792 3.864 1.00 0.00 O ATOM 1367 CB LYS A 91 -10.810 -8.386 6.161 1.00 0.00 C ATOM 1368 CG LYS A 91 -11.941 -7.969 5.204 1.00 0.00 C ATOM 1369 CD LYS A 91 -11.650 -6.738 4.329 1.00 0.00 C ATOM 1370 CE LYS A 91 -11.660 -5.408 5.106 1.00 0.00 C ATOM 1371 NZ LYS A 91 -10.337 -5.043 5.676 1.00 0.00 N ATOM 0 H LYS A 91 -9.134 -9.052 3.664 1.00 0.00 H new ATOM 0 HA LYS A 91 -9.171 -9.623 6.523 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -11.267 -8.822 7.049 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -10.291 -7.482 6.481 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -12.169 -8.811 4.551 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -12.837 -7.771 5.793 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -10.677 -6.863 3.854 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -12.391 -6.688 3.531 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -11.992 -4.611 4.441 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -12.389 -5.474 5.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -10.266 -4.008 5.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -10.236 -5.469 6.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -9.582 -5.396 5.054 1.00 0.00 H new ATOM 1385 N PRO A 92 -10.585 -11.707 5.933 1.00 0.00 N ATOM 1386 CA PRO A 92 -11.039 -13.027 5.498 1.00 0.00 C ATOM 1387 C PRO A 92 -12.490 -13.012 4.997 1.00 0.00 C ATOM 1388 O PRO A 92 -13.179 -11.994 5.053 1.00 0.00 O ATOM 1389 CB PRO A 92 -10.840 -13.945 6.714 1.00 0.00 C ATOM 1390 CG PRO A 92 -10.971 -12.994 7.899 1.00 0.00 C ATOM 1391 CD PRO A 92 -10.331 -11.715 7.369 1.00 0.00 C ATOM 0 HA PRO A 92 -10.470 -13.382 4.639 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -11.590 -14.735 6.748 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -9.865 -14.432 6.695 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -12.012 -12.839 8.182 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -10.454 -13.371 8.781 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -10.762 -10.835 7.847 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -9.261 -11.698 7.577 1.00 0.00 H new ATOM 1399 N LYS A 93 -12.971 -14.171 4.534 1.00 0.00 N ATOM 1400 CA LYS A 93 -14.242 -14.338 3.821 1.00 0.00 C ATOM 1401 C LYS A 93 -15.437 -13.867 4.647 1.00 0.00 C ATOM 1402 O LYS A 93 -16.424 -13.375 4.096 1.00 0.00 O ATOM 1403 CB LYS A 93 -14.364 -15.827 3.414 1.00 0.00 C ATOM 1404 CG LYS A 93 -14.799 -16.070 1.965 1.00 0.00 C ATOM 1405 CD LYS A 93 -16.224 -15.650 1.601 1.00 0.00 C ATOM 1406 CE LYS A 93 -17.332 -16.554 2.164 1.00 0.00 C ATOM 1407 NZ LYS A 93 -17.816 -16.163 3.507 1.00 0.00 N ATOM 0 H LYS A 93 -12.467 -15.050 4.650 1.00 0.00 H new ATOM 0 HA LYS A 93 -14.248 -13.709 2.931 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -13.401 -16.312 3.574 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -15.079 -16.312 4.078 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -14.109 -15.540 1.308 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -14.691 -17.133 1.750 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -16.389 -14.633 1.958 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -16.313 -15.625 0.515 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -18.174 -16.550 1.472 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -16.961 -17.578 2.209 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -18.839 -16.340 3.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -17.320 -16.722 4.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -17.629 -15.152 3.662 1.00 0.00 H new ATOM 1421 N GLU A 94 -15.367 -14.027 5.963 1.00 0.00 N ATOM 1422 CA GLU A 94 -16.445 -13.667 6.862 1.00 0.00 C ATOM 1423 C GLU A 94 -16.405 -12.172 7.160 1.00 0.00 C ATOM 1424 O GLU A 94 -17.438 -11.511 7.173 1.00 0.00 O ATOM 1425 CB GLU A 94 -16.308 -14.459 8.165 1.00 0.00 C ATOM 1426 CG GLU A 94 -16.746 -15.923 8.047 1.00 0.00 C ATOM 1427 CD GLU A 94 -16.046 -16.730 6.939 1.00 0.00 C ATOM 1428 OE1 GLU A 94 -14.866 -17.109 7.117 1.00 0.00 O ATOM 1429 OE2 GLU A 94 -16.681 -16.991 5.891 1.00 0.00 O ATOM 0 H GLU A 94 -14.550 -14.414 6.436 1.00 0.00 H new ATOM 0 HA GLU A 94 -17.398 -13.905 6.390 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -15.269 -14.425 8.492 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -16.902 -13.973 8.939 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -16.567 -16.417 9.002 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -17.821 -15.951 7.870 1.00 0.00 H new ATOM 1436 N ALA A 95 -15.209 -11.616 7.357 1.00 0.00 N ATOM 1437 CA ALA A 95 -15.020 -10.186 7.543 1.00 0.00 C ATOM 1438 C ALA A 95 -15.495 -9.416 6.314 1.00 0.00 C ATOM 1439 O ALA A 95 -16.134 -8.372 6.437 1.00 0.00 O ATOM 1440 CB ALA A 95 -13.538 -9.929 7.789 1.00 0.00 C ATOM 0 H ALA A 95 -14.342 -12.153 7.391 1.00 0.00 H new ATOM 0 HA ALA A 95 -15.607 -9.844 8.395 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -13.373 -8.861 7.931 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -13.218 -10.468 8.681 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -12.962 -10.274 6.931 1.00 0.00 H new ATOM 1446 N LEU A 96 -15.203 -9.963 5.133 1.00 0.00 N ATOM 1447 CA LEU A 96 -15.618 -9.405 3.860 1.00 0.00 C ATOM 1448 C LEU A 96 -17.133 -9.285 3.822 1.00 0.00 C ATOM 1449 O LEU A 96 -17.685 -8.219 3.544 1.00 0.00 O ATOM 1450 CB LEU A 96 -15.148 -10.325 2.720 1.00 0.00 C ATOM 1451 CG LEU A 96 -14.878 -9.510 1.448 1.00 0.00 C ATOM 1452 CD1 LEU A 96 -13.431 -9.007 1.506 1.00 0.00 C ATOM 1453 CD2 LEU A 96 -15.137 -10.348 0.193 1.00 0.00 C ATOM 0 H LEU A 96 -14.661 -10.822 5.041 1.00 0.00 H new ATOM 0 HA LEU A 96 -15.175 -8.417 3.738 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -14.242 -10.852 3.020 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -15.906 -11.082 2.520 1.00 0.00 H new ATOM 0 HG LEU A 96 -15.557 -8.659 1.395 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -13.213 -8.423 0.612 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -13.298 -8.382 2.389 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -12.752 -9.858 1.559 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -14.938 -9.746 -0.694 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -14.481 -11.219 0.195 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -16.176 -10.676 0.183 1.00 0.00 H new ATOM 1465 N GLN A 97 -17.797 -10.404 4.118 1.00 0.00 N ATOM 1466 CA GLN A 97 -19.235 -10.468 4.029 1.00 0.00 C ATOM 1467 C GLN A 97 -19.870 -9.619 5.107 1.00 0.00 C ATOM 1468 O GLN A 97 -20.854 -8.965 4.812 1.00 0.00 O ATOM 1469 CB GLN A 97 -19.731 -11.909 3.983 1.00 0.00 C ATOM 1470 CG GLN A 97 -20.062 -12.662 5.269 1.00 0.00 C ATOM 1471 CD GLN A 97 -20.321 -14.136 4.952 1.00 0.00 C ATOM 1472 OE1 GLN A 97 -19.616 -15.005 5.454 1.00 0.00 O ATOM 1473 NE2 GLN A 97 -21.254 -14.461 4.067 1.00 0.00 N ATOM 0 H GLN A 97 -17.352 -11.271 4.420 1.00 0.00 H new ATOM 0 HA GLN A 97 -19.556 -10.036 3.081 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -20.629 -11.919 3.365 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -18.975 -12.491 3.456 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -19.238 -12.572 5.977 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -20.939 -12.223 5.743 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -21.838 -13.735 3.652 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -21.387 -15.437 3.802 1.00 0.00 H new ATOM 1482 N GLU A 98 -19.301 -9.551 6.311 1.00 0.00 N ATOM 1483 CA GLU A 98 -19.815 -8.688 7.366 1.00 0.00 C ATOM 1484 C GLU A 98 -19.794 -7.221 6.921 1.00 0.00 C ATOM 1485 O GLU A 98 -20.797 -6.516 7.053 1.00 0.00 O ATOM 1486 CB GLU A 98 -19.013 -8.929 8.655 1.00 0.00 C ATOM 1487 CG GLU A 98 -19.480 -8.037 9.811 1.00 0.00 C ATOM 1488 CD GLU A 98 -18.768 -8.399 11.126 1.00 0.00 C ATOM 1489 OE1 GLU A 98 -17.675 -7.855 11.404 1.00 0.00 O ATOM 1490 OE2 GLU A 98 -19.304 -9.216 11.910 1.00 0.00 O ATOM 0 H GLU A 98 -18.477 -10.090 6.578 1.00 0.00 H new ATOM 0 HA GLU A 98 -20.857 -8.932 7.572 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -19.106 -9.975 8.947 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -17.956 -8.745 8.462 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -19.287 -6.992 9.567 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -20.558 -8.140 9.939 1.00 0.00 H new ATOM 1497 N LEU A 99 -18.673 -6.782 6.344 1.00 0.00 N ATOM 1498 CA LEU A 99 -18.442 -5.409 5.912 1.00 0.00 C ATOM 1499 C LEU A 99 -19.489 -4.953 4.899 1.00 0.00 C ATOM 1500 O LEU A 99 -19.953 -3.818 4.984 1.00 0.00 O ATOM 1501 CB LEU A 99 -17.010 -5.305 5.361 1.00 0.00 C ATOM 1502 CG LEU A 99 -16.683 -4.042 4.543 1.00 0.00 C ATOM 1503 CD1 LEU A 99 -16.844 -2.736 5.328 1.00 0.00 C ATOM 1504 CD2 LEU A 99 -15.236 -4.157 4.061 1.00 0.00 C ATOM 0 H LEU A 99 -17.878 -7.395 6.161 1.00 0.00 H new ATOM 0 HA LEU A 99 -18.544 -4.735 6.762 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -16.316 -5.358 6.200 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -16.820 -6.177 4.735 1.00 0.00 H new ATOM 0 HG LEU A 99 -17.394 -3.993 3.719 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -16.596 -1.892 4.685 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -17.875 -2.641 5.669 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -16.176 -2.744 6.189 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -14.976 -3.274 3.477 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -14.571 -4.232 4.921 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -15.129 -5.047 3.441 1.00 0.00 H new ATOM 1516 N VAL A 100 -19.880 -5.818 3.964 1.00 0.00 N ATOM 1517 CA VAL A 100 -20.901 -5.442 2.986 1.00 0.00 C ATOM 1518 C VAL A 100 -22.311 -5.741 3.514 1.00 0.00 C ATOM 1519 O VAL A 100 -23.197 -4.898 3.383 1.00 0.00 O ATOM 1520 CB VAL A 100 -20.551 -5.987 1.587 1.00 0.00 C ATOM 1521 CG1 VAL A 100 -20.533 -7.519 1.490 1.00 0.00 C ATOM 1522 CG2 VAL A 100 -21.513 -5.415 0.537 1.00 0.00 C ATOM 0 H VAL A 100 -19.515 -6.765 3.863 1.00 0.00 H new ATOM 0 HA VAL A 100 -20.910 -4.361 2.845 1.00 0.00 H new ATOM 0 HB VAL A 100 -19.530 -5.658 1.393 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -20.278 -7.816 0.473 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -19.791 -7.919 2.181 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -21.517 -7.911 1.747 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -21.254 -5.808 -0.446 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -22.535 -5.702 0.785 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -21.434 -4.328 0.525 1.00 0.00 H new ATOM 1532 N ASN A 101 -22.530 -6.873 4.189 1.00 0.00 N ATOM 1533 CA ASN A 101 -23.833 -7.306 4.704 1.00 0.00 C ATOM 1534 C ASN A 101 -24.445 -6.281 5.654 1.00 0.00 C ATOM 1535 O ASN A 101 -25.661 -6.109 5.669 1.00 0.00 O ATOM 1536 CB ASN A 101 -23.732 -8.665 5.407 1.00 0.00 C ATOM 1537 CG ASN A 101 -25.087 -9.093 5.955 1.00 0.00 C ATOM 1538 OD1 ASN A 101 -25.914 -9.649 5.239 1.00 0.00 O ATOM 1539 ND2 ASN A 101 -25.345 -8.831 7.224 1.00 0.00 N ATOM 0 H ASN A 101 -21.782 -7.534 4.399 1.00 0.00 H new ATOM 0 HA ASN A 101 -24.489 -7.402 3.839 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -23.365 -9.415 4.707 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -23.008 -8.606 6.220 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -26.246 -9.092 7.626 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -24.644 -8.368 7.802 1.00 0.00 H new ATOM 1546 N LYS A 102 -23.617 -5.580 6.434 1.00 0.00 N ATOM 1547 CA LYS A 102 -24.098 -4.572 7.380 1.00 0.00 C ATOM 1548 C LYS A 102 -24.751 -3.360 6.690 1.00 0.00 C ATOM 1549 O LYS A 102 -25.364 -2.546 7.381 1.00 0.00 O ATOM 1550 CB LYS A 102 -22.974 -4.194 8.361 1.00 0.00 C ATOM 1551 CG LYS A 102 -21.932 -3.243 7.789 1.00 0.00 C ATOM 1552 CD LYS A 102 -20.692 -3.279 8.688 1.00 0.00 C ATOM 1553 CE LYS A 102 -19.630 -2.305 8.192 1.00 0.00 C ATOM 1554 NZ LYS A 102 -19.994 -0.886 8.421 1.00 0.00 N ATOM 0 H LYS A 102 -22.603 -5.694 6.427 1.00 0.00 H new ATOM 0 HA LYS A 102 -24.908 -5.011 7.963 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -23.419 -3.737 9.245 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -22.474 -5.105 8.690 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -21.671 -3.535 6.772 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -22.332 -2.230 7.737 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -20.972 -3.027 9.711 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -20.283 -4.289 8.709 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -18.686 -2.518 8.694 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -19.467 -2.465 7.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -19.151 -0.288 8.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -20.720 -0.598 7.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -20.367 -0.775 9.385 1.00 0.00 H new ATOM 1568 N HIS A 103 -24.662 -3.249 5.356 1.00 0.00 N ATOM 1569 CA HIS A 103 -25.327 -2.213 4.564 1.00 0.00 C ATOM 1570 C HIS A 103 -26.227 -2.808 3.467 1.00 0.00 C ATOM 1571 O HIS A 103 -27.256 -2.218 3.134 1.00 0.00 O ATOM 1572 CB HIS A 103 -24.268 -1.301 3.925 1.00 0.00 C ATOM 1573 CG HIS A 103 -23.377 -0.602 4.915 1.00 0.00 C ATOM 1574 ND1 HIS A 103 -23.714 0.496 5.676 1.00 0.00 N ATOM 1575 CD2 HIS A 103 -22.084 -0.930 5.218 1.00 0.00 C ATOM 1576 CE1 HIS A 103 -22.650 0.818 6.428 1.00 0.00 C ATOM 1577 NE2 HIS A 103 -21.634 -0.033 6.196 1.00 0.00 N ATOM 0 H HIS A 103 -24.112 -3.894 4.788 1.00 0.00 H new ATOM 0 HA HIS A 103 -25.966 -1.640 5.236 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -23.649 -1.897 3.254 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -24.771 -0.552 3.314 1.00 0.00 H new ATOM 0 HD1 HIS A 103 -24.613 0.979 5.669 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -21.512 -1.736 4.782 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -22.614 1.645 7.122 1.00 0.00 H new ATOM 1585 N LEU A 104 -25.838 -3.951 2.898 1.00 0.00 N ATOM 1586 CA LEU A 104 -26.549 -4.699 1.863 1.00 0.00 C ATOM 1587 C LEU A 104 -27.939 -5.082 2.367 1.00 0.00 C ATOM 1588 O LEU A 104 -28.931 -4.721 1.704 1.00 0.00 O ATOM 1589 CB LEU A 104 -25.668 -5.899 1.496 1.00 0.00 C ATOM 1590 CG LEU A 104 -26.358 -7.070 0.792 1.00 0.00 C ATOM 1591 CD1 LEU A 104 -26.981 -6.678 -0.547 1.00 0.00 C ATOM 1592 CD2 LEU A 104 -25.294 -8.146 0.573 1.00 0.00 C ATOM 1593 OXT LEU A 104 -28.043 -5.736 3.425 1.00 0.00 O ATOM 0 H LEU A 104 -24.965 -4.405 3.165 1.00 0.00 H new ATOM 0 HA LEU A 104 -26.719 -4.110 0.962 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -24.861 -5.545 0.855 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -25.208 -6.275 2.410 1.00 0.00 H new ATOM 0 HG LEU A 104 -27.180 -7.424 1.414 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -27.455 -7.550 -0.997 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -27.729 -5.901 -0.387 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -26.205 -6.302 -1.213 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -25.742 -9.004 0.072 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -24.491 -7.743 -0.045 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -24.889 -8.459 1.536 1.00 0.00 H new TER 1605 LEU A 104 ATOM 1606 N MET B 1 8.916 29.134 -9.798 1.00 0.00 N ATOM 1607 CA MET B 1 7.720 28.336 -9.431 1.00 0.00 C ATOM 1608 C MET B 1 7.515 28.379 -7.918 1.00 0.00 C ATOM 1609 O MET B 1 8.392 27.967 -7.156 1.00 0.00 O ATOM 1610 CB MET B 1 7.806 26.871 -9.913 1.00 0.00 C ATOM 1611 CG MET B 1 7.680 26.717 -11.436 1.00 0.00 C ATOM 1612 SD MET B 1 6.135 27.360 -12.144 1.00 0.00 S ATOM 1613 CE MET B 1 6.393 26.921 -13.886 1.00 0.00 C ATOM 0 H1 MET B 1 9.052 29.102 -10.829 1.00 0.00 H new ATOM 0 H2 MET B 1 8.781 30.120 -9.497 1.00 0.00 H new ATOM 0 H3 MET B 1 9.755 28.740 -9.326 1.00 0.00 H new ATOM 0 HA MET B 1 6.866 28.785 -9.937 1.00 0.00 H new ATOM 0 HB2 MET B 1 8.757 26.446 -9.591 1.00 0.00 H new ATOM 0 HB3 MET B 1 7.018 26.292 -9.431 1.00 0.00 H new ATOM 0 HG2 MET B 1 8.519 27.227 -11.909 1.00 0.00 H new ATOM 0 HG3 MET B 1 7.766 25.660 -11.688 1.00 0.00 H new ATOM 0 HE1 MET B 1 5.534 27.244 -14.474 1.00 0.00 H new ATOM 0 HE2 MET B 1 7.292 27.414 -14.256 1.00 0.00 H new ATOM 0 HE3 MET B 1 6.509 25.841 -13.976 1.00 0.00 H new ATOM 1625 N GLU B 2 6.361 28.874 -7.466 1.00 0.00 N ATOM 1626 CA GLU B 2 5.994 28.930 -6.053 1.00 0.00 C ATOM 1627 C GLU B 2 5.513 27.539 -5.612 1.00 0.00 C ATOM 1628 O GLU B 2 4.311 27.273 -5.554 1.00 0.00 O ATOM 1629 CB GLU B 2 4.943 30.029 -5.811 1.00 0.00 C ATOM 1630 CG GLU B 2 5.509 31.436 -6.053 1.00 0.00 C ATOM 1631 CD GLU B 2 4.456 32.523 -5.771 1.00 0.00 C ATOM 1632 OE1 GLU B 2 3.709 32.913 -6.697 1.00 0.00 O ATOM 1633 OE2 GLU B 2 4.375 33.020 -4.623 1.00 0.00 O ATOM 0 H GLU B 2 5.644 29.253 -8.084 1.00 0.00 H new ATOM 0 HA GLU B 2 6.859 29.197 -5.445 1.00 0.00 H new ATOM 0 HB2 GLU B 2 4.090 29.864 -6.469 1.00 0.00 H new ATOM 0 HB3 GLU B 2 4.575 29.958 -4.787 1.00 0.00 H new ATOM 0 HG2 GLU B 2 6.378 31.595 -5.414 1.00 0.00 H new ATOM 0 HG3 GLU B 2 5.852 31.519 -7.084 1.00 0.00 H new ATOM 1640 N ASN B 3 6.476 26.654 -5.335 1.00 0.00 N ATOM 1641 CA ASN B 3 6.345 25.302 -4.822 1.00 0.00 C ATOM 1642 C ASN B 3 5.953 24.320 -5.915 1.00 0.00 C ATOM 1643 O ASN B 3 4.978 24.468 -6.653 1.00 0.00 O ATOM 1644 CB ASN B 3 5.458 25.147 -3.572 1.00 0.00 C ATOM 1645 CG ASN B 3 5.748 26.154 -2.455 1.00 0.00 C ATOM 1646 OD1 ASN B 3 5.077 27.177 -2.346 1.00 0.00 O ATOM 1647 ND2 ASN B 3 6.720 25.907 -1.592 1.00 0.00 N ATOM 0 H ASN B 3 7.456 26.897 -5.481 1.00 0.00 H new ATOM 0 HA ASN B 3 7.346 25.053 -4.471 1.00 0.00 H new ATOM 0 HB2 ASN B 3 4.414 25.245 -3.869 1.00 0.00 H new ATOM 0 HB3 ASN B 3 5.584 24.139 -3.176 1.00 0.00 H new ATOM 0 HD21 ASN B 3 6.911 26.566 -0.837 1.00 0.00 H new ATOM 0 HD22 ASN B 3 7.278 25.058 -1.682 1.00 0.00 H new ATOM 1654 N LYS B 4 6.755 23.268 -5.933 1.00 0.00 N ATOM 1655 CA LYS B 4 6.677 22.060 -6.731 1.00 0.00 C ATOM 1656 C LYS B 4 6.701 20.947 -5.702 1.00 0.00 C ATOM 1657 O LYS B 4 7.609 20.917 -4.871 1.00 0.00 O ATOM 1658 CB LYS B 4 7.876 21.991 -7.682 1.00 0.00 C ATOM 1659 CG LYS B 4 7.862 23.164 -8.672 1.00 0.00 C ATOM 1660 CD LYS B 4 9.082 23.163 -9.589 1.00 0.00 C ATOM 1661 CE LYS B 4 10.394 23.438 -8.842 1.00 0.00 C ATOM 1662 NZ LYS B 4 11.558 23.526 -9.762 1.00 0.00 N ATOM 0 H LYS B 4 7.568 23.240 -5.318 1.00 0.00 H new ATOM 0 HA LYS B 4 5.791 22.004 -7.363 1.00 0.00 H new ATOM 0 HB2 LYS B 4 8.802 22.007 -7.107 1.00 0.00 H new ATOM 0 HB3 LYS B 4 7.857 21.049 -8.229 1.00 0.00 H new ATOM 0 HG2 LYS B 4 6.956 23.116 -9.276 1.00 0.00 H new ATOM 0 HG3 LYS B 4 7.827 24.103 -8.119 1.00 0.00 H new ATOM 0 HD2 LYS B 4 9.152 22.198 -10.091 1.00 0.00 H new ATOM 0 HD3 LYS B 4 8.947 23.917 -10.365 1.00 0.00 H new ATOM 0 HE2 LYS B 4 10.303 24.370 -8.284 1.00 0.00 H new ATOM 0 HE3 LYS B 4 10.568 22.646 -8.114 1.00 0.00 H new ATOM 0 HZ1 LYS B 4 12.237 24.224 -9.397 1.00 0.00 H new ATOM 0 HZ2 LYS B 4 12.019 22.596 -9.829 1.00 0.00 H new ATOM 0 HZ3 LYS B 4 11.233 23.820 -10.705 1.00 0.00 H new ATOM 1676 N ILE B 5 5.703 20.076 -5.701 1.00 0.00 N ATOM 1677 CA ILE B 5 5.534 19.153 -4.593 1.00 0.00 C ATOM 1678 C ILE B 5 6.250 17.845 -4.899 1.00 0.00 C ATOM 1679 O ILE B 5 6.212 17.355 -6.025 1.00 0.00 O ATOM 1680 CB ILE B 5 4.033 19.062 -4.239 1.00 0.00 C ATOM 1681 CG1 ILE B 5 3.568 20.482 -3.824 1.00 0.00 C ATOM 1682 CG2 ILE B 5 3.762 17.995 -3.164 1.00 0.00 C ATOM 1683 CD1 ILE B 5 2.319 20.555 -2.951 1.00 0.00 C ATOM 0 H ILE B 5 5.009 19.990 -6.443 1.00 0.00 H new ATOM 0 HA ILE B 5 6.013 19.504 -3.679 1.00 0.00 H new ATOM 0 HB ILE B 5 3.453 18.733 -5.101 1.00 0.00 H new ATOM 0 HG12 ILE B 5 4.386 20.968 -3.293 1.00 0.00 H new ATOM 0 HG13 ILE B 5 3.387 21.061 -4.729 1.00 0.00 H new ATOM 0 HG21 ILE B 5 2.695 17.963 -2.944 1.00 0.00 H new ATOM 0 HG22 ILE B 5 4.087 17.020 -3.529 1.00 0.00 H new ATOM 0 HG23 ILE B 5 4.312 18.245 -2.257 1.00 0.00 H new ATOM 0 HD11 ILE B 5 2.093 21.597 -2.726 1.00 0.00 H new ATOM 0 HD12 ILE B 5 1.478 20.107 -3.481 1.00 0.00 H new ATOM 0 HD13 ILE B 5 2.493 20.013 -2.021 1.00 0.00 H new ATOM 1695 N ILE B 6 6.870 17.266 -3.879 1.00 0.00 N ATOM 1696 CA ILE B 6 7.564 15.989 -3.943 1.00 0.00 C ATOM 1697 C ILE B 6 7.105 15.197 -2.716 1.00 0.00 C ATOM 1698 O ILE B 6 6.918 15.771 -1.638 1.00 0.00 O ATOM 1699 CB ILE B 6 9.093 16.223 -4.063 1.00 0.00 C ATOM 1700 CG1 ILE B 6 9.796 14.933 -4.534 1.00 0.00 C ATOM 1701 CG2 ILE B 6 9.726 16.809 -2.787 1.00 0.00 C ATOM 1702 CD1 ILE B 6 11.311 15.063 -4.744 1.00 0.00 C ATOM 0 H ILE B 6 6.904 17.689 -2.951 1.00 0.00 H new ATOM 0 HA ILE B 6 7.324 15.400 -4.828 1.00 0.00 H new ATOM 0 HB ILE B 6 9.243 16.990 -4.823 1.00 0.00 H new ATOM 0 HG12 ILE B 6 9.611 14.148 -3.801 1.00 0.00 H new ATOM 0 HG13 ILE B 6 9.341 14.609 -5.470 1.00 0.00 H new ATOM 0 HG21 ILE B 6 10.796 16.947 -2.942 1.00 0.00 H new ATOM 0 HG22 ILE B 6 9.265 17.771 -2.561 1.00 0.00 H new ATOM 0 HG23 ILE B 6 9.565 16.125 -1.954 1.00 0.00 H new ATOM 0 HD11 ILE B 6 11.716 14.106 -5.074 1.00 0.00 H new ATOM 0 HD12 ILE B 6 11.510 15.822 -5.501 1.00 0.00 H new ATOM 0 HD13 ILE B 6 11.785 15.353 -3.806 1.00 0.00 H new ATOM 1714 N TYR B 7 6.884 13.896 -2.878 1.00 0.00 N ATOM 1715 CA TYR B 7 6.240 13.066 -1.872 1.00 0.00 C ATOM 1716 C TYR B 7 7.082 11.820 -1.673 1.00 0.00 C ATOM 1717 O TYR B 7 7.535 11.233 -2.656 1.00 0.00 O ATOM 1718 CB TYR B 7 4.841 12.705 -2.374 1.00 0.00 C ATOM 1719 CG TYR B 7 3.828 12.355 -1.305 1.00 0.00 C ATOM 1720 CD1 TYR B 7 3.828 11.093 -0.676 1.00 0.00 C ATOM 1721 CD2 TYR B 7 2.795 13.269 -1.029 1.00 0.00 C ATOM 1722 CE1 TYR B 7 2.749 10.711 0.129 1.00 0.00 C ATOM 1723 CE2 TYR B 7 1.721 12.889 -0.210 1.00 0.00 C ATOM 1724 CZ TYR B 7 1.679 11.600 0.349 1.00 0.00 C ATOM 1725 OH TYR B 7 0.601 11.225 1.083 1.00 0.00 O ATOM 0 H TYR B 7 7.150 13.386 -3.720 1.00 0.00 H new ATOM 0 HA TYR B 7 6.151 13.588 -0.919 1.00 0.00 H new ATOM 0 HB2 TYR B 7 4.455 13.544 -2.953 1.00 0.00 H new ATOM 0 HB3 TYR B 7 4.927 11.860 -3.057 1.00 0.00 H new ATOM 0 HD1 TYR B 7 4.662 10.421 -0.816 1.00 0.00 H new ATOM 0 HD2 TYR B 7 2.829 14.264 -1.448 1.00 0.00 H new ATOM 0 HE1 TYR B 7 2.737 9.731 0.583 1.00 0.00 H new ATOM 0 HE2 TYR B 7 0.924 13.589 -0.008 1.00 0.00 H new ATOM 0 HH TYR B 7 -0.173 11.770 0.829 1.00 0.00 H new ATOM 1735 N PHE B 8 7.304 11.402 -0.430 1.00 0.00 N ATOM 1736 CA PHE B 8 8.099 10.221 -0.117 1.00 0.00 C ATOM 1737 C PHE B 8 7.157 9.145 0.421 1.00 0.00 C ATOM 1738 O PHE B 8 6.231 9.457 1.177 1.00 0.00 O ATOM 1739 CB PHE B 8 9.203 10.555 0.903 1.00 0.00 C ATOM 1740 CG PHE B 8 10.173 11.691 0.582 1.00 0.00 C ATOM 1741 CD1 PHE B 8 10.293 12.258 -0.707 1.00 0.00 C ATOM 1742 CD2 PHE B 8 10.982 12.196 1.618 1.00 0.00 C ATOM 1743 CE1 PHE B 8 11.166 13.332 -0.946 1.00 0.00 C ATOM 1744 CE2 PHE B 8 11.856 13.265 1.374 1.00 0.00 C ATOM 1745 CZ PHE B 8 11.941 13.847 0.103 1.00 0.00 C ATOM 0 H PHE B 8 6.934 11.877 0.393 1.00 0.00 H new ATOM 0 HA PHE B 8 8.599 9.858 -1.015 1.00 0.00 H new ATOM 0 HB2 PHE B 8 8.718 10.791 1.851 1.00 0.00 H new ATOM 0 HB3 PHE B 8 9.792 9.652 1.062 1.00 0.00 H new ATOM 0 HD1 PHE B 8 9.705 11.860 -1.520 1.00 0.00 H new ATOM 0 HD2 PHE B 8 10.929 11.758 2.604 1.00 0.00 H new ATOM 0 HE1 PHE B 8 11.240 13.760 -1.935 1.00 0.00 H new ATOM 0 HE2 PHE B 8 12.471 13.644 2.176 1.00 0.00 H new ATOM 0 HZ PHE B 8 12.599 14.686 -0.068 1.00 0.00 H new ATOM 1755 N LEU B 9 7.398 7.883 0.060 1.00 0.00 N ATOM 1756 CA LEU B 9 6.636 6.738 0.545 1.00 0.00 C ATOM 1757 C LEU B 9 7.639 5.744 1.104 1.00 0.00 C ATOM 1758 O LEU B 9 8.557 5.337 0.386 1.00 0.00 O ATOM 1759 CB LEU B 9 5.823 6.089 -0.592 1.00 0.00 C ATOM 1760 CG LEU B 9 4.478 6.762 -0.921 1.00 0.00 C ATOM 1761 CD1 LEU B 9 3.817 5.977 -2.061 1.00 0.00 C ATOM 1762 CD2 LEU B 9 3.509 6.803 0.269 1.00 0.00 C ATOM 0 H LEU B 9 8.142 7.627 -0.589 1.00 0.00 H new ATOM 0 HA LEU B 9 5.924 7.054 1.308 1.00 0.00 H new ATOM 0 HB2 LEU B 9 6.435 6.083 -1.494 1.00 0.00 H new ATOM 0 HB3 LEU B 9 5.633 5.048 -0.329 1.00 0.00 H new ATOM 0 HG LEU B 9 4.689 7.795 -1.196 1.00 0.00 H new ATOM 0 HD11 LEU B 9 2.861 6.436 -2.312 1.00 0.00 H new ATOM 0 HD12 LEU B 9 4.467 5.990 -2.936 1.00 0.00 H new ATOM 0 HD13 LEU B 9 3.653 4.946 -1.746 1.00 0.00 H new ATOM 0 HD21 LEU B 9 2.582 7.290 -0.033 1.00 0.00 H new ATOM 0 HD22 LEU B 9 3.294 5.786 0.598 1.00 0.00 H new ATOM 0 HD23 LEU B 9 3.962 7.361 1.088 1.00 0.00 H new ATOM 1774 N SER B 10 7.489 5.369 2.372 1.00 0.00 N ATOM 1775 CA SER B 10 8.329 4.368 3.006 1.00 0.00 C ATOM 1776 C SER B 10 7.579 3.747 4.184 1.00 0.00 C ATOM 1777 O SER B 10 6.809 4.444 4.847 1.00 0.00 O ATOM 1778 CB SER B 10 9.641 5.029 3.437 1.00 0.00 C ATOM 1779 OG SER B 10 9.467 6.106 4.349 1.00 0.00 O ATOM 0 H SER B 10 6.775 5.757 2.989 1.00 0.00 H new ATOM 0 HA SER B 10 8.568 3.562 2.312 1.00 0.00 H new ATOM 0 HB2 SER B 10 10.283 4.277 3.895 1.00 0.00 H new ATOM 0 HB3 SER B 10 10.161 5.395 2.552 1.00 0.00 H new ATOM 0 HG SER B 10 10.317 6.581 4.460 1.00 0.00 H new ATOM 1785 N THR B 11 7.824 2.462 4.469 1.00 0.00 N ATOM 1786 CA THR B 11 7.104 1.661 5.458 1.00 0.00 C ATOM 1787 C THR B 11 6.934 2.410 6.784 1.00 0.00 C ATOM 1788 O THR B 11 7.911 2.678 7.488 1.00 0.00 O ATOM 1789 CB THR B 11 7.828 0.312 5.609 1.00 0.00 C ATOM 1790 OG1 THR B 11 7.802 -0.342 4.353 1.00 0.00 O ATOM 1791 CG2 THR B 11 7.185 -0.583 6.673 1.00 0.00 C ATOM 0 H THR B 11 8.558 1.934 3.997 1.00 0.00 H new ATOM 0 HA THR B 11 6.087 1.470 5.115 1.00 0.00 H new ATOM 0 HB THR B 11 8.850 0.502 5.936 1.00 0.00 H new ATOM 0 HG1 THR B 11 8.076 -1.276 4.465 1.00 0.00 H new ATOM 0 HG21 THR B 11 7.734 -1.522 6.739 1.00 0.00 H new ATOM 0 HG22 THR B 11 7.213 -0.078 7.638 1.00 0.00 H new ATOM 0 HG23 THR B 11 6.150 -0.787 6.400 1.00 0.00 H new ATOM 1799 N GLY B 12 5.693 2.777 7.116 1.00 0.00 N ATOM 1800 CA GLY B 12 5.347 3.421 8.382 1.00 0.00 C ATOM 1801 C GLY B 12 5.962 4.814 8.553 1.00 0.00 C ATOM 1802 O GLY B 12 5.900 5.368 9.648 1.00 0.00 O ATOM 0 H GLY B 12 4.891 2.632 6.503 1.00 0.00 H new ATOM 0 HA2 GLY B 12 4.262 3.501 8.454 1.00 0.00 H new ATOM 0 HA3 GLY B 12 5.675 2.785 9.204 1.00 0.00 H new ATOM 1806 N ASN B 13 6.536 5.378 7.481 1.00 0.00 N ATOM 1807 CA ASN B 13 7.276 6.647 7.415 1.00 0.00 C ATOM 1808 C ASN B 13 8.163 6.914 8.646 1.00 0.00 C ATOM 1809 O ASN B 13 8.279 8.054 9.089 1.00 0.00 O ATOM 1810 CB ASN B 13 6.290 7.798 7.149 1.00 0.00 C ATOM 1811 CG ASN B 13 6.966 8.963 6.447 1.00 0.00 C ATOM 1812 OD1 ASN B 13 7.230 8.895 5.257 1.00 0.00 O ATOM 1813 ND2 ASN B 13 7.283 10.044 7.139 1.00 0.00 N ATOM 0 H ASN B 13 6.492 4.925 6.568 1.00 0.00 H new ATOM 0 HA ASN B 13 7.979 6.575 6.585 1.00 0.00 H new ATOM 0 HB2 ASN B 13 5.463 7.435 6.539 1.00 0.00 H new ATOM 0 HB3 ASN B 13 5.864 8.139 8.093 1.00 0.00 H new ATOM 0 HD21 ASN B 13 7.750 10.825 6.679 1.00 0.00 H new ATOM 0 HD22 ASN B 13 7.061 10.097 8.133 1.00 0.00 H new ATOM 1820 N SER B 14 8.768 5.886 9.237 1.00 0.00 N ATOM 1821 CA SER B 14 9.429 5.971 10.531 1.00 0.00 C ATOM 1822 C SER B 14 10.722 6.787 10.571 1.00 0.00 C ATOM 1823 O SER B 14 10.872 7.613 11.473 1.00 0.00 O ATOM 1824 CB SER B 14 9.682 4.535 11.007 1.00 0.00 C ATOM 1825 OG SER B 14 10.167 3.728 9.941 1.00 0.00 O ATOM 0 H SER B 14 8.812 4.956 8.820 1.00 0.00 H new ATOM 0 HA SER B 14 8.762 6.524 11.193 1.00 0.00 H new ATOM 0 HB2 SER B 14 10.404 4.540 11.823 1.00 0.00 H new ATOM 0 HB3 SER B 14 8.759 4.109 11.400 1.00 0.00 H new ATOM 0 HG SER B 14 10.324 2.817 10.266 1.00 0.00 H new ATOM 1831 N ALA B 15 11.647 6.590 9.622 1.00 0.00 N ATOM 1832 CA ALA B 15 13.001 7.139 9.729 1.00 0.00 C ATOM 1833 C ALA B 15 13.580 7.745 8.452 1.00 0.00 C ATOM 1834 O ALA B 15 13.854 8.943 8.421 1.00 0.00 O ATOM 1835 CB ALA B 15 13.917 6.006 10.216 1.00 0.00 C ATOM 0 H ALA B 15 11.480 6.053 8.771 1.00 0.00 H new ATOM 0 HA ALA B 15 12.941 7.978 10.423 1.00 0.00 H new ATOM 0 HB1 ALA B 15 14.938 6.377 10.308 1.00 0.00 H new ATOM 0 HB2 ALA B 15 13.571 5.650 11.187 1.00 0.00 H new ATOM 0 HB3 ALA B 15 13.893 5.185 9.499 1.00 0.00 H new ATOM 1841 N ARG B 16 13.816 6.943 7.406 1.00 0.00 N ATOM 1842 CA ARG B 16 14.491 7.425 6.187 1.00 0.00 C ATOM 1843 C ARG B 16 13.754 8.599 5.562 1.00 0.00 C ATOM 1844 O ARG B 16 14.404 9.494 5.044 1.00 0.00 O ATOM 1845 CB ARG B 16 14.747 6.330 5.124 1.00 0.00 C ATOM 1846 CG ARG B 16 14.078 4.969 5.339 1.00 0.00 C ATOM 1847 CD ARG B 16 12.548 4.970 5.322 1.00 0.00 C ATOM 1848 NE ARG B 16 12.078 3.720 5.927 1.00 0.00 N ATOM 1849 CZ ARG B 16 10.917 3.480 6.533 1.00 0.00 C ATOM 1850 NH1 ARG B 16 9.944 4.382 6.559 1.00 0.00 N ATOM 1851 NH2 ARG B 16 10.726 2.310 7.118 1.00 0.00 N ATOM 0 H ARG B 16 13.551 5.958 7.376 1.00 0.00 H new ATOM 0 HA ARG B 16 15.471 7.756 6.529 1.00 0.00 H new ATOM 0 HB2 ARG B 16 14.422 6.716 4.158 1.00 0.00 H new ATOM 0 HB3 ARG B 16 15.823 6.170 5.058 1.00 0.00 H new ATOM 0 HG2 ARG B 16 14.431 4.286 4.567 1.00 0.00 H new ATOM 0 HG3 ARG B 16 14.412 4.568 6.296 1.00 0.00 H new ATOM 0 HD2 ARG B 16 12.163 5.827 5.875 1.00 0.00 H new ATOM 0 HD3 ARG B 16 12.180 5.058 4.300 1.00 0.00 H new ATOM 0 HE ARG B 16 12.724 2.932 5.877 1.00 0.00 H new ATOM 0 HH11 ARG B 16 10.075 5.287 6.107 1.00 0.00 H new ATOM 0 HH12 ARG B 16 9.065 4.170 7.031 1.00 0.00 H new ATOM 0 HH21 ARG B 16 11.463 1.605 7.101 1.00 0.00 H new ATOM 0 HH22 ARG B 16 9.842 2.112 7.586 1.00 0.00 H new ATOM 1865 N SER B 17 12.432 8.623 5.652 1.00 0.00 N ATOM 1866 CA SER B 17 11.586 9.736 5.268 1.00 0.00 C ATOM 1867 C SER B 17 11.983 11.017 6.001 1.00 0.00 C ATOM 1868 O SER B 17 12.301 12.016 5.365 1.00 0.00 O ATOM 1869 CB SER B 17 10.162 9.331 5.637 1.00 0.00 C ATOM 1870 OG SER B 17 10.156 8.657 6.898 1.00 0.00 O ATOM 0 H SER B 17 11.900 7.830 6.011 1.00 0.00 H new ATOM 0 HA SER B 17 11.683 9.947 4.203 1.00 0.00 H new ATOM 0 HB2 SER B 17 9.525 10.214 5.684 1.00 0.00 H new ATOM 0 HB3 SER B 17 9.749 8.681 4.866 1.00 0.00 H new ATOM 0 HG SER B 17 9.951 7.709 6.761 1.00 0.00 H new ATOM 1876 N GLN B 18 12.002 10.953 7.336 1.00 0.00 N ATOM 1877 CA GLN B 18 12.365 12.033 8.249 1.00 0.00 C ATOM 1878 C GLN B 18 13.724 12.610 7.849 1.00 0.00 C ATOM 1879 O GLN B 18 13.921 13.817 7.686 1.00 0.00 O ATOM 1880 CB GLN B 18 12.438 11.519 9.697 1.00 0.00 C ATOM 1881 CG GLN B 18 11.311 10.581 10.167 1.00 0.00 C ATOM 1882 CD GLN B 18 9.946 11.257 10.327 1.00 0.00 C ATOM 1883 OE1 GLN B 18 9.829 12.453 10.569 1.00 0.00 O ATOM 1884 NE2 GLN B 18 8.872 10.500 10.213 1.00 0.00 N ATOM 0 H GLN B 18 11.750 10.098 7.832 1.00 0.00 H new ATOM 0 HA GLN B 18 11.601 12.808 8.188 1.00 0.00 H new ATOM 0 HB2 GLN B 18 13.387 10.997 9.823 1.00 0.00 H new ATOM 0 HB3 GLN B 18 12.458 12.383 10.362 1.00 0.00 H new ATOM 0 HG2 GLN B 18 11.215 9.763 9.453 1.00 0.00 H new ATOM 0 HG3 GLN B 18 11.598 10.140 11.121 1.00 0.00 H new ATOM 0 HE21 GLN B 18 8.969 9.505 10.012 1.00 0.00 H new ATOM 0 HE22 GLN B 18 7.945 10.910 10.326 1.00 0.00 H new ATOM 1893 N MET B 19 14.672 11.696 7.667 1.00 0.00 N ATOM 1894 CA MET B 19 16.034 12.049 7.363 1.00 0.00 C ATOM 1895 C MET B 19 16.104 12.669 5.965 1.00 0.00 C ATOM 1896 O MET B 19 16.733 13.705 5.780 1.00 0.00 O ATOM 1897 CB MET B 19 16.874 10.780 7.449 1.00 0.00 C ATOM 1898 CG MET B 19 18.365 11.098 7.492 1.00 0.00 C ATOM 1899 SD MET B 19 19.372 9.843 6.679 1.00 0.00 S ATOM 1900 CE MET B 19 18.698 8.346 7.444 1.00 0.00 C ATOM 0 H MET B 19 14.506 10.691 7.729 1.00 0.00 H new ATOM 0 HA MET B 19 16.416 12.785 8.070 1.00 0.00 H new ATOM 0 HB2 MET B 19 16.595 10.218 8.340 1.00 0.00 H new ATOM 0 HB3 MET B 19 16.661 10.143 6.590 1.00 0.00 H new ATOM 0 HG2 MET B 19 18.540 12.062 7.015 1.00 0.00 H new ATOM 0 HG3 MET B 19 18.681 11.194 8.531 1.00 0.00 H new ATOM 0 HE1 MET B 19 19.406 7.526 7.324 1.00 0.00 H new ATOM 0 HE2 MET B 19 18.527 8.525 8.506 1.00 0.00 H new ATOM 0 HE3 MET B 19 17.755 8.085 6.964 1.00 0.00 H new ATOM 1910 N ALA B 20 15.448 12.057 4.977 1.00 0.00 N ATOM 1911 CA ALA B 20 15.435 12.526 3.605 1.00 0.00 C ATOM 1912 C ALA B 20 14.811 13.903 3.514 1.00 0.00 C ATOM 1913 O ALA B 20 15.291 14.713 2.735 1.00 0.00 O ATOM 1914 CB ALA B 20 14.683 11.557 2.695 1.00 0.00 C ATOM 0 H ALA B 20 14.903 11.206 5.119 1.00 0.00 H new ATOM 0 HA ALA B 20 16.470 12.582 3.269 1.00 0.00 H new ATOM 0 HB1 ALA B 20 14.691 11.937 1.673 1.00 0.00 H new ATOM 0 HB2 ALA B 20 15.168 10.581 2.723 1.00 0.00 H new ATOM 0 HB3 ALA B 20 13.653 11.461 3.038 1.00 0.00 H new ATOM 1920 N GLU B 21 13.760 14.190 4.280 1.00 0.00 N ATOM 1921 CA GLU B 21 13.082 15.467 4.155 1.00 0.00 C ATOM 1922 C GLU B 21 13.932 16.579 4.778 1.00 0.00 C ATOM 1923 O GLU B 21 13.908 17.703 4.279 1.00 0.00 O ATOM 1924 CB GLU B 21 11.613 15.382 4.601 1.00 0.00 C ATOM 1925 CG GLU B 21 11.363 15.236 6.099 1.00 0.00 C ATOM 1926 CD GLU B 21 9.855 15.194 6.404 1.00 0.00 C ATOM 1927 OE1 GLU B 21 9.230 14.123 6.220 1.00 0.00 O ATOM 1928 OE2 GLU B 21 9.283 16.238 6.798 1.00 0.00 O ATOM 0 H GLU B 21 13.368 13.562 4.982 1.00 0.00 H new ATOM 0 HA GLU B 21 12.993 15.748 3.106 1.00 0.00 H new ATOM 0 HB2 GLU B 21 11.099 16.279 4.255 1.00 0.00 H new ATOM 0 HB3 GLU B 21 11.151 14.535 4.094 1.00 0.00 H new ATOM 0 HG2 GLU B 21 11.837 14.325 6.463 1.00 0.00 H new ATOM 0 HG3 GLU B 21 11.822 16.069 6.631 1.00 0.00 H new ATOM 1935 N GLY B 22 14.776 16.271 5.773 1.00 0.00 N ATOM 1936 CA GLY B 22 15.769 17.219 6.263 1.00 0.00 C ATOM 1937 C GLY B 22 16.927 17.367 5.270 1.00 0.00 C ATOM 1938 O GLY B 22 17.283 18.492 4.915 1.00 0.00 O ATOM 0 H GLY B 22 14.785 15.370 6.250 1.00 0.00 H new ATOM 0 HA2 GLY B 22 15.300 18.189 6.427 1.00 0.00 H new ATOM 0 HA3 GLY B 22 16.153 16.883 7.226 1.00 0.00 H new ATOM 1942 N TRP B 23 17.461 16.253 4.743 1.00 0.00 N ATOM 1943 CA TRP B 23 18.478 16.241 3.685 1.00 0.00 C ATOM 1944 C TRP B 23 18.015 17.025 2.461 1.00 0.00 C ATOM 1945 O TRP B 23 18.840 17.620 1.766 1.00 0.00 O ATOM 1946 CB TRP B 23 18.778 14.804 3.228 1.00 0.00 C ATOM 1947 CG TRP B 23 19.842 14.054 3.963 1.00 0.00 C ATOM 1948 CD1 TRP B 23 19.667 12.913 4.661 1.00 0.00 C ATOM 1949 CD2 TRP B 23 21.278 14.303 3.979 1.00 0.00 C ATOM 1950 NE1 TRP B 23 20.879 12.464 5.136 1.00 0.00 N ATOM 1951 CE2 TRP B 23 21.918 13.265 4.716 1.00 0.00 C ATOM 1952 CE3 TRP B 23 22.107 15.277 3.389 1.00 0.00 C ATOM 1953 CZ2 TRP B 23 23.313 13.206 4.863 1.00 0.00 C ATOM 1954 CZ3 TRP B 23 23.507 15.221 3.511 1.00 0.00 C ATOM 1955 CH2 TRP B 23 24.110 14.181 4.240 1.00 0.00 C ATOM 0 H TRP B 23 17.191 15.318 5.048 1.00 0.00 H new ATOM 0 HA TRP B 23 19.371 16.701 4.107 1.00 0.00 H new ATOM 0 HB2 TRP B 23 17.854 14.230 3.296 1.00 0.00 H new ATOM 0 HB3 TRP B 23 19.056 14.837 2.175 1.00 0.00 H new ATOM 0 HD1 TRP B 23 18.718 12.424 4.823 1.00 0.00 H new ATOM 0 HE1 TRP B 23 20.993 11.640 5.726 1.00 0.00 H new ATOM 0 HE3 TRP B 23 21.658 16.085 2.831 1.00 0.00 H new ATOM 0 HZ2 TRP B 23 23.768 12.420 5.448 1.00 0.00 H new ATOM 0 HZ3 TRP B 23 24.120 15.978 3.044 1.00 0.00 H new ATOM 0 HH2 TRP B 23 25.186 14.132 4.321 1.00 0.00 H new ATOM 1966 N ALA B 24 16.715 16.995 2.182 1.00 0.00 N ATOM 1967 CA ALA B 24 16.120 17.667 1.057 1.00 0.00 C ATOM 1968 C ALA B 24 15.975 19.150 1.337 1.00 0.00 C ATOM 1969 O ALA B 24 16.411 19.949 0.520 1.00 0.00 O ATOM 1970 CB ALA B 24 14.727 17.091 0.784 1.00 0.00 C ATOM 0 H ALA B 24 16.039 16.487 2.753 1.00 0.00 H new ATOM 0 HA ALA B 24 16.768 17.519 0.193 1.00 0.00 H new ATOM 0 HB1 ALA B 24 14.282 17.604 -0.069 1.00 0.00 H new ATOM 0 HB2 ALA B 24 14.810 16.027 0.564 1.00 0.00 H new ATOM 0 HB3 ALA B 24 14.096 17.232 1.662 1.00 0.00 H new ATOM 1976 N LYS B 25 15.393 19.550 2.473 1.00 0.00 N ATOM 1977 CA LYS B 25 15.002 20.942 2.688 1.00 0.00 C ATOM 1978 C LYS B 25 16.182 21.909 2.739 1.00 0.00 C ATOM 1979 O LYS B 25 16.003 23.085 2.423 1.00 0.00 O ATOM 1980 CB LYS B 25 14.065 21.050 3.905 1.00 0.00 C ATOM 1981 CG LYS B 25 13.181 22.307 3.842 1.00 0.00 C ATOM 1982 CD LYS B 25 12.065 22.262 4.898 1.00 0.00 C ATOM 1983 CE LYS B 25 11.042 23.399 4.726 1.00 0.00 C ATOM 1984 NZ LYS B 25 11.607 24.742 5.014 1.00 0.00 N ATOM 0 H LYS B 25 15.184 18.929 3.254 1.00 0.00 H new ATOM 0 HA LYS B 25 14.442 21.264 1.810 1.00 0.00 H new ATOM 0 HB2 LYS B 25 13.432 20.164 3.955 1.00 0.00 H new ATOM 0 HB3 LYS B 25 14.659 21.070 4.819 1.00 0.00 H new ATOM 0 HG2 LYS B 25 13.795 23.194 3.998 1.00 0.00 H new ATOM 0 HG3 LYS B 25 12.741 22.394 2.849 1.00 0.00 H new ATOM 0 HD2 LYS B 25 11.551 21.303 4.837 1.00 0.00 H new ATOM 0 HD3 LYS B 25 12.508 22.324 5.892 1.00 0.00 H new ATOM 0 HE2 LYS B 25 10.660 23.384 3.705 1.00 0.00 H new ATOM 0 HE3 LYS B 25 10.194 23.219 5.387 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 10.871 25.464 4.881 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 11.948 24.772 5.996 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 12.399 24.932 4.367 1.00 0.00 H new ATOM 1998 N GLN B 26 17.393 21.433 3.053 1.00 0.00 N ATOM 1999 CA GLN B 26 18.598 22.256 2.920 1.00 0.00 C ATOM 2000 C GLN B 26 18.889 22.707 1.468 1.00 0.00 C ATOM 2001 O GLN B 26 19.673 23.639 1.286 1.00 0.00 O ATOM 2002 CB GLN B 26 19.816 21.556 3.550 1.00 0.00 C ATOM 2003 CG GLN B 26 19.991 20.131 3.005 1.00 0.00 C ATOM 2004 CD GLN B 26 21.429 19.627 2.912 1.00 0.00 C ATOM 2005 OE1 GLN B 26 22.385 20.215 3.410 1.00 0.00 O ATOM 2006 NE2 GLN B 26 21.597 18.515 2.220 1.00 0.00 N ATOM 0 H GLN B 26 17.563 20.488 3.399 1.00 0.00 H new ATOM 0 HA GLN B 26 18.400 23.173 3.474 1.00 0.00 H new ATOM 0 HB2 GLN B 26 20.716 22.137 3.348 1.00 0.00 H new ATOM 0 HB3 GLN B 26 19.697 21.520 4.633 1.00 0.00 H new ATOM 0 HG2 GLN B 26 19.427 19.448 3.640 1.00 0.00 H new ATOM 0 HG3 GLN B 26 19.545 20.085 2.012 1.00 0.00 H new ATOM 0 HE21 GLN B 26 20.791 18.040 1.814 1.00 0.00 H new ATOM 0 HE22 GLN B 26 22.533 18.131 2.092 1.00 0.00 H new ATOM 2015 N TYR B 27 18.279 22.085 0.448 1.00 0.00 N ATOM 2016 CA TYR B 27 18.500 22.404 -0.973 1.00 0.00 C ATOM 2017 C TYR B 27 17.189 22.613 -1.747 1.00 0.00 C ATOM 2018 O TYR B 27 17.096 23.527 -2.568 1.00 0.00 O ATOM 2019 CB TYR B 27 19.313 21.283 -1.650 1.00 0.00 C ATOM 2020 CG TYR B 27 20.819 21.468 -1.619 1.00 0.00 C ATOM 2021 CD1 TYR B 27 21.561 21.072 -0.492 1.00 0.00 C ATOM 2022 CD2 TYR B 27 21.485 22.022 -2.730 1.00 0.00 C ATOM 2023 CE1 TYR B 27 22.955 21.240 -0.459 1.00 0.00 C ATOM 2024 CE2 TYR B 27 22.882 22.182 -2.715 1.00 0.00 C ATOM 2025 CZ TYR B 27 23.625 21.791 -1.575 1.00 0.00 C ATOM 2026 OH TYR B 27 24.981 21.921 -1.546 1.00 0.00 O ATOM 0 H TYR B 27 17.606 21.332 0.589 1.00 0.00 H new ATOM 0 HA TYR B 27 19.053 23.343 -0.998 1.00 0.00 H new ATOM 0 HB2 TYR B 27 19.069 20.337 -1.167 1.00 0.00 H new ATOM 0 HB3 TYR B 27 18.994 21.202 -2.689 1.00 0.00 H new ATOM 0 HD1 TYR B 27 21.054 20.635 0.356 1.00 0.00 H new ATOM 0 HD2 TYR B 27 20.919 22.326 -3.598 1.00 0.00 H new ATOM 0 HE1 TYR B 27 23.514 20.949 0.418 1.00 0.00 H new ATOM 0 HE2 TYR B 27 23.387 22.603 -3.572 1.00 0.00 H new ATOM 0 HH TYR B 27 25.290 22.315 -2.388 1.00 0.00 H new ATOM 2036 N LEU B 28 16.172 21.790 -1.491 1.00 0.00 N ATOM 2037 CA LEU B 28 14.816 21.901 -2.004 1.00 0.00 C ATOM 2038 C LEU B 28 14.130 22.985 -1.169 1.00 0.00 C ATOM 2039 O LEU B 28 13.391 22.697 -0.225 1.00 0.00 O ATOM 2040 CB LEU B 28 14.053 20.556 -1.950 1.00 0.00 C ATOM 2041 CG LEU B 28 14.613 19.393 -2.797 1.00 0.00 C ATOM 2042 CD1 LEU B 28 13.577 18.263 -2.887 1.00 0.00 C ATOM 2043 CD2 LEU B 28 14.971 19.789 -4.231 1.00 0.00 C ATOM 0 H LEU B 28 16.285 20.980 -0.882 1.00 0.00 H new ATOM 0 HA LEU B 28 14.826 22.170 -3.060 1.00 0.00 H new ATOM 0 HB2 LEU B 28 14.016 20.230 -0.911 1.00 0.00 H new ATOM 0 HB3 LEU B 28 13.025 20.738 -2.263 1.00 0.00 H new ATOM 0 HG LEU B 28 15.525 19.079 -2.289 1.00 0.00 H new ATOM 0 HD11 LEU B 28 13.980 17.447 -3.486 1.00 0.00 H new ATOM 0 HD12 LEU B 28 13.348 17.899 -1.885 1.00 0.00 H new ATOM 0 HD13 LEU B 28 12.667 18.640 -3.353 1.00 0.00 H new ATOM 0 HD21 LEU B 28 15.357 18.920 -4.763 1.00 0.00 H new ATOM 0 HD22 LEU B 28 14.081 20.159 -4.739 1.00 0.00 H new ATOM 0 HD23 LEU B 28 15.730 20.571 -4.214 1.00 0.00 H new ATOM 2055 N GLY B 29 14.485 24.231 -1.477 1.00 0.00 N ATOM 2056 CA GLY B 29 13.955 25.449 -0.870 1.00 0.00 C ATOM 2057 C GLY B 29 12.470 25.653 -1.181 1.00 0.00 C ATOM 2058 O GLY B 29 11.800 24.738 -1.655 1.00 0.00 O ATOM 0 H GLY B 29 15.185 24.427 -2.192 1.00 0.00 H new ATOM 0 HA2 GLY B 29 14.095 25.405 0.210 1.00 0.00 H new ATOM 0 HA3 GLY B 29 14.521 26.308 -1.230 1.00 0.00 H new ATOM 2062 N ASP B 30 11.947 26.868 -0.970 1.00 0.00 N ATOM 2063 CA ASP B 30 10.532 27.207 -1.214 1.00 0.00 C ATOM 2064 C ASP B 30 10.126 27.082 -2.696 1.00 0.00 C ATOM 2065 O ASP B 30 8.955 27.182 -3.054 1.00 0.00 O ATOM 2066 CB ASP B 30 10.201 28.597 -0.661 1.00 0.00 C ATOM 2067 CG ASP B 30 8.686 28.879 -0.698 1.00 0.00 C ATOM 2068 OD1 ASP B 30 7.900 28.073 -0.148 1.00 0.00 O ATOM 2069 OD2 ASP B 30 8.286 29.946 -1.218 1.00 0.00 O ATOM 0 H ASP B 30 12.497 27.653 -0.622 1.00 0.00 H new ATOM 0 HA ASP B 30 9.938 26.469 -0.675 1.00 0.00 H new ATOM 0 HB2 ASP B 30 10.561 28.676 0.365 1.00 0.00 H new ATOM 0 HB3 ASP B 30 10.727 29.355 -1.242 1.00 0.00 H new ATOM 2074 N GLU B 31 11.096 26.854 -3.582 1.00 0.00 N ATOM 2075 CA GLU B 31 10.853 26.469 -4.969 1.00 0.00 C ATOM 2076 C GLU B 31 10.114 25.107 -5.008 1.00 0.00 C ATOM 2077 O GLU B 31 9.448 24.773 -5.988 1.00 0.00 O ATOM 2078 CB GLU B 31 12.222 26.444 -5.676 1.00 0.00 C ATOM 2079 CG GLU B 31 12.160 25.851 -7.085 1.00 0.00 C ATOM 2080 CD GLU B 31 13.485 25.884 -7.865 1.00 0.00 C ATOM 2081 OE1 GLU B 31 14.293 26.830 -7.720 1.00 0.00 O ATOM 2082 OE2 GLU B 31 13.692 24.952 -8.675 1.00 0.00 O ATOM 0 H GLU B 31 12.086 26.933 -3.351 1.00 0.00 H new ATOM 0 HA GLU B 31 10.206 27.175 -5.490 1.00 0.00 H new ATOM 0 HB2 GLU B 31 12.613 27.460 -5.733 1.00 0.00 H new ATOM 0 HB3 GLU B 31 12.924 25.865 -5.075 1.00 0.00 H new ATOM 0 HG2 GLU B 31 11.824 24.816 -7.013 1.00 0.00 H new ATOM 0 HG3 GLU B 31 11.406 26.391 -7.657 1.00 0.00 H new ATOM 2089 N TRP B 32 10.170 24.340 -3.916 1.00 0.00 N ATOM 2090 CA TRP B 32 9.661 22.988 -3.750 1.00 0.00 C ATOM 2091 C TRP B 32 8.827 22.893 -2.471 1.00 0.00 C ATOM 2092 O TRP B 32 8.718 23.864 -1.715 1.00 0.00 O ATOM 2093 CB TRP B 32 10.845 22.017 -3.672 1.00 0.00 C ATOM 2094 CG TRP B 32 11.834 22.106 -4.791 1.00 0.00 C ATOM 2095 CD1 TRP B 32 12.893 22.944 -4.833 1.00 0.00 C ATOM 2096 CD2 TRP B 32 11.871 21.358 -6.043 1.00 0.00 C ATOM 2097 NE1 TRP B 32 13.596 22.751 -6.003 1.00 0.00 N ATOM 2098 CE2 TRP B 32 13.008 21.787 -6.791 1.00 0.00 C ATOM 2099 CE3 TRP B 32 11.058 20.361 -6.627 1.00 0.00 C ATOM 2100 CZ2 TRP B 32 13.330 21.250 -8.043 1.00 0.00 C ATOM 2101 CZ3 TRP B 32 11.365 19.822 -7.891 1.00 0.00 C ATOM 2102 CH2 TRP B 32 12.500 20.261 -8.598 1.00 0.00 C ATOM 0 H TRP B 32 10.609 24.681 -3.061 1.00 0.00 H new ATOM 0 HA TRP B 32 9.027 22.731 -4.599 1.00 0.00 H new ATOM 0 HB2 TRP B 32 11.371 22.189 -2.733 1.00 0.00 H new ATOM 0 HB3 TRP B 32 10.455 21.000 -3.637 1.00 0.00 H new ATOM 0 HD1 TRP B 32 13.150 23.658 -4.065 1.00 0.00 H new ATOM 0 HE1 TRP B 32 14.445 23.258 -6.253 1.00 0.00 H new ATOM 0 HE3 TRP B 32 10.187 20.007 -6.095 1.00 0.00 H new ATOM 0 HZ2 TRP B 32 14.205 21.591 -8.576 1.00 0.00 H new ATOM 0 HZ3 TRP B 32 10.725 19.066 -8.321 1.00 0.00 H new ATOM 0 HH2 TRP B 32 12.733 19.839 -9.565 1.00 0.00 H new ATOM 2113 N LYS B 33 8.214 21.734 -2.220 1.00 0.00 N ATOM 2114 CA LYS B 33 7.579 21.416 -0.947 1.00 0.00 C ATOM 2115 C LYS B 33 7.614 19.903 -0.799 1.00 0.00 C ATOM 2116 O LYS B 33 7.221 19.195 -1.724 1.00 0.00 O ATOM 2117 CB LYS B 33 6.141 21.978 -0.897 1.00 0.00 C ATOM 2118 CG LYS B 33 5.685 22.340 0.525 1.00 0.00 C ATOM 2119 CD LYS B 33 5.121 21.142 1.304 1.00 0.00 C ATOM 2120 CE LYS B 33 5.181 21.398 2.816 1.00 0.00 C ATOM 2121 NZ LYS B 33 4.903 20.167 3.596 1.00 0.00 N ATOM 0 H LYS B 33 8.146 20.983 -2.907 1.00 0.00 H new ATOM 0 HA LYS B 33 8.108 21.879 -0.114 1.00 0.00 H new ATOM 0 HB2 LYS B 33 6.082 22.865 -1.528 1.00 0.00 H new ATOM 0 HB3 LYS B 33 5.455 21.242 -1.316 1.00 0.00 H new ATOM 0 HG2 LYS B 33 6.529 22.758 1.075 1.00 0.00 H new ATOM 0 HG3 LYS B 33 4.924 23.119 0.468 1.00 0.00 H new ATOM 0 HD2 LYS B 33 4.090 20.959 1.002 1.00 0.00 H new ATOM 0 HD3 LYS B 33 5.688 20.244 1.060 1.00 0.00 H new ATOM 0 HE2 LYS B 33 6.167 21.781 3.081 1.00 0.00 H new ATOM 0 HE3 LYS B 33 4.458 22.168 3.083 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 5.101 20.341 4.602 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 3.904 19.901 3.481 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 5.509 19.394 3.253 1.00 0.00 H new ATOM 2135 N VAL B 34 8.079 19.406 0.341 1.00 0.00 N ATOM 2136 CA VAL B 34 8.237 17.986 0.600 1.00 0.00 C ATOM 2137 C VAL B 34 7.113 17.513 1.527 1.00 0.00 C ATOM 2138 O VAL B 34 6.687 18.243 2.429 1.00 0.00 O ATOM 2139 CB VAL B 34 9.668 17.754 1.127 1.00 0.00 C ATOM 2140 CG1 VAL B 34 10.019 18.559 2.391 1.00 0.00 C ATOM 2141 CG2 VAL B 34 9.965 16.270 1.358 1.00 0.00 C ATOM 0 H VAL B 34 8.362 19.994 1.125 1.00 0.00 H new ATOM 0 HA VAL B 34 8.137 17.379 -0.300 1.00 0.00 H new ATOM 0 HB VAL B 34 10.308 18.129 0.329 1.00 0.00 H new ATOM 0 HG11 VAL B 34 11.042 18.336 2.692 1.00 0.00 H new ATOM 0 HG12 VAL B 34 9.927 19.625 2.181 1.00 0.00 H new ATOM 0 HG13 VAL B 34 9.336 18.288 3.196 1.00 0.00 H new ATOM 0 HG21 VAL B 34 10.984 16.156 1.729 1.00 0.00 H new ATOM 0 HG22 VAL B 34 9.265 15.869 2.091 1.00 0.00 H new ATOM 0 HG23 VAL B 34 9.858 15.727 0.419 1.00 0.00 H new ATOM 2151 N TYR B 35 6.639 16.286 1.314 1.00 0.00 N ATOM 2152 CA TYR B 35 5.728 15.572 2.197 1.00 0.00 C ATOM 2153 C TYR B 35 6.192 14.112 2.247 1.00 0.00 C ATOM 2154 O TYR B 35 6.842 13.640 1.311 1.00 0.00 O ATOM 2155 CB TYR B 35 4.296 15.699 1.658 1.00 0.00 C ATOM 2156 CG TYR B 35 3.212 15.300 2.643 1.00 0.00 C ATOM 2157 CD1 TYR B 35 2.756 13.969 2.707 1.00 0.00 C ATOM 2158 CD2 TYR B 35 2.647 16.270 3.493 1.00 0.00 C ATOM 2159 CE1 TYR B 35 1.728 13.611 3.597 1.00 0.00 C ATOM 2160 CE2 TYR B 35 1.624 15.921 4.391 1.00 0.00 C ATOM 2161 CZ TYR B 35 1.153 14.588 4.442 1.00 0.00 C ATOM 2162 OH TYR B 35 0.147 14.238 5.289 1.00 0.00 O ATOM 0 H TYR B 35 6.891 15.744 0.488 1.00 0.00 H new ATOM 0 HA TYR B 35 5.733 15.986 3.205 1.00 0.00 H new ATOM 0 HB2 TYR B 35 4.128 16.731 1.351 1.00 0.00 H new ATOM 0 HB3 TYR B 35 4.202 15.082 0.765 1.00 0.00 H new ATOM 0 HD1 TYR B 35 3.199 13.219 2.069 1.00 0.00 H new ATOM 0 HD2 TYR B 35 3.002 17.289 3.455 1.00 0.00 H new ATOM 0 HE1 TYR B 35 1.378 12.590 3.635 1.00 0.00 H new ATOM 0 HE2 TYR B 35 1.198 16.670 5.042 1.00 0.00 H new ATOM 0 HH TYR B 35 -0.138 15.024 5.801 1.00 0.00 H new ATOM 2172 N SER B 36 5.842 13.384 3.305 1.00 0.00 N ATOM 2173 CA SER B 36 6.281 12.011 3.519 1.00 0.00 C ATOM 2174 C SER B 36 5.142 11.258 4.207 1.00 0.00 C ATOM 2175 O SER B 36 4.503 11.814 5.107 1.00 0.00 O ATOM 2176 CB SER B 36 7.539 12.004 4.400 1.00 0.00 C ATOM 2177 OG SER B 36 8.509 12.954 4.019 1.00 0.00 O ATOM 0 H SER B 36 5.237 13.738 4.046 1.00 0.00 H new ATOM 0 HA SER B 36 6.526 11.530 2.572 1.00 0.00 H new ATOM 0 HB2 SER B 36 7.248 12.191 5.434 1.00 0.00 H new ATOM 0 HB3 SER B 36 7.986 11.010 4.370 1.00 0.00 H new ATOM 0 HG SER B 36 8.982 13.275 4.815 1.00 0.00 H new ATOM 2183 N ALA B 37 4.866 10.020 3.789 1.00 0.00 N ATOM 2184 CA ALA B 37 3.715 9.252 4.246 1.00 0.00 C ATOM 2185 C ALA B 37 3.995 7.743 4.197 1.00 0.00 C ATOM 2186 O ALA B 37 5.015 7.314 3.652 1.00 0.00 O ATOM 2187 CB ALA B 37 2.538 9.579 3.330 1.00 0.00 C ATOM 0 H ALA B 37 5.446 9.520 3.115 1.00 0.00 H new ATOM 0 HA ALA B 37 3.495 9.516 5.280 1.00 0.00 H new ATOM 0 HB1 ALA B 37 1.661 9.017 3.650 1.00 0.00 H new ATOM 0 HB2 ALA B 37 2.323 10.646 3.381 1.00 0.00 H new ATOM 0 HB3 ALA B 37 2.789 9.308 2.304 1.00 0.00 H new ATOM 2193 N GLY B 38 3.069 6.931 4.718 1.00 0.00 N ATOM 2194 CA GLY B 38 3.186 5.477 4.687 1.00 0.00 C ATOM 2195 C GLY B 38 1.950 4.767 5.239 1.00 0.00 C ATOM 2196 O GLY B 38 0.940 5.414 5.521 1.00 0.00 O ATOM 0 H GLY B 38 2.220 7.267 5.172 1.00 0.00 H new ATOM 0 HA2 GLY B 38 3.356 5.153 3.660 1.00 0.00 H new ATOM 0 HA3 GLY B 38 4.060 5.176 5.265 1.00 0.00 H new ATOM 2200 N ILE B 39 2.029 3.439 5.380 1.00 0.00 N ATOM 2201 CA ILE B 39 0.910 2.544 5.706 1.00 0.00 C ATOM 2202 C ILE B 39 0.135 2.959 6.965 1.00 0.00 C ATOM 2203 O ILE B 39 -1.078 3.162 6.904 1.00 0.00 O ATOM 2204 CB ILE B 39 1.383 1.066 5.767 1.00 0.00 C ATOM 2205 CG1 ILE B 39 0.288 0.150 6.368 1.00 0.00 C ATOM 2206 CG2 ILE B 39 2.725 0.834 6.491 1.00 0.00 C ATOM 2207 CD1 ILE B 39 0.271 -1.260 5.778 1.00 0.00 C ATOM 0 H ILE B 39 2.909 2.937 5.266 1.00 0.00 H new ATOM 0 HA ILE B 39 0.192 2.637 4.891 1.00 0.00 H new ATOM 0 HB ILE B 39 1.563 0.799 4.726 1.00 0.00 H new ATOM 0 HG12 ILE B 39 0.436 0.081 7.446 1.00 0.00 H new ATOM 0 HG13 ILE B 39 -0.686 0.612 6.209 1.00 0.00 H new ATOM 0 HG21 ILE B 39 2.966 -0.229 6.479 1.00 0.00 H new ATOM 0 HG22 ILE B 39 3.513 1.390 5.984 1.00 0.00 H new ATOM 0 HG23 ILE B 39 2.646 1.176 7.523 1.00 0.00 H new ATOM 0 HD11 ILE B 39 -0.522 -1.842 6.248 1.00 0.00 H new ATOM 0 HD12 ILE B 39 0.091 -1.203 4.704 1.00 0.00 H new ATOM 0 HD13 ILE B 39 1.231 -1.742 5.960 1.00 0.00 H new ATOM 2219 N GLU B 40 0.837 3.066 8.090 1.00 0.00 N ATOM 2220 CA GLU B 40 0.295 3.350 9.422 1.00 0.00 C ATOM 2221 C GLU B 40 1.146 4.466 10.055 1.00 0.00 C ATOM 2222 O GLU B 40 1.398 4.509 11.259 1.00 0.00 O ATOM 2223 CB GLU B 40 0.205 2.053 10.256 1.00 0.00 C ATOM 2224 CG GLU B 40 1.513 1.249 10.387 1.00 0.00 C ATOM 2225 CD GLU B 40 1.408 0.187 11.498 1.00 0.00 C ATOM 2226 OE1 GLU B 40 0.830 -0.899 11.262 1.00 0.00 O ATOM 2227 OE2 GLU B 40 1.918 0.416 12.619 1.00 0.00 O ATOM 0 H GLU B 40 1.851 2.952 8.101 1.00 0.00 H new ATOM 0 HA GLU B 40 -0.730 3.716 9.372 1.00 0.00 H new ATOM 0 HB2 GLU B 40 -0.143 2.310 11.256 1.00 0.00 H new ATOM 0 HB3 GLU B 40 -0.553 1.408 9.810 1.00 0.00 H new ATOM 0 HG2 GLU B 40 1.741 0.764 9.438 1.00 0.00 H new ATOM 0 HG3 GLU B 40 2.339 1.926 10.605 1.00 0.00 H new ATOM 2234 N ALA B 41 1.666 5.325 9.175 1.00 0.00 N ATOM 2235 CA ALA B 41 2.659 6.340 9.446 1.00 0.00 C ATOM 2236 C ALA B 41 2.139 7.449 10.362 1.00 0.00 C ATOM 2237 O ALA B 41 0.961 7.805 10.302 1.00 0.00 O ATOM 2238 CB ALA B 41 3.070 6.914 8.092 1.00 0.00 C ATOM 0 H ALA B 41 1.380 5.321 8.196 1.00 0.00 H new ATOM 0 HA ALA B 41 3.502 5.896 9.975 1.00 0.00 H new ATOM 0 HB1 ALA B 41 3.822 7.689 8.239 1.00 0.00 H new ATOM 0 HB2 ALA B 41 3.484 6.120 7.471 1.00 0.00 H new ATOM 0 HB3 ALA B 41 2.198 7.343 7.599 1.00 0.00 H new ATOM 2244 N HIS B 42 3.076 8.018 11.131 1.00 0.00 N ATOM 2245 CA HIS B 42 2.994 9.127 12.081 1.00 0.00 C ATOM 2246 C HIS B 42 4.005 8.762 13.166 1.00 0.00 C ATOM 2247 O HIS B 42 3.739 7.892 14.000 1.00 0.00 O ATOM 2248 CB HIS B 42 1.585 9.388 12.661 1.00 0.00 C ATOM 2249 CG HIS B 42 1.547 10.383 13.801 1.00 0.00 C ATOM 2250 ND1 HIS B 42 1.989 10.170 15.089 1.00 0.00 N ATOM 2251 CD2 HIS B 42 1.016 11.646 13.767 1.00 0.00 C ATOM 2252 CE1 HIS B 42 1.747 11.279 15.807 1.00 0.00 C ATOM 2253 NE2 HIS B 42 1.151 12.215 15.042 1.00 0.00 N ATOM 0 H HIS B 42 4.031 7.662 11.094 1.00 0.00 H new ATOM 0 HA HIS B 42 3.215 10.072 11.584 1.00 0.00 H new ATOM 0 HB2 HIS B 42 0.938 9.747 11.861 1.00 0.00 H new ATOM 0 HB3 HIS B 42 1.168 8.442 13.008 1.00 0.00 H new ATOM 0 HD2 HIS B 42 0.570 12.122 12.906 1.00 0.00 H new ATOM 0 HE1 HIS B 42 1.995 11.403 16.851 1.00 0.00 H new ATOM 0 HE2 HIS B 42 0.858 13.148 15.332 1.00 0.00 H new ATOM 2261 N GLY B 43 5.191 9.361 13.115 1.00 0.00 N ATOM 2262 CA GLY B 43 6.309 8.984 13.962 1.00 0.00 C ATOM 2263 C GLY B 43 7.508 9.874 13.668 1.00 0.00 C ATOM 2264 O GLY B 43 7.427 10.768 12.822 1.00 0.00 O ATOM 0 H GLY B 43 5.401 10.129 12.477 1.00 0.00 H new ATOM 0 HA2 GLY B 43 6.028 9.074 15.011 1.00 0.00 H new ATOM 0 HA3 GLY B 43 6.570 7.940 13.790 1.00 0.00 H new ATOM 2268 N LEU B 44 8.610 9.618 14.374 1.00 0.00 N ATOM 2269 CA LEU B 44 9.930 10.193 14.142 1.00 0.00 C ATOM 2270 C LEU B 44 10.917 9.276 14.859 1.00 0.00 C ATOM 2271 O LEU B 44 11.015 9.331 16.086 1.00 0.00 O ATOM 2272 CB LEU B 44 10.004 11.638 14.683 1.00 0.00 C ATOM 2273 CG LEU B 44 11.426 12.241 14.719 1.00 0.00 C ATOM 2274 CD1 LEU B 44 12.120 12.179 13.356 1.00 0.00 C ATOM 2275 CD2 LEU B 44 11.357 13.698 15.191 1.00 0.00 C ATOM 0 H LEU B 44 8.603 8.971 15.162 1.00 0.00 H new ATOM 0 HA LEU B 44 10.159 10.258 13.078 1.00 0.00 H new ATOM 0 HB2 LEU B 44 9.369 12.275 14.067 1.00 0.00 H new ATOM 0 HB3 LEU B 44 9.591 11.656 15.691 1.00 0.00 H new ATOM 0 HG LEU B 44 12.015 11.644 15.415 1.00 0.00 H new ATOM 0 HD11 LEU B 44 13.116 12.615 13.435 1.00 0.00 H new ATOM 0 HD12 LEU B 44 12.203 11.140 13.037 1.00 0.00 H new ATOM 0 HD13 LEU B 44 11.536 12.738 12.625 1.00 0.00 H new ATOM 0 HD21 LEU B 44 12.361 14.121 15.215 1.00 0.00 H new ATOM 0 HD22 LEU B 44 10.738 14.274 14.504 1.00 0.00 H new ATOM 0 HD23 LEU B 44 10.923 13.737 16.190 1.00 0.00 H new ATOM 2287 N ASN B 45 11.600 8.391 14.126 1.00 0.00 N ATOM 2288 CA ASN B 45 12.632 7.536 14.712 1.00 0.00 C ATOM 2289 C ASN B 45 13.745 8.429 15.293 1.00 0.00 C ATOM 2290 O ASN B 45 14.339 9.199 14.529 1.00 0.00 O ATOM 2291 CB ASN B 45 13.175 6.574 13.634 1.00 0.00 C ATOM 2292 CG ASN B 45 14.219 5.579 14.141 1.00 0.00 C ATOM 2293 OD1 ASN B 45 14.689 5.673 15.267 1.00 0.00 O ATOM 2294 ND2 ASN B 45 14.631 4.614 13.326 1.00 0.00 N ATOM 0 H ASN B 45 11.455 8.250 13.126 1.00 0.00 H new ATOM 0 HA ASN B 45 12.220 6.931 15.520 1.00 0.00 H new ATOM 0 HB2 ASN B 45 12.340 6.019 13.206 1.00 0.00 H new ATOM 0 HB3 ASN B 45 13.613 7.162 12.828 1.00 0.00 H new ATOM 0 HD21 ASN B 45 15.340 3.950 13.639 1.00 0.00 H new ATOM 0 HD22 ASN B 45 14.238 4.537 12.388 1.00 0.00 H new ATOM 2301 N PRO B 46 14.090 8.346 16.592 1.00 0.00 N ATOM 2302 CA PRO B 46 15.161 9.163 17.156 1.00 0.00 C ATOM 2303 C PRO B 46 16.515 8.874 16.497 1.00 0.00 C ATOM 2304 O PRO B 46 17.359 9.765 16.407 1.00 0.00 O ATOM 2305 CB PRO B 46 15.163 8.881 18.662 1.00 0.00 C ATOM 2306 CG PRO B 46 14.501 7.509 18.776 1.00 0.00 C ATOM 2307 CD PRO B 46 13.500 7.503 17.622 1.00 0.00 C ATOM 0 HA PRO B 46 14.989 10.223 16.966 1.00 0.00 H new ATOM 0 HB2 PRO B 46 16.175 8.872 19.066 1.00 0.00 H new ATOM 0 HB3 PRO B 46 14.607 9.640 19.212 1.00 0.00 H new ATOM 0 HG2 PRO B 46 15.228 6.703 18.681 1.00 0.00 H new ATOM 0 HG3 PRO B 46 14.006 7.380 19.738 1.00 0.00 H new ATOM 0 HD2 PRO B 46 13.333 6.491 17.253 1.00 0.00 H new ATOM 0 HD3 PRO B 46 12.532 7.891 17.940 1.00 0.00 H new ATOM 2315 N ASN B 47 16.726 7.670 15.958 1.00 0.00 N ATOM 2316 CA ASN B 47 17.911 7.384 15.157 1.00 0.00 C ATOM 2317 C ASN B 47 17.901 8.142 13.818 1.00 0.00 C ATOM 2318 O ASN B 47 18.976 8.467 13.330 1.00 0.00 O ATOM 2319 CB ASN B 47 18.078 5.870 14.975 1.00 0.00 C ATOM 2320 CG ASN B 47 18.838 5.532 13.712 1.00 0.00 C ATOM 2321 OD1 ASN B 47 20.064 5.507 13.679 1.00 0.00 O ATOM 2322 ND2 ASN B 47 18.097 5.271 12.654 1.00 0.00 N ATOM 0 H ASN B 47 16.089 6.880 16.064 1.00 0.00 H new ATOM 0 HA ASN B 47 18.784 7.751 15.697 1.00 0.00 H new ATOM 0 HB2 ASN B 47 18.604 5.457 15.836 1.00 0.00 H new ATOM 0 HB3 ASN B 47 17.096 5.398 14.945 1.00 0.00 H new ATOM 0 HD21 ASN B 47 18.541 5.037 11.766 1.00 0.00 H new ATOM 0 HD22 ASN B 47 17.080 5.302 12.723 1.00 0.00 H new ATOM 2329 N ALA B 48 16.748 8.489 13.226 1.00 0.00 N ATOM 2330 CA ALA B 48 16.730 9.369 12.051 1.00 0.00 C ATOM 2331 C ALA B 48 17.175 10.781 12.454 1.00 0.00 C ATOM 2332 O ALA B 48 17.861 11.466 11.695 1.00 0.00 O ATOM 2333 CB ALA B 48 15.323 9.460 11.450 1.00 0.00 C ATOM 0 H ALA B 48 15.828 8.178 13.538 1.00 0.00 H new ATOM 0 HA ALA B 48 17.410 8.949 11.310 1.00 0.00 H new ATOM 0 HB1 ALA B 48 15.340 10.118 10.581 1.00 0.00 H new ATOM 0 HB2 ALA B 48 14.992 8.467 11.146 1.00 0.00 H new ATOM 0 HB3 ALA B 48 14.634 9.860 12.195 1.00 0.00 H new ATOM 2339 N VAL B 49 16.796 11.211 13.662 1.00 0.00 N ATOM 2340 CA VAL B 49 17.277 12.478 14.219 1.00 0.00 C ATOM 2341 C VAL B 49 18.802 12.395 14.338 1.00 0.00 C ATOM 2342 O VAL B 49 19.491 13.245 13.776 1.00 0.00 O ATOM 2343 CB VAL B 49 16.600 12.849 15.560 1.00 0.00 C ATOM 2344 CG1 VAL B 49 16.954 14.288 15.964 1.00 0.00 C ATOM 2345 CG2 VAL B 49 15.069 12.739 15.511 1.00 0.00 C ATOM 0 H VAL B 49 16.158 10.700 14.272 1.00 0.00 H new ATOM 0 HA VAL B 49 17.003 13.289 13.545 1.00 0.00 H new ATOM 0 HB VAL B 49 16.977 12.132 16.289 1.00 0.00 H new ATOM 0 HG11 VAL B 49 16.469 14.530 16.909 1.00 0.00 H new ATOM 0 HG12 VAL B 49 18.034 14.379 16.077 1.00 0.00 H new ATOM 0 HG13 VAL B 49 16.611 14.977 15.193 1.00 0.00 H new ATOM 0 HG21 VAL B 49 14.653 13.012 16.481 1.00 0.00 H new ATOM 0 HG22 VAL B 49 14.680 13.412 14.747 1.00 0.00 H new ATOM 0 HG23 VAL B 49 14.785 11.715 15.270 1.00 0.00 H new ATOM 2355 N LYS B 50 19.346 11.342 14.967 1.00 0.00 N ATOM 2356 CA LYS B 50 20.795 11.122 15.038 1.00 0.00 C ATOM 2357 C LYS B 50 21.400 11.173 13.636 1.00 0.00 C ATOM 2358 O LYS B 50 22.362 11.907 13.426 1.00 0.00 O ATOM 2359 CB LYS B 50 21.107 9.788 15.744 1.00 0.00 C ATOM 2360 CG LYS B 50 22.615 9.489 15.838 1.00 0.00 C ATOM 2361 CD LYS B 50 22.867 8.110 16.470 1.00 0.00 C ATOM 2362 CE LYS B 50 24.344 7.684 16.415 1.00 0.00 C ATOM 2363 NZ LYS B 50 25.222 8.489 17.303 1.00 0.00 N ATOM 0 H LYS B 50 18.796 10.624 15.438 1.00 0.00 H new ATOM 0 HA LYS B 50 21.248 11.917 15.630 1.00 0.00 H new ATOM 0 HB2 LYS B 50 20.684 9.808 16.748 1.00 0.00 H new ATOM 0 HB3 LYS B 50 20.615 8.977 15.207 1.00 0.00 H new ATOM 0 HG2 LYS B 50 23.058 9.523 14.843 1.00 0.00 H new ATOM 0 HG3 LYS B 50 23.106 10.260 16.432 1.00 0.00 H new ATOM 0 HD2 LYS B 50 22.538 8.127 17.509 1.00 0.00 H new ATOM 0 HD3 LYS B 50 22.260 7.365 15.956 1.00 0.00 H new ATOM 0 HE2 LYS B 50 24.422 6.633 16.694 1.00 0.00 H new ATOM 0 HE3 LYS B 50 24.701 7.769 15.389 1.00 0.00 H new ATOM 0 HZ1 LYS B 50 26.213 8.374 17.008 1.00 0.00 H new ATOM 0 HZ2 LYS B 50 24.955 9.492 17.238 1.00 0.00 H new ATOM 0 HZ3 LYS B 50 25.113 8.165 18.285 1.00 0.00 H new ATOM 2377 N ALA B 51 20.800 10.465 12.678 1.00 0.00 N ATOM 2378 CA ALA B 51 21.264 10.374 11.305 1.00 0.00 C ATOM 2379 C ALA B 51 21.453 11.769 10.679 1.00 0.00 C ATOM 2380 O ALA B 51 22.358 11.960 9.868 1.00 0.00 O ATOM 2381 CB ALA B 51 20.297 9.526 10.480 1.00 0.00 C ATOM 0 H ALA B 51 19.952 9.925 12.848 1.00 0.00 H new ATOM 0 HA ALA B 51 22.240 9.888 11.306 1.00 0.00 H new ATOM 0 HB1 ALA B 51 20.654 9.464 9.452 1.00 0.00 H new ATOM 0 HB2 ALA B 51 20.238 8.524 10.905 1.00 0.00 H new ATOM 0 HB3 ALA B 51 19.308 9.984 10.494 1.00 0.00 H new ATOM 2387 N MET B 52 20.619 12.750 11.049 1.00 0.00 N ATOM 2388 CA MET B 52 20.716 14.124 10.575 1.00 0.00 C ATOM 2389 C MET B 52 21.722 14.926 11.391 1.00 0.00 C ATOM 2390 O MET B 52 22.478 15.710 10.817 1.00 0.00 O ATOM 2391 CB MET B 52 19.341 14.797 10.679 1.00 0.00 C ATOM 2392 CG MET B 52 18.321 14.224 9.696 1.00 0.00 C ATOM 2393 SD MET B 52 18.011 15.275 8.258 1.00 0.00 S ATOM 2394 CE MET B 52 19.568 15.133 7.346 1.00 0.00 C ATOM 0 H MET B 52 19.846 12.601 11.698 1.00 0.00 H new ATOM 0 HA MET B 52 21.053 14.100 9.539 1.00 0.00 H new ATOM 0 HB2 MET B 52 18.962 14.683 11.695 1.00 0.00 H new ATOM 0 HB3 MET B 52 19.451 15.866 10.498 1.00 0.00 H new ATOM 0 HG2 MET B 52 18.671 13.250 9.352 1.00 0.00 H new ATOM 0 HG3 MET B 52 17.380 14.058 10.221 1.00 0.00 H new ATOM 0 HE1 MET B 52 19.476 15.644 6.388 1.00 0.00 H new ATOM 0 HE2 MET B 52 20.372 15.589 7.925 1.00 0.00 H new ATOM 0 HE3 MET B 52 19.795 14.081 7.176 1.00 0.00 H new ATOM 2404 N LYS B 53 21.784 14.725 12.710 1.00 0.00 N ATOM 2405 CA LYS B 53 22.748 15.420 13.561 1.00 0.00 C ATOM 2406 C LYS B 53 24.179 15.068 13.150 1.00 0.00 C ATOM 2407 O LYS B 53 25.057 15.919 13.283 1.00 0.00 O ATOM 2408 CB LYS B 53 22.518 15.074 15.045 1.00 0.00 C ATOM 2409 CG LYS B 53 21.148 15.498 15.601 1.00 0.00 C ATOM 2410 CD LYS B 53 21.014 16.996 15.892 1.00 0.00 C ATOM 2411 CE LYS B 53 19.555 17.280 16.280 1.00 0.00 C ATOM 2412 NZ LYS B 53 19.340 18.664 16.758 1.00 0.00 N ATOM 0 H LYS B 53 21.173 14.082 13.213 1.00 0.00 H new ATOM 0 HA LYS B 53 22.602 16.492 13.432 1.00 0.00 H new ATOM 0 HB2 LYS B 53 22.629 13.997 15.174 1.00 0.00 H new ATOM 0 HB3 LYS B 53 23.299 15.549 15.640 1.00 0.00 H new ATOM 0 HG2 LYS B 53 20.376 15.209 14.888 1.00 0.00 H new ATOM 0 HG3 LYS B 53 20.956 14.944 16.520 1.00 0.00 H new ATOM 0 HD2 LYS B 53 21.686 17.288 16.699 1.00 0.00 H new ATOM 0 HD3 LYS B 53 21.295 17.580 15.016 1.00 0.00 H new ATOM 0 HE2 LYS B 53 18.914 17.096 15.418 1.00 0.00 H new ATOM 0 HE3 LYS B 53 19.250 16.581 17.059 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 18.361 18.952 16.558 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 19.511 18.708 17.783 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 19.997 19.306 16.270 1.00 0.00 H new ATOM 2426 N GLU B 54 24.418 13.873 12.592 1.00 0.00 N ATOM 2427 CA GLU B 54 25.732 13.478 12.080 1.00 0.00 C ATOM 2428 C GLU B 54 26.234 14.436 10.992 1.00 0.00 C ATOM 2429 O GLU B 54 27.444 14.611 10.840 1.00 0.00 O ATOM 2430 CB GLU B 54 25.708 12.051 11.510 1.00 0.00 C ATOM 2431 CG GLU B 54 25.548 10.958 12.572 1.00 0.00 C ATOM 2432 CD GLU B 54 25.725 9.571 11.947 1.00 0.00 C ATOM 2433 OE1 GLU B 54 26.874 9.078 11.873 1.00 0.00 O ATOM 2434 OE2 GLU B 54 24.745 8.998 11.428 1.00 0.00 O ATOM 0 H GLU B 54 23.703 13.154 12.484 1.00 0.00 H new ATOM 0 HA GLU B 54 26.413 13.518 12.930 1.00 0.00 H new ATOM 0 HB2 GLU B 54 24.890 11.970 10.794 1.00 0.00 H new ATOM 0 HB3 GLU B 54 26.632 11.875 10.959 1.00 0.00 H new ATOM 0 HG2 GLU B 54 26.283 11.103 13.364 1.00 0.00 H new ATOM 0 HG3 GLU B 54 24.563 11.032 13.033 1.00 0.00 H new ATOM 2441 N VAL B 55 25.318 15.077 10.261 1.00 0.00 N ATOM 2442 CA VAL B 55 25.611 16.005 9.171 1.00 0.00 C ATOM 2443 C VAL B 55 25.119 17.423 9.508 1.00 0.00 C ATOM 2444 O VAL B 55 25.066 18.292 8.637 1.00 0.00 O ATOM 2445 CB VAL B 55 25.063 15.427 7.848 1.00 0.00 C ATOM 2446 CG1 VAL B 55 25.751 14.081 7.550 1.00 0.00 C ATOM 2447 CG2 VAL B 55 23.536 15.240 7.854 1.00 0.00 C ATOM 0 H VAL B 55 24.317 14.958 10.419 1.00 0.00 H new ATOM 0 HA VAL B 55 26.687 16.113 9.038 1.00 0.00 H new ATOM 0 HB VAL B 55 25.287 16.154 7.067 1.00 0.00 H new ATOM 0 HG11 VAL B 55 25.364 13.673 6.616 1.00 0.00 H new ATOM 0 HG12 VAL B 55 26.827 14.234 7.461 1.00 0.00 H new ATOM 0 HG13 VAL B 55 25.550 13.382 8.362 1.00 0.00 H new ATOM 0 HG21 VAL B 55 23.216 14.831 6.896 1.00 0.00 H new ATOM 0 HG22 VAL B 55 23.257 14.553 8.653 1.00 0.00 H new ATOM 0 HG23 VAL B 55 23.052 16.203 8.017 1.00 0.00 H new ATOM 2457 N GLY B 56 24.791 17.673 10.781 1.00 0.00 N ATOM 2458 CA GLY B 56 24.439 18.988 11.286 1.00 0.00 C ATOM 2459 C GLY B 56 23.103 19.501 10.751 1.00 0.00 C ATOM 2460 O GLY B 56 22.990 20.705 10.509 1.00 0.00 O ATOM 0 H GLY B 56 24.765 16.946 11.496 1.00 0.00 H new ATOM 0 HA2 GLY B 56 24.398 18.953 12.375 1.00 0.00 H new ATOM 0 HA3 GLY B 56 25.225 19.695 11.020 1.00 0.00 H new ATOM 2464 N ILE B 57 22.099 18.633 10.561 1.00 0.00 N ATOM 2465 CA ILE B 57 20.734 19.070 10.263 1.00 0.00 C ATOM 2466 C ILE B 57 19.904 18.673 11.490 1.00 0.00 C ATOM 2467 O ILE B 57 20.210 17.686 12.166 1.00 0.00 O ATOM 2468 CB ILE B 57 20.255 18.484 8.909 1.00 0.00 C ATOM 2469 CG1 ILE B 57 21.104 19.078 7.757 1.00 0.00 C ATOM 2470 CG2 ILE B 57 18.757 18.747 8.655 1.00 0.00 C ATOM 2471 CD1 ILE B 57 20.743 18.609 6.340 1.00 0.00 C ATOM 0 H ILE B 57 22.211 17.620 10.609 1.00 0.00 H new ATOM 0 HA ILE B 57 20.639 20.145 10.113 1.00 0.00 H new ATOM 0 HB ILE B 57 20.388 17.403 8.950 1.00 0.00 H new ATOM 0 HG12 ILE B 57 21.017 20.164 7.791 1.00 0.00 H new ATOM 0 HG13 ILE B 57 22.151 18.836 7.942 1.00 0.00 H new ATOM 0 HG21 ILE B 57 18.470 18.318 7.695 1.00 0.00 H new ATOM 0 HG22 ILE B 57 18.167 18.288 9.449 1.00 0.00 H new ATOM 0 HG23 ILE B 57 18.573 19.821 8.641 1.00 0.00 H new ATOM 0 HD11 ILE B 57 21.403 19.090 5.618 1.00 0.00 H new ATOM 0 HD12 ILE B 57 20.860 17.527 6.274 1.00 0.00 H new ATOM 0 HD13 ILE B 57 19.709 18.876 6.121 1.00 0.00 H new ATOM 2483 N ASP B 58 18.860 19.445 11.792 1.00 0.00 N ATOM 2484 CA ASP B 58 17.952 19.183 12.902 1.00 0.00 C ATOM 2485 C ASP B 58 16.560 18.921 12.349 1.00 0.00 C ATOM 2486 O ASP B 58 16.095 19.640 11.461 1.00 0.00 O ATOM 2487 CB ASP B 58 17.897 20.369 13.872 1.00 0.00 C ATOM 2488 CG ASP B 58 16.813 20.131 14.935 1.00 0.00 C ATOM 2489 OD1 ASP B 58 16.822 19.032 15.541 1.00 0.00 O ATOM 2490 OD2 ASP B 58 15.961 21.019 15.152 1.00 0.00 O ATOM 0 H ASP B 58 18.620 20.283 11.262 1.00 0.00 H new ATOM 0 HA ASP B 58 18.317 18.314 13.450 1.00 0.00 H new ATOM 0 HB2 ASP B 58 18.866 20.501 14.353 1.00 0.00 H new ATOM 0 HB3 ASP B 58 17.685 21.287 13.324 1.00 0.00 H new ATOM 2495 N ILE B 59 15.899 17.909 12.907 1.00 0.00 N ATOM 2496 CA ILE B 59 14.531 17.527 12.581 1.00 0.00 C ATOM 2497 C ILE B 59 13.755 17.151 13.845 1.00 0.00 C ATOM 2498 O ILE B 59 12.725 16.489 13.744 1.00 0.00 O ATOM 2499 CB ILE B 59 14.503 16.368 11.563 1.00 0.00 C ATOM 2500 CG1 ILE B 59 15.213 15.099 12.091 1.00 0.00 C ATOM 2501 CG2 ILE B 59 15.127 16.789 10.222 1.00 0.00 C ATOM 2502 CD1 ILE B 59 14.834 13.849 11.297 1.00 0.00 C ATOM 0 H ILE B 59 16.317 17.314 13.622 1.00 0.00 H new ATOM 0 HA ILE B 59 14.046 18.389 12.123 1.00 0.00 H new ATOM 0 HB ILE B 59 13.452 16.124 11.409 1.00 0.00 H new ATOM 0 HG12 ILE B 59 16.292 15.243 12.044 1.00 0.00 H new ATOM 0 HG13 ILE B 59 14.957 14.952 13.140 1.00 0.00 H new ATOM 0 HG21 ILE B 59 15.093 15.951 9.526 1.00 0.00 H new ATOM 0 HG22 ILE B 59 14.568 17.628 9.808 1.00 0.00 H new ATOM 0 HG23 ILE B 59 16.164 17.087 10.381 1.00 0.00 H new ATOM 0 HD11 ILE B 59 15.358 12.985 11.706 1.00 0.00 H new ATOM 0 HD12 ILE B 59 13.758 13.687 11.366 1.00 0.00 H new ATOM 0 HD13 ILE B 59 15.115 13.982 10.252 1.00 0.00 H new ATOM 2514 N SER B 60 14.233 17.524 15.036 1.00 0.00 N ATOM 2515 CA SER B 60 13.680 17.030 16.296 1.00 0.00 C ATOM 2516 C SER B 60 12.181 17.348 16.483 1.00 0.00 C ATOM 2517 O SER B 60 11.530 16.755 17.345 1.00 0.00 O ATOM 2518 CB SER B 60 14.512 17.583 17.460 1.00 0.00 C ATOM 2519 OG SER B 60 15.897 17.340 17.271 1.00 0.00 O ATOM 0 H SER B 60 15.011 18.174 15.151 1.00 0.00 H new ATOM 0 HA SER B 60 13.741 15.942 16.274 1.00 0.00 H new ATOM 0 HB2 SER B 60 14.339 18.655 17.555 1.00 0.00 H new ATOM 0 HB3 SER B 60 14.185 17.124 18.393 1.00 0.00 H new ATOM 0 HG SER B 60 16.254 17.975 16.616 1.00 0.00 H new ATOM 2525 N ASN B 61 11.627 18.270 15.684 1.00 0.00 N ATOM 2526 CA ASN B 61 10.228 18.671 15.706 1.00 0.00 C ATOM 2527 C ASN B 61 9.342 17.861 14.742 1.00 0.00 C ATOM 2528 O ASN B 61 8.119 17.938 14.856 1.00 0.00 O ATOM 2529 CB ASN B 61 10.144 20.170 15.365 1.00 0.00 C ATOM 2530 CG ASN B 61 8.719 20.710 15.481 1.00 0.00 C ATOM 2531 OD1 ASN B 61 8.137 20.735 16.561 1.00 0.00 O ATOM 2532 ND2 ASN B 61 8.135 21.170 14.385 1.00 0.00 N ATOM 0 H ASN B 61 12.168 18.772 14.980 1.00 0.00 H new ATOM 0 HA ASN B 61 9.844 18.472 16.706 1.00 0.00 H new ATOM 0 HB2 ASN B 61 10.798 20.730 16.033 1.00 0.00 H new ATOM 0 HB3 ASN B 61 10.510 20.331 14.351 1.00 0.00 H new ATOM 0 HD21 ASN B 61 7.190 21.551 14.432 1.00 0.00 H new ATOM 0 HD22 ASN B 61 8.630 21.143 13.494 1.00 0.00 H new ATOM 2539 N GLN B 62 9.915 17.130 13.773 1.00 0.00 N ATOM 2540 CA GLN B 62 9.167 16.508 12.689 1.00 0.00 C ATOM 2541 C GLN B 62 8.051 15.558 13.139 1.00 0.00 C ATOM 2542 O GLN B 62 8.126 14.891 14.173 1.00 0.00 O ATOM 2543 CB GLN B 62 10.099 15.806 11.698 1.00 0.00 C ATOM 2544 CG GLN B 62 10.754 16.860 10.801 1.00 0.00 C ATOM 2545 CD GLN B 62 11.540 16.264 9.642 1.00 0.00 C ATOM 2546 OE1 GLN B 62 11.575 15.064 9.400 1.00 0.00 O ATOM 2547 NE2 GLN B 62 12.210 17.128 8.906 1.00 0.00 N ATOM 0 H GLN B 62 10.919 16.958 13.727 1.00 0.00 H new ATOM 0 HA GLN B 62 8.664 17.338 12.192 1.00 0.00 H new ATOM 0 HB2 GLN B 62 10.861 15.240 12.234 1.00 0.00 H new ATOM 0 HB3 GLN B 62 9.538 15.093 11.094 1.00 0.00 H new ATOM 0 HG2 GLN B 62 9.982 17.520 10.405 1.00 0.00 H new ATOM 0 HG3 GLN B 62 11.421 17.476 11.404 1.00 0.00 H new ATOM 0 HE21 GLN B 62 12.168 18.124 9.123 1.00 0.00 H new ATOM 0 HE22 GLN B 62 12.770 16.801 8.119 1.00 0.00 H new ATOM 2556 N THR B 63 7.043 15.478 12.274 1.00 0.00 N ATOM 2557 CA THR B 63 5.838 14.662 12.382 1.00 0.00 C ATOM 2558 C THR B 63 5.587 13.942 11.043 1.00 0.00 C ATOM 2559 O THR B 63 6.285 14.196 10.054 1.00 0.00 O ATOM 2560 CB THR B 63 4.661 15.583 12.781 1.00 0.00 C ATOM 2561 OG1 THR B 63 4.499 16.655 11.865 1.00 0.00 O ATOM 2562 CG2 THR B 63 4.910 16.228 14.146 1.00 0.00 C ATOM 0 H THR B 63 7.049 16.025 11.413 1.00 0.00 H new ATOM 0 HA THR B 63 5.948 13.894 13.148 1.00 0.00 H new ATOM 0 HB THR B 63 3.776 14.947 12.793 1.00 0.00 H new ATOM 0 HG1 THR B 63 3.746 17.215 12.147 1.00 0.00 H new ATOM 0 HG21 THR B 63 4.068 16.871 14.404 1.00 0.00 H new ATOM 0 HG22 THR B 63 5.017 15.450 14.902 1.00 0.00 H new ATOM 0 HG23 THR B 63 5.822 16.823 14.106 1.00 0.00 H new ATOM 2570 N SER B 64 4.592 13.050 10.977 1.00 0.00 N ATOM 2571 CA SER B 64 4.145 12.407 9.739 1.00 0.00 C ATOM 2572 C SER B 64 2.668 12.014 9.870 1.00 0.00 C ATOM 2573 O SER B 64 2.021 12.345 10.864 1.00 0.00 O ATOM 2574 CB SER B 64 5.016 11.185 9.413 1.00 0.00 C ATOM 2575 OG SER B 64 6.382 11.522 9.432 1.00 0.00 O ATOM 0 H SER B 64 4.066 12.750 11.798 1.00 0.00 H new ATOM 0 HA SER B 64 4.249 13.111 8.914 1.00 0.00 H new ATOM 0 HB2 SER B 64 4.823 10.393 10.136 1.00 0.00 H new ATOM 0 HB3 SER B 64 4.748 10.794 8.432 1.00 0.00 H new ATOM 0 HG SER B 64 6.556 12.218 8.765 1.00 0.00 H new ATOM 2581 N ASP B 65 2.141 11.302 8.875 1.00 0.00 N ATOM 2582 CA ASP B 65 0.753 10.865 8.767 1.00 0.00 C ATOM 2583 C ASP B 65 0.693 9.722 7.747 1.00 0.00 C ATOM 2584 O ASP B 65 1.667 9.508 7.016 1.00 0.00 O ATOM 2585 CB ASP B 65 -0.116 12.031 8.274 1.00 0.00 C ATOM 2586 CG ASP B 65 -1.624 11.731 8.362 1.00 0.00 C ATOM 2587 OD1 ASP B 65 -2.033 10.902 9.204 1.00 0.00 O ATOM 2588 OD2 ASP B 65 -2.411 12.363 7.624 1.00 0.00 O ATOM 0 H ASP B 65 2.703 10.999 8.080 1.00 0.00 H new ATOM 0 HA ASP B 65 0.385 10.532 9.737 1.00 0.00 H new ATOM 0 HB2 ASP B 65 0.108 12.920 8.864 1.00 0.00 H new ATOM 0 HB3 ASP B 65 0.144 12.261 7.241 1.00 0.00 H new ATOM 2593 N ILE B 66 -0.429 9.006 7.667 1.00 0.00 N ATOM 2594 CA ILE B 66 -0.678 7.984 6.658 1.00 0.00 C ATOM 2595 C ILE B 66 -0.707 8.578 5.244 1.00 0.00 C ATOM 2596 O ILE B 66 -0.749 9.803 5.088 1.00 0.00 O ATOM 2597 CB ILE B 66 -1.993 7.247 6.980 1.00 0.00 C ATOM 2598 CG1 ILE B 66 -3.171 8.217 7.209 1.00 0.00 C ATOM 2599 CG2 ILE B 66 -1.763 6.317 8.180 1.00 0.00 C ATOM 2600 CD1 ILE B 66 -4.529 7.523 7.299 1.00 0.00 C ATOM 0 H ILE B 66 -1.205 9.125 8.318 1.00 0.00 H new ATOM 0 HA ILE B 66 0.144 7.269 6.682 1.00 0.00 H new ATOM 0 HB ILE B 66 -2.280 6.647 6.116 1.00 0.00 H new ATOM 0 HG12 ILE B 66 -2.997 8.776 8.129 1.00 0.00 H new ATOM 0 HG13 ILE B 66 -3.197 8.942 6.396 1.00 0.00 H new ATOM 0 HG21 ILE B 66 -2.688 5.791 8.415 1.00 0.00 H new ATOM 0 HG22 ILE B 66 -0.986 5.593 7.935 1.00 0.00 H new ATOM 0 HG23 ILE B 66 -1.451 6.906 9.042 1.00 0.00 H new ATOM 0 HD11 ILE B 66 -5.308 8.268 7.460 1.00 0.00 H new ATOM 0 HD12 ILE B 66 -4.726 6.987 6.371 1.00 0.00 H new ATOM 0 HD13 ILE B 66 -4.523 6.818 8.130 1.00 0.00 H new ATOM 2612 N ILE B 67 -0.703 7.710 4.216 1.00 0.00 N ATOM 2613 CA ILE B 67 -0.874 8.129 2.830 1.00 0.00 C ATOM 2614 C ILE B 67 -2.085 9.066 2.732 1.00 0.00 C ATOM 2615 O ILE B 67 -3.137 8.820 3.330 1.00 0.00 O ATOM 2616 CB ILE B 67 -0.881 6.954 1.809 1.00 0.00 C ATOM 2617 CG1 ILE B 67 -2.275 6.362 1.486 1.00 0.00 C ATOM 2618 CG2 ILE B 67 0.130 5.852 2.188 1.00 0.00 C ATOM 2619 CD1 ILE B 67 -2.300 5.501 0.213 1.00 0.00 C ATOM 0 H ILE B 67 -0.581 6.704 4.331 1.00 0.00 H new ATOM 0 HA ILE B 67 0.009 8.692 2.529 1.00 0.00 H new ATOM 0 HB ILE B 67 -0.557 7.414 0.876 1.00 0.00 H new ATOM 0 HG12 ILE B 67 -2.608 5.757 2.330 1.00 0.00 H new ATOM 0 HG13 ILE B 67 -2.990 7.177 1.377 1.00 0.00 H new ATOM 0 HG21 ILE B 67 0.091 5.052 1.448 1.00 0.00 H new ATOM 0 HG22 ILE B 67 1.135 6.273 2.214 1.00 0.00 H new ATOM 0 HG23 ILE B 67 -0.121 5.450 3.170 1.00 0.00 H new ATOM 0 HD11 ILE B 67 -3.309 5.121 0.051 1.00 0.00 H new ATOM 0 HD12 ILE B 67 -1.999 6.107 -0.642 1.00 0.00 H new ATOM 0 HD13 ILE B 67 -1.611 4.664 0.326 1.00 0.00 H new ATOM 2631 N ASP B 68 -1.909 10.147 1.985 1.00 0.00 N ATOM 2632 CA ASP B 68 -2.850 11.252 1.898 1.00 0.00 C ATOM 2633 C ASP B 68 -2.876 11.741 0.461 1.00 0.00 C ATOM 2634 O ASP B 68 -1.998 12.474 -0.008 1.00 0.00 O ATOM 2635 CB ASP B 68 -2.517 12.378 2.885 1.00 0.00 C ATOM 2636 CG ASP B 68 -3.662 13.410 2.953 1.00 0.00 C ATOM 2637 OD1 ASP B 68 -4.365 13.629 1.940 1.00 0.00 O ATOM 2638 OD2 ASP B 68 -3.890 13.977 4.045 1.00 0.00 O ATOM 0 H ASP B 68 -1.081 10.282 1.405 1.00 0.00 H new ATOM 0 HA ASP B 68 -3.843 10.905 2.183 1.00 0.00 H new ATOM 0 HB2 ASP B 68 -2.342 11.958 3.876 1.00 0.00 H new ATOM 0 HB3 ASP B 68 -1.595 12.872 2.580 1.00 0.00 H new ATOM 2643 N SER B 69 -3.896 11.268 -0.240 1.00 0.00 N ATOM 2644 CA SER B 69 -4.202 11.567 -1.619 1.00 0.00 C ATOM 2645 C SER B 69 -4.247 13.059 -1.935 1.00 0.00 C ATOM 2646 O SER B 69 -3.962 13.431 -3.072 1.00 0.00 O ATOM 2647 CB SER B 69 -5.556 10.924 -1.924 1.00 0.00 C ATOM 2648 OG SER B 69 -5.590 9.588 -1.435 1.00 0.00 O ATOM 0 H SER B 69 -4.572 10.624 0.172 1.00 0.00 H new ATOM 0 HA SER B 69 -3.402 11.168 -2.243 1.00 0.00 H new ATOM 0 HB2 SER B 69 -6.355 11.507 -1.465 1.00 0.00 H new ATOM 0 HB3 SER B 69 -5.735 10.930 -2.999 1.00 0.00 H new ATOM 0 HG SER B 69 -6.457 9.184 -1.648 1.00 0.00 H new ATOM 2654 N ASP B 70 -4.575 13.927 -0.975 1.00 0.00 N ATOM 2655 CA ASP B 70 -4.800 15.341 -1.262 1.00 0.00 C ATOM 2656 C ASP B 70 -3.483 16.037 -1.578 1.00 0.00 C ATOM 2657 O ASP B 70 -3.467 17.018 -2.318 1.00 0.00 O ATOM 2658 CB ASP B 70 -5.523 16.047 -0.112 1.00 0.00 C ATOM 2659 CG ASP B 70 -5.809 17.520 -0.454 1.00 0.00 C ATOM 2660 OD1 ASP B 70 -6.665 17.785 -1.327 1.00 0.00 O ATOM 2661 OD2 ASP B 70 -5.219 18.419 0.186 1.00 0.00 O ATOM 0 H ASP B 70 -4.690 13.673 0.006 1.00 0.00 H new ATOM 0 HA ASP B 70 -5.447 15.400 -2.137 1.00 0.00 H new ATOM 0 HB2 ASP B 70 -6.460 15.532 0.102 1.00 0.00 H new ATOM 0 HB3 ASP B 70 -4.915 15.992 0.791 1.00 0.00 H new ATOM 2666 N ILE B 71 -2.370 15.474 -1.103 1.00 0.00 N ATOM 2667 CA ILE B 71 -1.040 15.962 -1.402 1.00 0.00 C ATOM 2668 C ILE B 71 -0.360 15.030 -2.410 1.00 0.00 C ATOM 2669 O ILE B 71 0.365 15.529 -3.267 1.00 0.00 O ATOM 2670 CB ILE B 71 -0.187 16.185 -0.126 1.00 0.00 C ATOM 2671 CG1 ILE B 71 -0.688 15.611 1.220 1.00 0.00 C ATOM 2672 CG2 ILE B 71 0.195 17.668 0.002 1.00 0.00 C ATOM 2673 CD1 ILE B 71 -1.879 16.303 1.895 1.00 0.00 C ATOM 0 H ILE B 71 -2.377 14.657 -0.493 1.00 0.00 H new ATOM 0 HA ILE B 71 -1.133 16.947 -1.858 1.00 0.00 H new ATOM 0 HB ILE B 71 0.685 15.557 -0.308 1.00 0.00 H new ATOM 0 HG12 ILE B 71 -0.955 14.566 1.060 1.00 0.00 H new ATOM 0 HG13 ILE B 71 0.147 15.623 1.920 1.00 0.00 H new ATOM 0 HG21 ILE B 71 0.794 17.813 0.901 1.00 0.00 H new ATOM 0 HG22 ILE B 71 0.772 17.972 -0.871 1.00 0.00 H new ATOM 0 HG23 ILE B 71 -0.710 18.272 0.067 1.00 0.00 H new ATOM 0 HD11 ILE B 71 -2.117 15.791 2.828 1.00 0.00 H new ATOM 0 HD12 ILE B 71 -1.625 17.342 2.106 1.00 0.00 H new ATOM 0 HD13 ILE B 71 -2.743 16.269 1.232 1.00 0.00 H new ATOM 2685 N LEU B 72 -0.620 13.713 -2.377 1.00 0.00 N ATOM 2686 CA LEU B 72 -0.006 12.778 -3.325 1.00 0.00 C ATOM 2687 C LEU B 72 -0.446 13.127 -4.742 1.00 0.00 C ATOM 2688 O LEU B 72 0.404 13.346 -5.598 1.00 0.00 O ATOM 2689 CB LEU B 72 -0.386 11.329 -2.980 1.00 0.00 C ATOM 2690 CG LEU B 72 0.385 10.191 -3.696 1.00 0.00 C ATOM 2691 CD1 LEU B 72 0.326 10.182 -5.225 1.00 0.00 C ATOM 2692 CD2 LEU B 72 1.841 10.121 -3.253 1.00 0.00 C ATOM 0 H LEU B 72 -1.250 13.275 -1.705 1.00 0.00 H new ATOM 0 HA LEU B 72 1.079 12.864 -3.258 1.00 0.00 H new ATOM 0 HB2 LEU B 72 -0.259 11.196 -1.906 1.00 0.00 H new ATOM 0 HB3 LEU B 72 -1.447 11.201 -3.193 1.00 0.00 H new ATOM 0 HG LEU B 72 -0.161 9.304 -3.375 1.00 0.00 H new ATOM 0 HD11 LEU B 72 0.903 9.340 -5.606 1.00 0.00 H new ATOM 0 HD12 LEU B 72 -0.711 10.088 -5.549 1.00 0.00 H new ATOM 0 HD13 LEU B 72 0.743 11.112 -5.611 1.00 0.00 H new ATOM 0 HD21 LEU B 72 2.343 9.310 -3.780 1.00 0.00 H new ATOM 0 HD22 LEU B 72 2.337 11.064 -3.482 1.00 0.00 H new ATOM 0 HD23 LEU B 72 1.886 9.939 -2.179 1.00 0.00 H new ATOM 2704 N ASN B 73 -1.760 13.236 -4.990 1.00 0.00 N ATOM 2705 CA ASN B 73 -2.285 13.493 -6.337 1.00 0.00 C ATOM 2706 C ASN B 73 -1.723 14.812 -6.906 1.00 0.00 C ATOM 2707 O ASN B 73 -1.602 14.964 -8.120 1.00 0.00 O ATOM 2708 CB ASN B 73 -3.830 13.530 -6.350 1.00 0.00 C ATOM 2709 CG ASN B 73 -4.408 14.936 -6.188 1.00 0.00 C ATOM 2710 OD1 ASN B 73 -4.741 15.606 -7.160 1.00 0.00 O ATOM 2711 ND2 ASN B 73 -4.503 15.425 -4.966 1.00 0.00 N ATOM 0 H ASN B 73 -2.479 13.150 -4.272 1.00 0.00 H new ATOM 0 HA ASN B 73 -1.959 12.668 -6.970 1.00 0.00 H new ATOM 0 HB2 ASN B 73 -4.188 13.105 -7.288 1.00 0.00 H new ATOM 0 HB3 ASN B 73 -4.207 12.896 -5.548 1.00 0.00 H new ATOM 0 HD21 ASN B 73 -4.857 16.371 -4.821 1.00 0.00 H new ATOM 0 HD22 ASN B 73 -4.223 14.857 -4.166 1.00 0.00 H new ATOM 2718 N ASN B 74 -1.404 15.767 -6.019 1.00 0.00 N ATOM 2719 CA ASN B 74 -0.890 17.091 -6.344 1.00 0.00 C ATOM 2720 C ASN B 74 0.635 17.114 -6.484 1.00 0.00 C ATOM 2721 O ASN B 74 1.179 18.120 -6.946 1.00 0.00 O ATOM 2722 CB ASN B 74 -1.323 18.106 -5.263 1.00 0.00 C ATOM 2723 CG ASN B 74 -2.699 18.700 -5.549 1.00 0.00 C ATOM 2724 OD1 ASN B 74 -2.919 19.306 -6.595 1.00 0.00 O ATOM 2725 ND2 ASN B 74 -3.654 18.554 -4.644 1.00 0.00 N ATOM 0 H ASN B 74 -1.504 15.624 -5.014 1.00 0.00 H new ATOM 0 HA ASN B 74 -1.312 17.366 -7.311 1.00 0.00 H new ATOM 0 HB2 ASN B 74 -1.336 17.615 -4.290 1.00 0.00 H new ATOM 0 HB3 ASN B 74 -0.588 18.908 -5.205 1.00 0.00 H new ATOM 0 HD21 ASN B 74 -4.581 18.946 -4.812 1.00 0.00 H new ATOM 0 HD22 ASN B 74 -3.463 18.050 -3.778 1.00 0.00 H new ATOM 2732 N ALA B 75 1.341 16.058 -6.065 1.00 0.00 N ATOM 2733 CA ALA B 75 2.782 15.971 -6.176 1.00 0.00 C ATOM 2734 C ALA B 75 3.200 15.891 -7.643 1.00 0.00 C ATOM 2735 O ALA B 75 2.407 15.572 -8.531 1.00 0.00 O ATOM 2736 CB ALA B 75 3.313 14.784 -5.359 1.00 0.00 C ATOM 0 H ALA B 75 0.914 15.237 -5.636 1.00 0.00 H new ATOM 0 HA ALA B 75 3.226 16.875 -5.760 1.00 0.00 H new ATOM 0 HB1 ALA B 75 4.398 14.733 -5.454 1.00 0.00 H new ATOM 0 HB2 ALA B 75 3.046 14.916 -4.310 1.00 0.00 H new ATOM 0 HB3 ALA B 75 2.873 13.859 -5.732 1.00 0.00 H new ATOM 2742 N ASP B 76 4.476 16.175 -7.876 1.00 0.00 N ATOM 2743 CA ASP B 76 5.138 15.947 -9.158 1.00 0.00 C ATOM 2744 C ASP B 76 5.766 14.554 -9.183 1.00 0.00 C ATOM 2745 O ASP B 76 5.755 13.898 -10.225 1.00 0.00 O ATOM 2746 CB ASP B 76 6.234 16.992 -9.396 1.00 0.00 C ATOM 2747 CG ASP B 76 6.931 16.753 -10.744 1.00 0.00 C ATOM 2748 OD1 ASP B 76 6.325 17.045 -11.801 1.00 0.00 O ATOM 2749 OD2 ASP B 76 8.102 16.314 -10.754 1.00 0.00 O ATOM 0 H ASP B 76 5.091 16.577 -7.169 1.00 0.00 H new ATOM 0 HA ASP B 76 4.388 16.029 -9.945 1.00 0.00 H new ATOM 0 HB2 ASP B 76 5.800 17.992 -9.378 1.00 0.00 H new ATOM 0 HB3 ASP B 76 6.966 16.948 -8.590 1.00 0.00 H new ATOM 2754 N LEU B 77 6.261 14.074 -8.032 1.00 0.00 N ATOM 2755 CA LEU B 77 7.028 12.842 -7.908 1.00 0.00 C ATOM 2756 C LEU B 77 6.644 12.109 -6.626 1.00 0.00 C ATOM 2757 O LEU B 77 6.478 12.745 -5.582 1.00 0.00 O ATOM 2758 CB LEU B 77 8.543 13.155 -7.853 1.00 0.00 C ATOM 2759 CG LEU B 77 9.454 12.236 -8.681 1.00 0.00 C ATOM 2760 CD1 LEU B 77 10.920 12.628 -8.477 1.00 0.00 C ATOM 2761 CD2 LEU B 77 9.311 10.736 -8.411 1.00 0.00 C ATOM 0 H LEU B 77 6.130 14.552 -7.141 1.00 0.00 H new ATOM 0 HA LEU B 77 6.808 12.219 -8.775 1.00 0.00 H new ATOM 0 HB2 LEU B 77 8.694 14.181 -8.189 1.00 0.00 H new ATOM 0 HB3 LEU B 77 8.865 13.110 -6.813 1.00 0.00 H new ATOM 0 HG LEU B 77 9.126 12.388 -9.709 1.00 0.00 H new ATOM 0 HD11 LEU B 77 11.558 11.971 -9.068 1.00 0.00 H new ATOM 0 HD12 LEU B 77 11.068 13.660 -8.795 1.00 0.00 H new ATOM 0 HD13 LEU B 77 11.179 12.533 -7.422 1.00 0.00 H new ATOM 0 HD21 LEU B 77 10.000 10.184 -9.050 1.00 0.00 H new ATOM 0 HD22 LEU B 77 9.542 10.531 -7.366 1.00 0.00 H new ATOM 0 HD23 LEU B 77 8.289 10.424 -8.625 1.00 0.00 H new ATOM 2773 N VAL B 78 6.606 10.782 -6.697 1.00 0.00 N ATOM 2774 CA VAL B 78 6.484 9.878 -5.566 1.00 0.00 C ATOM 2775 C VAL B 78 7.789 9.096 -5.508 1.00 0.00 C ATOM 2776 O VAL B 78 8.065 8.238 -6.345 1.00 0.00 O ATOM 2777 CB VAL B 78 5.219 9.007 -5.640 1.00 0.00 C ATOM 2778 CG1 VAL B 78 4.989 8.375 -4.261 1.00 0.00 C ATOM 2779 CG2 VAL B 78 3.979 9.813 -6.056 1.00 0.00 C ATOM 0 H VAL B 78 6.662 10.288 -7.588 1.00 0.00 H new ATOM 0 HA VAL B 78 6.344 10.421 -4.631 1.00 0.00 H new ATOM 0 HB VAL B 78 5.370 8.242 -6.402 1.00 0.00 H new ATOM 0 HG11 VAL B 78 4.095 7.752 -4.291 1.00 0.00 H new ATOM 0 HG12 VAL B 78 5.850 7.762 -3.994 1.00 0.00 H new ATOM 0 HG13 VAL B 78 4.858 9.161 -3.518 1.00 0.00 H new ATOM 0 HG21 VAL B 78 3.112 9.153 -6.094 1.00 0.00 H new ATOM 0 HG22 VAL B 78 3.800 10.606 -5.330 1.00 0.00 H new ATOM 0 HG23 VAL B 78 4.144 10.252 -7.040 1.00 0.00 H new ATOM 2789 N VAL B 79 8.632 9.479 -4.558 1.00 0.00 N ATOM 2790 CA VAL B 79 9.928 8.891 -4.298 1.00 0.00 C ATOM 2791 C VAL B 79 9.666 7.722 -3.355 1.00 0.00 C ATOM 2792 O VAL B 79 9.471 7.918 -2.151 1.00 0.00 O ATOM 2793 CB VAL B 79 10.846 9.963 -3.667 1.00 0.00 C ATOM 2794 CG1 VAL B 79 12.251 9.446 -3.327 1.00 0.00 C ATOM 2795 CG2 VAL B 79 10.985 11.202 -4.569 1.00 0.00 C ATOM 0 H VAL B 79 8.415 10.245 -3.921 1.00 0.00 H new ATOM 0 HA VAL B 79 10.431 8.537 -5.198 1.00 0.00 H new ATOM 0 HB VAL B 79 10.350 10.234 -2.735 1.00 0.00 H new ATOM 0 HG11 VAL B 79 12.839 10.252 -2.888 1.00 0.00 H new ATOM 0 HG12 VAL B 79 12.174 8.624 -2.615 1.00 0.00 H new ATOM 0 HG13 VAL B 79 12.739 9.094 -4.236 1.00 0.00 H new ATOM 0 HG21 VAL B 79 11.638 11.930 -4.088 1.00 0.00 H new ATOM 0 HG22 VAL B 79 11.413 10.908 -5.528 1.00 0.00 H new ATOM 0 HG23 VAL B 79 10.003 11.646 -4.731 1.00 0.00 H new ATOM 2805 N THR B 80 9.585 6.505 -3.887 1.00 0.00 N ATOM 2806 CA THR B 80 9.578 5.335 -3.024 1.00 0.00 C ATOM 2807 C THR B 80 10.974 5.292 -2.382 1.00 0.00 C ATOM 2808 O THR B 80 11.994 5.265 -3.078 1.00 0.00 O ATOM 2809 CB THR B 80 9.202 4.096 -3.833 1.00 0.00 C ATOM 2810 OG1 THR B 80 7.932 4.312 -4.419 1.00 0.00 O ATOM 2811 CG2 THR B 80 9.105 2.848 -2.962 1.00 0.00 C ATOM 0 H THR B 80 9.525 6.309 -4.886 1.00 0.00 H new ATOM 0 HA THR B 80 8.830 5.374 -2.232 1.00 0.00 H new ATOM 0 HB THR B 80 9.979 3.937 -4.580 1.00 0.00 H new ATOM 0 HG1 THR B 80 7.303 4.620 -3.733 1.00 0.00 H new ATOM 0 HG21 THR B 80 8.835 1.992 -3.581 1.00 0.00 H new ATOM 0 HG22 THR B 80 10.067 2.662 -2.485 1.00 0.00 H new ATOM 0 HG23 THR B 80 8.343 2.997 -2.197 1.00 0.00 H new ATOM 2819 N LEU B 81 11.018 5.302 -1.053 1.00 0.00 N ATOM 2820 CA LEU B 81 12.222 5.509 -0.260 1.00 0.00 C ATOM 2821 C LEU B 81 12.416 4.347 0.712 1.00 0.00 C ATOM 2822 O LEU B 81 12.522 4.527 1.925 1.00 0.00 O ATOM 2823 CB LEU B 81 12.082 6.878 0.429 1.00 0.00 C ATOM 2824 CG LEU B 81 13.377 7.392 1.080 1.00 0.00 C ATOM 2825 CD1 LEU B 81 14.385 7.896 0.037 1.00 0.00 C ATOM 2826 CD2 LEU B 81 13.014 8.524 2.037 1.00 0.00 C ATOM 0 H LEU B 81 10.186 5.161 -0.480 1.00 0.00 H new ATOM 0 HA LEU B 81 13.122 5.524 -0.874 1.00 0.00 H new ATOM 0 HB2 LEU B 81 11.743 7.609 -0.305 1.00 0.00 H new ATOM 0 HB3 LEU B 81 11.307 6.810 1.192 1.00 0.00 H new ATOM 0 HG LEU B 81 13.851 6.568 1.613 1.00 0.00 H new ATOM 0 HD11 LEU B 81 15.284 8.249 0.541 1.00 0.00 H new ATOM 0 HD12 LEU B 81 14.645 7.083 -0.641 1.00 0.00 H new ATOM 0 HD13 LEU B 81 13.942 8.714 -0.531 1.00 0.00 H new ATOM 0 HD21 LEU B 81 13.919 8.904 2.511 1.00 0.00 H new ATOM 0 HD22 LEU B 81 12.529 9.328 1.483 1.00 0.00 H new ATOM 0 HD23 LEU B 81 12.334 8.150 2.802 1.00 0.00 H new ATOM 2838 N SER B 82 12.397 3.121 0.196 1.00 0.00 N ATOM 2839 CA SER B 82 12.740 1.917 0.937 1.00 0.00 C ATOM 2840 C SER B 82 13.257 0.860 -0.050 1.00 0.00 C ATOM 2841 O SER B 82 13.396 1.136 -1.246 1.00 0.00 O ATOM 2842 CB SER B 82 11.504 1.410 1.707 1.00 0.00 C ATOM 2843 OG SER B 82 11.110 2.338 2.696 1.00 0.00 O ATOM 0 H SER B 82 12.136 2.936 -0.773 1.00 0.00 H new ATOM 0 HA SER B 82 13.522 2.129 1.666 1.00 0.00 H new ATOM 0 HB2 SER B 82 10.681 1.242 1.012 1.00 0.00 H new ATOM 0 HB3 SER B 82 11.729 0.450 2.172 1.00 0.00 H new ATOM 0 HG SER B 82 11.639 3.158 2.605 1.00 0.00 H new ATOM 2849 N GLY B 83 13.517 -0.347 0.453 1.00 0.00 N ATOM 2850 CA GLY B 83 13.808 -1.556 -0.310 1.00 0.00 C ATOM 2851 C GLY B 83 12.912 -2.660 0.253 1.00 0.00 C ATOM 2852 O GLY B 83 13.380 -3.753 0.572 1.00 0.00 O ATOM 0 H GLY B 83 13.530 -0.514 1.459 1.00 0.00 H new ATOM 0 HA2 GLY B 83 13.610 -1.401 -1.371 1.00 0.00 H new ATOM 0 HA3 GLY B 83 14.860 -1.827 -0.218 1.00 0.00 H new ATOM 2856 N ASP B 84 11.640 -2.318 0.475 1.00 0.00 N ATOM 2857 CA ASP B 84 10.630 -3.091 1.192 1.00 0.00 C ATOM 2858 C ASP B 84 9.252 -2.736 0.613 1.00 0.00 C ATOM 2859 O ASP B 84 9.126 -1.729 -0.092 1.00 0.00 O ATOM 2860 CB ASP B 84 10.712 -2.734 2.688 1.00 0.00 C ATOM 2861 CG ASP B 84 9.611 -3.380 3.533 1.00 0.00 C ATOM 2862 OD1 ASP B 84 9.273 -4.564 3.313 1.00 0.00 O ATOM 2863 OD2 ASP B 84 9.076 -2.681 4.421 1.00 0.00 O ATOM 0 H ASP B 84 11.266 -1.432 0.134 1.00 0.00 H new ATOM 0 HA ASP B 84 10.794 -4.163 1.080 1.00 0.00 H new ATOM 0 HB2 ASP B 84 11.683 -3.043 3.074 1.00 0.00 H new ATOM 0 HB3 ASP B 84 10.655 -1.651 2.798 1.00 0.00 H new ATOM 2868 N ALA B 85 8.228 -3.546 0.899 1.00 0.00 N ATOM 2869 CA ALA B 85 6.890 -3.449 0.321 1.00 0.00 C ATOM 2870 C ALA B 85 5.779 -3.499 1.384 1.00 0.00 C ATOM 2871 O ALA B 85 4.601 -3.549 1.026 1.00 0.00 O ATOM 2872 CB ALA B 85 6.719 -4.565 -0.720 1.00 0.00 C ATOM 0 H ALA B 85 8.314 -4.314 1.564 1.00 0.00 H new ATOM 0 HA ALA B 85 6.793 -2.476 -0.161 1.00 0.00 H new ATOM 0 HB1 ALA B 85 5.723 -4.503 -1.159 1.00 0.00 H new ATOM 0 HB2 ALA B 85 7.469 -4.450 -1.503 1.00 0.00 H new ATOM 0 HB3 ALA B 85 6.843 -5.535 -0.238 1.00 0.00 H new ATOM 2878 N ALA B 86 6.121 -3.468 2.681 1.00 0.00 N ATOM 2879 CA ALA B 86 5.142 -3.436 3.768 1.00 0.00 C ATOM 2880 C ALA B 86 4.259 -2.177 3.735 1.00 0.00 C ATOM 2881 O ALA B 86 3.220 -2.148 4.388 1.00 0.00 O ATOM 2882 CB ALA B 86 5.871 -3.528 5.116 1.00 0.00 C ATOM 0 H ALA B 86 7.089 -3.465 3.002 1.00 0.00 H new ATOM 0 HA ALA B 86 4.480 -4.292 3.636 1.00 0.00 H new ATOM 0 HB1 ALA B 86 5.142 -3.504 5.926 1.00 0.00 H new ATOM 0 HB2 ALA B 86 6.434 -4.460 5.162 1.00 0.00 H new ATOM 0 HB3 ALA B 86 6.555 -2.685 5.218 1.00 0.00 H new ATOM 2888 N ASP B 87 4.648 -1.138 2.990 1.00 0.00 N ATOM 2889 CA ASP B 87 4.050 0.199 3.004 1.00 0.00 C ATOM 2890 C ASP B 87 2.641 0.326 2.375 1.00 0.00 C ATOM 2891 O ASP B 87 2.304 1.392 1.868 1.00 0.00 O ATOM 2892 CB ASP B 87 5.033 1.193 2.367 1.00 0.00 C ATOM 2893 CG ASP B 87 4.714 2.629 2.812 1.00 0.00 C ATOM 2894 OD1 ASP B 87 4.373 2.804 4.009 1.00 0.00 O ATOM 2895 OD2 ASP B 87 4.870 3.555 1.985 1.00 0.00 O ATOM 0 H ASP B 87 5.423 -1.210 2.331 1.00 0.00 H new ATOM 0 HA ASP B 87 3.875 0.431 4.055 1.00 0.00 H new ATOM 0 HB2 ASP B 87 6.054 0.937 2.651 1.00 0.00 H new ATOM 0 HB3 ASP B 87 4.978 1.122 1.281 1.00 0.00 H new ATOM 2900 N LYS B 88 1.809 -0.731 2.373 1.00 0.00 N ATOM 2901 CA LYS B 88 0.429 -0.774 1.824 1.00 0.00 C ATOM 2902 C LYS B 88 0.410 -0.972 0.297 1.00 0.00 C ATOM 2903 O LYS B 88 -0.606 -0.697 -0.347 1.00 0.00 O ATOM 2904 CB LYS B 88 -0.402 0.454 2.280 1.00 0.00 C ATOM 2905 CG LYS B 88 -1.928 0.264 2.314 1.00 0.00 C ATOM 2906 CD LYS B 88 -2.621 1.539 2.831 1.00 0.00 C ATOM 2907 CE LYS B 88 -2.624 1.588 4.364 1.00 0.00 C ATOM 2908 NZ LYS B 88 -3.170 2.856 4.915 1.00 0.00 N ATOM 0 H LYS B 88 2.089 -1.627 2.773 1.00 0.00 H new ATOM 0 HA LYS B 88 -0.056 -1.656 2.242 1.00 0.00 H new ATOM 0 HB2 LYS B 88 -0.070 0.742 3.278 1.00 0.00 H new ATOM 0 HB3 LYS B 88 -0.175 1.288 1.616 1.00 0.00 H new ATOM 0 HG2 LYS B 88 -2.293 0.025 1.315 1.00 0.00 H new ATOM 0 HG3 LYS B 88 -2.181 -0.580 2.956 1.00 0.00 H new ATOM 0 HD2 LYS B 88 -2.110 2.418 2.438 1.00 0.00 H new ATOM 0 HD3 LYS B 88 -3.646 1.574 2.462 1.00 0.00 H new ATOM 0 HE2 LYS B 88 -3.211 0.753 4.745 1.00 0.00 H new ATOM 0 HE3 LYS B 88 -1.605 1.453 4.726 1.00 0.00 H new ATOM 0 HZ1 LYS B 88 -2.553 3.196 5.680 1.00 0.00 H new ATOM 0 HZ2 LYS B 88 -3.214 3.571 4.161 1.00 0.00 H new ATOM 0 HZ3 LYS B 88 -4.126 2.689 5.290 1.00 0.00 H new ATOM 2922 N CYS B 89 1.530 -1.430 -0.281 1.00 0.00 N ATOM 2923 CA CYS B 89 1.775 -1.559 -1.722 1.00 0.00 C ATOM 2924 C CYS B 89 1.101 -0.436 -2.546 1.00 0.00 C ATOM 2925 O CYS B 89 0.311 -0.753 -3.441 1.00 0.00 O ATOM 2926 CB CYS B 89 1.313 -2.951 -2.192 1.00 0.00 C ATOM 2927 SG CYS B 89 1.753 -4.369 -1.152 1.00 0.00 S ATOM 0 H CYS B 89 2.329 -1.736 0.274 1.00 0.00 H new ATOM 0 HA CYS B 89 2.846 -1.452 -1.893 1.00 0.00 H new ATOM 0 HB2 CYS B 89 0.228 -2.930 -2.292 1.00 0.00 H new ATOM 0 HB3 CYS B 89 1.722 -3.123 -3.188 1.00 0.00 H new ATOM 2932 N PRO B 90 1.303 0.861 -2.221 1.00 0.00 N ATOM 2933 CA PRO B 90 0.520 1.933 -2.819 1.00 0.00 C ATOM 2934 C PRO B 90 0.666 1.928 -4.335 1.00 0.00 C ATOM 2935 O PRO B 90 1.793 1.870 -4.835 1.00 0.00 O ATOM 2936 CB PRO B 90 1.013 3.247 -2.200 1.00 0.00 C ATOM 2937 CG PRO B 90 1.679 2.784 -0.908 1.00 0.00 C ATOM 2938 CD PRO B 90 2.289 1.447 -1.329 1.00 0.00 C ATOM 0 HA PRO B 90 -0.543 1.803 -2.617 1.00 0.00 H new ATOM 0 HB2 PRO B 90 1.715 3.764 -2.854 1.00 0.00 H new ATOM 0 HB3 PRO B 90 0.191 3.936 -2.007 1.00 0.00 H new ATOM 0 HG2 PRO B 90 2.437 3.488 -0.564 1.00 0.00 H new ATOM 0 HG3 PRO B 90 0.960 2.668 -0.097 1.00 0.00 H new ATOM 0 HD2 PRO B 90 3.245 1.588 -1.833 1.00 0.00 H new ATOM 0 HD3 PRO B 90 2.474 0.806 -0.467 1.00 0.00 H new ATOM 2946 N MET B 91 -0.449 1.990 -5.069 1.00 0.00 N ATOM 2947 CA MET B 91 -0.397 1.882 -6.519 1.00 0.00 C ATOM 2948 C MET B 91 -0.149 3.222 -7.230 1.00 0.00 C ATOM 2949 O MET B 91 -0.026 3.186 -8.451 1.00 0.00 O ATOM 2950 CB MET B 91 -1.593 1.083 -7.038 1.00 0.00 C ATOM 2951 CG MET B 91 -2.931 1.647 -6.627 1.00 0.00 C ATOM 2952 SD MET B 91 -3.296 3.244 -7.382 1.00 0.00 S ATOM 2953 CE MET B 91 -5.000 3.182 -6.879 1.00 0.00 C ATOM 0 H MET B 91 -1.385 2.113 -4.683 1.00 0.00 H new ATOM 0 HA MET B 91 0.492 1.309 -6.782 1.00 0.00 H new ATOM 0 HB2 MET B 91 -1.546 1.043 -8.126 1.00 0.00 H new ATOM 0 HB3 MET B 91 -1.516 0.057 -6.677 1.00 0.00 H new ATOM 0 HG2 MET B 91 -3.714 0.938 -6.896 1.00 0.00 H new ATOM 0 HG3 MET B 91 -2.955 1.752 -5.542 1.00 0.00 H new ATOM 0 HE1 MET B 91 -5.459 4.160 -7.027 1.00 0.00 H new ATOM 0 HE2 MET B 91 -5.529 2.439 -7.476 1.00 0.00 H new ATOM 0 HE3 MET B 91 -5.059 2.909 -5.825 1.00 0.00 H new ATOM 2963 N THR B 92 -0.029 4.354 -6.498 1.00 0.00 N ATOM 2964 CA THR B 92 0.413 5.671 -6.998 1.00 0.00 C ATOM 2965 C THR B 92 -0.290 6.123 -8.303 1.00 0.00 C ATOM 2966 O THR B 92 0.155 5.747 -9.392 1.00 0.00 O ATOM 2967 CB THR B 92 1.951 5.712 -7.139 1.00 0.00 C ATOM 2968 OG1 THR B 92 2.432 4.567 -7.815 1.00 0.00 O ATOM 2969 CG2 THR B 92 2.675 5.784 -5.788 1.00 0.00 C ATOM 0 H THR B 92 -0.247 4.372 -5.502 1.00 0.00 H new ATOM 0 HA THR B 92 0.106 6.397 -6.245 1.00 0.00 H new ATOM 0 HB THR B 92 2.162 6.619 -7.706 1.00 0.00 H new ATOM 0 HG1 THR B 92 1.826 4.343 -8.552 1.00 0.00 H new ATOM 0 HG21 THR B 92 3.752 5.810 -5.953 1.00 0.00 H new ATOM 0 HG22 THR B 92 2.367 6.685 -5.258 1.00 0.00 H new ATOM 0 HG23 THR B 92 2.421 4.908 -5.192 1.00 0.00 H new ATOM 2977 N PRO B 93 -1.369 6.932 -8.238 1.00 0.00 N ATOM 2978 CA PRO B 93 -2.163 7.264 -9.416 1.00 0.00 C ATOM 2979 C PRO B 93 -1.249 7.918 -10.491 1.00 0.00 C ATOM 2980 O PRO B 93 -0.465 8.811 -10.160 1.00 0.00 O ATOM 2981 CB PRO B 93 -3.337 8.091 -8.873 1.00 0.00 C ATOM 2982 CG PRO B 93 -2.822 8.724 -7.583 1.00 0.00 C ATOM 2983 CD PRO B 93 -1.879 7.632 -7.066 1.00 0.00 C ATOM 0 HA PRO B 93 -2.587 6.419 -9.959 1.00 0.00 H new ATOM 0 HB2 PRO B 93 -3.646 8.853 -9.589 1.00 0.00 H new ATOM 0 HB3 PRO B 93 -4.206 7.462 -8.682 1.00 0.00 H new ATOM 0 HG2 PRO B 93 -2.301 9.664 -7.766 1.00 0.00 H new ATOM 0 HG3 PRO B 93 -3.627 8.938 -6.880 1.00 0.00 H new ATOM 0 HD2 PRO B 93 -1.063 8.067 -6.489 1.00 0.00 H new ATOM 0 HD3 PRO B 93 -2.407 6.946 -6.404 1.00 0.00 H new ATOM 2991 N PRO B 94 -1.320 7.491 -11.773 1.00 0.00 N ATOM 2992 CA PRO B 94 -0.354 7.832 -12.825 1.00 0.00 C ATOM 2993 C PRO B 94 -0.259 9.299 -13.261 1.00 0.00 C ATOM 2994 O PRO B 94 0.637 9.626 -14.041 1.00 0.00 O ATOM 2995 CB PRO B 94 -0.691 6.917 -14.012 1.00 0.00 C ATOM 2996 CG PRO B 94 -2.175 6.634 -13.827 1.00 0.00 C ATOM 2997 CD PRO B 94 -2.296 6.555 -12.310 1.00 0.00 C ATOM 0 HA PRO B 94 0.641 7.675 -12.409 1.00 0.00 H new ATOM 0 HB2 PRO B 94 -0.491 7.405 -14.966 1.00 0.00 H new ATOM 0 HB3 PRO B 94 -0.101 6.000 -13.993 1.00 0.00 H new ATOM 0 HG2 PRO B 94 -2.797 7.426 -14.245 1.00 0.00 H new ATOM 0 HG3 PRO B 94 -2.476 5.704 -14.309 1.00 0.00 H new ATOM 0 HD2 PRO B 94 -3.304 6.816 -11.986 1.00 0.00 H new ATOM 0 HD3 PRO B 94 -2.099 5.543 -11.956 1.00 0.00 H new ATOM 3005 N HIS B 95 -1.110 10.201 -12.766 1.00 0.00 N ATOM 3006 CA HIS B 95 -0.944 11.642 -12.975 1.00 0.00 C ATOM 3007 C HIS B 95 0.196 12.231 -12.112 1.00 0.00 C ATOM 3008 O HIS B 95 0.293 13.451 -11.966 1.00 0.00 O ATOM 3009 CB HIS B 95 -2.296 12.357 -12.808 1.00 0.00 C ATOM 3010 CG HIS B 95 -3.073 11.991 -11.569 1.00 0.00 C ATOM 3011 ND1 HIS B 95 -4.255 11.283 -11.535 1.00 0.00 N ATOM 3012 CD2 HIS B 95 -2.769 12.336 -10.280 1.00 0.00 C ATOM 3013 CE1 HIS B 95 -4.658 11.212 -10.256 1.00 0.00 C ATOM 3014 NE2 HIS B 95 -3.770 11.820 -9.450 1.00 0.00 N ATOM 0 H HIS B 95 -1.930 9.955 -12.211 1.00 0.00 H new ATOM 0 HA HIS B 95 -0.621 11.817 -14.001 1.00 0.00 H new ATOM 0 HB2 HIS B 95 -2.120 13.433 -12.801 1.00 0.00 H new ATOM 0 HB3 HIS B 95 -2.913 12.140 -13.680 1.00 0.00 H new ATOM 0 HD1 HIS B 95 -4.738 10.883 -12.339 1.00 0.00 H new ATOM 0 HD2 HIS B 95 -1.909 12.906 -9.960 1.00 0.00 H new ATOM 0 HE1 HIS B 95 -5.567 10.734 -9.922 1.00 0.00 H new ATOM 3022 N VAL B 96 1.072 11.388 -11.552 1.00 0.00 N ATOM 3023 CA VAL B 96 2.261 11.756 -10.789 1.00 0.00 C ATOM 3024 C VAL B 96 3.402 10.858 -11.288 1.00 0.00 C ATOM 3025 O VAL B 96 3.165 9.684 -11.600 1.00 0.00 O ATOM 3026 CB VAL B 96 2.001 11.554 -9.276 1.00 0.00 C ATOM 3027 CG1 VAL B 96 3.102 12.235 -8.458 1.00 0.00 C ATOM 3028 CG2 VAL B 96 0.642 12.099 -8.805 1.00 0.00 C ATOM 0 H VAL B 96 0.960 10.377 -11.626 1.00 0.00 H new ATOM 0 HA VAL B 96 2.520 12.805 -10.929 1.00 0.00 H new ATOM 0 HB VAL B 96 1.997 10.476 -9.117 1.00 0.00 H new ATOM 0 HG11 VAL B 96 2.910 12.087 -7.395 1.00 0.00 H new ATOM 0 HG12 VAL B 96 4.068 11.801 -8.716 1.00 0.00 H new ATOM 0 HG13 VAL B 96 3.113 13.302 -8.680 1.00 0.00 H new ATOM 0 HG21 VAL B 96 0.530 11.922 -7.735 1.00 0.00 H new ATOM 0 HG22 VAL B 96 0.591 13.170 -9.003 1.00 0.00 H new ATOM 0 HG23 VAL B 96 -0.159 11.592 -9.342 1.00 0.00 H new ATOM 3038 N LYS B 97 4.631 11.381 -11.383 1.00 0.00 N ATOM 3039 CA LYS B 97 5.808 10.569 -11.683 1.00 0.00 C ATOM 3040 C LYS B 97 6.093 9.688 -10.464 1.00 0.00 C ATOM 3041 O LYS B 97 5.793 10.082 -9.337 1.00 0.00 O ATOM 3042 CB LYS B 97 6.972 11.507 -12.059 1.00 0.00 C ATOM 3043 CG LYS B 97 8.084 10.786 -12.841 1.00 0.00 C ATOM 3044 CD LYS B 97 9.405 10.689 -12.083 1.00 0.00 C ATOM 3045 CE LYS B 97 10.251 11.984 -12.021 1.00 0.00 C ATOM 3046 NZ LYS B 97 10.808 12.376 -13.338 1.00 0.00 N ATOM 0 H LYS B 97 4.833 12.373 -11.254 1.00 0.00 H new ATOM 0 HA LYS B 97 5.655 9.907 -12.535 1.00 0.00 H new ATOM 0 HB2 LYS B 97 6.589 12.333 -12.658 1.00 0.00 H new ATOM 0 HB3 LYS B 97 7.393 11.939 -11.151 1.00 0.00 H new ATOM 0 HG2 LYS B 97 7.745 9.781 -13.093 1.00 0.00 H new ATOM 0 HG3 LYS B 97 8.253 11.310 -13.781 1.00 0.00 H new ATOM 0 HD2 LYS B 97 9.193 10.369 -11.063 1.00 0.00 H new ATOM 0 HD3 LYS B 97 10.008 9.907 -12.544 1.00 0.00 H new ATOM 0 HE2 LYS B 97 9.634 12.796 -11.637 1.00 0.00 H new ATOM 0 HE3 LYS B 97 11.069 11.844 -11.314 1.00 0.00 H new ATOM 0 HZ1 LYS B 97 11.663 12.950 -13.196 1.00 0.00 H new ATOM 0 HZ2 LYS B 97 11.050 11.522 -13.881 1.00 0.00 H new ATOM 0 HZ3 LYS B 97 10.102 12.931 -13.862 1.00 0.00 H new ATOM 3060 N ARG B 98 6.730 8.532 -10.638 1.00 0.00 N ATOM 3061 CA ARG B 98 7.181 7.704 -9.521 1.00 0.00 C ATOM 3062 C ARG B 98 8.526 7.130 -9.901 1.00 0.00 C ATOM 3063 O ARG B 98 8.720 6.723 -11.047 1.00 0.00 O ATOM 3064 CB ARG B 98 6.189 6.569 -9.209 1.00 0.00 C ATOM 3065 CG ARG B 98 6.590 5.784 -7.941 1.00 0.00 C ATOM 3066 CD ARG B 98 5.778 4.498 -7.813 1.00 0.00 C ATOM 3067 NE ARG B 98 6.043 3.831 -6.530 1.00 0.00 N ATOM 3068 CZ ARG B 98 5.207 3.057 -5.831 1.00 0.00 C ATOM 3069 NH1 ARG B 98 3.988 2.781 -6.278 1.00 0.00 N ATOM 3070 NH2 ARG B 98 5.616 2.573 -4.665 1.00 0.00 N ATOM 0 H ARG B 98 6.948 8.143 -11.555 1.00 0.00 H new ATOM 0 HA ARG B 98 7.251 8.314 -8.620 1.00 0.00 H new ATOM 0 HB2 ARG B 98 5.191 6.986 -9.077 1.00 0.00 H new ATOM 0 HB3 ARG B 98 6.140 5.887 -10.058 1.00 0.00 H new ATOM 0 HG2 ARG B 98 7.653 5.545 -7.978 1.00 0.00 H new ATOM 0 HG3 ARG B 98 6.434 6.406 -7.060 1.00 0.00 H new ATOM 0 HD2 ARG B 98 4.715 4.725 -7.896 1.00 0.00 H new ATOM 0 HD3 ARG B 98 6.025 3.825 -8.634 1.00 0.00 H new ATOM 0 HE ARG B 98 6.969 3.975 -6.128 1.00 0.00 H new ATOM 0 HH11 ARG B 98 3.674 3.162 -7.171 1.00 0.00 H new ATOM 0 HH12 ARG B 98 3.366 2.188 -5.729 1.00 0.00 H new ATOM 0 HH21 ARG B 98 6.550 2.794 -4.321 1.00 0.00 H new ATOM 0 HH22 ARG B 98 4.996 1.980 -4.113 1.00 0.00 H new ATOM 3084 N GLU B 99 9.422 7.064 -8.926 1.00 0.00 N ATOM 3085 CA GLU B 99 10.685 6.361 -9.019 1.00 0.00 C ATOM 3086 C GLU B 99 10.965 5.805 -7.624 1.00 0.00 C ATOM 3087 O GLU B 99 10.458 6.325 -6.625 1.00 0.00 O ATOM 3088 CB GLU B 99 11.801 7.326 -9.435 1.00 0.00 C ATOM 3089 CG GLU B 99 11.672 7.864 -10.864 1.00 0.00 C ATOM 3090 CD GLU B 99 12.810 8.827 -11.216 1.00 0.00 C ATOM 3091 OE1 GLU B 99 13.067 9.780 -10.450 1.00 0.00 O ATOM 3092 OE2 GLU B 99 13.441 8.677 -12.285 1.00 0.00 O ATOM 0 H GLU B 99 9.281 7.514 -8.022 1.00 0.00 H new ATOM 0 HA GLU B 99 10.643 5.567 -9.765 1.00 0.00 H new ATOM 0 HB2 GLU B 99 11.814 8.168 -8.743 1.00 0.00 H new ATOM 0 HB3 GLU B 99 12.760 6.817 -9.336 1.00 0.00 H new ATOM 0 HG2 GLU B 99 11.671 7.031 -11.567 1.00 0.00 H new ATOM 0 HG3 GLU B 99 10.716 8.376 -10.974 1.00 0.00 H new ATOM 3099 N HIS B 100 11.798 4.774 -7.549 1.00 0.00 N ATOM 3100 CA HIS B 100 12.310 4.240 -6.299 1.00 0.00 C ATOM 3101 C HIS B 100 13.788 4.599 -6.180 1.00 0.00 C ATOM 3102 O HIS B 100 14.542 4.499 -7.154 1.00 0.00 O ATOM 3103 CB HIS B 100 12.044 2.724 -6.208 1.00 0.00 C ATOM 3104 CG HIS B 100 12.473 1.894 -7.402 1.00 0.00 C ATOM 3105 ND1 HIS B 100 13.598 2.072 -8.177 1.00 0.00 N ATOM 3106 CD2 HIS B 100 11.805 0.813 -7.914 1.00 0.00 C ATOM 3107 CE1 HIS B 100 13.605 1.129 -9.134 1.00 0.00 C ATOM 3108 NE2 HIS B 100 12.528 0.331 -9.016 1.00 0.00 N ATOM 0 H HIS B 100 12.141 4.279 -8.372 1.00 0.00 H new ATOM 0 HA HIS B 100 11.790 4.686 -5.451 1.00 0.00 H new ATOM 0 HB2 HIS B 100 12.553 2.340 -5.324 1.00 0.00 H new ATOM 0 HB3 HIS B 100 10.976 2.573 -6.052 1.00 0.00 H new ATOM 0 HD1 HIS B 100 14.305 2.796 -8.047 1.00 0.00 H new ATOM 0 HD2 HIS B 100 10.881 0.402 -7.535 1.00 0.00 H new ATOM 0 HE1 HIS B 100 14.368 1.026 -9.892 1.00 0.00 H new ATOM 3116 N TRP B 101 14.187 5.020 -4.980 1.00 0.00 N ATOM 3117 CA TRP B 101 15.513 5.567 -4.716 1.00 0.00 C ATOM 3118 C TRP B 101 16.071 5.134 -3.353 1.00 0.00 C ATOM 3119 O TRP B 101 17.204 5.491 -3.027 1.00 0.00 O ATOM 3120 CB TRP B 101 15.435 7.097 -4.834 1.00 0.00 C ATOM 3121 CG TRP B 101 15.200 7.637 -6.217 1.00 0.00 C ATOM 3122 CD1 TRP B 101 14.049 8.176 -6.682 1.00 0.00 C ATOM 3123 CD2 TRP B 101 16.121 7.660 -7.353 1.00 0.00 C ATOM 3124 NE1 TRP B 101 14.237 8.648 -7.963 1.00 0.00 N ATOM 3125 CE2 TRP B 101 15.482 8.323 -8.442 1.00 0.00 C ATOM 3126 CE3 TRP B 101 17.417 7.156 -7.594 1.00 0.00 C ATOM 3127 CZ2 TRP B 101 16.101 8.502 -9.685 1.00 0.00 C ATOM 3128 CZ3 TRP B 101 18.049 7.323 -8.844 1.00 0.00 C ATOM 3129 CH2 TRP B 101 17.398 8.004 -9.887 1.00 0.00 C ATOM 0 H TRP B 101 13.589 4.989 -4.155 1.00 0.00 H new ATOM 0 HA TRP B 101 16.211 5.171 -5.453 1.00 0.00 H new ATOM 0 HB2 TRP B 101 14.634 7.452 -4.185 1.00 0.00 H new ATOM 0 HB3 TRP B 101 16.365 7.519 -4.453 1.00 0.00 H new ATOM 0 HD1 TRP B 101 13.121 8.228 -6.131 1.00 0.00 H new ATOM 0 HE1 TRP B 101 13.539 9.173 -8.489 1.00 0.00 H new ATOM 0 HE3 TRP B 101 17.936 6.632 -6.805 1.00 0.00 H new ATOM 0 HZ2 TRP B 101 15.585 9.018 -10.481 1.00 0.00 H new ATOM 0 HZ3 TRP B 101 19.041 6.925 -9.001 1.00 0.00 H new ATOM 0 HH2 TRP B 101 17.892 8.143 -10.837 1.00 0.00 H new ATOM 3140 N GLY B 102 15.312 4.371 -2.553 1.00 0.00 N ATOM 3141 CA GLY B 102 15.787 3.877 -1.263 1.00 0.00 C ATOM 3142 C GLY B 102 16.707 2.673 -1.448 1.00 0.00 C ATOM 3143 O GLY B 102 17.841 2.692 -0.970 1.00 0.00 O ATOM 0 H GLY B 102 14.361 4.084 -2.784 1.00 0.00 H new ATOM 0 HA2 GLY B 102 16.320 4.670 -0.739 1.00 0.00 H new ATOM 0 HA3 GLY B 102 14.937 3.598 -0.640 1.00 0.00 H new ATOM 3147 N PHE B 103 16.225 1.645 -2.163 1.00 0.00 N ATOM 3148 CA PHE B 103 16.889 0.364 -2.451 1.00 0.00 C ATOM 3149 C PHE B 103 17.283 -0.462 -1.209 1.00 0.00 C ATOM 3150 O PHE B 103 17.783 -1.580 -1.344 1.00 0.00 O ATOM 3151 CB PHE B 103 18.093 0.568 -3.389 1.00 0.00 C ATOM 3152 CG PHE B 103 17.808 1.350 -4.658 1.00 0.00 C ATOM 3153 CD1 PHE B 103 17.071 0.758 -5.703 1.00 0.00 C ATOM 3154 CD2 PHE B 103 18.306 2.659 -4.811 1.00 0.00 C ATOM 3155 CE1 PHE B 103 16.838 1.469 -6.893 1.00 0.00 C ATOM 3156 CE2 PHE B 103 18.077 3.365 -6.005 1.00 0.00 C ATOM 3157 CZ PHE B 103 17.340 2.773 -7.045 1.00 0.00 C ATOM 0 H PHE B 103 15.297 1.690 -2.584 1.00 0.00 H new ATOM 0 HA PHE B 103 16.134 -0.239 -2.956 1.00 0.00 H new ATOM 0 HB2 PHE B 103 18.879 1.081 -2.836 1.00 0.00 H new ATOM 0 HB3 PHE B 103 18.485 -0.410 -3.666 1.00 0.00 H new ATOM 0 HD1 PHE B 103 16.684 -0.244 -5.589 1.00 0.00 H new ATOM 0 HD2 PHE B 103 18.864 3.121 -4.010 1.00 0.00 H new ATOM 0 HE1 PHE B 103 16.272 1.013 -7.692 1.00 0.00 H new ATOM 0 HE2 PHE B 103 18.468 4.365 -6.123 1.00 0.00 H new ATOM 0 HZ PHE B 103 17.160 3.319 -7.959 1.00 0.00 H new ATOM 3167 N ASP B 104 17.050 0.056 -0.007 1.00 0.00 N ATOM 3168 CA ASP B 104 17.372 -0.508 1.299 1.00 0.00 C ATOM 3169 C ASP B 104 16.479 0.231 2.304 1.00 0.00 C ATOM 3170 O ASP B 104 15.851 1.231 1.940 1.00 0.00 O ATOM 3171 CB ASP B 104 18.865 -0.270 1.604 1.00 0.00 C ATOM 3172 CG ASP B 104 19.366 -0.930 2.900 1.00 0.00 C ATOM 3173 OD1 ASP B 104 18.699 -1.847 3.431 1.00 0.00 O ATOM 3174 OD2 ASP B 104 20.465 -0.546 3.361 1.00 0.00 O ATOM 0 H ASP B 104 16.590 0.962 0.086 1.00 0.00 H new ATOM 0 HA ASP B 104 17.198 -1.583 1.344 1.00 0.00 H new ATOM 0 HB2 ASP B 104 19.457 -0.644 0.769 1.00 0.00 H new ATOM 0 HB3 ASP B 104 19.043 0.804 1.666 1.00 0.00 H new ATOM 3179 N ASP B 105 16.415 -0.215 3.556 1.00 0.00 N ATOM 3180 CA ASP B 105 15.703 0.492 4.617 1.00 0.00 C ATOM 3181 C ASP B 105 16.543 0.460 5.903 1.00 0.00 C ATOM 3182 O ASP B 105 16.682 -0.597 6.525 1.00 0.00 O ATOM 3183 CB ASP B 105 14.295 -0.068 4.842 1.00 0.00 C ATOM 3184 CG ASP B 105 13.546 0.730 5.917 1.00 0.00 C ATOM 3185 OD1 ASP B 105 14.020 1.797 6.361 1.00 0.00 O ATOM 3186 OD2 ASP B 105 12.437 0.309 6.307 1.00 0.00 O ATOM 0 H ASP B 105 16.857 -1.081 3.864 1.00 0.00 H new ATOM 0 HA ASP B 105 15.566 1.529 4.310 1.00 0.00 H new ATOM 0 HB2 ASP B 105 13.735 -0.038 3.907 1.00 0.00 H new ATOM 0 HB3 ASP B 105 14.360 -1.114 5.141 1.00 0.00 H new ATOM 3191 N PRO B 106 17.159 1.589 6.296 1.00 0.00 N ATOM 3192 CA PRO B 106 18.086 1.663 7.411 1.00 0.00 C ATOM 3193 C PRO B 106 17.399 1.407 8.749 1.00 0.00 C ATOM 3194 O PRO B 106 17.990 0.721 9.581 1.00 0.00 O ATOM 3195 CB PRO B 106 18.767 3.022 7.257 1.00 0.00 C ATOM 3196 CG PRO B 106 17.704 3.890 6.595 1.00 0.00 C ATOM 3197 CD PRO B 106 17.023 2.889 5.670 1.00 0.00 C ATOM 0 HA PRO B 106 18.840 0.876 7.401 1.00 0.00 H new ATOM 0 HB2 PRO B 106 19.071 3.428 8.222 1.00 0.00 H new ATOM 0 HB3 PRO B 106 19.665 2.952 6.643 1.00 0.00 H new ATOM 0 HG2 PRO B 106 17.011 4.314 7.321 1.00 0.00 H new ATOM 0 HG3 PRO B 106 18.140 4.724 6.046 1.00 0.00 H new ATOM 0 HD2 PRO B 106 15.972 3.144 5.530 1.00 0.00 H new ATOM 0 HD3 PRO B 106 17.487 2.895 4.684 1.00 0.00 H new ATOM 3205 N ALA B 107 16.145 1.853 8.943 1.00 0.00 N ATOM 3206 CA ALA B 107 15.268 1.710 10.120 1.00 0.00 C ATOM 3207 C ALA B 107 15.160 0.282 10.640 1.00 0.00 C ATOM 3208 O ALA B 107 14.669 0.032 11.739 1.00 0.00 O ATOM 3209 CB ALA B 107 13.859 2.180 9.730 1.00 0.00 C ATOM 0 H ALA B 107 15.673 2.375 8.205 1.00 0.00 H new ATOM 0 HA ALA B 107 15.709 2.309 10.917 1.00 0.00 H new ATOM 0 HB1 ALA B 107 13.193 2.083 10.587 1.00 0.00 H new ATOM 0 HB2 ALA B 107 13.897 3.223 9.417 1.00 0.00 H new ATOM 0 HB3 ALA B 107 13.486 1.568 8.909 1.00 0.00 H new ATOM 3215 N ARG B 108 15.621 -0.641 9.818 1.00 0.00 N ATOM 3216 CA ARG B 108 15.502 -2.081 10.013 1.00 0.00 C ATOM 3217 C ARG B 108 16.855 -2.592 10.480 1.00 0.00 C ATOM 3218 O ARG B 108 16.943 -3.154 11.572 1.00 0.00 O ATOM 3219 CB ARG B 108 15.039 -2.783 8.712 1.00 0.00 C ATOM 3220 CG ARG B 108 13.932 -2.058 7.924 1.00 0.00 C ATOM 3221 CD ARG B 108 12.585 -1.932 8.653 1.00 0.00 C ATOM 3222 NE ARG B 108 11.632 -2.988 8.262 1.00 0.00 N ATOM 3223 CZ ARG B 108 10.812 -2.926 7.200 1.00 0.00 C ATOM 3224 NH1 ARG B 108 10.824 -1.892 6.371 1.00 0.00 N ATOM 3225 NH2 ARG B 108 9.955 -3.903 6.931 1.00 0.00 N ATOM 0 H ARG B 108 16.111 -0.401 8.956 1.00 0.00 H new ATOM 0 HA ARG B 108 14.744 -2.304 10.764 1.00 0.00 H new ATOM 0 HB2 ARG B 108 15.903 -2.907 8.060 1.00 0.00 H new ATOM 0 HB3 ARG B 108 14.685 -3.782 8.965 1.00 0.00 H new ATOM 0 HG2 ARG B 108 14.284 -1.058 7.670 1.00 0.00 H new ATOM 0 HG3 ARG B 108 13.771 -2.587 6.985 1.00 0.00 H new ATOM 0 HD2 ARG B 108 12.752 -1.978 9.729 1.00 0.00 H new ATOM 0 HD3 ARG B 108 12.149 -0.956 8.439 1.00 0.00 H new ATOM 0 HE ARG B 108 11.593 -3.827 8.841 1.00 0.00 H new ATOM 0 HH11 ARG B 108 11.467 -1.117 6.532 1.00 0.00 H new ATOM 0 HH12 ARG B 108 10.190 -1.871 5.572 1.00 0.00 H new ATOM 0 HH21 ARG B 108 9.910 -4.723 7.536 1.00 0.00 H new ATOM 0 HH22 ARG B 108 9.342 -3.834 6.119 1.00 0.00 H new ATOM 3239 N ALA B 109 17.903 -2.288 9.701 1.00 0.00 N ATOM 3240 CA ALA B 109 19.256 -2.819 9.822 1.00 0.00 C ATOM 3241 C ALA B 109 19.294 -4.315 10.180 1.00 0.00 C ATOM 3242 O ALA B 109 18.319 -5.050 10.003 1.00 0.00 O ATOM 3243 CB ALA B 109 20.029 -1.945 10.819 1.00 0.00 C ATOM 0 H ALA B 109 17.818 -1.628 8.928 1.00 0.00 H new ATOM 0 HA ALA B 109 19.743 -2.772 8.848 1.00 0.00 H new ATOM 0 HB1 ALA B 109 21.045 -2.325 10.925 1.00 0.00 H new ATOM 0 HB2 ALA B 109 20.062 -0.919 10.454 1.00 0.00 H new ATOM 0 HB3 ALA B 109 19.530 -1.970 11.788 1.00 0.00 H new ATOM 3249 N GLN B 110 20.464 -4.784 10.625 1.00 0.00 N ATOM 3250 CA GLN B 110 20.577 -6.111 11.230 1.00 0.00 C ATOM 3251 C GLN B 110 19.871 -6.047 12.585 1.00 0.00 C ATOM 3252 O GLN B 110 19.056 -6.916 12.894 1.00 0.00 O ATOM 3253 CB GLN B 110 22.046 -6.546 11.377 1.00 0.00 C ATOM 3254 CG GLN B 110 22.272 -7.840 12.182 1.00 0.00 C ATOM 3255 CD GLN B 110 21.515 -9.058 11.648 1.00 0.00 C ATOM 3256 OE1 GLN B 110 22.027 -9.828 10.839 1.00 0.00 O ATOM 3257 NE2 GLN B 110 20.287 -9.271 12.097 1.00 0.00 N ATOM 0 H GLN B 110 21.341 -4.266 10.577 1.00 0.00 H new ATOM 0 HA GLN B 110 20.110 -6.860 10.591 1.00 0.00 H new ATOM 0 HB2 GLN B 110 22.470 -6.678 10.382 1.00 0.00 H new ATOM 0 HB3 GLN B 110 22.601 -5.739 11.855 1.00 0.00 H new ATOM 0 HG2 GLN B 110 23.338 -8.066 12.191 1.00 0.00 H new ATOM 0 HG3 GLN B 110 21.974 -7.667 13.216 1.00 0.00 H new ATOM 0 HE21 GLN B 110 19.871 -8.626 12.769 1.00 0.00 H new ATOM 0 HE22 GLN B 110 19.758 -10.080 11.771 1.00 0.00 H new ATOM 3266 N GLY B 111 20.171 -5.018 13.382 1.00 0.00 N ATOM 3267 CA GLY B 111 19.446 -4.767 14.618 1.00 0.00 C ATOM 3268 C GLY B 111 20.289 -4.290 15.786 1.00 0.00 C ATOM 3269 O GLY B 111 19.752 -3.701 16.727 1.00 0.00 O ATOM 0 H GLY B 111 20.914 -4.347 13.187 1.00 0.00 H new ATOM 0 HA2 GLY B 111 18.675 -4.022 14.421 1.00 0.00 H new ATOM 0 HA3 GLY B 111 18.936 -5.684 14.912 1.00 0.00 H new ATOM 3273 N THR B 112 21.588 -4.567 15.748 1.00 0.00 N ATOM 3274 CA THR B 112 22.497 -4.200 16.823 1.00 0.00 C ATOM 3275 C THR B 112 22.693 -2.688 16.824 1.00 0.00 C ATOM 3276 O THR B 112 22.337 -1.996 15.865 1.00 0.00 O ATOM 3277 CB THR B 112 23.833 -4.941 16.678 1.00 0.00 C ATOM 3278 OG1 THR B 112 24.487 -4.531 15.506 1.00 0.00 O ATOM 3279 CG2 THR B 112 23.624 -6.443 16.572 1.00 0.00 C ATOM 0 H THR B 112 22.038 -5.052 14.971 1.00 0.00 H new ATOM 0 HA THR B 112 22.067 -4.495 17.780 1.00 0.00 H new ATOM 0 HB THR B 112 24.425 -4.708 17.563 1.00 0.00 H new ATOM 0 HG1 THR B 112 25.255 -5.116 15.338 1.00 0.00 H new ATOM 0 HG21 THR B 112 24.590 -6.938 16.470 1.00 0.00 H new ATOM 0 HG22 THR B 112 23.123 -6.805 17.470 1.00 0.00 H new ATOM 0 HG23 THR B 112 23.009 -6.664 15.700 1.00 0.00 H new ATOM 3287 N GLU B 113 23.306 -2.175 17.887 1.00 0.00 N ATOM 3288 CA GLU B 113 23.563 -0.752 18.008 1.00 0.00 C ATOM 3289 C GLU B 113 24.491 -0.278 16.889 1.00 0.00 C ATOM 3290 O GLU B 113 24.281 0.775 16.284 1.00 0.00 O ATOM 3291 CB GLU B 113 24.218 -0.472 19.367 1.00 0.00 C ATOM 3292 CG GLU B 113 23.306 -0.869 20.534 1.00 0.00 C ATOM 3293 CD GLU B 113 23.918 -0.479 21.892 1.00 0.00 C ATOM 3294 OE1 GLU B 113 24.663 -1.290 22.488 1.00 0.00 O ATOM 3295 OE2 GLU B 113 23.646 0.638 22.391 1.00 0.00 O ATOM 0 H GLU B 113 23.633 -2.730 18.678 1.00 0.00 H new ATOM 0 HA GLU B 113 22.618 -0.214 17.930 1.00 0.00 H new ATOM 0 HB2 GLU B 113 25.157 -1.021 19.437 1.00 0.00 H new ATOM 0 HB3 GLU B 113 24.462 0.588 19.441 1.00 0.00 H new ATOM 0 HG2 GLU B 113 22.336 -0.385 20.419 1.00 0.00 H new ATOM 0 HG3 GLU B 113 23.130 -1.944 20.509 1.00 0.00 H new ATOM 3302 N GLU B 114 25.513 -1.087 16.607 1.00 0.00 N ATOM 3303 CA GLU B 114 26.494 -0.835 15.586 1.00 0.00 C ATOM 3304 C GLU B 114 25.852 -1.019 14.227 1.00 0.00 C ATOM 3305 O GLU B 114 26.110 -0.190 13.366 1.00 0.00 O ATOM 3306 CB GLU B 114 27.733 -1.733 15.754 1.00 0.00 C ATOM 3307 CG GLU B 114 27.441 -3.203 16.078 1.00 0.00 C ATOM 3308 CD GLU B 114 28.737 -3.991 16.339 1.00 0.00 C ATOM 3309 OE1 GLU B 114 29.376 -4.470 15.373 1.00 0.00 O ATOM 3310 OE2 GLU B 114 29.130 -4.153 17.517 1.00 0.00 O ATOM 0 H GLU B 114 25.674 -1.961 17.108 1.00 0.00 H new ATOM 0 HA GLU B 114 26.846 0.193 15.678 1.00 0.00 H new ATOM 0 HB2 GLU B 114 28.319 -1.690 14.836 1.00 0.00 H new ATOM 0 HB3 GLU B 114 28.355 -1.320 16.548 1.00 0.00 H new ATOM 0 HG2 GLU B 114 26.795 -3.262 16.954 1.00 0.00 H new ATOM 0 HG3 GLU B 114 26.898 -3.658 15.250 1.00 0.00 H new ATOM 3317 N GLU B 115 25.004 -2.033 14.006 1.00 0.00 N ATOM 3318 CA GLU B 115 24.513 -2.283 12.664 1.00 0.00 C ATOM 3319 C GLU B 115 23.436 -1.266 12.304 1.00 0.00 C ATOM 3320 O GLU B 115 23.372 -0.847 11.153 1.00 0.00 O ATOM 3321 CB GLU B 115 24.056 -3.726 12.494 1.00 0.00 C ATOM 3322 CG GLU B 115 25.252 -4.699 12.518 1.00 0.00 C ATOM 3323 CD GLU B 115 25.961 -4.788 11.153 1.00 0.00 C ATOM 3324 OE1 GLU B 115 26.900 -4.003 10.895 1.00 0.00 O ATOM 3325 OE2 GLU B 115 25.602 -5.666 10.336 1.00 0.00 O ATOM 0 H GLU B 115 24.658 -2.671 14.723 1.00 0.00 H new ATOM 0 HA GLU B 115 25.332 -2.151 11.957 1.00 0.00 H new ATOM 0 HB2 GLU B 115 23.358 -3.985 13.290 1.00 0.00 H new ATOM 0 HB3 GLU B 115 23.518 -3.831 11.552 1.00 0.00 H new ATOM 0 HG2 GLU B 115 25.966 -4.375 13.275 1.00 0.00 H new ATOM 0 HG3 GLU B 115 24.905 -5.690 12.810 1.00 0.00 H new ATOM 3332 N LYS B 116 22.626 -0.810 13.267 1.00 0.00 N ATOM 3333 CA LYS B 116 21.729 0.324 13.062 1.00 0.00 C ATOM 3334 C LYS B 116 22.540 1.525 12.606 1.00 0.00 C ATOM 3335 O LYS B 116 22.280 2.048 11.525 1.00 0.00 O ATOM 3336 CB LYS B 116 20.952 0.653 14.349 1.00 0.00 C ATOM 3337 CG LYS B 116 19.791 -0.307 14.649 1.00 0.00 C ATOM 3338 CD LYS B 116 18.466 0.129 13.995 1.00 0.00 C ATOM 3339 CE LYS B 116 17.352 -0.817 14.473 1.00 0.00 C ATOM 3340 NZ LYS B 116 15.979 -0.299 14.246 1.00 0.00 N ATOM 0 H LYS B 116 22.577 -1.216 14.202 1.00 0.00 H new ATOM 0 HA LYS B 116 20.999 0.066 12.295 1.00 0.00 H new ATOM 0 HB2 LYS B 116 21.645 0.641 15.191 1.00 0.00 H new ATOM 0 HB3 LYS B 116 20.559 1.667 14.273 1.00 0.00 H new ATOM 0 HG2 LYS B 116 20.052 -1.305 14.298 1.00 0.00 H new ATOM 0 HG3 LYS B 116 19.652 -0.375 15.728 1.00 0.00 H new ATOM 0 HD2 LYS B 116 18.231 1.158 14.265 1.00 0.00 H new ATOM 0 HD3 LYS B 116 18.551 0.096 12.909 1.00 0.00 H new ATOM 0 HE2 LYS B 116 17.457 -1.773 13.961 1.00 0.00 H new ATOM 0 HE3 LYS B 116 17.485 -1.009 15.538 1.00 0.00 H new ATOM 0 HZ1 LYS B 116 15.292 -0.914 14.727 1.00 0.00 H new ATOM 0 HZ2 LYS B 116 15.905 0.666 14.626 1.00 0.00 H new ATOM 0 HZ3 LYS B 116 15.777 -0.286 13.226 1.00 0.00 H new ATOM 3354 N TRP B 117 23.544 1.935 13.381 1.00 0.00 N ATOM 3355 CA TRP B 117 24.346 3.098 13.023 1.00 0.00 C ATOM 3356 C TRP B 117 25.011 2.868 11.661 1.00 0.00 C ATOM 3357 O TRP B 117 24.994 3.750 10.810 1.00 0.00 O ATOM 3358 CB TRP B 117 25.358 3.410 14.139 1.00 0.00 C ATOM 3359 CG TRP B 117 26.058 4.739 14.101 1.00 0.00 C ATOM 3360 CD1 TRP B 117 26.013 5.657 13.108 1.00 0.00 C ATOM 3361 CD2 TRP B 117 26.912 5.328 15.130 1.00 0.00 C ATOM 3362 NE1 TRP B 117 26.792 6.743 13.431 1.00 0.00 N ATOM 3363 CE2 TRP B 117 27.365 6.599 14.671 1.00 0.00 C ATOM 3364 CE3 TRP B 117 27.345 4.925 16.413 1.00 0.00 C ATOM 3365 CZ2 TRP B 117 28.202 7.421 15.431 1.00 0.00 C ATOM 3366 CZ3 TRP B 117 28.187 5.746 17.190 1.00 0.00 C ATOM 3367 CH2 TRP B 117 28.620 6.992 16.701 1.00 0.00 C ATOM 0 H TRP B 117 23.817 1.482 14.253 1.00 0.00 H new ATOM 0 HA TRP B 117 23.708 3.976 12.926 1.00 0.00 H new ATOM 0 HB2 TRP B 117 24.838 3.333 15.094 1.00 0.00 H new ATOM 0 HB3 TRP B 117 26.120 2.630 14.128 1.00 0.00 H new ATOM 0 HD1 TRP B 117 25.447 5.552 12.194 1.00 0.00 H new ATOM 0 HE1 TRP B 117 26.927 7.553 12.826 1.00 0.00 H new ATOM 0 HE3 TRP B 117 27.025 3.971 16.805 1.00 0.00 H new ATOM 0 HZ2 TRP B 117 28.524 8.377 15.045 1.00 0.00 H new ATOM 0 HZ3 TRP B 117 28.502 5.416 18.169 1.00 0.00 H new ATOM 0 HH2 TRP B 117 29.270 7.614 17.298 1.00 0.00 H new ATOM 3378 N ALA B 118 25.528 1.669 11.411 1.00 0.00 N ATOM 3379 CA ALA B 118 26.192 1.299 10.173 1.00 0.00 C ATOM 3380 C ALA B 118 25.263 1.432 8.961 1.00 0.00 C ATOM 3381 O ALA B 118 25.656 2.007 7.943 1.00 0.00 O ATOM 3382 CB ALA B 118 26.725 -0.132 10.333 1.00 0.00 C ATOM 0 H ALA B 118 25.493 0.907 12.088 1.00 0.00 H new ATOM 0 HA ALA B 118 27.020 1.982 9.981 1.00 0.00 H new ATOM 0 HB1 ALA B 118 27.230 -0.437 9.416 1.00 0.00 H new ATOM 0 HB2 ALA B 118 27.430 -0.167 11.164 1.00 0.00 H new ATOM 0 HB3 ALA B 118 25.895 -0.809 10.533 1.00 0.00 H new ATOM 3388 N PHE B 119 24.025 0.945 9.072 1.00 0.00 N ATOM 3389 CA PHE B 119 23.024 1.072 8.021 1.00 0.00 C ATOM 3390 C PHE B 119 22.690 2.544 7.820 1.00 0.00 C ATOM 3391 O PHE B 119 22.679 3.021 6.687 1.00 0.00 O ATOM 3392 CB PHE B 119 21.758 0.260 8.350 1.00 0.00 C ATOM 3393 CG PHE B 119 21.751 -1.148 7.781 1.00 0.00 C ATOM 3394 CD1 PHE B 119 22.735 -2.081 8.162 1.00 0.00 C ATOM 3395 CD2 PHE B 119 20.760 -1.532 6.853 1.00 0.00 C ATOM 3396 CE1 PHE B 119 22.723 -3.384 7.634 1.00 0.00 C ATOM 3397 CE2 PHE B 119 20.746 -2.836 6.328 1.00 0.00 C ATOM 3398 CZ PHE B 119 21.726 -3.764 6.719 1.00 0.00 C ATOM 0 H PHE B 119 23.691 0.450 9.899 1.00 0.00 H new ATOM 0 HA PHE B 119 23.433 0.666 7.096 1.00 0.00 H new ATOM 0 HB2 PHE B 119 21.650 0.202 9.433 1.00 0.00 H new ATOM 0 HB3 PHE B 119 20.888 0.796 7.971 1.00 0.00 H new ATOM 0 HD1 PHE B 119 23.504 -1.794 8.864 1.00 0.00 H new ATOM 0 HD2 PHE B 119 20.008 -0.821 6.544 1.00 0.00 H new ATOM 0 HE1 PHE B 119 23.481 -4.094 7.932 1.00 0.00 H new ATOM 0 HE2 PHE B 119 19.981 -3.125 5.623 1.00 0.00 H new ATOM 0 HZ PHE B 119 21.713 -4.767 6.318 1.00 0.00 H new ATOM 3408 N PHE B 120 22.451 3.281 8.906 1.00 0.00 N ATOM 3409 CA PHE B 120 22.091 4.684 8.815 1.00 0.00 C ATOM 3410 C PHE B 120 23.210 5.533 8.237 1.00 0.00 C ATOM 3411 O PHE B 120 22.916 6.428 7.454 1.00 0.00 O ATOM 3412 CB PHE B 120 21.580 5.203 10.162 1.00 0.00 C ATOM 3413 CG PHE B 120 20.092 4.978 10.219 1.00 0.00 C ATOM 3414 CD1 PHE B 120 19.562 3.749 10.641 1.00 0.00 C ATOM 3415 CD2 PHE B 120 19.241 5.969 9.708 1.00 0.00 C ATOM 3416 CE1 PHE B 120 18.178 3.532 10.569 1.00 0.00 C ATOM 3417 CE2 PHE B 120 17.860 5.738 9.590 1.00 0.00 C ATOM 3418 CZ PHE B 120 17.326 4.512 10.016 1.00 0.00 C ATOM 0 H PHE B 120 22.502 2.921 9.859 1.00 0.00 H new ATOM 0 HA PHE B 120 21.268 4.771 8.105 1.00 0.00 H new ATOM 0 HB2 PHE B 120 22.075 4.683 10.982 1.00 0.00 H new ATOM 0 HB3 PHE B 120 21.809 6.263 10.273 1.00 0.00 H new ATOM 0 HD1 PHE B 120 20.215 2.976 11.018 1.00 0.00 H new ATOM 0 HD2 PHE B 120 19.652 6.920 9.402 1.00 0.00 H new ATOM 0 HE1 PHE B 120 17.761 2.607 10.940 1.00 0.00 H new ATOM 0 HE2 PHE B 120 17.215 6.498 9.175 1.00 0.00 H new ATOM 0 HZ PHE B 120 16.268 4.319 9.921 1.00 0.00 H new ATOM 3428 N GLN B 121 24.473 5.233 8.537 1.00 0.00 N ATOM 3429 CA GLN B 121 25.613 5.919 7.960 1.00 0.00 C ATOM 3430 C GLN B 121 25.624 5.732 6.440 1.00 0.00 C ATOM 3431 O GLN B 121 25.739 6.704 5.687 1.00 0.00 O ATOM 3432 CB GLN B 121 26.886 5.379 8.624 1.00 0.00 C ATOM 3433 CG GLN B 121 28.123 6.129 8.129 1.00 0.00 C ATOM 3434 CD GLN B 121 29.388 5.680 8.863 1.00 0.00 C ATOM 3435 OE1 GLN B 121 30.296 5.097 8.275 1.00 0.00 O ATOM 3436 NE2 GLN B 121 29.476 5.929 10.161 1.00 0.00 N ATOM 0 H GLN B 121 24.729 4.498 9.196 1.00 0.00 H new ATOM 0 HA GLN B 121 25.555 6.992 8.143 1.00 0.00 H new ATOM 0 HB2 GLN B 121 26.806 5.478 9.707 1.00 0.00 H new ATOM 0 HB3 GLN B 121 26.990 4.316 8.408 1.00 0.00 H new ATOM 0 HG2 GLN B 121 28.245 5.963 7.059 1.00 0.00 H new ATOM 0 HG3 GLN B 121 27.980 7.200 8.271 1.00 0.00 H new ATOM 0 HE21 GLN B 121 28.717 6.414 10.640 1.00 0.00 H new ATOM 0 HE22 GLN B 121 30.303 5.636 10.682 1.00 0.00 H new ATOM 3445 N ARG B 122 25.477 4.485 5.978 1.00 0.00 N ATOM 3446 CA ARG B 122 25.493 4.194 4.553 1.00 0.00 C ATOM 3447 C ARG B 122 24.320 4.896 3.871 1.00 0.00 C ATOM 3448 O ARG B 122 24.512 5.609 2.885 1.00 0.00 O ATOM 3449 CB ARG B 122 25.442 2.670 4.342 1.00 0.00 C ATOM 3450 CG ARG B 122 25.377 2.285 2.853 1.00 0.00 C ATOM 3451 CD ARG B 122 25.325 0.768 2.640 1.00 0.00 C ATOM 3452 NE ARG B 122 24.102 0.161 3.206 1.00 0.00 N ATOM 3453 CZ ARG B 122 24.015 -0.626 4.288 1.00 0.00 C ATOM 3454 NH1 ARG B 122 25.089 -0.926 5.017 1.00 0.00 N ATOM 3455 NH2 ARG B 122 22.833 -1.108 4.643 1.00 0.00 N ATOM 0 H ARG B 122 25.346 3.668 6.574 1.00 0.00 H new ATOM 0 HA ARG B 122 26.413 4.568 4.104 1.00 0.00 H new ATOM 0 HB2 ARG B 122 26.323 2.214 4.794 1.00 0.00 H new ATOM 0 HB3 ARG B 122 24.572 2.264 4.858 1.00 0.00 H new ATOM 0 HG2 ARG B 122 24.497 2.742 2.401 1.00 0.00 H new ATOM 0 HG3 ARG B 122 26.247 2.691 2.338 1.00 0.00 H new ATOM 0 HD2 ARG B 122 25.374 0.552 1.573 1.00 0.00 H new ATOM 0 HD3 ARG B 122 26.201 0.309 3.099 1.00 0.00 H new ATOM 0 HE ARG B 122 23.228 0.363 2.720 1.00 0.00 H new ATOM 0 HH11 ARG B 122 26.002 -0.555 4.756 1.00 0.00 H new ATOM 0 HH12 ARG B 122 24.998 -1.527 5.836 1.00 0.00 H new ATOM 0 HH21 ARG B 122 22.004 -0.879 4.095 1.00 0.00 H new ATOM 0 HH22 ARG B 122 22.753 -1.708 5.464 1.00 0.00 H new ATOM 3469 N VAL B 123 23.105 4.692 4.382 1.00 0.00 N ATOM 3470 CA VAL B 123 21.915 5.189 3.715 1.00 0.00 C ATOM 3471 C VAL B 123 21.865 6.720 3.789 1.00 0.00 C ATOM 3472 O VAL B 123 21.458 7.325 2.801 1.00 0.00 O ATOM 3473 CB VAL B 123 20.645 4.489 4.245 1.00 0.00 C ATOM 3474 CG1 VAL B 123 19.395 5.042 3.546 1.00 0.00 C ATOM 3475 CG2 VAL B 123 20.681 2.967 3.993 1.00 0.00 C ATOM 0 H VAL B 123 22.926 4.188 5.251 1.00 0.00 H new ATOM 0 HA VAL B 123 21.959 4.937 2.656 1.00 0.00 H new ATOM 0 HB VAL B 123 20.610 4.682 5.317 1.00 0.00 H new ATOM 0 HG11 VAL B 123 18.509 4.537 3.932 1.00 0.00 H new ATOM 0 HG12 VAL B 123 19.315 6.112 3.737 1.00 0.00 H new ATOM 0 HG13 VAL B 123 19.472 4.870 2.472 1.00 0.00 H new ATOM 0 HG21 VAL B 123 19.769 2.512 4.381 1.00 0.00 H new ATOM 0 HG22 VAL B 123 20.754 2.777 2.922 1.00 0.00 H new ATOM 0 HG23 VAL B 123 21.545 2.535 4.498 1.00 0.00 H new ATOM 3485 N ARG B 124 22.307 7.380 4.874 1.00 0.00 N ATOM 3486 CA ARG B 124 22.289 8.847 4.918 1.00 0.00 C ATOM 3487 C ARG B 124 23.170 9.439 3.829 1.00 0.00 C ATOM 3488 O ARG B 124 22.759 10.411 3.201 1.00 0.00 O ATOM 3489 CB ARG B 124 22.628 9.424 6.309 1.00 0.00 C ATOM 3490 CG ARG B 124 24.093 9.387 6.762 1.00 0.00 C ATOM 3491 CD ARG B 124 24.254 10.112 8.103 1.00 0.00 C ATOM 3492 NE ARG B 124 25.493 9.756 8.813 1.00 0.00 N ATOM 3493 CZ ARG B 124 26.757 10.068 8.494 1.00 0.00 C ATOM 3494 NH1 ARG B 124 27.047 10.689 7.353 1.00 0.00 N ATOM 3495 NH2 ARG B 124 27.733 9.756 9.339 1.00 0.00 N ATOM 0 H ARG B 124 22.673 6.930 5.713 1.00 0.00 H new ATOM 0 HA ARG B 124 21.260 9.147 4.721 1.00 0.00 H new ATOM 0 HB2 ARG B 124 22.297 10.462 6.330 1.00 0.00 H new ATOM 0 HB3 ARG B 124 22.035 8.885 7.048 1.00 0.00 H new ATOM 0 HG2 ARG B 124 24.425 8.353 6.858 1.00 0.00 H new ATOM 0 HG3 ARG B 124 24.726 9.857 6.009 1.00 0.00 H new ATOM 0 HD2 ARG B 124 24.239 11.188 7.930 1.00 0.00 H new ATOM 0 HD3 ARG B 124 23.400 9.879 8.739 1.00 0.00 H new ATOM 0 HE ARG B 124 25.374 9.199 9.659 1.00 0.00 H new ATOM 0 HH11 ARG B 124 26.301 10.936 6.703 1.00 0.00 H new ATOM 0 HH12 ARG B 124 28.015 10.918 7.129 1.00 0.00 H new ATOM 0 HH21 ARG B 124 27.516 9.285 10.217 1.00 0.00 H new ATOM 0 HH22 ARG B 124 28.700 9.987 9.110 1.00 0.00 H new ATOM 3509 N ASP B 125 24.347 8.854 3.593 1.00 0.00 N ATOM 3510 CA ASP B 125 25.241 9.337 2.544 1.00 0.00 C ATOM 3511 C ASP B 125 24.551 9.263 1.180 1.00 0.00 C ATOM 3512 O ASP B 125 24.601 10.218 0.402 1.00 0.00 O ATOM 3513 CB ASP B 125 26.541 8.527 2.523 1.00 0.00 C ATOM 3514 CG ASP B 125 27.448 8.999 1.375 1.00 0.00 C ATOM 3515 OD1 ASP B 125 28.062 10.083 1.493 1.00 0.00 O ATOM 3516 OD2 ASP B 125 27.578 8.276 0.362 1.00 0.00 O ATOM 0 H ASP B 125 24.699 8.050 4.112 1.00 0.00 H new ATOM 0 HA ASP B 125 25.487 10.377 2.758 1.00 0.00 H new ATOM 0 HB2 ASP B 125 27.061 8.637 3.475 1.00 0.00 H new ATOM 0 HB3 ASP B 125 26.315 7.467 2.404 1.00 0.00 H new ATOM 3521 N GLU B 126 23.862 8.150 0.914 1.00 0.00 N ATOM 3522 CA GLU B 126 23.170 7.932 -0.347 1.00 0.00 C ATOM 3523 C GLU B 126 21.968 8.879 -0.483 1.00 0.00 C ATOM 3524 O GLU B 126 21.857 9.577 -1.492 1.00 0.00 O ATOM 3525 CB GLU B 126 22.765 6.452 -0.452 1.00 0.00 C ATOM 3526 CG GLU B 126 22.349 6.108 -1.888 1.00 0.00 C ATOM 3527 CD GLU B 126 21.930 4.642 -2.088 1.00 0.00 C ATOM 3528 OE1 GLU B 126 22.498 3.723 -1.452 1.00 0.00 O ATOM 3529 OE2 GLU B 126 21.057 4.409 -2.954 1.00 0.00 O ATOM 0 H GLU B 126 23.772 7.376 1.573 1.00 0.00 H new ATOM 0 HA GLU B 126 23.837 8.161 -1.178 1.00 0.00 H new ATOM 0 HB2 GLU B 126 23.598 5.819 -0.147 1.00 0.00 H new ATOM 0 HB3 GLU B 126 21.941 6.245 0.231 1.00 0.00 H new ATOM 0 HG2 GLU B 126 21.521 6.754 -2.179 1.00 0.00 H new ATOM 0 HG3 GLU B 126 23.179 6.332 -2.558 1.00 0.00 H new ATOM 3536 N ILE B 127 21.098 8.944 0.532 1.00 0.00 N ATOM 3537 CA ILE B 127 19.915 9.802 0.552 1.00 0.00 C ATOM 3538 C ILE B 127 20.344 11.252 0.322 1.00 0.00 C ATOM 3539 O ILE B 127 19.770 11.916 -0.541 1.00 0.00 O ATOM 3540 CB ILE B 127 19.108 9.586 1.866 1.00 0.00 C ATOM 3541 CG1 ILE B 127 18.287 8.275 1.754 1.00 0.00 C ATOM 3542 CG2 ILE B 127 18.174 10.759 2.213 1.00 0.00 C ATOM 3543 CD1 ILE B 127 17.323 7.978 2.919 1.00 0.00 C ATOM 0 H ILE B 127 21.203 8.387 1.380 1.00 0.00 H new ATOM 0 HA ILE B 127 19.234 9.537 -0.257 1.00 0.00 H new ATOM 0 HB ILE B 127 19.834 9.521 2.677 1.00 0.00 H new ATOM 0 HG12 ILE B 127 17.709 8.310 0.831 1.00 0.00 H new ATOM 0 HG13 ILE B 127 18.983 7.441 1.663 1.00 0.00 H new ATOM 0 HG21 ILE B 127 17.644 10.540 3.140 1.00 0.00 H new ATOM 0 HG22 ILE B 127 18.762 11.668 2.338 1.00 0.00 H new ATOM 0 HG23 ILE B 127 17.453 10.901 1.408 1.00 0.00 H new ATOM 0 HD11 ILE B 127 16.804 7.038 2.731 1.00 0.00 H new ATOM 0 HD12 ILE B 127 17.888 7.902 3.848 1.00 0.00 H new ATOM 0 HD13 ILE B 127 16.594 8.784 3.003 1.00 0.00 H new ATOM 3555 N GLY B 128 21.356 11.740 1.043 1.00 0.00 N ATOM 3556 CA GLY B 128 21.806 13.115 0.917 1.00 0.00 C ATOM 3557 C GLY B 128 22.231 13.431 -0.510 1.00 0.00 C ATOM 3558 O GLY B 128 21.784 14.434 -1.070 1.00 0.00 O ATOM 0 H GLY B 128 21.880 11.191 1.725 1.00 0.00 H new ATOM 0 HA2 GLY B 128 21.005 13.791 1.218 1.00 0.00 H new ATOM 0 HA3 GLY B 128 22.642 13.290 1.594 1.00 0.00 H new ATOM 3562 N ASN B 129 23.032 12.558 -1.130 1.00 0.00 N ATOM 3563 CA ASN B 129 23.453 12.762 -2.508 1.00 0.00 C ATOM 3564 C ASN B 129 22.267 12.761 -3.467 1.00 0.00 C ATOM 3565 O ASN B 129 22.174 13.645 -4.317 1.00 0.00 O ATOM 3566 CB ASN B 129 24.482 11.712 -2.952 1.00 0.00 C ATOM 3567 CG ASN B 129 24.803 11.923 -4.432 1.00 0.00 C ATOM 3568 OD1 ASN B 129 25.547 12.832 -4.789 1.00 0.00 O ATOM 3569 ND2 ASN B 129 24.222 11.128 -5.317 1.00 0.00 N ATOM 0 H ASN B 129 23.397 11.710 -0.697 1.00 0.00 H new ATOM 0 HA ASN B 129 23.925 13.744 -2.543 1.00 0.00 H new ATOM 0 HB2 ASN B 129 25.389 11.798 -2.354 1.00 0.00 H new ATOM 0 HB3 ASN B 129 24.089 10.708 -2.792 1.00 0.00 H new ATOM 0 HD21 ASN B 129 24.390 11.266 -6.314 1.00 0.00 H new ATOM 0 HD22 ASN B 129 23.607 10.378 -5.002 1.00 0.00 H new ATOM 3576 N ARG B 130 21.364 11.787 -3.345 1.00 0.00 N ATOM 3577 CA ARG B 130 20.233 11.672 -4.265 1.00 0.00 C ATOM 3578 C ARG B 130 19.338 12.901 -4.150 1.00 0.00 C ATOM 3579 O ARG B 130 19.013 13.505 -5.169 1.00 0.00 O ATOM 3580 CB ARG B 130 19.443 10.376 -4.023 1.00 0.00 C ATOM 3581 CG ARG B 130 20.240 9.132 -4.453 1.00 0.00 C ATOM 3582 CD ARG B 130 19.363 7.873 -4.380 1.00 0.00 C ATOM 3583 NE ARG B 130 20.121 6.623 -4.575 1.00 0.00 N ATOM 3584 CZ ARG B 130 20.758 6.192 -5.670 1.00 0.00 C ATOM 3585 NH1 ARG B 130 20.789 6.905 -6.794 1.00 0.00 N ATOM 3586 NH2 ARG B 130 21.360 5.014 -5.609 1.00 0.00 N ATOM 0 H ARG B 130 21.394 11.069 -2.621 1.00 0.00 H new ATOM 0 HA ARG B 130 20.620 11.623 -5.283 1.00 0.00 H new ATOM 0 HB2 ARG B 130 19.189 10.297 -2.966 1.00 0.00 H new ATOM 0 HB3 ARG B 130 18.504 10.414 -4.575 1.00 0.00 H new ATOM 0 HG2 ARG B 130 20.610 9.265 -5.470 1.00 0.00 H new ATOM 0 HG3 ARG B 130 21.111 9.012 -3.809 1.00 0.00 H new ATOM 0 HD2 ARG B 130 18.865 7.841 -3.411 1.00 0.00 H new ATOM 0 HD3 ARG B 130 18.582 7.938 -5.137 1.00 0.00 H new ATOM 0 HE ARG B 130 20.166 6.003 -3.766 1.00 0.00 H new ATOM 0 HH11 ARG B 130 20.318 7.809 -6.838 1.00 0.00 H new ATOM 0 HH12 ARG B 130 21.284 6.548 -7.611 1.00 0.00 H new ATOM 0 HH21 ARG B 130 21.328 4.469 -4.748 1.00 0.00 H new ATOM 0 HH22 ARG B 130 21.856 4.652 -6.424 1.00 0.00 H new ATOM 3600 N LEU B 131 18.986 13.318 -2.931 1.00 0.00 N ATOM 3601 CA LEU B 131 18.128 14.480 -2.740 1.00 0.00 C ATOM 3602 C LEU B 131 18.815 15.753 -3.230 1.00 0.00 C ATOM 3603 O LEU B 131 18.146 16.603 -3.822 1.00 0.00 O ATOM 3604 CB LEU B 131 17.685 14.618 -1.269 1.00 0.00 C ATOM 3605 CG LEU B 131 16.383 13.879 -0.898 1.00 0.00 C ATOM 3606 CD1 LEU B 131 15.184 14.416 -1.687 1.00 0.00 C ATOM 3607 CD2 LEU B 131 16.443 12.362 -1.112 1.00 0.00 C ATOM 0 H LEU B 131 19.283 12.866 -2.066 1.00 0.00 H new ATOM 0 HA LEU B 131 17.230 14.330 -3.340 1.00 0.00 H new ATOM 0 HB2 LEU B 131 18.487 14.249 -0.630 1.00 0.00 H new ATOM 0 HB3 LEU B 131 17.559 15.677 -1.043 1.00 0.00 H new ATOM 0 HG LEU B 131 16.263 14.070 0.168 1.00 0.00 H new ATOM 0 HD11 LEU B 131 14.285 13.871 -1.399 1.00 0.00 H new ATOM 0 HD12 LEU B 131 15.051 15.476 -1.470 1.00 0.00 H new ATOM 0 HD13 LEU B 131 15.362 14.284 -2.754 1.00 0.00 H new ATOM 0 HD21 LEU B 131 15.490 11.917 -0.828 1.00 0.00 H new ATOM 0 HD22 LEU B 131 16.644 12.150 -2.162 1.00 0.00 H new ATOM 0 HD23 LEU B 131 17.238 11.939 -0.498 1.00 0.00 H new ATOM 3619 N LYS B 132 20.135 15.892 -3.042 1.00 0.00 N ATOM 3620 CA LYS B 132 20.867 17.019 -3.597 1.00 0.00 C ATOM 3621 C LYS B 132 20.800 16.977 -5.120 1.00 0.00 C ATOM 3622 O LYS B 132 20.530 18.011 -5.724 1.00 0.00 O ATOM 3623 CB LYS B 132 22.303 16.987 -3.065 1.00 0.00 C ATOM 3624 CG LYS B 132 23.121 18.208 -3.505 1.00 0.00 C ATOM 3625 CD LYS B 132 24.566 18.113 -3.002 1.00 0.00 C ATOM 3626 CE LYS B 132 24.666 18.263 -1.476 1.00 0.00 C ATOM 3627 NZ LYS B 132 26.075 18.337 -1.012 1.00 0.00 N ATOM 0 H LYS B 132 20.708 15.236 -2.511 1.00 0.00 H new ATOM 0 HA LYS B 132 20.420 17.964 -3.288 1.00 0.00 H new ATOM 0 HB2 LYS B 132 22.282 16.941 -1.976 1.00 0.00 H new ATOM 0 HB3 LYS B 132 22.796 16.079 -3.413 1.00 0.00 H new ATOM 0 HG2 LYS B 132 23.115 18.281 -4.593 1.00 0.00 H new ATOM 0 HG3 LYS B 132 22.658 19.117 -3.122 1.00 0.00 H new ATOM 0 HD2 LYS B 132 24.989 17.153 -3.298 1.00 0.00 H new ATOM 0 HD3 LYS B 132 25.166 18.887 -3.481 1.00 0.00 H new ATOM 0 HE2 LYS B 132 24.135 19.163 -1.165 1.00 0.00 H new ATOM 0 HE3 LYS B 132 24.171 17.419 -0.996 1.00 0.00 H new ATOM 0 HZ1 LYS B 132 26.095 18.438 0.023 1.00 0.00 H new ATOM 0 HZ2 LYS B 132 26.576 17.468 -1.285 1.00 0.00 H new ATOM 0 HZ3 LYS B 132 26.542 19.157 -1.449 1.00 0.00 H new ATOM 3641 N GLU B 133 20.979 15.814 -5.755 1.00 0.00 N ATOM 3642 CA GLU B 133 20.848 15.719 -7.201 1.00 0.00 C ATOM 3643 C GLU B 133 19.462 16.116 -7.650 1.00 0.00 C ATOM 3644 O GLU B 133 19.383 16.756 -8.683 1.00 0.00 O ATOM 3645 CB GLU B 133 21.168 14.326 -7.773 1.00 0.00 C ATOM 3646 CG GLU B 133 22.650 14.227 -8.127 1.00 0.00 C ATOM 3647 CD GLU B 133 23.043 12.825 -8.628 1.00 0.00 C ATOM 3648 OE1 GLU B 133 22.674 12.454 -9.766 1.00 0.00 O ATOM 3649 OE2 GLU B 133 23.755 12.092 -7.904 1.00 0.00 O ATOM 0 H GLU B 133 21.213 14.937 -5.290 1.00 0.00 H new ATOM 0 HA GLU B 133 21.593 16.412 -7.592 1.00 0.00 H new ATOM 0 HB2 GLU B 133 20.909 13.558 -7.044 1.00 0.00 H new ATOM 0 HB3 GLU B 133 20.562 14.141 -8.660 1.00 0.00 H new ATOM 0 HG2 GLU B 133 22.887 14.964 -8.895 1.00 0.00 H new ATOM 0 HG3 GLU B 133 23.247 14.477 -7.250 1.00 0.00 H new ATOM 3656 N PHE B 134 18.374 15.805 -6.944 1.00 0.00 N ATOM 3657 CA PHE B 134 17.045 16.188 -7.435 1.00 0.00 C ATOM 3658 C PHE B 134 16.963 17.700 -7.593 1.00 0.00 C ATOM 3659 O PHE B 134 16.421 18.209 -8.572 1.00 0.00 O ATOM 3660 CB PHE B 134 15.937 15.757 -6.471 1.00 0.00 C ATOM 3661 CG PHE B 134 15.757 14.278 -6.222 1.00 0.00 C ATOM 3662 CD1 PHE B 134 16.538 13.305 -6.865 1.00 0.00 C ATOM 3663 CD2 PHE B 134 14.777 13.890 -5.302 1.00 0.00 C ATOM 3664 CE1 PHE B 134 16.339 11.940 -6.583 1.00 0.00 C ATOM 3665 CE2 PHE B 134 14.569 12.530 -5.017 1.00 0.00 C ATOM 3666 CZ PHE B 134 15.350 11.553 -5.659 1.00 0.00 C ATOM 0 H PHE B 134 18.381 15.304 -6.056 1.00 0.00 H new ATOM 0 HA PHE B 134 16.903 15.687 -8.392 1.00 0.00 H new ATOM 0 HB2 PHE B 134 16.122 16.238 -5.511 1.00 0.00 H new ATOM 0 HB3 PHE B 134 14.993 16.151 -6.848 1.00 0.00 H new ATOM 0 HD1 PHE B 134 17.293 13.604 -7.577 1.00 0.00 H new ATOM 0 HD2 PHE B 134 14.177 14.640 -4.808 1.00 0.00 H new ATOM 0 HE1 PHE B 134 16.943 11.192 -7.074 1.00 0.00 H new ATOM 0 HE2 PHE B 134 13.811 12.236 -4.306 1.00 0.00 H new ATOM 0 HZ PHE B 134 15.191 10.507 -5.443 1.00 0.00 H new ATOM 3676 N ALA B 135 17.552 18.396 -6.625 1.00 0.00 N ATOM 3677 CA ALA B 135 17.655 19.846 -6.632 1.00 0.00 C ATOM 3678 C ALA B 135 18.419 20.369 -7.862 1.00 0.00 C ATOM 3679 O ALA B 135 18.072 21.425 -8.392 1.00 0.00 O ATOM 3680 CB ALA B 135 18.298 20.347 -5.332 1.00 0.00 C ATOM 0 H ALA B 135 17.975 17.961 -5.805 1.00 0.00 H new ATOM 0 HA ALA B 135 16.642 20.243 -6.696 1.00 0.00 H new ATOM 0 HB1 ALA B 135 18.367 21.435 -5.356 1.00 0.00 H new ATOM 0 HB2 ALA B 135 17.688 20.040 -4.483 1.00 0.00 H new ATOM 0 HB3 ALA B 135 19.297 19.922 -5.233 1.00 0.00 H new ATOM 3686 N GLU B 136 19.448 19.648 -8.319 1.00 0.00 N ATOM 3687 CA GLU B 136 20.282 20.029 -9.456 1.00 0.00 C ATOM 3688 C GLU B 136 19.635 19.642 -10.792 1.00 0.00 C ATOM 3689 O GLU B 136 19.574 20.433 -11.734 1.00 0.00 O ATOM 3690 CB GLU B 136 21.672 19.368 -9.368 1.00 0.00 C ATOM 3691 CG GLU B 136 22.472 19.757 -8.119 1.00 0.00 C ATOM 3692 CD GLU B 136 23.942 19.318 -8.230 1.00 0.00 C ATOM 3693 OE1 GLU B 136 24.258 18.141 -7.941 1.00 0.00 O ATOM 3694 OE2 GLU B 136 24.802 20.151 -8.597 1.00 0.00 O ATOM 0 H GLU B 136 19.728 18.763 -7.896 1.00 0.00 H new ATOM 0 HA GLU B 136 20.387 21.113 -9.415 1.00 0.00 H new ATOM 0 HB2 GLU B 136 21.549 18.285 -9.385 1.00 0.00 H new ATOM 0 HB3 GLU B 136 22.247 19.638 -10.254 1.00 0.00 H new ATOM 0 HG2 GLU B 136 22.424 20.837 -7.977 1.00 0.00 H new ATOM 0 HG3 GLU B 136 22.020 19.299 -7.239 1.00 0.00 H new ATOM 3701 N THR B 137 19.167 18.400 -10.857 1.00 0.00 N ATOM 3702 CA THR B 137 18.704 17.699 -12.048 1.00 0.00 C ATOM 3703 C THR B 137 17.254 18.047 -12.394 1.00 0.00 C ATOM 3704 O THR B 137 16.842 17.912 -13.549 1.00 0.00 O ATOM 3705 CB THR B 137 18.906 16.183 -11.816 1.00 0.00 C ATOM 3706 OG1 THR B 137 18.120 15.724 -10.734 1.00 0.00 O ATOM 3707 CG2 THR B 137 20.383 15.833 -11.582 1.00 0.00 C ATOM 0 H THR B 137 19.097 17.818 -10.022 1.00 0.00 H new ATOM 0 HA THR B 137 19.286 18.016 -12.913 1.00 0.00 H new ATOM 0 HB THR B 137 18.580 15.677 -12.725 1.00 0.00 H new ATOM 0 HG1 THR B 137 18.610 15.854 -9.895 1.00 0.00 H new ATOM 0 HG21 THR B 137 20.482 14.759 -11.423 1.00 0.00 H new ATOM 0 HG22 THR B 137 20.969 16.126 -12.453 1.00 0.00 H new ATOM 0 HG23 THR B 137 20.748 16.365 -10.703 1.00 0.00 H new ATOM 3715 N GLY B 138 16.479 18.509 -11.406 1.00 0.00 N ATOM 3716 CA GLY B 138 15.034 18.659 -11.517 1.00 0.00 C ATOM 3717 C GLY B 138 14.350 17.286 -11.593 1.00 0.00 C ATOM 3718 O GLY B 138 13.150 17.215 -11.867 1.00 0.00 O ATOM 0 H GLY B 138 16.848 18.791 -10.498 1.00 0.00 H new ATOM 0 HA2 GLY B 138 14.654 19.213 -10.659 1.00 0.00 H new ATOM 0 HA3 GLY B 138 14.791 19.242 -12.406 1.00 0.00 H new ATOM 3722 N LYS B 139 15.109 16.217 -11.317 1.00 0.00 N ATOM 3723 CA LYS B 139 14.747 14.818 -11.437 1.00 0.00 C ATOM 3724 C LYS B 139 13.987 14.485 -12.725 1.00 0.00 C ATOM 3725 O LYS B 139 14.247 15.122 -13.768 1.00 0.00 O ATOM 3726 CB LYS B 139 14.086 14.394 -10.127 1.00 0.00 C ATOM 3727 CG LYS B 139 14.236 12.909 -9.810 1.00 0.00 C ATOM 3728 CD LYS B 139 15.611 12.233 -10.011 1.00 0.00 C ATOM 3729 CE LYS B 139 15.960 11.751 -11.435 1.00 0.00 C ATOM 3730 NZ LYS B 139 14.797 11.217 -12.181 1.00 0.00 N ATOM 3731 OXT LYS B 139 13.233 13.488 -12.728 1.00 0.00 O ATOM 0 H LYS B 139 16.065 16.328 -10.978 1.00 0.00 H new ATOM 0 HA LYS B 139 15.637 14.202 -11.568 1.00 0.00 H new ATOM 0 HB2 LYS B 139 14.515 14.975 -9.310 1.00 0.00 H new ATOM 0 HB3 LYS B 139 13.025 14.641 -10.170 1.00 0.00 H new ATOM 0 HG2 LYS B 139 13.948 12.765 -8.769 1.00 0.00 H new ATOM 0 HG3 LYS B 139 13.512 12.368 -10.419 1.00 0.00 H new ATOM 0 HD2 LYS B 139 16.382 12.935 -9.694 1.00 0.00 H new ATOM 0 HD3 LYS B 139 15.666 11.375 -9.341 1.00 0.00 H new ATOM 0 HE2 LYS B 139 16.391 12.581 -11.995 1.00 0.00 H new ATOM 0 HE3 LYS B 139 16.726 10.978 -11.371 1.00 0.00 H new ATOM 0 HZ1 LYS B 139 15.128 10.563 -12.918 1.00 0.00 H new ATOM 0 HZ2 LYS B 139 14.167 10.711 -11.526 1.00 0.00 H new ATOM 0 HZ3 LYS B 139 14.278 12.002 -12.623 1.00 0.00 H new TER 3745 LYS B 139