USER MOD reduce.3.24.130724 H: found=0, std=0, add=1738, rem=0, adj=64 USER MOD reduce.3.24.130724 removed 1734 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 100 ASN : amide:sc= -3.34! C(o=-8!,f=-21!) USER MOD Set 1.2: B 103 MET CE :methyl 146:sc= -4.7! (180deg=-1.53!) USER MOD Set 2.1: A 63 LYS NZ :NH3+ 176:sc= 1.07 (180deg=1.02) USER MOD Set 2.2: B 90 THR OG1 : rot -135:sc= 0.0298 USER MOD Set 3.1: A 41 SER OG : rot -123:sc= -9.14! USER MOD Set 3.2: B 79 HIS : no HD1:sc= -0.701 X(o=-9.8,f=-10) USER MOD Set 4.1: B 53 LYS NZ :NH3+ -156:sc= -0.901 (180deg=-1.56) USER MOD Set 4.2: B 56 THR OG1 : rot -54:sc= 1.14 USER MOD Set 5.1: B 44 THR OG1 : rot -48:sc= -1.77 USER MOD Set 5.2: B 47 CYS SG : rot -70:sc= -4.28 USER MOD Set 5.3: B 68 CYS SG : rot -155:sc= -2.79 USER MOD Set 6.1: A 79 HIS : no HD1:sc= -0.744 X(o=-9.8,f=-10) USER MOD Set 6.2: B 41 SER OG : rot 20:sc= -9.1! USER MOD Set 7.1: A 100 ASN : amide:sc= -3.31! C(o=-8!,f=-21!) USER MOD Set 7.2: A 103 MET CE :methyl 147:sc= -4.64! (180deg=-1.72!) USER MOD Set 8.1: A 90 THR OG1 : rot -137:sc= 0.215 USER MOD Set 8.2: B 63 LYS NZ :NH3+ 176:sc= 1.04 (180deg=0.983) USER MOD Set 9.1: A 53 LYS NZ :NH3+ -156:sc= -0.843 (180deg=-1.49!) USER MOD Set 9.2: A 56 THR OG1 : rot -54:sc= 1.12 USER MOD Set10.1: A 44 THR OG1 : rot -37:sc= -1.85 USER MOD Set10.2: A 47 CYS SG : rot -70:sc= -4.33 USER MOD Set10.3: A 68 CYS SG : rot -152:sc= -3 USER MOD Single : A 1 MET CE :methyl 156:sc= -0.151 (180deg=-0.76) USER MOD Single : A 1 MET N :NH3+ -164:sc= -0.0198 (180deg=-0.346) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 ASN : amide:sc= -3.03 X(o=-3,f=-3.5!) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 160:sc= 0.00509 USER MOD Single : A 31 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 32 ASN : amide:sc= -1.11 K(o=-1.1,f=-7.3!) USER MOD Single : A 33 GLN : amide:sc= -0.0848 X(o=-0.085,f=0) USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 TYR OH : rot 114:sc= -0.119 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 GLN : amide:sc= -3.21 K(o=-3.2,f=-7!) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 50 HIS : no HD1:sc= -0.266 X(o=-0.27,f=0.055) USER MOD Single : A 51 CYS SG : rot -22:sc= -1.98 USER MOD Single : A 59 ASN : amide:sc= -4.25 X(o=-4.3,f=-4.1!) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 TYR OH : rot 159:sc= -0.0806 USER MOD Single : A 67 THR OG1 : rot 48:sc= 0.852 USER MOD Single : A 71 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 72 GLN : amide:sc= -0.351 K(o=-0.35,f=-6.4!) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 ASN : amide:sc= -4.08 K(o=-4.1,f=-6!) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 CYS SG : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot -47:sc= 0.00749 USER MOD Single : A 89 THR OG1 : rot 180:sc= -1.26 USER MOD Single : A 93 SER OG : rot -72:sc= 2.28 USER MOD Single : A 95 THR OG1 : rot 20:sc= -3.44! USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 SER OG : rot 180:sc= -0.977 USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 CYS SG : rot 180:sc= -0.413 USER MOD Single : A 107 CYS SG : rot -20:sc= -1.29 USER MOD Single : A 108 THR OG1 : rot -61:sc= -0.298 USER MOD Single : B 1 MET CE :methyl 155:sc= -0.17 (180deg=-0.708) USER MOD Single : B 1 MET N :NH3+ -164:sc= 0 (180deg=-0.314) USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD Single : B 20 ASN : amide:sc= -2.87 K(o=-2.9,f=-3.4!) USER MOD Single : B 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 25 SER OG : rot 160:sc= 0.00612 USER MOD Single : B 31 GLN : amide:sc=-0.00762 K(o=-0.0076,f=-1.2) USER MOD Single : B 32 ASN : amide:sc= -1.09 K(o=-1.1,f=-7.3!) USER MOD Single : B 33 GLN : amide:sc= -0.0798 X(o=-0.08,f=0) USER MOD Single : B 34 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 35 TYR OH : rot 116:sc= -0.133 USER MOD Single : B 36 SER OG : rot 180:sc= 0 USER MOD Single : B 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 42 GLN : amide:sc= -3.11 K(o=-3.1,f=-7.1!) USER MOD Single : B 45 SER OG : rot 180:sc= 0 USER MOD Single : B 46 SER OG : rot 180:sc= 0 USER MOD Single : B 50 HIS : no HD1:sc= -0.26 X(o=-0.26,f=0.05) USER MOD Single : B 51 CYS SG : rot 70:sc= -2.03! USER MOD Single : B 59 ASN : amide:sc= -4.19 X(o=-4.2,f=-3.8!) USER MOD Single : B 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 64 TYR OH : rot 171:sc= -0.0228 USER MOD Single : B 67 THR OG1 : rot 47:sc= 0.855 USER MOD Single : B 71 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 72 GLN : amide:sc= -0.206 K(o=-0.21,f=-6.4!) USER MOD Single : B 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 74 ASN : amide:sc= -4.18 K(o=-4.2,f=-5.8!) USER MOD Single : B 80 THR OG1 : rot 180:sc= 0 USER MOD Single : B 83 SER OG : rot 180:sc= 0 USER MOD Single : B 84 CYS SG : rot 180:sc= 0 USER MOD Single : B 88 SER OG : rot -47:sc= 0.00813 USER MOD Single : B 89 THR OG1 : rot 180:sc= -1.26 USER MOD Single : B 93 SER OG : rot -70:sc= 2.3 USER MOD Single : B 95 THR OG1 : rot 20:sc= -3.44! USER MOD Single : B 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 102 SER OG : rot 180:sc= -0.994 USER MOD Single : B 104 TYR OH : rot 180:sc= 0 USER MOD Single : B 105 CYS SG : rot 180:sc= -0.397 USER MOD Single : B 107 CYS SG : rot -20:sc= -1.3 USER MOD Single : B 108 THR OG1 : rot -60:sc= -0.316 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 35.574 2.149 -12.306 1.00 0.00 N ATOM 2 CA MET A 1 34.585 2.318 -11.210 1.00 0.00 C ATOM 3 C MET A 1 33.562 3.397 -11.552 1.00 0.00 C ATOM 4 O MET A 1 33.678 4.539 -11.109 1.00 0.00 O ATOM 5 CB MET A 1 35.335 2.688 -9.929 1.00 0.00 C ATOM 6 CG MET A 1 36.482 1.747 -9.603 1.00 0.00 C ATOM 7 SD MET A 1 37.139 2.002 -7.943 1.00 0.00 S ATOM 8 CE MET A 1 35.748 1.477 -6.943 1.00 0.00 C ATOM 0 H1 MET A 1 36.081 1.250 -12.180 1.00 0.00 H new ATOM 0 H2 MET A 1 35.080 2.143 -13.221 1.00 0.00 H new ATOM 0 H3 MET A 1 36.254 2.936 -12.284 1.00 0.00 H new ATOM 0 HA MET A 1 34.042 1.383 -11.071 1.00 0.00 H new ATOM 0 HB2 MET A 1 35.724 3.702 -10.025 1.00 0.00 H new ATOM 0 HB3 MET A 1 34.633 2.694 -9.095 1.00 0.00 H new ATOM 0 HG2 MET A 1 36.140 0.717 -9.700 1.00 0.00 H new ATOM 0 HG3 MET A 1 37.281 1.888 -10.331 1.00 0.00 H new ATOM 0 HE1 MET A 1 36.103 1.168 -5.960 1.00 0.00 H new ATOM 0 HE2 MET A 1 35.047 2.304 -6.832 1.00 0.00 H new ATOM 0 HE3 MET A 1 35.247 0.639 -7.428 1.00 0.00 H new ATOM 18 N GLU A 2 32.560 3.026 -12.343 1.00 0.00 N ATOM 19 CA GLU A 2 31.517 3.962 -12.744 1.00 0.00 C ATOM 20 C GLU A 2 30.195 3.236 -12.976 1.00 0.00 C ATOM 21 O GLU A 2 30.095 2.371 -13.846 1.00 0.00 O ATOM 22 CB GLU A 2 31.932 4.707 -14.013 1.00 0.00 C ATOM 23 CG GLU A 2 31.020 5.873 -14.360 1.00 0.00 C ATOM 24 CD GLU A 2 31.688 6.885 -15.269 1.00 0.00 C ATOM 25 OE1 GLU A 2 31.764 6.627 -16.490 1.00 0.00 O ATOM 26 OE2 GLU A 2 32.136 7.935 -14.763 1.00 0.00 O ATOM 0 H GLU A 2 32.449 2.084 -12.718 1.00 0.00 H new ATOM 0 HA GLU A 2 31.379 4.682 -11.937 1.00 0.00 H new ATOM 0 HB2 GLU A 2 32.950 5.077 -13.891 1.00 0.00 H new ATOM 0 HB3 GLU A 2 31.946 4.006 -14.848 1.00 0.00 H new ATOM 0 HG2 GLU A 2 30.120 5.494 -14.844 1.00 0.00 H new ATOM 0 HG3 GLU A 2 30.704 6.368 -13.442 1.00 0.00 H new ATOM 33 N GLY A 3 29.183 3.595 -12.192 1.00 0.00 N ATOM 34 CA GLY A 3 27.882 2.969 -12.328 1.00 0.00 C ATOM 35 C GLY A 3 26.866 3.523 -11.348 1.00 0.00 C ATOM 36 O GLY A 3 25.697 3.700 -11.689 1.00 0.00 O ATOM 0 H GLY A 3 29.242 4.308 -11.465 1.00 0.00 H new ATOM 0 HA2 GLY A 3 27.517 3.113 -13.345 1.00 0.00 H new ATOM 0 HA3 GLY A 3 27.982 1.894 -12.175 1.00 0.00 H new ATOM 40 N VAL A 4 27.314 3.800 -10.127 1.00 0.00 N ATOM 41 CA VAL A 4 26.436 4.337 -9.096 1.00 0.00 C ATOM 42 C VAL A 4 26.194 5.828 -9.303 1.00 0.00 C ATOM 43 O VAL A 4 27.112 6.576 -9.639 1.00 0.00 O ATOM 44 CB VAL A 4 27.021 4.115 -7.688 1.00 0.00 C ATOM 45 CG1 VAL A 4 26.008 4.500 -6.622 1.00 0.00 C ATOM 46 CG2 VAL A 4 27.464 2.670 -7.516 1.00 0.00 C ATOM 0 H VAL A 4 28.279 3.661 -9.829 1.00 0.00 H new ATOM 0 HA VAL A 4 25.490 3.802 -9.177 1.00 0.00 H new ATOM 0 HB VAL A 4 27.896 4.755 -7.573 1.00 0.00 H new ATOM 0 HG11 VAL A 4 26.439 4.336 -5.634 1.00 0.00 H new ATOM 0 HG12 VAL A 4 25.745 5.552 -6.733 1.00 0.00 H new ATOM 0 HG13 VAL A 4 25.113 3.888 -6.733 1.00 0.00 H new ATOM 0 HG21 VAL A 4 27.874 2.532 -6.516 1.00 0.00 H new ATOM 0 HG22 VAL A 4 26.608 2.009 -7.652 1.00 0.00 H new ATOM 0 HG23 VAL A 4 28.227 2.433 -8.257 1.00 0.00 H new ATOM 56 N ASP A 5 24.951 6.253 -9.101 1.00 0.00 N ATOM 57 CA ASP A 5 24.586 7.655 -9.266 1.00 0.00 C ATOM 58 C ASP A 5 23.620 8.101 -8.166 1.00 0.00 C ATOM 59 O ASP A 5 22.411 7.915 -8.291 1.00 0.00 O ATOM 60 CB ASP A 5 23.949 7.877 -10.639 1.00 0.00 C ATOM 61 CG ASP A 5 23.738 9.346 -10.948 1.00 0.00 C ATOM 62 OD1 ASP A 5 23.656 10.148 -9.995 1.00 0.00 O ATOM 63 OD2 ASP A 5 23.655 9.695 -12.145 1.00 0.00 O ATOM 0 H ASP A 5 24.180 5.646 -8.823 1.00 0.00 H new ATOM 0 HA ASP A 5 25.494 8.253 -9.191 1.00 0.00 H new ATOM 0 HB2 ASP A 5 24.584 7.435 -11.407 1.00 0.00 H new ATOM 0 HB3 ASP A 5 22.991 7.359 -10.680 1.00 0.00 H new ATOM 68 N PRO A 6 24.135 8.697 -7.068 1.00 0.00 N ATOM 69 CA PRO A 6 23.299 9.165 -5.952 1.00 0.00 C ATOM 70 C PRO A 6 22.490 10.412 -6.313 1.00 0.00 C ATOM 71 O PRO A 6 22.657 11.471 -5.706 1.00 0.00 O ATOM 72 CB PRO A 6 24.324 9.489 -4.864 1.00 0.00 C ATOM 73 CG PRO A 6 25.549 9.862 -5.620 1.00 0.00 C ATOM 74 CD PRO A 6 25.569 8.966 -6.825 1.00 0.00 C ATOM 0 HA PRO A 6 22.557 8.424 -5.656 1.00 0.00 H new ATOM 0 HB2 PRO A 6 23.985 10.306 -4.227 1.00 0.00 H new ATOM 0 HB3 PRO A 6 24.502 8.631 -4.215 1.00 0.00 H new ATOM 0 HG2 PRO A 6 25.525 10.912 -5.913 1.00 0.00 H new ATOM 0 HG3 PRO A 6 26.443 9.721 -5.012 1.00 0.00 H new ATOM 0 HD2 PRO A 6 26.038 9.452 -7.680 1.00 0.00 H new ATOM 0 HD3 PRO A 6 26.125 8.048 -6.635 1.00 0.00 H new ATOM 82 N ALA A 7 21.615 10.273 -7.312 1.00 0.00 N ATOM 83 CA ALA A 7 20.760 11.371 -7.791 1.00 0.00 C ATOM 84 C ALA A 7 20.213 11.036 -9.172 1.00 0.00 C ATOM 85 O ALA A 7 19.030 10.744 -9.334 1.00 0.00 O ATOM 86 CB ALA A 7 21.523 12.693 -7.854 1.00 0.00 C ATOM 0 H ALA A 7 21.476 9.396 -7.815 1.00 0.00 H new ATOM 0 HA ALA A 7 19.940 11.486 -7.083 1.00 0.00 H new ATOM 0 HB1 ALA A 7 20.859 13.480 -8.212 1.00 0.00 H new ATOM 0 HB2 ALA A 7 21.888 12.950 -6.860 1.00 0.00 H new ATOM 0 HB3 ALA A 7 22.368 12.593 -8.536 1.00 0.00 H new ATOM 92 N VAL A 8 21.109 11.068 -10.157 1.00 0.00 N ATOM 93 CA VAL A 8 20.776 10.757 -11.553 1.00 0.00 C ATOM 94 C VAL A 8 19.787 11.755 -12.135 1.00 0.00 C ATOM 95 O VAL A 8 20.131 12.568 -12.993 1.00 0.00 O ATOM 96 CB VAL A 8 20.190 9.325 -11.748 1.00 0.00 C ATOM 97 CG1 VAL A 8 20.744 8.700 -13.015 1.00 0.00 C ATOM 98 CG2 VAL A 8 20.455 8.423 -10.552 1.00 0.00 C ATOM 0 H VAL A 8 22.089 11.310 -10.013 1.00 0.00 H new ATOM 0 HA VAL A 8 21.728 10.817 -12.081 1.00 0.00 H new ATOM 0 HB VAL A 8 19.109 9.427 -11.838 1.00 0.00 H new ATOM 0 HG11 VAL A 8 20.327 7.701 -13.140 1.00 0.00 H new ATOM 0 HG12 VAL A 8 20.473 9.316 -13.873 1.00 0.00 H new ATOM 0 HG13 VAL A 8 21.830 8.634 -12.944 1.00 0.00 H new ATOM 0 HG21 VAL A 8 20.027 7.438 -10.737 1.00 0.00 H new ATOM 0 HG22 VAL A 8 21.530 8.329 -10.398 1.00 0.00 H new ATOM 0 HG23 VAL A 8 19.998 8.855 -9.662 1.00 0.00 H new ATOM 108 N GLU A 9 18.549 11.658 -11.681 1.00 0.00 N ATOM 109 CA GLU A 9 17.482 12.511 -12.159 1.00 0.00 C ATOM 110 C GLU A 9 17.064 13.528 -11.101 1.00 0.00 C ATOM 111 O GLU A 9 16.154 13.279 -10.312 1.00 0.00 O ATOM 112 CB GLU A 9 16.301 11.634 -12.568 1.00 0.00 C ATOM 113 CG GLU A 9 16.183 11.428 -14.069 1.00 0.00 C ATOM 114 CD GLU A 9 15.096 12.283 -14.690 1.00 0.00 C ATOM 115 OE1 GLU A 9 15.044 13.492 -14.381 1.00 0.00 O ATOM 116 OE2 GLU A 9 14.300 11.745 -15.487 1.00 0.00 O ATOM 0 H GLU A 9 18.259 10.985 -10.971 1.00 0.00 H new ATOM 0 HA GLU A 9 17.836 13.078 -13.020 1.00 0.00 H new ATOM 0 HB2 GLU A 9 16.397 10.662 -12.083 1.00 0.00 H new ATOM 0 HB3 GLU A 9 15.380 12.085 -12.199 1.00 0.00 H new ATOM 0 HG2 GLU A 9 17.138 11.661 -14.540 1.00 0.00 H new ATOM 0 HG3 GLU A 9 15.975 10.378 -14.273 1.00 0.00 H new ATOM 123 N GLU A 10 17.734 14.677 -11.097 1.00 0.00 N ATOM 124 CA GLU A 10 17.432 15.734 -10.140 1.00 0.00 C ATOM 125 C GLU A 10 16.146 16.461 -10.522 1.00 0.00 C ATOM 126 O GLU A 10 16.045 17.042 -11.602 1.00 0.00 O ATOM 127 CB GLU A 10 18.590 16.730 -10.065 1.00 0.00 C ATOM 128 CG GLU A 10 18.515 17.659 -8.865 1.00 0.00 C ATOM 129 CD GLU A 10 17.832 18.974 -9.187 1.00 0.00 C ATOM 130 OE1 GLU A 10 16.586 18.991 -9.266 1.00 0.00 O ATOM 131 OE2 GLU A 10 18.544 19.986 -9.360 1.00 0.00 O ATOM 0 H GLU A 10 18.489 14.899 -11.746 1.00 0.00 H new ATOM 0 HA GLU A 10 17.293 15.275 -9.161 1.00 0.00 H new ATOM 0 HB2 GLU A 10 19.530 16.180 -10.030 1.00 0.00 H new ATOM 0 HB3 GLU A 10 18.604 17.328 -10.977 1.00 0.00 H new ATOM 0 HG2 GLU A 10 17.976 17.162 -8.059 1.00 0.00 H new ATOM 0 HG3 GLU A 10 19.523 17.857 -8.500 1.00 0.00 H new ATOM 138 N ALA A 11 15.167 16.423 -9.626 1.00 0.00 N ATOM 139 CA ALA A 11 13.885 17.076 -9.859 1.00 0.00 C ATOM 140 C ALA A 11 13.718 18.290 -8.952 1.00 0.00 C ATOM 141 O ALA A 11 14.442 18.443 -7.967 1.00 0.00 O ATOM 142 CB ALA A 11 12.742 16.095 -9.655 1.00 0.00 C ATOM 0 H ALA A 11 15.237 15.945 -8.728 1.00 0.00 H new ATOM 0 HA ALA A 11 13.864 17.421 -10.893 1.00 0.00 H new ATOM 0 HB1 ALA A 11 11.793 16.600 -9.833 1.00 0.00 H new ATOM 0 HB2 ALA A 11 12.847 15.264 -10.352 1.00 0.00 H new ATOM 0 HB3 ALA A 11 12.765 15.717 -8.633 1.00 0.00 H new ATOM 148 N ALA A 12 12.763 19.157 -9.293 1.00 0.00 N ATOM 149 CA ALA A 12 12.491 20.373 -8.520 1.00 0.00 C ATOM 150 C ALA A 12 13.515 21.458 -8.833 1.00 0.00 C ATOM 151 O ALA A 12 14.719 21.257 -8.671 1.00 0.00 O ATOM 152 CB ALA A 12 12.453 20.083 -7.017 1.00 0.00 C ATOM 0 H ALA A 12 12.159 19.039 -10.107 1.00 0.00 H new ATOM 0 HA ALA A 12 11.506 20.736 -8.815 1.00 0.00 H new ATOM 0 HB1 ALA A 12 12.249 21.006 -6.473 1.00 0.00 H new ATOM 0 HB2 ALA A 12 11.668 19.357 -6.806 1.00 0.00 H new ATOM 0 HB3 ALA A 12 13.415 19.680 -6.700 1.00 0.00 H new ATOM 158 N PHE A 13 13.028 22.608 -9.289 1.00 0.00 N ATOM 159 CA PHE A 13 13.899 23.726 -9.634 1.00 0.00 C ATOM 160 C PHE A 13 13.705 24.901 -8.678 1.00 0.00 C ATOM 161 O PHE A 13 14.613 25.711 -8.489 1.00 0.00 O ATOM 162 CB PHE A 13 13.635 24.179 -11.072 1.00 0.00 C ATOM 163 CG PHE A 13 14.868 24.643 -11.792 1.00 0.00 C ATOM 164 CD1 PHE A 13 15.276 25.965 -11.713 1.00 0.00 C ATOM 165 CD2 PHE A 13 15.619 23.757 -12.547 1.00 0.00 C ATOM 166 CE1 PHE A 13 16.411 26.394 -12.374 1.00 0.00 C ATOM 167 CE2 PHE A 13 16.755 24.181 -13.211 1.00 0.00 C ATOM 168 CZ PHE A 13 17.152 25.501 -13.125 1.00 0.00 C ATOM 0 H PHE A 13 12.034 22.790 -9.428 1.00 0.00 H new ATOM 0 HA PHE A 13 14.930 23.382 -9.546 1.00 0.00 H new ATOM 0 HB2 PHE A 13 13.189 23.354 -11.628 1.00 0.00 H new ATOM 0 HB3 PHE A 13 12.905 24.988 -11.061 1.00 0.00 H new ATOM 0 HD1 PHE A 13 14.701 26.668 -11.128 1.00 0.00 H new ATOM 0 HD2 PHE A 13 15.314 22.723 -12.618 1.00 0.00 H new ATOM 0 HE1 PHE A 13 16.719 27.427 -12.304 1.00 0.00 H new ATOM 0 HE2 PHE A 13 17.332 23.480 -13.797 1.00 0.00 H new ATOM 0 HZ PHE A 13 18.039 25.835 -13.643 1.00 0.00 H new ATOM 178 N VAL A 14 12.522 24.994 -8.075 1.00 0.00 N ATOM 179 CA VAL A 14 12.229 26.078 -7.144 1.00 0.00 C ATOM 180 C VAL A 14 12.551 25.669 -5.712 1.00 0.00 C ATOM 181 O VAL A 14 12.619 24.481 -5.397 1.00 0.00 O ATOM 182 CB VAL A 14 10.753 26.515 -7.222 1.00 0.00 C ATOM 183 CG1 VAL A 14 10.536 27.801 -6.441 1.00 0.00 C ATOM 184 CG2 VAL A 14 10.317 26.682 -8.670 1.00 0.00 C ATOM 0 H VAL A 14 11.756 24.335 -8.214 1.00 0.00 H new ATOM 0 HA VAL A 14 12.859 26.919 -7.434 1.00 0.00 H new ATOM 0 HB VAL A 14 10.140 25.734 -6.772 1.00 0.00 H new ATOM 0 HG11 VAL A 14 9.488 28.095 -6.507 1.00 0.00 H new ATOM 0 HG12 VAL A 14 10.803 27.642 -5.396 1.00 0.00 H new ATOM 0 HG13 VAL A 14 11.161 28.590 -6.859 1.00 0.00 H new ATOM 0 HG21 VAL A 14 9.272 26.991 -8.702 1.00 0.00 H new ATOM 0 HG22 VAL A 14 10.934 27.441 -9.151 1.00 0.00 H new ATOM 0 HG23 VAL A 14 10.432 25.734 -9.196 1.00 0.00 H new ATOM 194 N ALA A 15 12.750 26.659 -4.851 1.00 0.00 N ATOM 195 CA ALA A 15 13.067 26.400 -3.453 1.00 0.00 C ATOM 196 C ALA A 15 14.364 25.606 -3.327 1.00 0.00 C ATOM 197 O ALA A 15 14.427 24.601 -2.618 1.00 0.00 O ATOM 198 CB ALA A 15 11.919 25.661 -2.780 1.00 0.00 C ATOM 0 H ALA A 15 12.697 27.648 -5.096 1.00 0.00 H new ATOM 0 HA ALA A 15 13.208 27.357 -2.950 1.00 0.00 H new ATOM 0 HB1 ALA A 15 12.169 25.474 -1.736 1.00 0.00 H new ATOM 0 HB2 ALA A 15 11.015 26.267 -2.833 1.00 0.00 H new ATOM 0 HB3 ALA A 15 11.750 24.712 -3.288 1.00 0.00 H new ATOM 204 N ASP A 16 15.402 26.066 -4.023 1.00 0.00 N ATOM 205 CA ASP A 16 16.703 25.402 -3.994 1.00 0.00 C ATOM 206 C ASP A 16 17.219 25.269 -2.563 1.00 0.00 C ATOM 207 O ASP A 16 17.937 24.322 -2.236 1.00 0.00 O ATOM 208 CB ASP A 16 17.714 26.178 -4.841 1.00 0.00 C ATOM 209 CG ASP A 16 18.965 25.372 -5.130 1.00 0.00 C ATOM 210 OD1 ASP A 16 19.794 25.213 -4.211 1.00 0.00 O ATOM 211 OD2 ASP A 16 19.115 24.901 -6.278 1.00 0.00 O ATOM 0 H ASP A 16 15.367 26.896 -4.614 1.00 0.00 H new ATOM 0 HA ASP A 16 16.579 24.402 -4.410 1.00 0.00 H new ATOM 0 HB2 ASP A 16 17.248 26.470 -5.782 1.00 0.00 H new ATOM 0 HB3 ASP A 16 17.989 27.097 -4.323 1.00 0.00 H new ATOM 216 N ASP A 17 16.841 26.220 -1.713 1.00 0.00 N ATOM 217 CA ASP A 17 17.257 26.211 -0.314 1.00 0.00 C ATOM 218 C ASP A 17 16.848 24.907 0.365 1.00 0.00 C ATOM 219 O ASP A 17 17.642 24.282 1.065 1.00 0.00 O ATOM 220 CB ASP A 17 16.645 27.400 0.430 1.00 0.00 C ATOM 221 CG ASP A 17 17.534 27.900 1.551 1.00 0.00 C ATOM 222 OD1 ASP A 17 17.595 27.231 2.604 1.00 0.00 O ATOM 223 OD2 ASP A 17 18.169 28.961 1.377 1.00 0.00 O ATOM 0 H ASP A 17 16.246 27.008 -1.970 1.00 0.00 H new ATOM 0 HA ASP A 17 18.344 26.292 -0.283 1.00 0.00 H new ATOM 0 HB2 ASP A 17 16.463 28.211 -0.275 1.00 0.00 H new ATOM 0 HB3 ASP A 17 15.677 27.110 0.839 1.00 0.00 H new ATOM 228 N VAL A 18 15.602 24.502 0.145 1.00 0.00 N ATOM 229 CA VAL A 18 15.078 23.271 0.724 1.00 0.00 C ATOM 230 C VAL A 18 15.507 22.058 -0.092 1.00 0.00 C ATOM 231 O VAL A 18 15.695 20.967 0.446 1.00 0.00 O ATOM 232 CB VAL A 18 13.540 23.301 0.801 1.00 0.00 C ATOM 233 CG1 VAL A 18 13.016 22.092 1.564 1.00 0.00 C ATOM 234 CG2 VAL A 18 13.065 24.597 1.441 1.00 0.00 C ATOM 0 H VAL A 18 14.933 25.011 -0.433 1.00 0.00 H new ATOM 0 HA VAL A 18 15.486 23.194 1.732 1.00 0.00 H new ATOM 0 HB VAL A 18 13.142 23.256 -0.213 1.00 0.00 H new ATOM 0 HG11 VAL A 18 11.928 22.133 1.607 1.00 0.00 H new ATOM 0 HG12 VAL A 18 13.325 21.179 1.056 1.00 0.00 H new ATOM 0 HG13 VAL A 18 13.419 22.098 2.577 1.00 0.00 H new ATOM 0 HG21 VAL A 18 11.976 24.602 1.488 1.00 0.00 H new ATOM 0 HG22 VAL A 18 13.472 24.675 2.449 1.00 0.00 H new ATOM 0 HG23 VAL A 18 13.406 25.443 0.845 1.00 0.00 H new ATOM 244 N SER A 19 15.656 22.257 -1.397 1.00 0.00 N ATOM 245 CA SER A 19 16.055 21.184 -2.297 1.00 0.00 C ATOM 246 C SER A 19 17.399 20.589 -1.891 1.00 0.00 C ATOM 247 O SER A 19 17.570 19.372 -1.886 1.00 0.00 O ATOM 248 CB SER A 19 16.127 21.698 -3.736 1.00 0.00 C ATOM 249 OG SER A 19 15.990 20.637 -4.664 1.00 0.00 O ATOM 0 H SER A 19 15.505 23.156 -1.855 1.00 0.00 H new ATOM 0 HA SER A 19 15.302 20.399 -2.232 1.00 0.00 H new ATOM 0 HB2 SER A 19 15.341 22.434 -3.902 1.00 0.00 H new ATOM 0 HB3 SER A 19 17.078 22.206 -3.897 1.00 0.00 H new ATOM 0 HG SER A 19 16.038 20.992 -5.576 1.00 0.00 H new ATOM 255 N ASN A 20 18.352 21.451 -1.556 1.00 0.00 N ATOM 256 CA ASN A 20 19.680 20.991 -1.160 1.00 0.00 C ATOM 257 C ASN A 20 19.635 20.247 0.172 1.00 0.00 C ATOM 258 O ASN A 20 20.326 19.248 0.353 1.00 0.00 O ATOM 259 CB ASN A 20 20.656 22.171 -1.078 1.00 0.00 C ATOM 260 CG ASN A 20 20.321 23.135 0.044 1.00 0.00 C ATOM 261 OD1 ASN A 20 20.500 22.821 1.222 1.00 0.00 O ATOM 262 ND2 ASN A 20 19.833 24.314 -0.314 1.00 0.00 N ATOM 0 H ASN A 20 18.233 22.464 -1.550 1.00 0.00 H new ATOM 0 HA ASN A 20 20.032 20.296 -1.922 1.00 0.00 H new ATOM 0 HB2 ASN A 20 21.667 21.791 -0.934 1.00 0.00 H new ATOM 0 HB3 ASN A 20 20.650 22.708 -2.026 1.00 0.00 H new ATOM 0 HD21 ASN A 20 19.590 25.003 0.398 1.00 0.00 H new ATOM 0 HD22 ASN A 20 19.701 24.533 -1.301 1.00 0.00 H new ATOM 269 N ILE A 21 18.817 20.740 1.100 1.00 0.00 N ATOM 270 CA ILE A 21 18.686 20.121 2.417 1.00 0.00 C ATOM 271 C ILE A 21 18.283 18.652 2.298 1.00 0.00 C ATOM 272 O ILE A 21 18.939 17.775 2.860 1.00 0.00 O ATOM 273 CB ILE A 21 17.640 20.878 3.281 1.00 0.00 C ATOM 274 CG1 ILE A 21 18.105 22.308 3.542 1.00 0.00 C ATOM 275 CG2 ILE A 21 17.375 20.167 4.607 1.00 0.00 C ATOM 276 CD1 ILE A 21 17.110 23.130 4.329 1.00 0.00 C ATOM 0 H ILE A 21 18.235 21.567 0.964 1.00 0.00 H new ATOM 0 HA ILE A 21 19.660 20.179 2.903 1.00 0.00 H new ATOM 0 HB ILE A 21 16.706 20.896 2.720 1.00 0.00 H new ATOM 0 HG12 ILE A 21 19.051 22.281 4.083 1.00 0.00 H new ATOM 0 HG13 ILE A 21 18.297 22.799 2.588 1.00 0.00 H new ATOM 0 HG21 ILE A 21 16.638 20.729 5.180 1.00 0.00 H new ATOM 0 HG22 ILE A 21 16.995 19.164 4.412 1.00 0.00 H new ATOM 0 HG23 ILE A 21 18.303 20.100 5.176 1.00 0.00 H new ATOM 0 HD11 ILE A 21 17.505 24.135 4.478 1.00 0.00 H new ATOM 0 HD12 ILE A 21 16.170 23.187 3.780 1.00 0.00 H new ATOM 0 HD13 ILE A 21 16.936 22.661 5.298 1.00 0.00 H new ATOM 288 N ILE A 22 17.201 18.389 1.577 1.00 0.00 N ATOM 289 CA ILE A 22 16.728 17.025 1.412 1.00 0.00 C ATOM 290 C ILE A 22 17.785 16.156 0.727 1.00 0.00 C ATOM 291 O ILE A 22 18.155 15.108 1.248 1.00 0.00 O ATOM 292 CB ILE A 22 15.386 16.970 0.643 1.00 0.00 C ATOM 293 CG1 ILE A 22 14.855 15.538 0.583 1.00 0.00 C ATOM 294 CG2 ILE A 22 15.522 17.550 -0.754 1.00 0.00 C ATOM 295 CD1 ILE A 22 14.098 15.123 1.824 1.00 0.00 C ATOM 0 H ILE A 22 16.640 19.096 1.102 1.00 0.00 H new ATOM 0 HA ILE A 22 16.549 16.623 2.409 1.00 0.00 H new ATOM 0 HB ILE A 22 14.668 17.582 1.188 1.00 0.00 H new ATOM 0 HG12 ILE A 22 14.200 15.438 -0.283 1.00 0.00 H new ATOM 0 HG13 ILE A 22 15.691 14.855 0.432 1.00 0.00 H new ATOM 0 HG21 ILE A 22 14.561 17.495 -1.266 1.00 0.00 H new ATOM 0 HG22 ILE A 22 15.839 18.591 -0.687 1.00 0.00 H new ATOM 0 HG23 ILE A 22 16.264 16.981 -1.314 1.00 0.00 H new ATOM 0 HD11 ILE A 22 13.750 14.096 1.712 1.00 0.00 H new ATOM 0 HD12 ILE A 22 14.755 15.191 2.691 1.00 0.00 H new ATOM 0 HD13 ILE A 22 13.242 15.782 1.965 1.00 0.00 H new ATOM 307 N LYS A 23 18.302 16.603 -0.418 1.00 0.00 N ATOM 308 CA LYS A 23 19.338 15.850 -1.131 1.00 0.00 C ATOM 309 C LYS A 23 20.547 15.649 -0.243 1.00 0.00 C ATOM 310 O LYS A 23 21.000 14.526 -0.022 1.00 0.00 O ATOM 311 CB LYS A 23 19.760 16.605 -2.380 1.00 0.00 C ATOM 312 CG LYS A 23 18.615 16.855 -3.333 1.00 0.00 C ATOM 313 CD LYS A 23 19.028 17.726 -4.512 1.00 0.00 C ATOM 314 CE LYS A 23 19.721 19.018 -4.098 1.00 0.00 C ATOM 315 NZ LYS A 23 20.113 19.836 -5.279 1.00 0.00 N ATOM 0 H LYS A 23 18.025 17.475 -0.870 1.00 0.00 H new ATOM 0 HA LYS A 23 18.929 14.879 -1.409 1.00 0.00 H new ATOM 0 HB2 LYS A 23 20.199 17.560 -2.090 1.00 0.00 H new ATOM 0 HB3 LYS A 23 20.537 16.040 -2.895 1.00 0.00 H new ATOM 0 HG2 LYS A 23 18.237 15.902 -3.702 1.00 0.00 H new ATOM 0 HG3 LYS A 23 17.797 17.336 -2.797 1.00 0.00 H new ATOM 0 HD2 LYS A 23 19.695 17.156 -5.159 1.00 0.00 H new ATOM 0 HD3 LYS A 23 18.144 17.970 -5.101 1.00 0.00 H new ATOM 0 HE2 LYS A 23 19.057 19.598 -3.458 1.00 0.00 H new ATOM 0 HE3 LYS A 23 20.607 18.783 -3.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 20.582 20.707 -4.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 20.767 19.291 -5.877 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 19.265 20.082 -5.828 1.00 0.00 H new ATOM 329 N GLU A 24 21.050 16.759 0.281 1.00 0.00 N ATOM 330 CA GLU A 24 22.202 16.740 1.182 1.00 0.00 C ATOM 331 C GLU A 24 21.978 15.730 2.304 1.00 0.00 C ATOM 332 O GLU A 24 22.910 15.072 2.766 1.00 0.00 O ATOM 333 CB GLU A 24 22.431 18.133 1.778 1.00 0.00 C ATOM 334 CG GLU A 24 23.075 19.111 0.809 1.00 0.00 C ATOM 335 CD GLU A 24 24.584 19.158 0.945 1.00 0.00 C ATOM 336 OE1 GLU A 24 25.072 19.513 2.038 1.00 0.00 O ATOM 337 OE2 GLU A 24 25.279 18.840 -0.044 1.00 0.00 O ATOM 0 H GLU A 24 20.678 17.691 0.098 1.00 0.00 H new ATOM 0 HA GLU A 24 23.084 16.448 0.611 1.00 0.00 H new ATOM 0 HB2 GLU A 24 21.475 18.539 2.109 1.00 0.00 H new ATOM 0 HB3 GLU A 24 23.062 18.042 2.662 1.00 0.00 H new ATOM 0 HG2 GLU A 24 22.814 18.830 -0.212 1.00 0.00 H new ATOM 0 HG3 GLU A 24 22.667 20.107 0.980 1.00 0.00 H new ATOM 344 N SER A 25 20.723 15.616 2.724 1.00 0.00 N ATOM 345 CA SER A 25 20.349 14.692 3.778 1.00 0.00 C ATOM 346 C SER A 25 20.462 13.251 3.301 1.00 0.00 C ATOM 347 O SER A 25 21.022 12.424 4.002 1.00 0.00 O ATOM 348 CB SER A 25 18.927 14.976 4.261 1.00 0.00 C ATOM 349 OG SER A 25 18.932 15.858 5.371 1.00 0.00 O ATOM 0 H SER A 25 19.946 16.158 2.345 1.00 0.00 H new ATOM 0 HA SER A 25 21.037 14.835 4.611 1.00 0.00 H new ATOM 0 HB2 SER A 25 18.344 15.411 3.449 1.00 0.00 H new ATOM 0 HB3 SER A 25 18.440 14.041 4.538 1.00 0.00 H new ATOM 0 HG SER A 25 18.050 16.274 5.462 1.00 0.00 H new ATOM 355 N ILE A 26 19.953 12.946 2.101 1.00 0.00 N ATOM 356 CA ILE A 26 20.039 11.576 1.577 1.00 0.00 C ATOM 357 C ILE A 26 21.494 11.138 1.519 1.00 0.00 C ATOM 358 O ILE A 26 21.837 10.026 1.912 1.00 0.00 O ATOM 359 CB ILE A 26 19.387 11.437 0.167 1.00 0.00 C ATOM 360 CG1 ILE A 26 17.872 11.347 0.298 1.00 0.00 C ATOM 361 CG2 ILE A 26 19.894 10.206 -0.593 1.00 0.00 C ATOM 362 CD1 ILE A 26 17.214 12.662 0.612 1.00 0.00 C ATOM 0 H ILE A 26 19.487 13.612 1.485 1.00 0.00 H new ATOM 0 HA ILE A 26 19.482 10.932 2.257 1.00 0.00 H new ATOM 0 HB ILE A 26 19.669 12.324 -0.400 1.00 0.00 H new ATOM 0 HG12 ILE A 26 17.458 10.956 -0.632 1.00 0.00 H new ATOM 0 HG13 ILE A 26 17.626 10.631 1.082 1.00 0.00 H new ATOM 0 HG21 ILE A 26 19.409 10.155 -1.568 1.00 0.00 H new ATOM 0 HG22 ILE A 26 20.973 10.280 -0.728 1.00 0.00 H new ATOM 0 HG23 ILE A 26 19.660 9.306 -0.025 1.00 0.00 H new ATOM 0 HD11 ILE A 26 16.136 12.520 0.690 1.00 0.00 H new ATOM 0 HD12 ILE A 26 17.599 13.045 1.557 1.00 0.00 H new ATOM 0 HD13 ILE A 26 17.429 13.376 -0.183 1.00 0.00 H new ATOM 374 N ASP A 27 22.351 12.022 1.040 1.00 0.00 N ATOM 375 CA ASP A 27 23.770 11.719 0.943 1.00 0.00 C ATOM 376 C ASP A 27 24.295 11.192 2.279 1.00 0.00 C ATOM 377 O ASP A 27 25.118 10.287 2.324 1.00 0.00 O ATOM 378 CB ASP A 27 24.539 12.976 0.530 1.00 0.00 C ATOM 379 CG ASP A 27 25.981 12.681 0.166 1.00 0.00 C ATOM 380 OD1 ASP A 27 26.756 12.304 1.069 1.00 0.00 O ATOM 381 OD2 ASP A 27 26.334 12.826 -1.023 1.00 0.00 O ATOM 0 H ASP A 27 22.092 12.953 0.713 1.00 0.00 H new ATOM 0 HA ASP A 27 23.916 10.947 0.187 1.00 0.00 H new ATOM 0 HB2 ASP A 27 24.040 13.440 -0.321 1.00 0.00 H new ATOM 0 HB3 ASP A 27 24.514 13.698 1.346 1.00 0.00 H new ATOM 386 N ALA A 28 23.786 11.761 3.360 1.00 0.00 N ATOM 387 CA ALA A 28 24.192 11.359 4.704 1.00 0.00 C ATOM 388 C ALA A 28 23.320 10.234 5.260 1.00 0.00 C ATOM 389 O ALA A 28 23.821 9.263 5.836 1.00 0.00 O ATOM 390 CB ALA A 28 24.131 12.568 5.628 1.00 0.00 C ATOM 0 H ALA A 28 23.089 12.505 3.336 1.00 0.00 H new ATOM 0 HA ALA A 28 25.211 10.977 4.646 1.00 0.00 H new ATOM 0 HB1 ALA A 28 24.433 12.273 6.633 1.00 0.00 H new ATOM 0 HB2 ALA A 28 24.804 13.342 5.259 1.00 0.00 H new ATOM 0 HB3 ALA A 28 23.112 12.955 5.654 1.00 0.00 H new ATOM 396 N VAL A 29 22.013 10.385 5.081 1.00 0.00 N ATOM 397 CA VAL A 29 21.028 9.432 5.554 1.00 0.00 C ATOM 398 C VAL A 29 21.085 8.115 4.757 1.00 0.00 C ATOM 399 O VAL A 29 20.438 7.136 5.128 1.00 0.00 O ATOM 400 CB VAL A 29 19.621 10.133 5.587 1.00 0.00 C ATOM 401 CG1 VAL A 29 18.458 9.299 5.092 1.00 0.00 C ATOM 402 CG2 VAL A 29 19.314 10.601 6.996 1.00 0.00 C ATOM 0 H VAL A 29 21.607 11.185 4.596 1.00 0.00 H new ATOM 0 HA VAL A 29 21.250 9.124 6.576 1.00 0.00 H new ATOM 0 HB VAL A 29 19.712 10.963 4.886 1.00 0.00 H new ATOM 0 HG11 VAL A 29 17.539 9.881 5.159 1.00 0.00 H new ATOM 0 HG12 VAL A 29 18.631 9.013 4.055 1.00 0.00 H new ATOM 0 HG13 VAL A 29 18.366 8.403 5.705 1.00 0.00 H new ATOM 0 HG21 VAL A 29 18.338 11.086 7.014 1.00 0.00 H new ATOM 0 HG22 VAL A 29 19.306 9.745 7.670 1.00 0.00 H new ATOM 0 HG23 VAL A 29 20.077 11.309 7.319 1.00 0.00 H new ATOM 412 N LEU A 30 21.902 8.073 3.693 1.00 0.00 N ATOM 413 CA LEU A 30 22.065 6.852 2.909 1.00 0.00 C ATOM 414 C LEU A 30 23.534 6.422 2.853 1.00 0.00 C ATOM 415 O LEU A 30 23.830 5.230 2.914 1.00 0.00 O ATOM 416 CB LEU A 30 21.502 7.016 1.496 1.00 0.00 C ATOM 417 CG LEU A 30 19.979 6.899 1.403 1.00 0.00 C ATOM 418 CD1 LEU A 30 19.508 5.599 2.014 1.00 0.00 C ATOM 419 CD2 LEU A 30 19.316 8.050 2.119 1.00 0.00 C ATOM 0 H LEU A 30 22.453 8.866 3.363 1.00 0.00 H new ATOM 0 HA LEU A 30 21.498 6.068 3.410 1.00 0.00 H new ATOM 0 HB2 LEU A 30 21.803 7.989 1.109 1.00 0.00 H new ATOM 0 HB3 LEU A 30 21.952 6.263 0.849 1.00 0.00 H new ATOM 0 HG LEU A 30 19.705 6.922 0.348 1.00 0.00 H new ATOM 0 HD11 LEU A 30 18.423 5.534 1.939 1.00 0.00 H new ATOM 0 HD12 LEU A 30 19.960 4.762 1.482 1.00 0.00 H new ATOM 0 HD13 LEU A 30 19.802 5.563 3.063 1.00 0.00 H new ATOM 0 HD21 LEU A 30 18.233 7.951 2.043 1.00 0.00 H new ATOM 0 HD22 LEU A 30 19.608 8.042 3.169 1.00 0.00 H new ATOM 0 HD23 LEU A 30 19.627 8.990 1.663 1.00 0.00 H new ATOM 431 N GLN A 31 24.462 7.384 2.752 1.00 0.00 N ATOM 432 CA GLN A 31 25.884 7.045 2.710 1.00 0.00 C ATOM 433 C GLN A 31 26.442 6.772 4.107 1.00 0.00 C ATOM 434 O GLN A 31 27.538 6.227 4.239 1.00 0.00 O ATOM 435 CB GLN A 31 26.693 8.156 2.048 1.00 0.00 C ATOM 436 CG GLN A 31 28.051 7.705 1.578 1.00 0.00 C ATOM 437 CD GLN A 31 28.766 8.756 0.750 1.00 0.00 C ATOM 438 OE1 GLN A 31 28.168 9.749 0.335 1.00 0.00 O ATOM 439 NE2 GLN A 31 30.054 8.540 0.506 1.00 0.00 N ATOM 0 H GLN A 31 24.256 8.382 2.699 1.00 0.00 H new ATOM 0 HA GLN A 31 25.974 6.134 2.118 1.00 0.00 H new ATOM 0 HB2 GLN A 31 26.133 8.547 1.198 1.00 0.00 H new ATOM 0 HB3 GLN A 31 26.815 8.977 2.754 1.00 0.00 H new ATOM 0 HG2 GLN A 31 28.664 7.452 2.443 1.00 0.00 H new ATOM 0 HG3 GLN A 31 27.942 6.796 0.987 1.00 0.00 H new ATOM 0 HE21 GLN A 31 30.509 7.703 0.870 1.00 0.00 H new ATOM 0 HE22 GLN A 31 30.588 9.211 -0.046 1.00 0.00 H new ATOM 448 N ASN A 32 25.691 7.154 5.153 1.00 0.00 N ATOM 449 CA ASN A 32 26.118 6.949 6.545 1.00 0.00 C ATOM 450 C ASN A 32 26.781 5.584 6.766 1.00 0.00 C ATOM 451 O ASN A 32 27.658 5.446 7.620 1.00 0.00 O ATOM 452 CB ASN A 32 24.920 7.086 7.487 1.00 0.00 C ATOM 453 CG ASN A 32 23.704 6.326 6.993 1.00 0.00 C ATOM 454 OD1 ASN A 32 23.755 5.645 5.968 1.00 0.00 O ATOM 455 ND2 ASN A 32 22.603 6.435 7.721 1.00 0.00 N ATOM 0 H ASN A 32 24.782 7.608 5.059 1.00 0.00 H new ATOM 0 HA ASN A 32 26.862 7.716 6.762 1.00 0.00 H new ATOM 0 HB2 ASN A 32 25.196 6.721 8.476 1.00 0.00 H new ATOM 0 HB3 ASN A 32 24.666 8.140 7.596 1.00 0.00 H new ATOM 0 HD21 ASN A 32 21.754 5.944 7.439 1.00 0.00 H new ATOM 0 HD22 ASN A 32 22.604 7.010 8.564 1.00 0.00 H new ATOM 462 N GLN A 33 26.365 4.582 5.995 1.00 0.00 N ATOM 463 CA GLN A 33 26.937 3.245 6.128 1.00 0.00 C ATOM 464 C GLN A 33 26.961 2.504 4.779 1.00 0.00 C ATOM 465 O GLN A 33 27.896 2.680 3.997 1.00 0.00 O ATOM 466 CB GLN A 33 26.177 2.447 7.197 1.00 0.00 C ATOM 467 CG GLN A 33 26.672 1.018 7.362 1.00 0.00 C ATOM 468 CD GLN A 33 27.959 0.935 8.157 1.00 0.00 C ATOM 469 OE1 GLN A 33 28.973 0.436 7.668 1.00 0.00 O ATOM 470 NE2 GLN A 33 27.926 1.424 9.391 1.00 0.00 N ATOM 0 H GLN A 33 25.643 4.668 5.280 1.00 0.00 H new ATOM 0 HA GLN A 33 27.973 3.347 6.451 1.00 0.00 H new ATOM 0 HB2 GLN A 33 26.263 2.964 8.153 1.00 0.00 H new ATOM 0 HB3 GLN A 33 25.118 2.428 6.939 1.00 0.00 H new ATOM 0 HG2 GLN A 33 25.903 0.426 7.859 1.00 0.00 H new ATOM 0 HG3 GLN A 33 26.828 0.576 6.378 1.00 0.00 H new ATOM 0 HE21 GLN A 33 27.064 1.829 9.756 1.00 0.00 H new ATOM 0 HE22 GLN A 33 28.763 1.395 9.974 1.00 0.00 H new ATOM 479 N GLN A 34 25.948 1.676 4.501 1.00 0.00 N ATOM 480 CA GLN A 34 25.899 0.930 3.246 1.00 0.00 C ATOM 481 C GLN A 34 24.472 0.845 2.712 1.00 0.00 C ATOM 482 O GLN A 34 23.539 1.373 3.317 1.00 0.00 O ATOM 483 CB GLN A 34 26.467 -0.478 3.445 1.00 0.00 C ATOM 484 CG GLN A 34 27.283 -0.977 2.262 1.00 0.00 C ATOM 485 CD GLN A 34 28.776 -0.937 2.525 1.00 0.00 C ATOM 486 OE1 GLN A 34 29.325 -1.822 3.180 1.00 0.00 O ATOM 487 NE2 GLN A 34 29.440 0.092 2.013 1.00 0.00 N ATOM 0 H GLN A 34 25.159 1.509 5.125 1.00 0.00 H new ATOM 0 HA GLN A 34 26.507 1.462 2.514 1.00 0.00 H new ATOM 0 HB2 GLN A 34 27.093 -0.486 4.337 1.00 0.00 H new ATOM 0 HB3 GLN A 34 25.645 -1.170 3.627 1.00 0.00 H new ATOM 0 HG2 GLN A 34 26.987 -1.999 2.026 1.00 0.00 H new ATOM 0 HG3 GLN A 34 27.056 -0.369 1.386 1.00 0.00 H new ATOM 0 HE21 GLN A 34 28.944 0.803 1.476 1.00 0.00 H new ATOM 0 HE22 GLN A 34 30.447 0.172 2.156 1.00 0.00 H new ATOM 496 N TYR A 35 24.309 0.173 1.574 1.00 0.00 N ATOM 497 CA TYR A 35 22.994 0.017 0.962 1.00 0.00 C ATOM 498 C TYR A 35 22.290 -1.231 1.494 1.00 0.00 C ATOM 499 O TYR A 35 22.686 -2.357 1.197 1.00 0.00 O ATOM 500 CB TYR A 35 23.134 -0.061 -0.565 1.00 0.00 C ATOM 501 CG TYR A 35 21.838 -0.350 -1.300 1.00 0.00 C ATOM 502 CD1 TYR A 35 20.774 0.542 -1.257 1.00 0.00 C ATOM 503 CD2 TYR A 35 21.685 -1.518 -2.036 1.00 0.00 C ATOM 504 CE1 TYR A 35 19.593 0.277 -1.927 1.00 0.00 C ATOM 505 CE2 TYR A 35 20.508 -1.790 -2.710 1.00 0.00 C ATOM 506 CZ TYR A 35 19.467 -0.889 -2.652 1.00 0.00 C ATOM 507 OH TYR A 35 18.294 -1.156 -3.320 1.00 0.00 O ATOM 0 H TYR A 35 25.070 -0.271 1.059 1.00 0.00 H new ATOM 0 HA TYR A 35 22.387 0.885 1.221 1.00 0.00 H new ATOM 0 HB2 TYR A 35 23.541 0.882 -0.929 1.00 0.00 H new ATOM 0 HB3 TYR A 35 23.858 -0.837 -0.812 1.00 0.00 H new ATOM 0 HD1 TYR A 35 20.870 1.457 -0.691 1.00 0.00 H new ATOM 0 HD2 TYR A 35 22.499 -2.226 -2.083 1.00 0.00 H new ATOM 0 HE1 TYR A 35 18.774 0.980 -1.882 1.00 0.00 H new ATOM 0 HE2 TYR A 35 20.406 -2.703 -3.278 1.00 0.00 H new ATOM 0 HH TYR A 35 18.458 -1.146 -4.286 1.00 0.00 H new ATOM 517 N SER A 36 21.236 -1.015 2.272 1.00 0.00 N ATOM 518 CA SER A 36 20.455 -2.109 2.839 1.00 0.00 C ATOM 519 C SER A 36 18.966 -1.849 2.638 1.00 0.00 C ATOM 520 O SER A 36 18.483 -0.759 2.931 1.00 0.00 O ATOM 521 CB SER A 36 20.764 -2.268 4.330 1.00 0.00 C ATOM 522 OG SER A 36 21.776 -3.236 4.540 1.00 0.00 O ATOM 0 H SER A 36 20.900 -0.086 2.526 1.00 0.00 H new ATOM 0 HA SER A 36 20.726 -3.032 2.326 1.00 0.00 H new ATOM 0 HB2 SER A 36 21.081 -1.310 4.743 1.00 0.00 H new ATOM 0 HB3 SER A 36 19.860 -2.561 4.863 1.00 0.00 H new ATOM 0 HG SER A 36 21.956 -3.318 5.500 1.00 0.00 H new ATOM 528 N GLU A 37 18.239 -2.844 2.137 1.00 0.00 N ATOM 529 CA GLU A 37 16.807 -2.680 1.908 1.00 0.00 C ATOM 530 C GLU A 37 16.075 -2.380 3.211 1.00 0.00 C ATOM 531 O GLU A 37 15.165 -1.554 3.249 1.00 0.00 O ATOM 532 CB GLU A 37 16.206 -3.921 1.255 1.00 0.00 C ATOM 533 CG GLU A 37 14.738 -3.747 0.901 1.00 0.00 C ATOM 534 CD GLU A 37 14.479 -3.812 -0.592 1.00 0.00 C ATOM 535 OE1 GLU A 37 14.662 -2.781 -1.272 1.00 0.00 O ATOM 536 OE2 GLU A 37 14.091 -4.895 -1.079 1.00 0.00 O ATOM 0 H GLU A 37 18.611 -3.760 1.885 1.00 0.00 H new ATOM 0 HA GLU A 37 16.683 -1.835 1.231 1.00 0.00 H new ATOM 0 HB2 GLU A 37 16.767 -4.159 0.351 1.00 0.00 H new ATOM 0 HB3 GLU A 37 16.314 -4.770 1.930 1.00 0.00 H new ATOM 0 HG2 GLU A 37 14.155 -4.521 1.400 1.00 0.00 H new ATOM 0 HG3 GLU A 37 14.388 -2.788 1.284 1.00 0.00 H new ATOM 543 N ALA A 38 16.483 -3.043 4.285 1.00 0.00 N ATOM 544 CA ALA A 38 15.869 -2.823 5.590 1.00 0.00 C ATOM 545 C ALA A 38 15.989 -1.359 5.996 1.00 0.00 C ATOM 546 O ALA A 38 15.131 -0.817 6.692 1.00 0.00 O ATOM 547 CB ALA A 38 16.526 -3.710 6.631 1.00 0.00 C ATOM 0 H ALA A 38 17.233 -3.735 4.280 1.00 0.00 H new ATOM 0 HA ALA A 38 14.811 -3.078 5.524 1.00 0.00 H new ATOM 0 HB1 ALA A 38 16.061 -3.538 7.602 1.00 0.00 H new ATOM 0 HB2 ALA A 38 16.402 -4.756 6.349 1.00 0.00 H new ATOM 0 HB3 ALA A 38 17.589 -3.474 6.691 1.00 0.00 H new ATOM 553 N LYS A 39 17.066 -0.731 5.543 1.00 0.00 N ATOM 554 CA LYS A 39 17.333 0.667 5.832 1.00 0.00 C ATOM 555 C LYS A 39 16.796 1.574 4.715 1.00 0.00 C ATOM 556 O LYS A 39 16.575 2.764 4.926 1.00 0.00 O ATOM 557 CB LYS A 39 18.841 0.861 5.994 1.00 0.00 C ATOM 558 CG LYS A 39 19.287 1.039 7.433 1.00 0.00 C ATOM 559 CD LYS A 39 18.950 -0.177 8.271 1.00 0.00 C ATOM 560 CE LYS A 39 20.008 -1.259 8.135 1.00 0.00 C ATOM 561 NZ LYS A 39 19.864 -2.312 9.179 1.00 0.00 N ATOM 0 H LYS A 39 17.777 -1.179 4.965 1.00 0.00 H new ATOM 0 HA LYS A 39 16.823 0.943 6.755 1.00 0.00 H new ATOM 0 HB2 LYS A 39 19.356 -0.000 5.568 1.00 0.00 H new ATOM 0 HB3 LYS A 39 19.149 1.734 5.418 1.00 0.00 H new ATOM 0 HG2 LYS A 39 20.362 1.217 7.463 1.00 0.00 H new ATOM 0 HG3 LYS A 39 18.806 1.920 7.858 1.00 0.00 H new ATOM 0 HD2 LYS A 39 18.859 0.115 9.317 1.00 0.00 H new ATOM 0 HD3 LYS A 39 17.982 -0.573 7.966 1.00 0.00 H new ATOM 0 HE2 LYS A 39 19.936 -1.715 7.147 1.00 0.00 H new ATOM 0 HE3 LYS A 39 20.998 -0.809 8.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 20.604 -3.031 9.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 19.958 -1.882 10.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 18.929 -2.759 9.094 1.00 0.00 H new ATOM 575 N VAL A 40 16.596 0.999 3.525 1.00 0.00 N ATOM 576 CA VAL A 40 16.094 1.744 2.370 1.00 0.00 C ATOM 577 C VAL A 40 14.828 2.543 2.722 1.00 0.00 C ATOM 578 O VAL A 40 14.532 3.559 2.091 1.00 0.00 O ATOM 579 CB VAL A 40 15.845 0.767 1.173 1.00 0.00 C ATOM 580 CG1 VAL A 40 14.772 1.252 0.199 1.00 0.00 C ATOM 581 CG2 VAL A 40 17.148 0.514 0.430 1.00 0.00 C ATOM 0 H VAL A 40 16.776 0.013 3.338 1.00 0.00 H new ATOM 0 HA VAL A 40 16.850 2.470 2.070 1.00 0.00 H new ATOM 0 HB VAL A 40 15.470 -0.161 1.605 1.00 0.00 H new ATOM 0 HG11 VAL A 40 14.654 0.525 -0.604 1.00 0.00 H new ATOM 0 HG12 VAL A 40 13.826 1.366 0.728 1.00 0.00 H new ATOM 0 HG13 VAL A 40 15.070 2.212 -0.222 1.00 0.00 H new ATOM 0 HG21 VAL A 40 16.966 -0.167 -0.402 1.00 0.00 H new ATOM 0 HG22 VAL A 40 17.538 1.457 0.048 1.00 0.00 H new ATOM 0 HG23 VAL A 40 17.875 0.070 1.110 1.00 0.00 H new ATOM 591 N SER A 41 14.091 2.083 3.727 1.00 0.00 N ATOM 592 CA SER A 41 12.870 2.761 4.148 1.00 0.00 C ATOM 593 C SER A 41 13.090 3.525 5.447 1.00 0.00 C ATOM 594 O SER A 41 12.473 4.564 5.681 1.00 0.00 O ATOM 595 CB SER A 41 11.736 1.752 4.325 1.00 0.00 C ATOM 596 OG SER A 41 10.479 2.402 4.395 1.00 0.00 O ATOM 0 H SER A 41 14.317 1.246 4.264 1.00 0.00 H new ATOM 0 HA SER A 41 12.596 3.474 3.370 1.00 0.00 H new ATOM 0 HB2 SER A 41 11.739 1.048 3.493 1.00 0.00 H new ATOM 0 HB3 SER A 41 11.900 1.172 5.233 1.00 0.00 H new ATOM 0 HG SER A 41 10.032 2.160 5.233 1.00 0.00 H new ATOM 602 N GLN A 42 13.969 3.001 6.289 1.00 0.00 N ATOM 603 CA GLN A 42 14.266 3.631 7.569 1.00 0.00 C ATOM 604 C GLN A 42 15.137 4.860 7.387 1.00 0.00 C ATOM 605 O GLN A 42 14.972 5.856 8.092 1.00 0.00 O ATOM 606 CB GLN A 42 14.954 2.632 8.503 1.00 0.00 C ATOM 607 CG GLN A 42 13.996 1.688 9.215 1.00 0.00 C ATOM 608 CD GLN A 42 13.002 1.030 8.274 1.00 0.00 C ATOM 609 OE1 GLN A 42 12.182 1.703 7.651 1.00 0.00 O ATOM 610 NE2 GLN A 42 13.070 -0.292 8.172 1.00 0.00 N ATOM 0 H GLN A 42 14.489 2.142 6.110 1.00 0.00 H new ATOM 0 HA GLN A 42 13.323 3.947 8.016 1.00 0.00 H new ATOM 0 HB2 GLN A 42 15.667 2.043 7.926 1.00 0.00 H new ATOM 0 HB3 GLN A 42 15.526 3.183 9.249 1.00 0.00 H new ATOM 0 HG2 GLN A 42 14.570 0.915 9.727 1.00 0.00 H new ATOM 0 HG3 GLN A 42 13.452 2.241 9.981 1.00 0.00 H new ATOM 0 HE21 GLN A 42 13.767 -0.810 8.708 1.00 0.00 H new ATOM 0 HE22 GLN A 42 12.426 -0.790 7.558 1.00 0.00 H new ATOM 619 N TRP A 43 16.061 4.796 6.441 1.00 0.00 N ATOM 620 CA TRP A 43 16.944 5.919 6.184 1.00 0.00 C ATOM 621 C TRP A 43 16.161 7.140 5.753 1.00 0.00 C ATOM 622 O TRP A 43 16.294 8.208 6.341 1.00 0.00 O ATOM 623 CB TRP A 43 17.958 5.584 5.105 1.00 0.00 C ATOM 624 CG TRP A 43 19.129 4.772 5.563 1.00 0.00 C ATOM 625 CD1 TRP A 43 19.851 3.947 4.767 1.00 0.00 C ATOM 626 CD2 TRP A 43 19.741 4.700 6.878 1.00 0.00 C ATOM 627 NE1 TRP A 43 20.843 3.347 5.483 1.00 0.00 N ATOM 628 CE2 TRP A 43 20.807 3.788 6.771 1.00 0.00 C ATOM 629 CE3 TRP A 43 19.506 5.296 8.133 1.00 0.00 C ATOM 630 CZ2 TRP A 43 21.627 3.457 7.847 1.00 0.00 C ATOM 631 CZ3 TRP A 43 20.325 4.965 9.195 1.00 0.00 C ATOM 632 CH2 TRP A 43 21.373 4.053 9.047 1.00 0.00 C ATOM 0 H TRP A 43 16.217 3.984 5.843 1.00 0.00 H new ATOM 0 HA TRP A 43 17.466 6.133 7.117 1.00 0.00 H new ATOM 0 HB2 TRP A 43 17.450 5.042 4.307 1.00 0.00 H new ATOM 0 HB3 TRP A 43 18.327 6.515 4.674 1.00 0.00 H new ATOM 0 HD1 TRP A 43 19.667 3.788 3.715 1.00 0.00 H new ATOM 0 HE1 TRP A 43 21.510 2.671 5.111 1.00 0.00 H new ATOM 0 HE3 TRP A 43 18.698 6.001 8.263 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 22.437 2.752 7.735 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 20.152 5.420 10.159 1.00 0.00 H new ATOM 0 HH2 TRP A 43 21.993 3.816 9.899 1.00 0.00 H new ATOM 643 N THR A 44 15.339 6.980 4.723 1.00 0.00 N ATOM 644 CA THR A 44 14.546 8.091 4.208 1.00 0.00 C ATOM 645 C THR A 44 13.723 8.743 5.322 1.00 0.00 C ATOM 646 O THR A 44 13.405 9.930 5.260 1.00 0.00 O ATOM 647 CB THR A 44 13.663 7.619 3.046 1.00 0.00 C ATOM 648 OG1 THR A 44 13.348 8.701 2.192 1.00 0.00 O ATOM 649 CG2 THR A 44 12.362 6.974 3.469 1.00 0.00 C ATOM 0 H THR A 44 15.204 6.097 4.230 1.00 0.00 H new ATOM 0 HA THR A 44 15.222 8.855 3.824 1.00 0.00 H new ATOM 0 HB THR A 44 14.258 6.860 2.538 1.00 0.00 H new ATOM 0 HG1 THR A 44 13.215 9.512 2.726 1.00 0.00 H new ATOM 0 HG21 THR A 44 11.802 6.671 2.585 1.00 0.00 H new ATOM 0 HG22 THR A 44 12.573 6.098 4.083 1.00 0.00 H new ATOM 0 HG23 THR A 44 11.773 7.687 4.045 1.00 0.00 H new ATOM 657 N SER A 45 13.428 7.969 6.360 1.00 0.00 N ATOM 658 CA SER A 45 12.700 8.494 7.501 1.00 0.00 C ATOM 659 C SER A 45 13.643 9.403 8.275 1.00 0.00 C ATOM 660 O SER A 45 13.266 10.487 8.719 1.00 0.00 O ATOM 661 CB SER A 45 12.173 7.360 8.382 1.00 0.00 C ATOM 662 OG SER A 45 10.757 7.381 8.446 1.00 0.00 O ATOM 0 H SER A 45 13.681 6.983 6.432 1.00 0.00 H new ATOM 0 HA SER A 45 11.830 9.060 7.167 1.00 0.00 H new ATOM 0 HB2 SER A 45 12.508 6.401 7.986 1.00 0.00 H new ATOM 0 HB3 SER A 45 12.587 7.452 9.386 1.00 0.00 H new ATOM 0 HG SER A 45 10.444 6.646 9.013 1.00 0.00 H new ATOM 668 N SER A 46 14.897 8.963 8.378 1.00 0.00 N ATOM 669 CA SER A 46 15.931 9.749 9.034 1.00 0.00 C ATOM 670 C SER A 46 16.179 11.005 8.215 1.00 0.00 C ATOM 671 O SER A 46 16.405 12.083 8.760 1.00 0.00 O ATOM 672 CB SER A 46 17.220 8.940 9.179 1.00 0.00 C ATOM 673 OG SER A 46 17.207 8.166 10.366 1.00 0.00 O ATOM 0 H SER A 46 15.217 8.066 8.014 1.00 0.00 H new ATOM 0 HA SER A 46 15.600 10.021 10.036 1.00 0.00 H new ATOM 0 HB2 SER A 46 17.341 8.285 8.316 1.00 0.00 H new ATOM 0 HB3 SER A 46 18.077 9.614 9.190 1.00 0.00 H new ATOM 0 HG SER A 46 18.042 7.657 10.434 1.00 0.00 H new ATOM 679 N CYS A 47 16.082 10.860 6.892 1.00 0.00 N ATOM 680 CA CYS A 47 16.238 11.983 5.973 1.00 0.00 C ATOM 681 C CYS A 47 15.169 13.010 6.300 1.00 0.00 C ATOM 682 O CYS A 47 15.411 14.213 6.291 1.00 0.00 O ATOM 683 CB CYS A 47 16.085 11.481 4.521 1.00 0.00 C ATOM 684 SG CYS A 47 15.540 12.707 3.295 1.00 0.00 S ATOM 0 H CYS A 47 15.895 9.968 6.433 1.00 0.00 H new ATOM 0 HA CYS A 47 17.224 12.436 6.076 1.00 0.00 H new ATOM 0 HB2 CYS A 47 17.044 11.076 4.197 1.00 0.00 H new ATOM 0 HB3 CYS A 47 15.373 10.655 4.518 1.00 0.00 H new ATOM 0 HG CYS A 47 14.296 13.014 3.512 1.00 0.00 H new ATOM 690 N LEU A 48 13.983 12.501 6.586 1.00 0.00 N ATOM 691 CA LEU A 48 12.859 13.336 6.917 1.00 0.00 C ATOM 692 C LEU A 48 13.108 14.072 8.206 1.00 0.00 C ATOM 693 O LEU A 48 12.751 15.243 8.325 1.00 0.00 O ATOM 694 CB LEU A 48 11.587 12.487 6.990 1.00 0.00 C ATOM 695 CG LEU A 48 10.787 12.370 5.683 1.00 0.00 C ATOM 696 CD1 LEU A 48 11.686 12.552 4.459 1.00 0.00 C ATOM 697 CD2 LEU A 48 10.064 11.028 5.625 1.00 0.00 C ATOM 0 H LEU A 48 13.780 11.501 6.593 1.00 0.00 H new ATOM 0 HA LEU A 48 12.725 14.084 6.136 1.00 0.00 H new ATOM 0 HB2 LEU A 48 11.860 11.484 7.318 1.00 0.00 H new ATOM 0 HB3 LEU A 48 10.936 12.907 7.757 1.00 0.00 H new ATOM 0 HG LEU A 48 10.046 13.169 5.669 1.00 0.00 H new ATOM 0 HD11 LEU A 48 11.088 12.463 3.552 1.00 0.00 H new ATOM 0 HD12 LEU A 48 12.151 13.537 4.492 1.00 0.00 H new ATOM 0 HD13 LEU A 48 12.461 11.785 4.459 1.00 0.00 H new ATOM 0 HD21 LEU A 48 9.501 10.958 4.694 1.00 0.00 H new ATOM 0 HD22 LEU A 48 10.794 10.219 5.670 1.00 0.00 H new ATOM 0 HD23 LEU A 48 9.380 10.946 6.470 1.00 0.00 H new ATOM 709 N GLU A 49 13.757 13.412 9.160 1.00 0.00 N ATOM 710 CA GLU A 49 14.071 14.083 10.402 1.00 0.00 C ATOM 711 C GLU A 49 15.256 15.002 10.192 1.00 0.00 C ATOM 712 O GLU A 49 15.324 16.077 10.751 1.00 0.00 O ATOM 713 CB GLU A 49 14.360 13.136 11.552 1.00 0.00 C ATOM 714 CG GLU A 49 14.403 13.884 12.873 1.00 0.00 C ATOM 715 CD GLU A 49 15.065 13.091 13.982 1.00 0.00 C ATOM 716 OE1 GLU A 49 16.304 12.942 13.946 1.00 0.00 O ATOM 717 OE2 GLU A 49 14.344 12.621 14.887 1.00 0.00 O ATOM 0 H GLU A 49 14.065 12.442 9.096 1.00 0.00 H new ATOM 0 HA GLU A 49 13.183 14.648 10.684 1.00 0.00 H new ATOM 0 HB2 GLU A 49 13.593 12.362 11.593 1.00 0.00 H new ATOM 0 HB3 GLU A 49 15.312 12.633 11.383 1.00 0.00 H new ATOM 0 HG2 GLU A 49 14.939 14.823 12.735 1.00 0.00 H new ATOM 0 HG3 GLU A 49 13.387 14.139 13.173 1.00 0.00 H new ATOM 724 N HIS A 50 16.180 14.579 9.353 1.00 0.00 N ATOM 725 CA HIS A 50 17.347 15.391 9.056 1.00 0.00 C ATOM 726 C HIS A 50 17.021 16.435 7.978 1.00 0.00 C ATOM 727 O HIS A 50 17.876 17.240 7.610 1.00 0.00 O ATOM 728 CB HIS A 50 18.505 14.505 8.597 1.00 0.00 C ATOM 729 CG HIS A 50 19.185 13.779 9.715 1.00 0.00 C ATOM 730 ND1 HIS A 50 20.136 14.364 10.526 1.00 0.00 N ATOM 731 CD2 HIS A 50 19.046 12.507 10.158 1.00 0.00 C ATOM 732 CE1 HIS A 50 20.553 13.482 11.417 1.00 0.00 C ATOM 733 NE2 HIS A 50 19.907 12.349 11.216 1.00 0.00 N ATOM 0 H HIS A 50 16.148 13.683 8.866 1.00 0.00 H new ATOM 0 HA HIS A 50 17.641 15.914 9.966 1.00 0.00 H new ATOM 0 HB2 HIS A 50 18.131 13.777 7.877 1.00 0.00 H new ATOM 0 HB3 HIS A 50 19.238 15.121 8.076 1.00 0.00 H new ATOM 0 HD2 HIS A 50 18.382 11.757 9.755 1.00 0.00 H new ATOM 0 HE1 HIS A 50 21.296 13.658 12.180 1.00 0.00 H new ATOM 0 HE2 HIS A 50 20.028 11.494 11.759 1.00 0.00 H new ATOM 742 N CYS A 51 15.767 16.445 7.505 1.00 0.00 N ATOM 743 CA CYS A 51 15.331 17.413 6.518 1.00 0.00 C ATOM 744 C CYS A 51 14.647 18.525 7.285 1.00 0.00 C ATOM 745 O CYS A 51 14.989 19.701 7.172 1.00 0.00 O ATOM 746 CB CYS A 51 14.360 16.775 5.503 1.00 0.00 C ATOM 747 SG CYS A 51 13.809 17.917 4.215 1.00 0.00 S ATOM 0 H CYS A 51 15.044 15.788 7.798 1.00 0.00 H new ATOM 0 HA CYS A 51 16.177 17.789 5.944 1.00 0.00 H new ATOM 0 HB2 CYS A 51 14.847 15.920 5.035 1.00 0.00 H new ATOM 0 HB3 CYS A 51 13.489 16.394 6.036 1.00 0.00 H new ATOM 0 HG CYS A 51 13.953 19.141 4.629 1.00 0.00 H new ATOM 753 N ILE A 52 13.704 18.106 8.116 1.00 0.00 N ATOM 754 CA ILE A 52 12.959 19.007 8.981 1.00 0.00 C ATOM 755 C ILE A 52 13.904 19.797 9.889 1.00 0.00 C ATOM 756 O ILE A 52 13.782 21.014 10.015 1.00 0.00 O ATOM 757 CB ILE A 52 11.957 18.207 9.854 1.00 0.00 C ATOM 758 CG1 ILE A 52 11.245 19.130 10.872 1.00 0.00 C ATOM 759 CG2 ILE A 52 12.665 17.042 10.545 1.00 0.00 C ATOM 760 CD1 ILE A 52 11.120 18.577 12.263 1.00 0.00 C ATOM 0 H ILE A 52 13.433 17.127 8.209 1.00 0.00 H new ATOM 0 HA ILE A 52 12.413 19.706 8.347 1.00 0.00 H new ATOM 0 HB ILE A 52 11.186 17.792 9.205 1.00 0.00 H new ATOM 0 HG12 ILE A 52 11.787 20.075 10.922 1.00 0.00 H new ATOM 0 HG13 ILE A 52 10.246 19.355 10.497 1.00 0.00 H new ATOM 0 HG21 ILE A 52 11.949 16.490 11.154 1.00 0.00 H new ATOM 0 HG22 ILE A 52 13.090 16.377 9.793 1.00 0.00 H new ATOM 0 HG23 ILE A 52 13.462 17.427 11.182 1.00 0.00 H new ATOM 0 HD11 ILE A 52 10.607 19.300 12.897 1.00 0.00 H new ATOM 0 HD12 ILE A 52 10.549 17.649 12.236 1.00 0.00 H new ATOM 0 HD13 ILE A 52 12.113 18.380 12.667 1.00 0.00 H new ATOM 772 N LYS A 53 14.826 19.093 10.531 1.00 0.00 N ATOM 773 CA LYS A 53 15.769 19.717 11.446 1.00 0.00 C ATOM 774 C LYS A 53 16.594 20.781 10.745 1.00 0.00 C ATOM 775 O LYS A 53 16.958 21.793 11.345 1.00 0.00 O ATOM 776 CB LYS A 53 16.645 18.640 12.071 1.00 0.00 C ATOM 777 CG LYS A 53 15.832 17.632 12.865 1.00 0.00 C ATOM 778 CD LYS A 53 15.437 18.165 14.218 1.00 0.00 C ATOM 779 CE LYS A 53 14.159 18.996 14.153 1.00 0.00 C ATOM 780 NZ LYS A 53 14.361 20.365 14.702 1.00 0.00 N ATOM 0 H LYS A 53 14.940 18.084 10.434 1.00 0.00 H new ATOM 0 HA LYS A 53 15.220 20.225 12.239 1.00 0.00 H new ATOM 0 HB2 LYS A 53 17.197 18.122 11.287 1.00 0.00 H new ATOM 0 HB3 LYS A 53 17.382 19.107 12.725 1.00 0.00 H new ATOM 0 HG2 LYS A 53 14.936 17.367 12.304 1.00 0.00 H new ATOM 0 HG3 LYS A 53 16.412 16.717 12.991 1.00 0.00 H new ATOM 0 HD2 LYS A 53 15.294 17.333 14.908 1.00 0.00 H new ATOM 0 HD3 LYS A 53 16.247 18.775 14.618 1.00 0.00 H new ATOM 0 HE2 LYS A 53 13.823 19.065 13.118 1.00 0.00 H new ATOM 0 HE3 LYS A 53 13.370 18.493 14.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 13.448 20.750 15.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 15.018 20.323 15.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 14.758 20.980 13.963 1.00 0.00 H new ATOM 794 N ARG A 54 16.853 20.569 9.466 1.00 0.00 N ATOM 795 CA ARG A 54 17.598 21.541 8.683 1.00 0.00 C ATOM 796 C ARG A 54 16.690 22.719 8.345 1.00 0.00 C ATOM 797 O ARG A 54 17.130 23.870 8.291 1.00 0.00 O ATOM 798 CB ARG A 54 18.145 20.903 7.403 1.00 0.00 C ATOM 799 CG ARG A 54 19.620 20.544 7.483 1.00 0.00 C ATOM 800 CD ARG A 54 20.472 21.737 7.894 1.00 0.00 C ATOM 801 NE ARG A 54 20.965 21.612 9.264 1.00 0.00 N ATOM 802 CZ ARG A 54 21.760 22.504 9.857 1.00 0.00 C ATOM 803 NH1 ARG A 54 22.159 23.592 9.207 1.00 0.00 N ATOM 804 NH2 ARG A 54 22.157 22.306 11.106 1.00 0.00 N ATOM 0 H ARG A 54 16.561 19.739 8.950 1.00 0.00 H new ATOM 0 HA ARG A 54 18.446 21.895 9.269 1.00 0.00 H new ATOM 0 HB2 ARG A 54 17.572 20.002 7.183 1.00 0.00 H new ATOM 0 HB3 ARG A 54 17.992 21.590 6.571 1.00 0.00 H new ATOM 0 HG2 ARG A 54 19.758 19.735 8.200 1.00 0.00 H new ATOM 0 HG3 ARG A 54 19.957 20.173 6.515 1.00 0.00 H new ATOM 0 HD2 ARG A 54 21.317 21.831 7.212 1.00 0.00 H new ATOM 0 HD3 ARG A 54 19.885 22.651 7.802 1.00 0.00 H new ATOM 0 HE ARG A 54 20.684 20.791 9.800 1.00 0.00 H new ATOM 0 HH11 ARG A 54 21.857 23.751 8.246 1.00 0.00 H new ATOM 0 HH12 ARG A 54 22.767 24.268 9.669 1.00 0.00 H new ATOM 0 HH21 ARG A 54 21.855 21.473 11.611 1.00 0.00 H new ATOM 0 HH22 ARG A 54 22.765 22.986 11.562 1.00 0.00 H new ATOM 818 N LEU A 55 15.411 22.416 8.134 1.00 0.00 N ATOM 819 CA LEU A 55 14.428 23.439 7.814 1.00 0.00 C ATOM 820 C LEU A 55 14.172 24.330 9.021 1.00 0.00 C ATOM 821 O LEU A 55 13.867 25.514 8.881 1.00 0.00 O ATOM 822 CB LEU A 55 13.135 22.785 7.338 1.00 0.00 C ATOM 823 CG LEU A 55 13.266 22.049 6.008 1.00 0.00 C ATOM 824 CD1 LEU A 55 12.013 21.250 5.697 1.00 0.00 C ATOM 825 CD2 LEU A 55 13.570 23.035 4.899 1.00 0.00 C ATOM 0 H LEU A 55 15.035 21.469 8.180 1.00 0.00 H new ATOM 0 HA LEU A 55 14.817 24.065 7.011 1.00 0.00 H new ATOM 0 HB2 LEU A 55 12.794 22.083 8.098 1.00 0.00 H new ATOM 0 HB3 LEU A 55 12.366 23.551 7.243 1.00 0.00 H new ATOM 0 HG LEU A 55 14.093 21.343 6.084 1.00 0.00 H new ATOM 0 HD11 LEU A 55 12.136 20.737 4.743 1.00 0.00 H new ATOM 0 HD12 LEU A 55 11.844 20.516 6.485 1.00 0.00 H new ATOM 0 HD13 LEU A 55 11.157 21.923 5.639 1.00 0.00 H new ATOM 0 HD21 LEU A 55 13.662 22.502 3.953 1.00 0.00 H new ATOM 0 HD22 LEU A 55 12.762 23.763 4.828 1.00 0.00 H new ATOM 0 HD23 LEU A 55 14.505 23.551 5.117 1.00 0.00 H new ATOM 837 N THR A 56 14.319 23.754 10.208 1.00 0.00 N ATOM 838 CA THR A 56 14.127 24.495 11.445 1.00 0.00 C ATOM 839 C THR A 56 15.330 25.394 11.689 1.00 0.00 C ATOM 840 O THR A 56 15.194 26.515 12.180 1.00 0.00 O ATOM 841 CB THR A 56 13.932 23.533 12.620 1.00 0.00 C ATOM 842 OG1 THR A 56 15.177 23.028 13.068 1.00 0.00 O ATOM 843 CG2 THR A 56 13.049 22.350 12.284 1.00 0.00 C ATOM 0 H THR A 56 14.571 22.774 10.338 1.00 0.00 H new ATOM 0 HA THR A 56 13.232 25.111 11.358 1.00 0.00 H new ATOM 0 HB THR A 56 13.444 24.121 13.397 1.00 0.00 H new ATOM 0 HG1 THR A 56 15.659 22.630 12.313 1.00 0.00 H new ATOM 0 HG21 THR A 56 12.952 21.708 13.160 1.00 0.00 H new ATOM 0 HG22 THR A 56 12.063 22.705 11.984 1.00 0.00 H new ATOM 0 HG23 THR A 56 13.495 21.784 11.467 1.00 0.00 H new ATOM 851 N ALA A 57 16.507 24.898 11.317 1.00 0.00 N ATOM 852 CA ALA A 57 17.737 25.658 11.465 1.00 0.00 C ATOM 853 C ALA A 57 17.703 26.872 10.550 1.00 0.00 C ATOM 854 O ALA A 57 18.121 27.966 10.930 1.00 0.00 O ATOM 855 CB ALA A 57 18.943 24.784 11.152 1.00 0.00 C ATOM 0 H ALA A 57 16.631 23.971 10.910 1.00 0.00 H new ATOM 0 HA ALA A 57 17.824 25.997 12.497 1.00 0.00 H new ATOM 0 HB1 ALA A 57 19.856 25.368 11.268 1.00 0.00 H new ATOM 0 HB2 ALA A 57 18.966 23.936 11.837 1.00 0.00 H new ATOM 0 HB3 ALA A 57 18.873 24.420 10.127 1.00 0.00 H new ATOM 861 N LEU A 58 17.187 26.669 9.341 1.00 0.00 N ATOM 862 CA LEU A 58 17.074 27.737 8.365 1.00 0.00 C ATOM 863 C LEU A 58 15.898 28.652 8.707 1.00 0.00 C ATOM 864 O LEU A 58 15.936 29.854 8.443 1.00 0.00 O ATOM 865 CB LEU A 58 16.898 27.139 6.968 1.00 0.00 C ATOM 866 CG LEU A 58 18.168 27.104 6.114 1.00 0.00 C ATOM 867 CD1 LEU A 58 18.229 25.825 5.294 1.00 0.00 C ATOM 868 CD2 LEU A 58 18.232 28.324 5.209 1.00 0.00 C ATOM 0 H LEU A 58 16.840 25.766 9.017 1.00 0.00 H new ATOM 0 HA LEU A 58 17.986 28.334 8.384 1.00 0.00 H new ATOM 0 HB2 LEU A 58 16.519 26.122 7.070 1.00 0.00 H new ATOM 0 HB3 LEU A 58 16.137 27.712 6.437 1.00 0.00 H new ATOM 0 HG LEU A 58 19.031 27.122 6.780 1.00 0.00 H new ATOM 0 HD11 LEU A 58 19.139 25.820 4.694 1.00 0.00 H new ATOM 0 HD12 LEU A 58 18.230 24.964 5.962 1.00 0.00 H new ATOM 0 HD13 LEU A 58 17.361 25.773 4.637 1.00 0.00 H new ATOM 0 HD21 LEU A 58 19.141 28.284 4.608 1.00 0.00 H new ATOM 0 HD22 LEU A 58 17.363 28.335 4.552 1.00 0.00 H new ATOM 0 HD23 LEU A 58 18.239 29.228 5.817 1.00 0.00 H new ATOM 880 N ASN A 59 14.854 28.066 9.300 1.00 0.00 N ATOM 881 CA ASN A 59 13.648 28.803 9.697 1.00 0.00 C ATOM 882 C ASN A 59 13.180 29.776 8.612 1.00 0.00 C ATOM 883 O ASN A 59 13.336 30.990 8.743 1.00 0.00 O ATOM 884 CB ASN A 59 13.891 29.556 11.010 1.00 0.00 C ATOM 885 CG ASN A 59 15.006 30.578 10.904 1.00 0.00 C ATOM 886 OD1 ASN A 59 14.761 31.754 10.635 1.00 0.00 O ATOM 887 ND2 ASN A 59 16.238 30.133 11.115 1.00 0.00 N ATOM 0 H ASN A 59 14.820 27.070 9.518 1.00 0.00 H new ATOM 0 HA ASN A 59 12.856 28.069 9.841 1.00 0.00 H new ATOM 0 HB2 ASN A 59 12.972 30.058 11.311 1.00 0.00 H new ATOM 0 HB3 ASN A 59 14.134 28.840 11.795 1.00 0.00 H new ATOM 0 HD21 ASN A 59 17.029 30.774 11.057 1.00 0.00 H new ATOM 0 HD22 ASN A 59 16.394 29.149 11.335 1.00 0.00 H new ATOM 894 N LYS A 60 12.605 29.231 7.544 1.00 0.00 N ATOM 895 CA LYS A 60 12.111 30.051 6.439 1.00 0.00 C ATOM 896 C LYS A 60 11.478 29.176 5.346 1.00 0.00 C ATOM 897 O LYS A 60 12.190 28.450 4.652 1.00 0.00 O ATOM 898 CB LYS A 60 13.253 30.879 5.841 1.00 0.00 C ATOM 899 CG LYS A 60 12.840 32.287 5.448 1.00 0.00 C ATOM 900 CD LYS A 60 13.164 33.289 6.544 1.00 0.00 C ATOM 901 CE LYS A 60 12.719 34.692 6.166 1.00 0.00 C ATOM 902 NZ LYS A 60 13.512 35.737 6.873 1.00 0.00 N ATOM 0 H LYS A 60 12.469 28.228 7.419 1.00 0.00 H new ATOM 0 HA LYS A 60 11.347 30.722 6.832 1.00 0.00 H new ATOM 0 HB2 LYS A 60 14.067 30.936 6.564 1.00 0.00 H new ATOM 0 HB3 LYS A 60 13.643 30.365 4.962 1.00 0.00 H new ATOM 0 HG2 LYS A 60 13.351 32.574 4.529 1.00 0.00 H new ATOM 0 HG3 LYS A 60 11.771 32.308 5.238 1.00 0.00 H new ATOM 0 HD2 LYS A 60 12.674 32.988 7.470 1.00 0.00 H new ATOM 0 HD3 LYS A 60 14.237 33.286 6.736 1.00 0.00 H new ATOM 0 HE2 LYS A 60 12.820 34.827 5.089 1.00 0.00 H new ATOM 0 HE3 LYS A 60 11.663 34.814 6.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 13.177 36.679 6.587 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 13.396 35.625 7.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 14.517 35.637 6.625 1.00 0.00 H new ATOM 916 N PRO A 61 10.133 29.219 5.163 1.00 0.00 N ATOM 917 CA PRO A 61 9.220 30.059 5.950 1.00 0.00 C ATOM 918 C PRO A 61 8.986 29.510 7.371 1.00 0.00 C ATOM 919 O PRO A 61 9.728 29.853 8.291 1.00 0.00 O ATOM 920 CB PRO A 61 7.932 30.061 5.125 1.00 0.00 C ATOM 921 CG PRO A 61 7.966 28.793 4.341 1.00 0.00 C ATOM 922 CD PRO A 61 9.415 28.429 4.147 1.00 0.00 C ATOM 0 HA PRO A 61 9.622 31.059 6.115 1.00 0.00 H new ATOM 0 HB2 PRO A 61 7.053 30.103 5.768 1.00 0.00 H new ATOM 0 HB3 PRO A 61 7.887 30.929 4.467 1.00 0.00 H new ATOM 0 HG2 PRO A 61 7.437 28.000 4.869 1.00 0.00 H new ATOM 0 HG3 PRO A 61 7.469 28.922 3.379 1.00 0.00 H new ATOM 0 HD2 PRO A 61 9.578 27.360 4.287 1.00 0.00 H new ATOM 0 HD3 PRO A 61 9.755 28.674 3.141 1.00 0.00 H new ATOM 930 N PHE A 62 7.964 28.665 7.556 1.00 0.00 N ATOM 931 CA PHE A 62 7.670 28.099 8.867 1.00 0.00 C ATOM 932 C PHE A 62 7.184 26.658 8.746 1.00 0.00 C ATOM 933 O PHE A 62 7.821 25.733 9.248 1.00 0.00 O ATOM 934 CB PHE A 62 6.617 28.947 9.583 1.00 0.00 C ATOM 935 CG PHE A 62 6.622 28.777 11.076 1.00 0.00 C ATOM 936 CD1 PHE A 62 7.796 28.912 11.798 1.00 0.00 C ATOM 937 CD2 PHE A 62 5.451 28.482 11.755 1.00 0.00 C ATOM 938 CE1 PHE A 62 7.803 28.756 13.171 1.00 0.00 C ATOM 939 CE2 PHE A 62 5.452 28.326 13.129 1.00 0.00 C ATOM 940 CZ PHE A 62 6.629 28.463 13.837 1.00 0.00 C ATOM 0 H PHE A 62 7.332 28.363 6.814 1.00 0.00 H new ATOM 0 HA PHE A 62 8.591 28.101 9.451 1.00 0.00 H new ATOM 0 HB2 PHE A 62 6.785 29.997 9.345 1.00 0.00 H new ATOM 0 HB3 PHE A 62 5.631 28.687 9.199 1.00 0.00 H new ATOM 0 HD1 PHE A 62 8.717 29.142 11.282 1.00 0.00 H new ATOM 0 HD2 PHE A 62 4.528 28.373 11.205 1.00 0.00 H new ATOM 0 HE1 PHE A 62 8.725 28.863 13.723 1.00 0.00 H new ATOM 0 HE2 PHE A 62 4.533 28.097 13.648 1.00 0.00 H new ATOM 0 HZ PHE A 62 6.632 28.341 14.910 1.00 0.00 H new ATOM 950 N LYS A 63 6.044 26.476 8.081 1.00 0.00 N ATOM 951 CA LYS A 63 5.465 25.147 7.902 1.00 0.00 C ATOM 952 C LYS A 63 6.152 24.393 6.767 1.00 0.00 C ATOM 953 O LYS A 63 5.973 24.717 5.591 1.00 0.00 O ATOM 954 CB LYS A 63 3.966 25.256 7.620 1.00 0.00 C ATOM 955 CG LYS A 63 3.246 23.917 7.629 1.00 0.00 C ATOM 956 CD LYS A 63 1.800 24.064 8.073 1.00 0.00 C ATOM 957 CE LYS A 63 0.906 23.029 7.410 1.00 0.00 C ATOM 958 NZ LYS A 63 -0.432 23.586 7.072 1.00 0.00 N ATOM 0 H LYS A 63 5.504 27.231 7.658 1.00 0.00 H new ATOM 0 HA LYS A 63 5.618 24.589 8.826 1.00 0.00 H new ATOM 0 HB2 LYS A 63 3.511 25.909 8.365 1.00 0.00 H new ATOM 0 HB3 LYS A 63 3.821 25.731 6.650 1.00 0.00 H new ATOM 0 HG2 LYS A 63 3.278 23.479 6.631 1.00 0.00 H new ATOM 0 HG3 LYS A 63 3.764 23.229 8.297 1.00 0.00 H new ATOM 0 HD2 LYS A 63 1.738 23.959 9.156 1.00 0.00 H new ATOM 0 HD3 LYS A 63 1.443 25.065 7.829 1.00 0.00 H new ATOM 0 HE2 LYS A 63 1.386 22.662 6.503 1.00 0.00 H new ATOM 0 HE3 LYS A 63 0.786 22.174 8.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -0.987 22.870 6.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -0.929 23.851 7.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -0.316 24.427 6.472 1.00 0.00 H new ATOM 972 N TYR A 64 6.940 23.383 7.127 1.00 0.00 N ATOM 973 CA TYR A 64 7.653 22.583 6.140 1.00 0.00 C ATOM 974 C TYR A 64 7.206 21.124 6.183 1.00 0.00 C ATOM 975 O TYR A 64 7.155 20.511 7.250 1.00 0.00 O ATOM 976 CB TYR A 64 9.162 22.675 6.384 1.00 0.00 C ATOM 977 CG TYR A 64 9.863 23.677 5.496 1.00 0.00 C ATOM 978 CD1 TYR A 64 9.845 23.538 4.114 1.00 0.00 C ATOM 979 CD2 TYR A 64 10.545 24.758 6.038 1.00 0.00 C ATOM 980 CE1 TYR A 64 10.487 24.449 3.298 1.00 0.00 C ATOM 981 CE2 TYR A 64 11.189 25.674 5.229 1.00 0.00 C ATOM 982 CZ TYR A 64 11.157 25.515 3.859 1.00 0.00 C ATOM 983 OH TYR A 64 11.798 26.424 3.049 1.00 0.00 O ATOM 0 H TYR A 64 7.100 23.101 8.094 1.00 0.00 H new ATOM 0 HA TYR A 64 7.421 22.979 5.151 1.00 0.00 H new ATOM 0 HB2 TYR A 64 9.337 22.942 7.426 1.00 0.00 H new ATOM 0 HB3 TYR A 64 9.606 21.692 6.228 1.00 0.00 H new ATOM 0 HD1 TYR A 64 9.321 22.704 3.670 1.00 0.00 H new ATOM 0 HD2 TYR A 64 10.573 24.885 7.110 1.00 0.00 H new ATOM 0 HE1 TYR A 64 10.464 24.327 2.225 1.00 0.00 H new ATOM 0 HE2 TYR A 64 11.715 26.510 5.667 1.00 0.00 H new ATOM 0 HH TYR A 64 11.927 27.264 3.538 1.00 0.00 H new ATOM 993 N VAL A 65 6.902 20.569 5.014 1.00 0.00 N ATOM 994 CA VAL A 65 6.479 19.177 4.909 1.00 0.00 C ATOM 995 C VAL A 65 7.575 18.362 4.233 1.00 0.00 C ATOM 996 O VAL A 65 8.135 18.790 3.229 1.00 0.00 O ATOM 997 CB VAL A 65 5.121 19.051 4.141 1.00 0.00 C ATOM 998 CG1 VAL A 65 5.166 18.120 2.923 1.00 0.00 C ATOM 999 CG2 VAL A 65 4.036 18.573 5.060 1.00 0.00 C ATOM 0 H VAL A 65 6.941 21.064 4.123 1.00 0.00 H new ATOM 0 HA VAL A 65 6.314 18.783 5.912 1.00 0.00 H new ATOM 0 HB VAL A 65 4.914 20.056 3.773 1.00 0.00 H new ATOM 0 HG11 VAL A 65 4.184 18.091 2.451 1.00 0.00 H new ATOM 0 HG12 VAL A 65 5.902 18.490 2.209 1.00 0.00 H new ATOM 0 HG13 VAL A 65 5.444 17.116 3.243 1.00 0.00 H new ATOM 0 HG21 VAL A 65 3.100 18.492 4.507 1.00 0.00 H new ATOM 0 HG22 VAL A 65 4.305 17.597 5.463 1.00 0.00 H new ATOM 0 HG23 VAL A 65 3.914 19.282 5.878 1.00 0.00 H new ATOM 1009 N VAL A 66 7.868 17.193 4.775 1.00 0.00 N ATOM 1010 CA VAL A 66 8.889 16.335 4.193 1.00 0.00 C ATOM 1011 C VAL A 66 8.414 14.894 4.084 1.00 0.00 C ATOM 1012 O VAL A 66 8.212 14.226 5.094 1.00 0.00 O ATOM 1013 CB VAL A 66 10.206 16.363 4.993 1.00 0.00 C ATOM 1014 CG1 VAL A 66 11.347 15.904 4.106 1.00 0.00 C ATOM 1015 CG2 VAL A 66 10.488 17.750 5.558 1.00 0.00 C ATOM 0 H VAL A 66 7.419 16.817 5.610 1.00 0.00 H new ATOM 0 HA VAL A 66 9.076 16.734 3.196 1.00 0.00 H new ATOM 0 HB VAL A 66 10.110 15.683 5.839 1.00 0.00 H new ATOM 0 HG11 VAL A 66 12.278 15.924 4.672 1.00 0.00 H new ATOM 0 HG12 VAL A 66 11.154 14.888 3.761 1.00 0.00 H new ATOM 0 HG13 VAL A 66 11.430 16.569 3.247 1.00 0.00 H new ATOM 0 HG21 VAL A 66 11.424 17.732 6.116 1.00 0.00 H new ATOM 0 HG22 VAL A 66 10.566 18.467 4.741 1.00 0.00 H new ATOM 0 HG23 VAL A 66 9.675 18.044 6.222 1.00 0.00 H new ATOM 1025 N THR A 67 8.253 14.406 2.860 1.00 0.00 N ATOM 1026 CA THR A 67 7.826 13.024 2.650 1.00 0.00 C ATOM 1027 C THR A 67 8.648 12.355 1.560 1.00 0.00 C ATOM 1028 O THR A 67 9.036 12.984 0.576 1.00 0.00 O ATOM 1029 CB THR A 67 6.337 12.941 2.319 1.00 0.00 C ATOM 1030 OG1 THR A 67 5.989 11.634 1.895 1.00 0.00 O ATOM 1031 CG2 THR A 67 5.910 13.901 1.239 1.00 0.00 C ATOM 0 H THR A 67 8.409 14.939 2.004 1.00 0.00 H new ATOM 0 HA THR A 67 7.994 12.490 3.585 1.00 0.00 H new ATOM 0 HB THR A 67 5.822 13.207 3.242 1.00 0.00 H new ATOM 0 HG1 THR A 67 6.357 10.978 2.523 1.00 0.00 H new ATOM 0 HG21 THR A 67 4.842 13.789 1.054 1.00 0.00 H new ATOM 0 HG22 THR A 67 6.118 14.923 1.557 1.00 0.00 H new ATOM 0 HG23 THR A 67 6.461 13.687 0.323 1.00 0.00 H new ATOM 1039 N CYS A 68 8.920 11.072 1.761 1.00 0.00 N ATOM 1040 CA CYS A 68 9.710 10.296 0.820 1.00 0.00 C ATOM 1041 C CYS A 68 8.995 9.012 0.422 1.00 0.00 C ATOM 1042 O CYS A 68 8.176 8.485 1.171 1.00 0.00 O ATOM 1043 CB CYS A 68 11.061 9.952 1.442 1.00 0.00 C ATOM 1044 SG CYS A 68 12.256 11.304 1.420 1.00 0.00 S ATOM 0 H CYS A 68 8.601 10.546 2.574 1.00 0.00 H new ATOM 0 HA CYS A 68 9.855 10.900 -0.076 1.00 0.00 H new ATOM 0 HB2 CYS A 68 10.903 9.639 2.474 1.00 0.00 H new ATOM 0 HB3 CYS A 68 11.485 9.099 0.912 1.00 0.00 H new ATOM 0 HG CYS A 68 13.461 10.818 1.386 1.00 0.00 H new ATOM 1050 N ILE A 69 9.324 8.508 -0.758 1.00 0.00 N ATOM 1051 CA ILE A 69 8.737 7.276 -1.264 1.00 0.00 C ATOM 1052 C ILE A 69 9.820 6.449 -1.963 1.00 0.00 C ATOM 1053 O ILE A 69 10.451 6.915 -2.912 1.00 0.00 O ATOM 1054 CB ILE A 69 7.559 7.576 -2.231 1.00 0.00 C ATOM 1055 CG1 ILE A 69 6.385 8.188 -1.465 1.00 0.00 C ATOM 1056 CG2 ILE A 69 7.100 6.327 -2.976 1.00 0.00 C ATOM 1057 CD1 ILE A 69 5.591 9.187 -2.280 1.00 0.00 C ATOM 0 H ILE A 69 10.001 8.938 -1.388 1.00 0.00 H new ATOM 0 HA ILE A 69 8.334 6.705 -0.428 1.00 0.00 H new ATOM 0 HB ILE A 69 7.921 8.290 -2.971 1.00 0.00 H new ATOM 0 HG12 ILE A 69 5.720 7.390 -1.135 1.00 0.00 H new ATOM 0 HG13 ILE A 69 6.762 8.680 -0.568 1.00 0.00 H new ATOM 0 HG21 ILE A 69 6.275 6.583 -3.641 1.00 0.00 H new ATOM 0 HG22 ILE A 69 7.928 5.928 -3.562 1.00 0.00 H new ATOM 0 HG23 ILE A 69 6.768 5.577 -2.258 1.00 0.00 H new ATOM 0 HD11 ILE A 69 4.774 9.582 -1.676 1.00 0.00 H new ATOM 0 HD12 ILE A 69 6.242 10.005 -2.588 1.00 0.00 H new ATOM 0 HD13 ILE A 69 5.184 8.695 -3.163 1.00 0.00 H new ATOM 1069 N ILE A 70 10.042 5.233 -1.474 1.00 0.00 N ATOM 1070 CA ILE A 70 11.062 4.360 -2.043 1.00 0.00 C ATOM 1071 C ILE A 70 10.468 3.333 -3.002 1.00 0.00 C ATOM 1072 O ILE A 70 9.401 2.772 -2.750 1.00 0.00 O ATOM 1073 CB ILE A 70 11.851 3.623 -0.940 1.00 0.00 C ATOM 1074 CG1 ILE A 70 10.921 2.721 -0.119 1.00 0.00 C ATOM 1075 CG2 ILE A 70 12.560 4.626 -0.041 1.00 0.00 C ATOM 1076 CD1 ILE A 70 11.055 1.252 -0.457 1.00 0.00 C ATOM 0 H ILE A 70 9.531 4.831 -0.688 1.00 0.00 H new ATOM 0 HA ILE A 70 11.739 5.007 -2.601 1.00 0.00 H new ATOM 0 HB ILE A 70 12.602 2.991 -1.414 1.00 0.00 H new ATOM 0 HG12 ILE A 70 11.132 2.863 0.941 1.00 0.00 H new ATOM 0 HG13 ILE A 70 9.889 3.031 -0.283 1.00 0.00 H new ATOM 0 HG21 ILE A 70 13.113 4.094 0.733 1.00 0.00 H new ATOM 0 HG22 ILE A 70 13.252 5.222 -0.636 1.00 0.00 H new ATOM 0 HG23 ILE A 70 11.824 5.281 0.425 1.00 0.00 H new ATOM 0 HD11 ILE A 70 10.369 0.672 0.161 1.00 0.00 H new ATOM 0 HD12 ILE A 70 10.815 1.097 -1.509 1.00 0.00 H new ATOM 0 HD13 ILE A 70 12.078 0.927 -0.266 1.00 0.00 H new ATOM 1088 N MET A 71 11.177 3.090 -4.099 1.00 0.00 N ATOM 1089 CA MET A 71 10.744 2.129 -5.104 1.00 0.00 C ATOM 1090 C MET A 71 11.820 1.071 -5.329 1.00 0.00 C ATOM 1091 O MET A 71 12.929 1.382 -5.767 1.00 0.00 O ATOM 1092 CB MET A 71 10.427 2.841 -6.420 1.00 0.00 C ATOM 1093 CG MET A 71 9.226 3.769 -6.336 1.00 0.00 C ATOM 1094 SD MET A 71 9.689 5.477 -5.993 1.00 0.00 S ATOM 1095 CE MET A 71 9.914 6.107 -7.654 1.00 0.00 C ATOM 0 H MET A 71 12.061 3.550 -4.315 1.00 0.00 H new ATOM 0 HA MET A 71 9.840 1.638 -4.743 1.00 0.00 H new ATOM 0 HB2 MET A 71 11.299 3.416 -6.731 1.00 0.00 H new ATOM 0 HB3 MET A 71 10.245 2.094 -7.193 1.00 0.00 H new ATOM 0 HG2 MET A 71 8.674 3.728 -7.275 1.00 0.00 H new ATOM 0 HG3 MET A 71 8.553 3.416 -5.555 1.00 0.00 H new ATOM 0 HE1 MET A 71 10.204 7.157 -7.609 1.00 0.00 H new ATOM 0 HE2 MET A 71 10.695 5.536 -8.157 1.00 0.00 H new ATOM 0 HE3 MET A 71 8.981 6.012 -8.209 1.00 0.00 H new ATOM 1105 N GLN A 72 11.484 -0.179 -5.023 1.00 0.00 N ATOM 1106 CA GLN A 72 12.419 -1.290 -5.187 1.00 0.00 C ATOM 1107 C GLN A 72 12.905 -1.391 -6.629 1.00 0.00 C ATOM 1108 O GLN A 72 12.206 -0.988 -7.559 1.00 0.00 O ATOM 1109 CB GLN A 72 11.759 -2.605 -4.767 1.00 0.00 C ATOM 1110 CG GLN A 72 12.728 -3.603 -4.155 1.00 0.00 C ATOM 1111 CD GLN A 72 12.022 -4.780 -3.511 1.00 0.00 C ATOM 1112 OE1 GLN A 72 10.804 -4.768 -3.335 1.00 0.00 O ATOM 1113 NE2 GLN A 72 12.787 -5.805 -3.153 1.00 0.00 N ATOM 0 H GLN A 72 10.570 -0.449 -4.660 1.00 0.00 H new ATOM 0 HA GLN A 72 13.281 -1.101 -4.547 1.00 0.00 H new ATOM 0 HB2 GLN A 72 10.968 -2.392 -4.048 1.00 0.00 H new ATOM 0 HB3 GLN A 72 11.285 -3.058 -5.638 1.00 0.00 H new ATOM 0 HG2 GLN A 72 13.404 -3.968 -4.928 1.00 0.00 H new ATOM 0 HG3 GLN A 72 13.340 -3.098 -3.408 1.00 0.00 H new ATOM 0 HE21 GLN A 72 13.793 -5.773 -3.318 1.00 0.00 H new ATOM 0 HE22 GLN A 72 12.368 -6.625 -2.713 1.00 0.00 H new ATOM 1122 N LYS A 73 14.110 -1.930 -6.808 1.00 0.00 N ATOM 1123 CA LYS A 73 14.693 -2.083 -8.138 1.00 0.00 C ATOM 1124 C LYS A 73 13.784 -2.903 -9.048 1.00 0.00 C ATOM 1125 O LYS A 73 13.906 -4.126 -9.124 1.00 0.00 O ATOM 1126 CB LYS A 73 16.066 -2.750 -8.042 1.00 0.00 C ATOM 1127 CG LYS A 73 17.025 -2.325 -9.142 1.00 0.00 C ATOM 1128 CD LYS A 73 16.793 -3.116 -10.419 1.00 0.00 C ATOM 1129 CE LYS A 73 16.957 -2.242 -11.652 1.00 0.00 C ATOM 1130 NZ LYS A 73 17.603 -2.980 -12.773 1.00 0.00 N ATOM 0 H LYS A 73 14.701 -2.268 -6.048 1.00 0.00 H new ATOM 0 HA LYS A 73 14.805 -1.088 -8.570 1.00 0.00 H new ATOM 0 HB2 LYS A 73 16.509 -2.515 -7.074 1.00 0.00 H new ATOM 0 HB3 LYS A 73 15.939 -3.832 -8.080 1.00 0.00 H new ATOM 0 HG2 LYS A 73 16.900 -1.261 -9.344 1.00 0.00 H new ATOM 0 HG3 LYS A 73 18.052 -2.467 -8.806 1.00 0.00 H new ATOM 0 HD2 LYS A 73 17.495 -3.948 -10.466 1.00 0.00 H new ATOM 0 HD3 LYS A 73 15.791 -3.545 -10.406 1.00 0.00 H new ATOM 0 HE2 LYS A 73 15.981 -1.878 -11.972 1.00 0.00 H new ATOM 0 HE3 LYS A 73 17.556 -1.367 -11.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 17.697 -2.350 -13.595 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 18.545 -3.306 -12.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 17.018 -3.801 -13.031 1.00 0.00 H new ATOM 1144 N ASN A 74 12.875 -2.222 -9.737 1.00 0.00 N ATOM 1145 CA ASN A 74 11.947 -2.886 -10.644 1.00 0.00 C ATOM 1146 C ASN A 74 11.141 -1.864 -11.437 1.00 0.00 C ATOM 1147 O ASN A 74 10.331 -1.125 -10.877 1.00 0.00 O ATOM 1148 CB ASN A 74 11.005 -3.807 -9.864 1.00 0.00 C ATOM 1149 CG ASN A 74 10.141 -3.051 -8.874 1.00 0.00 C ATOM 1150 OD1 ASN A 74 10.538 -2.825 -7.731 1.00 0.00 O ATOM 1151 ND2 ASN A 74 8.948 -2.659 -9.308 1.00 0.00 N ATOM 0 H ASN A 74 12.761 -1.210 -9.684 1.00 0.00 H new ATOM 0 HA ASN A 74 12.528 -3.486 -11.344 1.00 0.00 H new ATOM 0 HB2 ASN A 74 10.365 -4.344 -10.564 1.00 0.00 H new ATOM 0 HB3 ASN A 74 11.592 -4.555 -9.331 1.00 0.00 H new ATOM 0 HD21 ASN A 74 8.321 -2.149 -8.685 1.00 0.00 H new ATOM 0 HD22 ASN A 74 8.659 -2.868 -10.264 1.00 0.00 H new ATOM 1158 N GLY A 75 11.371 -1.826 -12.745 1.00 0.00 N ATOM 1159 CA GLY A 75 10.661 -0.888 -13.596 1.00 0.00 C ATOM 1160 C GLY A 75 9.171 -1.164 -13.643 1.00 0.00 C ATOM 1161 O GLY A 75 8.689 -1.859 -14.538 1.00 0.00 O ATOM 0 H GLY A 75 12.036 -2.427 -13.231 1.00 0.00 H new ATOM 0 HA2 GLY A 75 10.829 0.126 -13.233 1.00 0.00 H new ATOM 0 HA3 GLY A 75 11.069 -0.937 -14.606 1.00 0.00 H new ATOM 1165 N ALA A 76 8.439 -0.617 -12.678 1.00 0.00 N ATOM 1166 CA ALA A 76 6.995 -0.805 -12.609 1.00 0.00 C ATOM 1167 C ALA A 76 6.261 0.517 -12.811 1.00 0.00 C ATOM 1168 O ALA A 76 6.685 1.557 -12.310 1.00 0.00 O ATOM 1169 CB ALA A 76 6.606 -1.428 -11.278 1.00 0.00 C ATOM 0 H ALA A 76 8.824 -0.038 -11.931 1.00 0.00 H new ATOM 0 HA ALA A 76 6.702 -1.481 -13.412 1.00 0.00 H new ATOM 0 HB1 ALA A 76 5.525 -1.562 -11.241 1.00 0.00 H new ATOM 0 HB2 ALA A 76 7.096 -2.396 -11.172 1.00 0.00 H new ATOM 0 HB3 ALA A 76 6.918 -0.773 -10.465 1.00 0.00 H new ATOM 1175 N GLY A 77 5.157 0.469 -13.550 1.00 0.00 N ATOM 1176 CA GLY A 77 4.383 1.669 -13.806 1.00 0.00 C ATOM 1177 C GLY A 77 3.761 2.238 -12.546 1.00 0.00 C ATOM 1178 O GLY A 77 2.819 1.665 -11.997 1.00 0.00 O ATOM 0 H GLY A 77 4.785 -0.380 -13.976 1.00 0.00 H new ATOM 0 HA2 GLY A 77 5.026 2.422 -14.262 1.00 0.00 H new ATOM 0 HA3 GLY A 77 3.596 1.443 -14.526 1.00 0.00 H new ATOM 1182 N LEU A 78 4.287 3.370 -12.088 1.00 0.00 N ATOM 1183 CA LEU A 78 3.779 4.021 -10.886 1.00 0.00 C ATOM 1184 C LEU A 78 3.343 5.451 -11.185 1.00 0.00 C ATOM 1185 O LEU A 78 4.167 6.308 -11.504 1.00 0.00 O ATOM 1186 CB LEU A 78 4.847 4.020 -9.790 1.00 0.00 C ATOM 1187 CG LEU A 78 4.320 4.245 -8.372 1.00 0.00 C ATOM 1188 CD1 LEU A 78 3.777 2.947 -7.794 1.00 0.00 C ATOM 1189 CD2 LEU A 78 5.415 4.812 -7.481 1.00 0.00 C ATOM 0 H LEU A 78 5.066 3.856 -12.532 1.00 0.00 H new ATOM 0 HA LEU A 78 2.911 3.461 -10.539 1.00 0.00 H new ATOM 0 HB2 LEU A 78 5.374 3.066 -9.818 1.00 0.00 H new ATOM 0 HB3 LEU A 78 5.579 4.795 -10.016 1.00 0.00 H new ATOM 0 HG LEU A 78 3.505 4.968 -8.416 1.00 0.00 H new ATOM 0 HD11 LEU A 78 3.406 3.125 -6.785 1.00 0.00 H new ATOM 0 HD12 LEU A 78 2.963 2.582 -8.420 1.00 0.00 H new ATOM 0 HD13 LEU A 78 4.572 2.202 -7.762 1.00 0.00 H new ATOM 0 HD21 LEU A 78 5.023 4.966 -6.476 1.00 0.00 H new ATOM 0 HD22 LEU A 78 6.250 4.113 -7.441 1.00 0.00 H new ATOM 0 HD23 LEU A 78 5.758 5.764 -7.887 1.00 0.00 H new ATOM 1201 N HIS A 79 2.041 5.702 -11.082 1.00 0.00 N ATOM 1202 CA HIS A 79 1.495 7.029 -11.343 1.00 0.00 C ATOM 1203 C HIS A 79 0.880 7.622 -10.080 1.00 0.00 C ATOM 1204 O HIS A 79 0.333 6.902 -9.244 1.00 0.00 O ATOM 1205 CB HIS A 79 0.443 6.961 -12.452 1.00 0.00 C ATOM 1206 CG HIS A 79 1.004 7.193 -13.821 1.00 0.00 C ATOM 1207 ND1 HIS A 79 0.784 6.337 -14.880 1.00 0.00 N ATOM 1208 CD2 HIS A 79 1.779 8.194 -14.303 1.00 0.00 C ATOM 1209 CE1 HIS A 79 1.401 6.800 -15.952 1.00 0.00 C ATOM 1210 NE2 HIS A 79 2.011 7.926 -15.629 1.00 0.00 N ATOM 0 H HIS A 79 1.345 5.004 -10.820 1.00 0.00 H new ATOM 0 HA HIS A 79 2.312 7.674 -11.665 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -0.039 5.983 -12.426 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -0.331 7.703 -12.254 1.00 0.00 H new ATOM 0 HD2 HIS A 79 2.146 9.044 -13.747 1.00 0.00 H new ATOM 0 HE1 HIS A 79 1.406 6.336 -16.927 1.00 0.00 H new ATOM 0 HE2 HIS A 79 2.565 8.503 -16.262 1.00 0.00 H new ATOM 1219 N THR A 80 0.976 8.941 -9.946 1.00 0.00 N ATOM 1220 CA THR A 80 0.431 9.637 -8.785 1.00 0.00 C ATOM 1221 C THR A 80 -0.533 10.739 -9.213 1.00 0.00 C ATOM 1222 O THR A 80 -0.420 11.284 -10.311 1.00 0.00 O ATOM 1223 CB THR A 80 1.562 10.231 -7.945 1.00 0.00 C ATOM 1224 OG1 THR A 80 2.581 9.272 -7.725 1.00 0.00 O ATOM 1225 CG2 THR A 80 1.103 10.732 -6.592 1.00 0.00 C ATOM 0 H THR A 80 1.427 9.551 -10.628 1.00 0.00 H new ATOM 0 HA THR A 80 -0.119 8.913 -8.183 1.00 0.00 H new ATOM 0 HB THR A 80 1.935 11.078 -8.521 1.00 0.00 H new ATOM 0 HG1 THR A 80 3.296 9.672 -7.187 1.00 0.00 H new ATOM 0 HG21 THR A 80 1.954 11.141 -6.047 1.00 0.00 H new ATOM 0 HG22 THR A 80 0.352 11.510 -6.728 1.00 0.00 H new ATOM 0 HG23 THR A 80 0.672 9.907 -6.025 1.00 0.00 H new ATOM 1233 N ALA A 81 -1.475 11.067 -8.336 1.00 0.00 N ATOM 1234 CA ALA A 81 -2.455 12.108 -8.616 1.00 0.00 C ATOM 1235 C ALA A 81 -2.680 12.959 -7.379 1.00 0.00 C ATOM 1236 O ALA A 81 -2.595 12.462 -6.256 1.00 0.00 O ATOM 1237 CB ALA A 81 -3.768 11.498 -9.085 1.00 0.00 C ATOM 0 H ALA A 81 -1.580 10.625 -7.423 1.00 0.00 H new ATOM 0 HA ALA A 81 -2.069 12.742 -9.414 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -4.486 12.292 -9.289 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -3.597 10.921 -9.994 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.163 10.843 -8.309 1.00 0.00 H new ATOM 1243 N ALA A 82 -2.956 14.242 -7.575 1.00 0.00 N ATOM 1244 CA ALA A 82 -3.174 15.130 -6.446 1.00 0.00 C ATOM 1245 C ALA A 82 -3.955 16.378 -6.825 1.00 0.00 C ATOM 1246 O ALA A 82 -3.757 16.963 -7.889 1.00 0.00 O ATOM 1247 CB ALA A 82 -1.851 15.502 -5.814 1.00 0.00 C ATOM 0 H ALA A 82 -3.033 14.684 -8.491 1.00 0.00 H new ATOM 0 HA ALA A 82 -3.782 14.588 -5.722 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -2.026 16.168 -4.969 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -1.347 14.600 -5.467 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -1.225 16.007 -6.550 1.00 0.00 H new ATOM 1253 N SER A 83 -4.840 16.777 -5.922 1.00 0.00 N ATOM 1254 CA SER A 83 -5.667 17.954 -6.105 1.00 0.00 C ATOM 1255 C SER A 83 -5.858 18.658 -4.770 1.00 0.00 C ATOM 1256 O SER A 83 -6.426 18.091 -3.836 1.00 0.00 O ATOM 1257 CB SER A 83 -7.020 17.555 -6.690 1.00 0.00 C ATOM 1258 OG SER A 83 -7.694 18.677 -7.235 1.00 0.00 O ATOM 0 H SER A 83 -5.002 16.290 -5.041 1.00 0.00 H new ATOM 0 HA SER A 83 -5.174 18.636 -6.798 1.00 0.00 H new ATOM 0 HB2 SER A 83 -6.876 16.802 -7.465 1.00 0.00 H new ATOM 0 HB3 SER A 83 -7.635 17.100 -5.914 1.00 0.00 H new ATOM 0 HG SER A 83 -8.556 18.393 -7.604 1.00 0.00 H new ATOM 1264 N CYS A 84 -5.375 19.890 -4.677 1.00 0.00 N ATOM 1265 CA CYS A 84 -5.487 20.657 -3.445 1.00 0.00 C ATOM 1266 C CYS A 84 -6.421 21.844 -3.621 1.00 0.00 C ATOM 1267 O CYS A 84 -6.671 22.293 -4.740 1.00 0.00 O ATOM 1268 CB CYS A 84 -4.114 21.142 -2.992 1.00 0.00 C ATOM 1269 SG CYS A 84 -2.817 19.884 -3.068 1.00 0.00 S ATOM 0 H CYS A 84 -4.903 20.378 -5.438 1.00 0.00 H new ATOM 0 HA CYS A 84 -5.904 20.001 -2.681 1.00 0.00 H new ATOM 0 HB2 CYS A 84 -3.819 21.989 -3.611 1.00 0.00 H new ATOM 0 HB3 CYS A 84 -4.190 21.507 -1.968 1.00 0.00 H new ATOM 0 HG CYS A 84 -1.692 20.396 -2.666 1.00 0.00 H new ATOM 1275 N TRP A 85 -6.933 22.349 -2.507 1.00 0.00 N ATOM 1276 CA TRP A 85 -7.840 23.486 -2.534 1.00 0.00 C ATOM 1277 C TRP A 85 -7.048 24.774 -2.775 1.00 0.00 C ATOM 1278 O TRP A 85 -5.949 24.729 -3.329 1.00 0.00 O ATOM 1279 CB TRP A 85 -8.616 23.558 -1.216 1.00 0.00 C ATOM 1280 CG TRP A 85 -10.063 23.884 -1.407 1.00 0.00 C ATOM 1281 CD1 TRP A 85 -10.998 23.101 -2.019 1.00 0.00 C ATOM 1282 CD2 TRP A 85 -10.743 25.073 -0.991 1.00 0.00 C ATOM 1283 NE1 TRP A 85 -12.217 23.727 -2.009 1.00 0.00 N ATOM 1284 CE2 TRP A 85 -12.089 24.940 -1.383 1.00 0.00 C ATOM 1285 CE3 TRP A 85 -10.348 26.236 -0.323 1.00 0.00 C ATOM 1286 CZ2 TRP A 85 -13.039 25.925 -1.130 1.00 0.00 C ATOM 1287 CZ3 TRP A 85 -11.292 27.214 -0.073 1.00 0.00 C ATOM 1288 CH2 TRP A 85 -12.625 27.053 -0.476 1.00 0.00 C ATOM 0 H TRP A 85 -6.735 21.989 -1.574 1.00 0.00 H new ATOM 0 HA TRP A 85 -8.555 23.366 -3.348 1.00 0.00 H new ATOM 0 HB2 TRP A 85 -8.530 22.603 -0.697 1.00 0.00 H new ATOM 0 HB3 TRP A 85 -8.161 24.312 -0.574 1.00 0.00 H new ATOM 0 HD1 TRP A 85 -10.805 22.129 -2.449 1.00 0.00 H new ATOM 0 HE1 TRP A 85 -13.080 23.351 -2.403 1.00 0.00 H new ATOM 0 HE3 TRP A 85 -9.323 26.368 -0.008 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 -14.067 25.803 -1.439 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 -10.998 28.117 0.441 1.00 0.00 H new ATOM 0 HH2 TRP A 85 -13.339 27.835 -0.266 1.00 0.00 H new ATOM 1299 N TRP A 86 -7.593 25.919 -2.370 1.00 0.00 N ATOM 1300 CA TRP A 86 -6.906 27.188 -2.569 1.00 0.00 C ATOM 1301 C TRP A 86 -5.948 27.477 -1.418 1.00 0.00 C ATOM 1302 O TRP A 86 -6.283 27.277 -0.250 1.00 0.00 O ATOM 1303 CB TRP A 86 -7.921 28.325 -2.702 1.00 0.00 C ATOM 1304 CG TRP A 86 -8.404 28.531 -4.105 1.00 0.00 C ATOM 1305 CD1 TRP A 86 -8.450 27.600 -5.103 1.00 0.00 C ATOM 1306 CD2 TRP A 86 -8.908 29.746 -4.668 1.00 0.00 C ATOM 1307 NE1 TRP A 86 -8.953 28.162 -6.251 1.00 0.00 N ATOM 1308 CE2 TRP A 86 -9.243 29.479 -6.008 1.00 0.00 C ATOM 1309 CE3 TRP A 86 -9.112 31.034 -4.166 1.00 0.00 C ATOM 1310 CZ2 TRP A 86 -9.767 30.455 -6.854 1.00 0.00 C ATOM 1311 CZ3 TRP A 86 -9.633 32.002 -5.004 1.00 0.00 C ATOM 1312 CH2 TRP A 86 -9.955 31.707 -6.336 1.00 0.00 C ATOM 0 H TRP A 86 -8.499 25.992 -1.907 1.00 0.00 H new ATOM 0 HA TRP A 86 -6.326 27.118 -3.489 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -8.776 28.116 -2.059 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -7.469 29.249 -2.342 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -8.136 26.571 -5.004 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -9.088 27.678 -7.139 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -8.867 31.269 -3.141 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -10.015 30.231 -7.881 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -9.794 33.001 -4.627 1.00 0.00 H new ATOM 0 HH2 TRP A 86 -10.360 32.485 -6.967 1.00 0.00 H new ATOM 1323 N ASP A 87 -4.751 27.950 -1.762 1.00 0.00 N ATOM 1324 CA ASP A 87 -3.726 28.273 -0.771 1.00 0.00 C ATOM 1325 C ASP A 87 -2.443 28.729 -1.461 1.00 0.00 C ATOM 1326 O ASP A 87 -1.531 27.933 -1.687 1.00 0.00 O ATOM 1327 CB ASP A 87 -3.434 27.062 0.124 1.00 0.00 C ATOM 1328 CG ASP A 87 -3.231 27.452 1.574 1.00 0.00 C ATOM 1329 OD1 ASP A 87 -2.900 28.629 1.832 1.00 0.00 O ATOM 1330 OD2 ASP A 87 -3.404 26.582 2.453 1.00 0.00 O ATOM 0 H ASP A 87 -4.466 28.119 -2.727 1.00 0.00 H new ATOM 0 HA ASP A 87 -4.102 29.085 -0.148 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -4.259 26.354 0.053 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -2.543 26.551 -0.240 1.00 0.00 H new ATOM 1335 N SER A 88 -2.381 30.010 -1.800 1.00 0.00 N ATOM 1336 CA SER A 88 -1.213 30.570 -2.473 1.00 0.00 C ATOM 1337 C SER A 88 -0.087 30.910 -1.490 1.00 0.00 C ATOM 1338 O SER A 88 0.942 31.455 -1.890 1.00 0.00 O ATOM 1339 CB SER A 88 -1.608 31.824 -3.255 1.00 0.00 C ATOM 1340 OG SER A 88 -0.742 32.031 -4.358 1.00 0.00 O ATOM 0 H SER A 88 -3.126 30.683 -1.620 1.00 0.00 H new ATOM 0 HA SER A 88 -0.838 29.809 -3.157 1.00 0.00 H new ATOM 0 HB2 SER A 88 -2.635 31.728 -3.608 1.00 0.00 H new ATOM 0 HB3 SER A 88 -1.577 32.692 -2.596 1.00 0.00 H new ATOM 0 HG SER A 88 0.189 31.941 -4.065 1.00 0.00 H new ATOM 1346 N THR A 89 -0.276 30.600 -0.206 1.00 0.00 N ATOM 1347 CA THR A 89 0.739 30.895 0.803 1.00 0.00 C ATOM 1348 C THR A 89 1.454 29.625 1.265 1.00 0.00 C ATOM 1349 O THR A 89 2.685 29.564 1.279 1.00 0.00 O ATOM 1350 CB THR A 89 0.109 31.627 2.000 1.00 0.00 C ATOM 1351 OG1 THR A 89 0.953 31.561 3.133 1.00 0.00 O ATOM 1352 CG2 THR A 89 -1.245 31.086 2.413 1.00 0.00 C ATOM 0 H THR A 89 -1.116 30.148 0.156 1.00 0.00 H new ATOM 0 HA THR A 89 1.484 31.547 0.347 1.00 0.00 H new ATOM 0 HB THR A 89 -0.023 32.653 1.656 1.00 0.00 H new ATOM 0 HG1 THR A 89 0.533 32.034 3.882 1.00 0.00 H new ATOM 0 HG21 THR A 89 -1.621 31.656 3.263 1.00 0.00 H new ATOM 0 HG22 THR A 89 -1.942 31.175 1.580 1.00 0.00 H new ATOM 0 HG23 THR A 89 -1.148 30.037 2.694 1.00 0.00 H new ATOM 1360 N THR A 90 0.688 28.608 1.640 1.00 0.00 N ATOM 1361 CA THR A 90 1.254 27.362 2.096 1.00 0.00 C ATOM 1362 C THR A 90 1.563 26.457 0.915 1.00 0.00 C ATOM 1363 O THR A 90 2.581 25.780 0.883 1.00 0.00 O ATOM 1364 CB THR A 90 0.275 26.666 3.051 1.00 0.00 C ATOM 1365 OG1 THR A 90 -0.764 26.032 2.329 1.00 0.00 O ATOM 1366 CG2 THR A 90 -0.370 27.606 4.051 1.00 0.00 C ATOM 0 H THR A 90 -0.332 28.631 1.634 1.00 0.00 H new ATOM 0 HA THR A 90 2.184 27.570 2.625 1.00 0.00 H new ATOM 0 HB THR A 90 0.879 25.942 3.599 1.00 0.00 H new ATOM 0 HG1 THR A 90 -1.621 26.203 2.772 1.00 0.00 H new ATOM 0 HG21 THR A 90 -1.049 27.044 4.693 1.00 0.00 H new ATOM 0 HG22 THR A 90 0.403 28.074 4.661 1.00 0.00 H new ATOM 0 HG23 THR A 90 -0.928 28.377 3.519 1.00 0.00 H new ATOM 1374 N ASP A 91 0.670 26.417 -0.051 1.00 0.00 N ATOM 1375 CA ASP A 91 0.873 25.541 -1.186 1.00 0.00 C ATOM 1376 C ASP A 91 2.106 25.897 -2.013 1.00 0.00 C ATOM 1377 O ASP A 91 2.249 27.012 -2.516 1.00 0.00 O ATOM 1378 CB ASP A 91 -0.371 25.488 -2.071 1.00 0.00 C ATOM 1379 CG ASP A 91 -0.555 24.135 -2.731 1.00 0.00 C ATOM 1380 OD1 ASP A 91 -0.660 23.128 -1.999 1.00 0.00 O ATOM 1381 OD2 ASP A 91 -0.592 24.083 -3.978 1.00 0.00 O ATOM 0 H ASP A 91 -0.188 26.969 -0.075 1.00 0.00 H new ATOM 0 HA ASP A 91 1.054 24.550 -0.770 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -1.251 25.719 -1.470 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -0.299 26.257 -2.840 1.00 0.00 H new ATOM 1386 N GLY A 92 2.976 24.900 -2.157 1.00 0.00 N ATOM 1387 CA GLY A 92 4.194 25.032 -2.931 1.00 0.00 C ATOM 1388 C GLY A 92 4.604 23.684 -3.492 1.00 0.00 C ATOM 1389 O GLY A 92 4.509 23.447 -4.696 1.00 0.00 O ATOM 0 H GLY A 92 2.850 23.979 -1.737 1.00 0.00 H new ATOM 0 HA2 GLY A 92 4.042 25.742 -3.744 1.00 0.00 H new ATOM 0 HA3 GLY A 92 4.991 25.431 -2.304 1.00 0.00 H new ATOM 1393 N SER A 93 5.006 22.787 -2.592 1.00 0.00 N ATOM 1394 CA SER A 93 5.387 21.417 -2.948 1.00 0.00 C ATOM 1395 C SER A 93 6.472 21.330 -4.021 1.00 0.00 C ATOM 1396 O SER A 93 6.345 21.890 -5.109 1.00 0.00 O ATOM 1397 CB SER A 93 4.153 20.640 -3.408 1.00 0.00 C ATOM 1398 OG SER A 93 3.214 20.501 -2.356 1.00 0.00 O ATOM 0 H SER A 93 5.077 22.988 -1.595 1.00 0.00 H new ATOM 0 HA SER A 93 5.811 20.978 -2.045 1.00 0.00 H new ATOM 0 HB2 SER A 93 3.688 21.155 -4.248 1.00 0.00 H new ATOM 0 HB3 SER A 93 4.452 19.654 -3.764 1.00 0.00 H new ATOM 0 HG SER A 93 3.553 19.859 -1.698 1.00 0.00 H new ATOM 1404 N ARG A 94 7.528 20.581 -3.710 1.00 0.00 N ATOM 1405 CA ARG A 94 8.629 20.368 -4.647 1.00 0.00 C ATOM 1406 C ARG A 94 9.249 18.987 -4.421 1.00 0.00 C ATOM 1407 O ARG A 94 9.913 18.754 -3.411 1.00 0.00 O ATOM 1408 CB ARG A 94 9.684 21.472 -4.505 1.00 0.00 C ATOM 1409 CG ARG A 94 9.983 22.188 -5.812 1.00 0.00 C ATOM 1410 CD ARG A 94 9.064 23.381 -6.019 1.00 0.00 C ATOM 1411 NE ARG A 94 8.796 23.627 -7.436 1.00 0.00 N ATOM 1412 CZ ARG A 94 7.867 22.987 -8.146 1.00 0.00 C ATOM 1413 NH1 ARG A 94 7.105 22.056 -7.584 1.00 0.00 N ATOM 1414 NH2 ARG A 94 7.698 23.281 -9.428 1.00 0.00 N ATOM 0 H ARG A 94 7.644 20.110 -2.813 1.00 0.00 H new ATOM 0 HA ARG A 94 8.237 20.410 -5.663 1.00 0.00 H new ATOM 0 HB2 ARG A 94 9.341 22.200 -3.770 1.00 0.00 H new ATOM 0 HB3 ARG A 94 10.605 21.037 -4.118 1.00 0.00 H new ATOM 0 HG2 ARG A 94 11.020 22.522 -5.815 1.00 0.00 H new ATOM 0 HG3 ARG A 94 9.870 21.492 -6.643 1.00 0.00 H new ATOM 0 HD2 ARG A 94 8.123 23.209 -5.497 1.00 0.00 H new ATOM 0 HD3 ARG A 94 9.516 24.268 -5.576 1.00 0.00 H new ATOM 0 HE ARG A 94 9.356 24.334 -7.912 1.00 0.00 H new ATOM 0 HH11 ARG A 94 7.227 21.824 -6.598 1.00 0.00 H new ATOM 0 HH12 ARG A 94 6.397 21.573 -8.138 1.00 0.00 H new ATOM 0 HH21 ARG A 94 8.278 23.995 -9.868 1.00 0.00 H new ATOM 0 HH22 ARG A 94 6.988 22.793 -9.974 1.00 0.00 H new ATOM 1428 N THR A 95 9.012 18.068 -5.359 1.00 0.00 N ATOM 1429 CA THR A 95 9.533 16.705 -5.246 1.00 0.00 C ATOM 1430 C THR A 95 10.897 16.558 -5.919 1.00 0.00 C ATOM 1431 O THR A 95 11.212 17.266 -6.874 1.00 0.00 O ATOM 1432 CB THR A 95 8.540 15.696 -5.826 1.00 0.00 C ATOM 1433 OG1 THR A 95 8.934 14.370 -5.519 1.00 0.00 O ATOM 1434 CG2 THR A 95 8.393 15.790 -7.322 1.00 0.00 C ATOM 0 H THR A 95 8.465 18.242 -6.202 1.00 0.00 H new ATOM 0 HA THR A 95 9.666 16.497 -4.184 1.00 0.00 H new ATOM 0 HB THR A 95 7.583 15.943 -5.367 1.00 0.00 H new ATOM 0 HG1 THR A 95 9.552 14.380 -4.759 1.00 0.00 H new ATOM 0 HG21 THR A 95 7.674 15.046 -7.664 1.00 0.00 H new ATOM 0 HG22 THR A 95 8.041 16.786 -7.591 1.00 0.00 H new ATOM 0 HG23 THR A 95 9.358 15.606 -7.795 1.00 0.00 H new ATOM 1442 N VAL A 96 11.704 15.632 -5.401 1.00 0.00 N ATOM 1443 CA VAL A 96 13.040 15.385 -5.938 1.00 0.00 C ATOM 1444 C VAL A 96 13.311 13.888 -6.069 1.00 0.00 C ATOM 1445 O VAL A 96 13.386 13.178 -5.068 1.00 0.00 O ATOM 1446 CB VAL A 96 14.123 16.008 -5.030 1.00 0.00 C ATOM 1447 CG1 VAL A 96 15.509 15.852 -5.641 1.00 0.00 C ATOM 1448 CG2 VAL A 96 13.816 17.472 -4.754 1.00 0.00 C ATOM 0 H VAL A 96 11.454 15.040 -4.609 1.00 0.00 H new ATOM 0 HA VAL A 96 13.081 15.848 -6.924 1.00 0.00 H new ATOM 0 HB VAL A 96 14.115 15.472 -4.081 1.00 0.00 H new ATOM 0 HG11 VAL A 96 16.251 16.300 -4.980 1.00 0.00 H new ATOM 0 HG12 VAL A 96 15.732 14.793 -5.772 1.00 0.00 H new ATOM 0 HG13 VAL A 96 15.538 16.351 -6.610 1.00 0.00 H new ATOM 0 HG21 VAL A 96 14.591 17.892 -4.113 1.00 0.00 H new ATOM 0 HG22 VAL A 96 13.787 18.021 -5.695 1.00 0.00 H new ATOM 0 HG23 VAL A 96 12.850 17.554 -4.256 1.00 0.00 H new ATOM 1458 N ARG A 97 13.470 13.413 -7.300 1.00 0.00 N ATOM 1459 CA ARG A 97 13.744 11.998 -7.528 1.00 0.00 C ATOM 1460 C ARG A 97 15.227 11.706 -7.318 1.00 0.00 C ATOM 1461 O ARG A 97 16.064 12.094 -8.129 1.00 0.00 O ATOM 1462 CB ARG A 97 13.317 11.596 -8.943 1.00 0.00 C ATOM 1463 CG ARG A 97 12.517 10.304 -8.993 1.00 0.00 C ATOM 1464 CD ARG A 97 11.053 10.544 -8.665 1.00 0.00 C ATOM 1465 NE ARG A 97 10.373 11.299 -9.715 1.00 0.00 N ATOM 1466 CZ ARG A 97 9.929 10.763 -10.853 1.00 0.00 C ATOM 1467 NH1 ARG A 97 10.090 9.468 -11.101 1.00 0.00 N ATOM 1468 NH2 ARG A 97 9.321 11.529 -11.750 1.00 0.00 N ATOM 0 H ARG A 97 13.415 13.979 -8.147 1.00 0.00 H new ATOM 0 HA ARG A 97 13.169 11.411 -6.811 1.00 0.00 H new ATOM 0 HB2 ARG A 97 12.721 12.400 -9.376 1.00 0.00 H new ATOM 0 HB3 ARG A 97 14.206 11.488 -9.565 1.00 0.00 H new ATOM 0 HG2 ARG A 97 12.601 9.861 -9.985 1.00 0.00 H new ATOM 0 HG3 ARG A 97 12.937 9.587 -8.287 1.00 0.00 H new ATOM 0 HD2 ARG A 97 10.551 9.587 -8.524 1.00 0.00 H new ATOM 0 HD3 ARG A 97 10.977 11.085 -7.722 1.00 0.00 H new ATOM 0 HE ARG A 97 10.229 12.298 -9.569 1.00 0.00 H new ATOM 0 HH11 ARG A 97 10.557 8.872 -10.418 1.00 0.00 H new ATOM 0 HH12 ARG A 97 9.746 9.069 -11.975 1.00 0.00 H new ATOM 0 HH21 ARG A 97 9.194 12.525 -11.568 1.00 0.00 H new ATOM 0 HH22 ARG A 97 8.980 11.122 -12.621 1.00 0.00 H new ATOM 1482 N TRP A 98 15.532 11.020 -6.221 1.00 0.00 N ATOM 1483 CA TRP A 98 16.903 10.667 -5.864 1.00 0.00 C ATOM 1484 C TRP A 98 17.098 9.153 -5.957 1.00 0.00 C ATOM 1485 O TRP A 98 16.361 8.387 -5.339 1.00 0.00 O ATOM 1486 CB TRP A 98 17.164 11.149 -4.429 1.00 0.00 C ATOM 1487 CG TRP A 98 18.282 12.145 -4.247 1.00 0.00 C ATOM 1488 CD1 TRP A 98 19.003 12.309 -3.104 1.00 0.00 C ATOM 1489 CD2 TRP A 98 18.796 13.115 -5.182 1.00 0.00 C ATOM 1490 NE1 TRP A 98 19.934 13.301 -3.256 1.00 0.00 N ATOM 1491 CE2 TRP A 98 19.834 13.811 -4.522 1.00 0.00 C ATOM 1492 CE3 TRP A 98 18.498 13.466 -6.503 1.00 0.00 C ATOM 1493 CZ2 TRP A 98 20.562 14.826 -5.137 1.00 0.00 C ATOM 1494 CZ3 TRP A 98 19.224 14.473 -7.110 1.00 0.00 C ATOM 1495 CH2 TRP A 98 20.245 15.141 -6.429 1.00 0.00 C ATOM 0 H TRP A 98 14.835 10.692 -5.553 1.00 0.00 H new ATOM 0 HA TRP A 98 17.604 11.142 -6.551 1.00 0.00 H new ATOM 0 HB2 TRP A 98 16.245 11.593 -4.046 1.00 0.00 H new ATOM 0 HB3 TRP A 98 17.379 10.278 -3.810 1.00 0.00 H new ATOM 0 HD1 TRP A 98 18.860 11.735 -2.201 1.00 0.00 H new ATOM 0 HE1 TRP A 98 20.594 13.610 -2.542 1.00 0.00 H new ATOM 0 HE3 TRP A 98 17.712 12.957 -7.041 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 21.349 15.346 -4.612 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 18.998 14.749 -8.129 1.00 0.00 H new ATOM 0 HH2 TRP A 98 20.795 15.922 -6.933 1.00 0.00 H new ATOM 1506 N GLU A 99 18.094 8.725 -6.724 1.00 0.00 N ATOM 1507 CA GLU A 99 18.375 7.301 -6.881 1.00 0.00 C ATOM 1508 C GLU A 99 19.839 7.006 -6.584 1.00 0.00 C ATOM 1509 O GLU A 99 20.667 7.916 -6.549 1.00 0.00 O ATOM 1510 CB GLU A 99 18.023 6.832 -8.294 1.00 0.00 C ATOM 1511 CG GLU A 99 16.708 7.389 -8.815 1.00 0.00 C ATOM 1512 CD GLU A 99 16.506 7.122 -10.293 1.00 0.00 C ATOM 1513 OE1 GLU A 99 17.454 7.350 -11.073 1.00 0.00 O ATOM 1514 OE2 GLU A 99 15.399 6.685 -10.672 1.00 0.00 O ATOM 0 H GLU A 99 18.719 9.340 -7.245 1.00 0.00 H new ATOM 0 HA GLU A 99 17.756 6.756 -6.168 1.00 0.00 H new ATOM 0 HB2 GLU A 99 18.824 7.122 -8.973 1.00 0.00 H new ATOM 0 HB3 GLU A 99 17.975 5.743 -8.304 1.00 0.00 H new ATOM 0 HG2 GLU A 99 15.884 6.949 -8.254 1.00 0.00 H new ATOM 0 HG3 GLU A 99 16.677 8.464 -8.636 1.00 0.00 H new ATOM 1521 N ASN A 100 20.152 5.733 -6.365 1.00 0.00 N ATOM 1522 CA ASN A 100 21.520 5.322 -6.063 1.00 0.00 C ATOM 1523 C ASN A 100 22.060 4.367 -7.125 1.00 0.00 C ATOM 1524 O ASN A 100 23.115 4.611 -7.709 1.00 0.00 O ATOM 1525 CB ASN A 100 21.592 4.664 -4.681 1.00 0.00 C ATOM 1526 CG ASN A 100 20.476 3.664 -4.448 1.00 0.00 C ATOM 1527 OD1 ASN A 100 19.302 3.959 -4.675 1.00 0.00 O ATOM 1528 ND2 ASN A 100 20.838 2.470 -3.991 1.00 0.00 N ATOM 0 H ASN A 100 19.478 4.968 -6.391 1.00 0.00 H new ATOM 0 HA ASN A 100 22.141 6.218 -6.062 1.00 0.00 H new ATOM 0 HB2 ASN A 100 22.553 4.161 -4.573 1.00 0.00 H new ATOM 0 HB3 ASN A 100 21.548 5.436 -3.913 1.00 0.00 H new ATOM 0 HD21 ASN A 100 20.131 1.756 -3.815 1.00 0.00 H new ATOM 0 HD22 ASN A 100 21.822 2.268 -3.816 1.00 0.00 H new ATOM 1535 N LYS A 101 21.335 3.278 -7.371 1.00 0.00 N ATOM 1536 CA LYS A 101 21.754 2.289 -8.361 1.00 0.00 C ATOM 1537 C LYS A 101 20.734 1.157 -8.470 1.00 0.00 C ATOM 1538 O LYS A 101 20.281 0.820 -9.565 1.00 0.00 O ATOM 1539 CB LYS A 101 23.132 1.720 -7.992 1.00 0.00 C ATOM 1540 CG LYS A 101 23.616 0.613 -8.917 1.00 0.00 C ATOM 1541 CD LYS A 101 23.286 -0.761 -8.355 1.00 0.00 C ATOM 1542 CE LYS A 101 23.990 -1.004 -7.029 1.00 0.00 C ATOM 1543 NZ LYS A 101 24.267 -2.449 -6.804 1.00 0.00 N ATOM 0 H LYS A 101 20.457 3.059 -6.900 1.00 0.00 H new ATOM 0 HA LYS A 101 21.820 2.786 -9.329 1.00 0.00 H new ATOM 0 HB2 LYS A 101 23.861 2.530 -8.000 1.00 0.00 H new ATOM 0 HB3 LYS A 101 23.093 1.336 -6.973 1.00 0.00 H new ATOM 0 HG2 LYS A 101 23.154 0.728 -9.898 1.00 0.00 H new ATOM 0 HG3 LYS A 101 24.693 0.701 -9.060 1.00 0.00 H new ATOM 0 HD2 LYS A 101 22.208 -0.850 -8.218 1.00 0.00 H new ATOM 0 HD3 LYS A 101 23.581 -1.528 -9.071 1.00 0.00 H new ATOM 0 HE2 LYS A 101 24.927 -0.447 -7.008 1.00 0.00 H new ATOM 0 HE3 LYS A 101 23.374 -0.622 -6.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 24.747 -2.572 -5.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 23.371 -2.977 -6.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 24.876 -2.809 -7.566 1.00 0.00 H new ATOM 1557 N SER A 102 20.388 0.565 -7.331 1.00 0.00 N ATOM 1558 CA SER A 102 19.434 -0.538 -7.301 1.00 0.00 C ATOM 1559 C SER A 102 18.180 -0.163 -6.516 1.00 0.00 C ATOM 1560 O SER A 102 17.594 -1.001 -5.832 1.00 0.00 O ATOM 1561 CB SER A 102 20.083 -1.778 -6.684 1.00 0.00 C ATOM 1562 OG SER A 102 19.686 -2.956 -7.364 1.00 0.00 O ATOM 0 H SER A 102 20.754 0.831 -6.417 1.00 0.00 H new ATOM 0 HA SER A 102 19.140 -0.757 -8.328 1.00 0.00 H new ATOM 0 HB2 SER A 102 21.168 -1.681 -6.722 1.00 0.00 H new ATOM 0 HB3 SER A 102 19.806 -1.851 -5.632 1.00 0.00 H new ATOM 0 HG SER A 102 20.116 -3.733 -6.950 1.00 0.00 H new ATOM 1568 N MET A 103 17.774 1.098 -6.619 1.00 0.00 N ATOM 1569 CA MET A 103 16.589 1.580 -5.917 1.00 0.00 C ATOM 1570 C MET A 103 16.332 3.052 -6.224 1.00 0.00 C ATOM 1571 O MET A 103 17.262 3.857 -6.275 1.00 0.00 O ATOM 1572 CB MET A 103 16.748 1.387 -4.403 1.00 0.00 C ATOM 1573 CG MET A 103 15.567 1.899 -3.588 1.00 0.00 C ATOM 1574 SD MET A 103 16.068 2.909 -2.178 1.00 0.00 S ATOM 1575 CE MET A 103 17.155 4.091 -2.971 1.00 0.00 C ATOM 0 H MET A 103 18.248 1.805 -7.182 1.00 0.00 H new ATOM 0 HA MET A 103 15.735 0.999 -6.265 1.00 0.00 H new ATOM 0 HB2 MET A 103 16.888 0.326 -4.195 1.00 0.00 H new ATOM 0 HB3 MET A 103 17.653 1.899 -4.074 1.00 0.00 H new ATOM 0 HG2 MET A 103 14.914 2.485 -4.234 1.00 0.00 H new ATOM 0 HG3 MET A 103 14.984 1.050 -3.231 1.00 0.00 H new ATOM 0 HE1 MET A 103 17.082 5.052 -2.461 1.00 0.00 H new ATOM 0 HE2 MET A 103 18.183 3.731 -2.921 1.00 0.00 H new ATOM 0 HE3 MET A 103 16.863 4.211 -4.014 1.00 0.00 H new ATOM 1585 N TYR A 104 15.063 3.398 -6.411 1.00 0.00 N ATOM 1586 CA TYR A 104 14.683 4.777 -6.693 1.00 0.00 C ATOM 1587 C TYR A 104 13.977 5.375 -5.484 1.00 0.00 C ATOM 1588 O TYR A 104 12.964 4.850 -5.026 1.00 0.00 O ATOM 1589 CB TYR A 104 13.773 4.843 -7.919 1.00 0.00 C ATOM 1590 CG TYR A 104 14.314 4.094 -9.115 1.00 0.00 C ATOM 1591 CD1 TYR A 104 15.650 4.194 -9.474 1.00 0.00 C ATOM 1592 CD2 TYR A 104 13.487 3.285 -9.883 1.00 0.00 C ATOM 1593 CE1 TYR A 104 16.149 3.510 -10.567 1.00 0.00 C ATOM 1594 CE2 TYR A 104 13.977 2.597 -10.976 1.00 0.00 C ATOM 1595 CZ TYR A 104 15.308 2.713 -11.314 1.00 0.00 C ATOM 1596 OH TYR A 104 15.800 2.029 -12.402 1.00 0.00 O ATOM 0 H TYR A 104 14.281 2.744 -6.372 1.00 0.00 H new ATOM 0 HA TYR A 104 15.585 5.353 -6.902 1.00 0.00 H new ATOM 0 HB2 TYR A 104 12.796 4.437 -7.658 1.00 0.00 H new ATOM 0 HB3 TYR A 104 13.621 5.887 -8.193 1.00 0.00 H new ATOM 0 HD1 TYR A 104 16.312 4.817 -8.890 1.00 0.00 H new ATOM 0 HD2 TYR A 104 12.443 3.192 -9.621 1.00 0.00 H new ATOM 0 HE1 TYR A 104 17.192 3.600 -10.834 1.00 0.00 H new ATOM 0 HE2 TYR A 104 13.320 1.971 -11.563 1.00 0.00 H new ATOM 0 HH TYR A 104 15.078 1.513 -12.818 1.00 0.00 H new ATOM 1606 N CYS A 105 14.519 6.467 -4.958 1.00 0.00 N ATOM 1607 CA CYS A 105 13.936 7.113 -3.789 1.00 0.00 C ATOM 1608 C CYS A 105 13.553 8.560 -4.076 1.00 0.00 C ATOM 1609 O CYS A 105 14.414 9.429 -4.211 1.00 0.00 O ATOM 1610 CB CYS A 105 14.917 7.063 -2.616 1.00 0.00 C ATOM 1611 SG CYS A 105 14.268 7.763 -1.080 1.00 0.00 S ATOM 0 H CYS A 105 15.357 6.922 -5.320 1.00 0.00 H new ATOM 0 HA CYS A 105 13.028 6.568 -3.532 1.00 0.00 H new ATOM 0 HB2 CYS A 105 15.202 6.026 -2.438 1.00 0.00 H new ATOM 0 HB3 CYS A 105 15.825 7.600 -2.892 1.00 0.00 H new ATOM 0 HG CYS A 105 15.169 7.673 -0.147 1.00 0.00 H new ATOM 1617 N ILE A 106 12.252 8.815 -4.139 1.00 0.00 N ATOM 1618 CA ILE A 106 11.752 10.161 -4.380 1.00 0.00 C ATOM 1619 C ILE A 106 11.533 10.866 -3.044 1.00 0.00 C ATOM 1620 O ILE A 106 10.960 10.299 -2.114 1.00 0.00 O ATOM 1621 CB ILE A 106 10.442 10.145 -5.213 1.00 0.00 C ATOM 1622 CG1 ILE A 106 9.787 11.532 -5.272 1.00 0.00 C ATOM 1623 CG2 ILE A 106 9.467 9.131 -4.651 1.00 0.00 C ATOM 1624 CD1 ILE A 106 8.919 11.740 -6.494 1.00 0.00 C ATOM 0 H ILE A 106 11.526 8.108 -4.027 1.00 0.00 H new ATOM 0 HA ILE A 106 12.495 10.707 -4.962 1.00 0.00 H new ATOM 0 HB ILE A 106 10.707 9.859 -6.231 1.00 0.00 H new ATOM 0 HG12 ILE A 106 9.181 11.677 -4.377 1.00 0.00 H new ATOM 0 HG13 ILE A 106 10.566 12.294 -5.256 1.00 0.00 H new ATOM 0 HG21 ILE A 106 8.555 9.134 -5.248 1.00 0.00 H new ATOM 0 HG22 ILE A 106 9.917 8.139 -4.681 1.00 0.00 H new ATOM 0 HG23 ILE A 106 9.227 9.390 -3.620 1.00 0.00 H new ATOM 0 HD11 ILE A 106 8.489 12.741 -6.469 1.00 0.00 H new ATOM 0 HD12 ILE A 106 9.524 11.627 -7.394 1.00 0.00 H new ATOM 0 HD13 ILE A 106 8.118 11.001 -6.501 1.00 0.00 H new ATOM 1636 N CYS A 107 12.008 12.100 -2.957 1.00 0.00 N ATOM 1637 CA CYS A 107 11.885 12.884 -1.739 1.00 0.00 C ATOM 1638 C CYS A 107 11.286 14.249 -2.044 1.00 0.00 C ATOM 1639 O CYS A 107 11.879 15.044 -2.773 1.00 0.00 O ATOM 1640 CB CYS A 107 13.259 13.043 -1.085 1.00 0.00 C ATOM 1641 SG CYS A 107 14.540 13.661 -2.202 1.00 0.00 S ATOM 0 H CYS A 107 12.484 12.581 -3.720 1.00 0.00 H new ATOM 0 HA CYS A 107 11.220 12.363 -1.050 1.00 0.00 H new ATOM 0 HB2 CYS A 107 13.170 13.724 -0.239 1.00 0.00 H new ATOM 0 HB3 CYS A 107 13.574 12.079 -0.686 1.00 0.00 H new ATOM 0 HG CYS A 107 14.174 13.464 -3.434 1.00 0.00 H new ATOM 1647 N THR A 108 10.103 14.517 -1.498 1.00 0.00 N ATOM 1648 CA THR A 108 9.436 15.789 -1.739 1.00 0.00 C ATOM 1649 C THR A 108 9.370 16.645 -0.484 1.00 0.00 C ATOM 1650 O THR A 108 9.271 16.137 0.634 1.00 0.00 O ATOM 1651 CB THR A 108 8.023 15.561 -2.311 1.00 0.00 C ATOM 1652 OG1 THR A 108 7.565 16.723 -2.978 1.00 0.00 O ATOM 1653 CG2 THR A 108 6.978 15.191 -1.271 1.00 0.00 C ATOM 0 H THR A 108 9.592 13.876 -0.891 1.00 0.00 H new ATOM 0 HA THR A 108 10.031 16.332 -2.473 1.00 0.00 H new ATOM 0 HB THR A 108 8.133 14.717 -2.991 1.00 0.00 H new ATOM 0 HG1 THR A 108 7.519 17.468 -2.343 1.00 0.00 H new ATOM 0 HG21 THR A 108 6.014 15.049 -1.759 1.00 0.00 H new ATOM 0 HG22 THR A 108 7.272 14.267 -0.772 1.00 0.00 H new ATOM 0 HG23 THR A 108 6.898 15.991 -0.535 1.00 0.00 H new ATOM 1661 N VAL A 109 9.402 17.953 -0.693 1.00 0.00 N ATOM 1662 CA VAL A 109 9.322 18.904 0.401 1.00 0.00 C ATOM 1663 C VAL A 109 8.281 19.965 0.081 1.00 0.00 C ATOM 1664 O VAL A 109 8.367 20.637 -0.951 1.00 0.00 O ATOM 1665 CB VAL A 109 10.674 19.614 0.708 1.00 0.00 C ATOM 1666 CG1 VAL A 109 10.870 19.752 2.211 1.00 0.00 C ATOM 1667 CG2 VAL A 109 11.860 18.885 0.089 1.00 0.00 C ATOM 0 H VAL A 109 9.483 18.380 -1.616 1.00 0.00 H new ATOM 0 HA VAL A 109 9.047 18.329 1.285 1.00 0.00 H new ATOM 0 HB VAL A 109 10.628 20.605 0.257 1.00 0.00 H new ATOM 0 HG11 VAL A 109 11.819 20.250 2.410 1.00 0.00 H new ATOM 0 HG12 VAL A 109 10.056 20.342 2.631 1.00 0.00 H new ATOM 0 HG13 VAL A 109 10.876 18.763 2.669 1.00 0.00 H new ATOM 0 HG21 VAL A 109 12.780 19.417 0.330 1.00 0.00 H new ATOM 0 HG22 VAL A 109 11.912 17.872 0.487 1.00 0.00 H new ATOM 0 HG23 VAL A 109 11.737 18.844 -0.993 1.00 0.00 H new ATOM 1677 N PHE A 110 7.309 20.135 0.970 1.00 0.00 N ATOM 1678 CA PHE A 110 6.287 21.150 0.768 1.00 0.00 C ATOM 1679 C PHE A 110 6.600 22.338 1.660 1.00 0.00 C ATOM 1680 O PHE A 110 6.356 22.317 2.866 1.00 0.00 O ATOM 1681 CB PHE A 110 4.861 20.635 1.028 1.00 0.00 C ATOM 1682 CG PHE A 110 4.432 19.425 0.218 1.00 0.00 C ATOM 1683 CD1 PHE A 110 5.231 18.885 -0.785 1.00 0.00 C ATOM 1684 CD2 PHE A 110 3.207 18.828 0.472 1.00 0.00 C ATOM 1685 CE1 PHE A 110 4.816 17.783 -1.508 1.00 0.00 C ATOM 1686 CE2 PHE A 110 2.788 17.725 -0.249 1.00 0.00 C ATOM 1687 CZ PHE A 110 3.594 17.203 -1.240 1.00 0.00 C ATOM 0 H PHE A 110 7.209 19.590 1.826 1.00 0.00 H new ATOM 0 HA PHE A 110 6.308 21.443 -0.282 1.00 0.00 H new ATOM 0 HB2 PHE A 110 4.772 20.389 2.086 1.00 0.00 H new ATOM 0 HB3 PHE A 110 4.161 21.447 0.830 1.00 0.00 H new ATOM 0 HD1 PHE A 110 6.189 19.334 -1.002 1.00 0.00 H new ATOM 0 HD2 PHE A 110 2.570 19.231 1.245 1.00 0.00 H new ATOM 0 HE1 PHE A 110 5.449 17.376 -2.283 1.00 0.00 H new ATOM 0 HE2 PHE A 110 1.831 17.272 -0.037 1.00 0.00 H new ATOM 0 HZ PHE A 110 3.268 16.342 -1.805 1.00 0.00 H new ATOM 1697 N GLY A 111 7.166 23.365 1.047 1.00 0.00 N ATOM 1698 CA GLY A 111 7.538 24.562 1.767 1.00 0.00 C ATOM 1699 C GLY A 111 6.369 25.492 1.926 1.00 0.00 C ATOM 1700 O GLY A 111 6.171 26.401 1.121 1.00 0.00 O ATOM 0 H GLY A 111 7.376 23.389 0.049 1.00 0.00 H new ATOM 0 HA2 GLY A 111 7.926 24.292 2.749 1.00 0.00 H new ATOM 0 HA3 GLY A 111 8.342 25.073 1.236 1.00 0.00 H new ATOM 1704 N LEU A 112 5.576 25.247 2.952 1.00 0.00 N ATOM 1705 CA LEU A 112 4.400 26.051 3.196 1.00 0.00 C ATOM 1706 C LEU A 112 4.753 27.310 3.962 1.00 0.00 C ATOM 1707 O LEU A 112 5.358 27.254 5.031 1.00 0.00 O ATOM 1708 CB LEU A 112 3.356 25.215 3.937 1.00 0.00 C ATOM 1709 CG LEU A 112 2.620 24.161 3.083 1.00 0.00 C ATOM 1710 CD1 LEU A 112 3.529 23.504 2.054 1.00 0.00 C ATOM 1711 CD2 LEU A 112 2.033 23.098 3.966 1.00 0.00 C ATOM 0 H LEU A 112 5.727 24.498 3.628 1.00 0.00 H new ATOM 0 HA LEU A 112 3.977 26.367 2.242 1.00 0.00 H new ATOM 0 HB2 LEU A 112 3.846 24.706 4.767 1.00 0.00 H new ATOM 0 HB3 LEU A 112 2.616 25.889 4.368 1.00 0.00 H new ATOM 0 HG LEU A 112 1.832 24.688 2.546 1.00 0.00 H new ATOM 0 HD11 LEU A 112 2.960 22.771 1.481 1.00 0.00 H new ATOM 0 HD12 LEU A 112 3.925 24.264 1.380 1.00 0.00 H new ATOM 0 HD13 LEU A 112 4.354 23.006 2.563 1.00 0.00 H new ATOM 0 HD21 LEU A 112 1.516 22.360 3.353 1.00 0.00 H new ATOM 0 HD22 LEU A 112 2.830 22.610 4.527 1.00 0.00 H new ATOM 0 HD23 LEU A 112 1.326 23.552 4.661 1.00 0.00 H new ATOM 1723 N ALA A 113 4.383 28.455 3.391 1.00 0.00 N ATOM 1724 CA ALA A 113 4.684 29.746 4.017 1.00 0.00 C ATOM 1725 C ALA A 113 4.214 29.795 5.473 1.00 0.00 C ATOM 1726 O ALA A 113 5.007 29.624 6.398 1.00 0.00 O ATOM 1727 CB ALA A 113 4.071 30.887 3.218 1.00 0.00 C ATOM 0 H ALA A 113 3.880 28.518 2.506 1.00 0.00 H new ATOM 0 HA ALA A 113 5.768 29.863 4.018 1.00 0.00 H new ATOM 0 HB1 ALA A 113 4.306 31.836 3.700 1.00 0.00 H new ATOM 0 HB2 ALA A 113 4.478 30.883 2.207 1.00 0.00 H new ATOM 0 HB3 ALA A 113 2.989 30.761 3.174 1.00 0.00 H new ATOM 1733 N ILE A 114 2.925 30.025 5.665 1.00 0.00 N ATOM 1734 CA ILE A 114 2.349 30.094 7.003 1.00 0.00 C ATOM 1735 C ILE A 114 1.401 28.926 7.254 1.00 0.00 C ATOM 1736 O ILE A 114 1.736 27.798 6.836 1.00 0.00 O ATOM 1737 CB ILE A 114 1.585 31.415 7.218 1.00 0.00 C ATOM 1738 CG1 ILE A 114 2.440 32.603 6.774 1.00 0.00 C ATOM 1739 CG2 ILE A 114 1.181 31.561 8.677 1.00 0.00 C ATOM 1740 CD1 ILE A 114 3.716 32.761 7.572 1.00 0.00 C ATOM 0 H ILE A 114 2.254 30.168 4.910 1.00 0.00 H new ATOM 0 HA ILE A 114 3.179 30.043 7.708 1.00 0.00 H new ATOM 0 HB ILE A 114 0.680 31.397 6.611 1.00 0.00 H new ATOM 0 HG12 ILE A 114 2.692 32.485 5.720 1.00 0.00 H new ATOM 0 HG13 ILE A 114 1.851 33.516 6.860 1.00 0.00 H new ATOM 0 HG21 ILE A 114 0.642 32.499 8.813 1.00 0.00 H new ATOM 0 HG22 ILE A 114 0.538 30.728 8.961 1.00 0.00 H new ATOM 0 HG23 ILE A 114 2.073 31.561 9.303 1.00 0.00 H new ATOM 0 HD11 ILE A 114 4.272 33.623 7.202 1.00 0.00 H new ATOM 0 HD12 ILE A 114 3.471 32.911 8.624 1.00 0.00 H new ATOM 0 HD13 ILE A 114 4.325 31.863 7.466 1.00 0.00 H new TER 1752 ILE A 114 ATOM 1753 N MET B 1 -18.493 -16.958 -9.770 1.00 0.00 N ATOM 1754 CA MET B 1 -18.012 -15.580 -10.050 1.00 0.00 C ATOM 1755 C MET B 1 -17.575 -14.877 -8.769 1.00 0.00 C ATOM 1756 O MET B 1 -18.325 -14.090 -8.193 1.00 0.00 O ATOM 1757 CB MET B 1 -19.141 -14.797 -10.722 1.00 0.00 C ATOM 1758 CG MET B 1 -19.745 -15.509 -11.922 1.00 0.00 C ATOM 1759 SD MET B 1 -20.835 -14.444 -12.885 1.00 0.00 S ATOM 1760 CE MET B 1 -19.661 -13.258 -13.536 1.00 0.00 C ATOM 0 H1 MET B 1 -18.526 -17.501 -10.656 1.00 0.00 H new ATOM 0 H2 MET B 1 -17.845 -17.423 -9.103 1.00 0.00 H new ATOM 0 H3 MET B 1 -19.446 -16.916 -9.355 1.00 0.00 H new ATOM 0 HA MET B 1 -17.145 -15.631 -10.709 1.00 0.00 H new ATOM 0 HB2 MET B 1 -19.926 -14.607 -9.990 1.00 0.00 H new ATOM 0 HB3 MET B 1 -18.760 -13.827 -11.040 1.00 0.00 H new ATOM 0 HG2 MET B 1 -18.944 -15.877 -12.563 1.00 0.00 H new ATOM 0 HG3 MET B 1 -20.304 -16.380 -11.579 1.00 0.00 H new ATOM 0 HE1 MET B 1 -20.052 -12.828 -14.458 1.00 0.00 H new ATOM 0 HE2 MET B 1 -19.501 -12.466 -12.805 1.00 0.00 H new ATOM 0 HE3 MET B 1 -18.715 -13.758 -13.742 1.00 0.00 H new ATOM 1770 N GLU B 2 -16.354 -15.169 -8.327 1.00 0.00 N ATOM 1771 CA GLU B 2 -15.817 -14.565 -7.113 1.00 0.00 C ATOM 1772 C GLU B 2 -14.299 -14.435 -7.196 1.00 0.00 C ATOM 1773 O GLU B 2 -13.587 -15.433 -7.309 1.00 0.00 O ATOM 1774 CB GLU B 2 -16.204 -15.397 -5.890 1.00 0.00 C ATOM 1775 CG GLU B 2 -15.901 -14.712 -4.568 1.00 0.00 C ATOM 1776 CD GLU B 2 -16.718 -15.273 -3.420 1.00 0.00 C ATOM 1777 OE1 GLU B 2 -16.354 -16.351 -2.904 1.00 0.00 O ATOM 1778 OE2 GLU B 2 -17.720 -14.634 -3.036 1.00 0.00 O ATOM 0 H GLU B 2 -15.720 -15.819 -8.791 1.00 0.00 H new ATOM 0 HA GLU B 2 -16.244 -13.567 -7.014 1.00 0.00 H new ATOM 0 HB2 GLU B 2 -17.269 -15.623 -5.937 1.00 0.00 H new ATOM 0 HB3 GLU B 2 -15.674 -16.349 -5.926 1.00 0.00 H new ATOM 0 HG2 GLU B 2 -14.840 -14.821 -4.341 1.00 0.00 H new ATOM 0 HG3 GLU B 2 -16.099 -13.644 -4.662 1.00 0.00 H new ATOM 1785 N GLY B 3 -13.812 -13.201 -7.139 1.00 0.00 N ATOM 1786 CA GLY B 3 -12.383 -12.964 -7.209 1.00 0.00 C ATOM 1787 C GLY B 3 -12.034 -11.492 -7.119 1.00 0.00 C ATOM 1788 O GLY B 3 -11.043 -11.118 -6.489 1.00 0.00 O ATOM 0 H GLY B 3 -14.382 -12.360 -7.046 1.00 0.00 H new ATOM 0 HA2 GLY B 3 -11.889 -13.501 -6.400 1.00 0.00 H new ATOM 0 HA3 GLY B 3 -11.996 -13.369 -8.144 1.00 0.00 H new ATOM 1792 N VAL B 4 -12.847 -10.653 -7.753 1.00 0.00 N ATOM 1793 CA VAL B 4 -12.619 -9.213 -7.741 1.00 0.00 C ATOM 1794 C VAL B 4 -13.069 -8.595 -6.422 1.00 0.00 C ATOM 1795 O VAL B 4 -14.115 -8.955 -5.882 1.00 0.00 O ATOM 1796 CB VAL B 4 -13.359 -8.518 -8.900 1.00 0.00 C ATOM 1797 CG1 VAL B 4 -12.954 -7.055 -8.992 1.00 0.00 C ATOM 1798 CG2 VAL B 4 -13.091 -9.237 -10.214 1.00 0.00 C ATOM 0 H VAL B 4 -13.669 -10.946 -8.281 1.00 0.00 H new ATOM 0 HA VAL B 4 -11.546 -9.062 -7.862 1.00 0.00 H new ATOM 0 HB VAL B 4 -14.430 -8.563 -8.701 1.00 0.00 H new ATOM 0 HG11 VAL B 4 -13.487 -6.581 -9.816 1.00 0.00 H new ATOM 0 HG12 VAL B 4 -13.204 -6.549 -8.060 1.00 0.00 H new ATOM 0 HG13 VAL B 4 -11.880 -6.985 -9.166 1.00 0.00 H new ATOM 0 HG21 VAL B 4 -13.622 -8.731 -11.020 1.00 0.00 H new ATOM 0 HG22 VAL B 4 -12.021 -9.228 -10.422 1.00 0.00 H new ATOM 0 HG23 VAL B 4 -13.437 -10.268 -10.142 1.00 0.00 H new ATOM 1808 N ASP B 5 -12.272 -7.664 -5.910 1.00 0.00 N ATOM 1809 CA ASP B 5 -12.588 -6.995 -4.653 1.00 0.00 C ATOM 1810 C ASP B 5 -12.259 -5.502 -4.731 1.00 0.00 C ATOM 1811 O ASP B 5 -11.119 -5.107 -4.494 1.00 0.00 O ATOM 1812 CB ASP B 5 -11.812 -7.640 -3.502 1.00 0.00 C ATOM 1813 CG ASP B 5 -12.253 -7.124 -2.146 1.00 0.00 C ATOM 1814 OD1 ASP B 5 -12.803 -6.005 -2.086 1.00 0.00 O ATOM 1815 OD2 ASP B 5 -12.049 -7.841 -1.144 1.00 0.00 O ATOM 0 H ASP B 5 -11.403 -7.355 -6.345 1.00 0.00 H new ATOM 0 HA ASP B 5 -13.657 -7.104 -4.470 1.00 0.00 H new ATOM 0 HB2 ASP B 5 -11.947 -8.721 -3.538 1.00 0.00 H new ATOM 0 HB3 ASP B 5 -10.747 -7.447 -3.632 1.00 0.00 H new ATOM 1820 N PRO B 6 -13.251 -4.649 -5.062 1.00 0.00 N ATOM 1821 CA PRO B 6 -13.046 -3.194 -5.166 1.00 0.00 C ATOM 1822 C PRO B 6 -12.865 -2.534 -3.799 1.00 0.00 C ATOM 1823 O PRO B 6 -13.659 -1.681 -3.398 1.00 0.00 O ATOM 1824 CB PRO B 6 -14.337 -2.710 -5.827 1.00 0.00 C ATOM 1825 CG PRO B 6 -15.358 -3.701 -5.397 1.00 0.00 C ATOM 1826 CD PRO B 6 -14.650 -5.024 -5.363 1.00 0.00 C ATOM 0 HA PRO B 6 -12.143 -2.944 -5.722 1.00 0.00 H new ATOM 0 HB2 PRO B 6 -14.598 -1.703 -5.502 1.00 0.00 H new ATOM 0 HB3 PRO B 6 -14.242 -2.681 -6.912 1.00 0.00 H new ATOM 0 HG2 PRO B 6 -15.761 -3.447 -4.417 1.00 0.00 H new ATOM 0 HG3 PRO B 6 -16.198 -3.724 -6.091 1.00 0.00 H new ATOM 0 HD2 PRO B 6 -15.064 -5.683 -4.600 1.00 0.00 H new ATOM 0 HD3 PRO B 6 -14.731 -5.549 -6.315 1.00 0.00 H new ATOM 1834 N ALA B 7 -11.809 -2.940 -3.088 1.00 0.00 N ATOM 1835 CA ALA B 7 -11.489 -2.414 -1.752 1.00 0.00 C ATOM 1836 C ALA B 7 -10.523 -3.353 -1.042 1.00 0.00 C ATOM 1837 O ALA B 7 -9.345 -3.045 -0.872 1.00 0.00 O ATOM 1838 CB ALA B 7 -12.744 -2.238 -0.899 1.00 0.00 C ATOM 0 H ALA B 7 -11.149 -3.643 -3.420 1.00 0.00 H new ATOM 0 HA ALA B 7 -11.028 -1.435 -1.885 1.00 0.00 H new ATOM 0 HB1 ALA B 7 -12.467 -1.848 0.080 1.00 0.00 H new ATOM 0 HB2 ALA B 7 -13.422 -1.539 -1.389 1.00 0.00 H new ATOM 0 HB3 ALA B 7 -13.240 -3.201 -0.779 1.00 0.00 H new ATOM 1844 N VAL B 8 -11.048 -4.513 -0.653 1.00 0.00 N ATOM 1845 CA VAL B 8 -10.271 -5.555 0.030 1.00 0.00 C ATOM 1846 C VAL B 8 -9.763 -5.087 1.385 1.00 0.00 C ATOM 1847 O VAL B 8 -10.225 -5.543 2.432 1.00 0.00 O ATOM 1848 CB VAL B 8 -9.048 -6.060 -0.796 1.00 0.00 C ATOM 1849 CG1 VAL B 8 -8.903 -7.564 -0.652 1.00 0.00 C ATOM 1850 CG2 VAL B 8 -9.143 -5.676 -2.264 1.00 0.00 C ATOM 0 H VAL B 8 -12.026 -4.761 -0.801 1.00 0.00 H new ATOM 0 HA VAL B 8 -10.972 -6.381 0.154 1.00 0.00 H new ATOM 0 HB VAL B 8 -8.161 -5.571 -0.393 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -8.046 -7.904 -1.233 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -8.753 -7.816 0.398 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -9.806 -8.053 -1.017 1.00 0.00 H new ATOM 0 HG21 VAL B 8 -8.268 -6.051 -2.795 1.00 0.00 H new ATOM 0 HG22 VAL B 8 -10.044 -6.111 -2.696 1.00 0.00 H new ATOM 0 HG23 VAL B 8 -9.185 -4.591 -2.354 1.00 0.00 H new ATOM 1860 N GLU B 9 -8.786 -4.197 1.349 1.00 0.00 N ATOM 1861 CA GLU B 9 -8.171 -3.678 2.552 1.00 0.00 C ATOM 1862 C GLU B 9 -8.564 -2.224 2.797 1.00 0.00 C ATOM 1863 O GLU B 9 -7.874 -1.302 2.362 1.00 0.00 O ATOM 1864 CB GLU B 9 -6.655 -3.818 2.423 1.00 0.00 C ATOM 1865 CG GLU B 9 -6.082 -4.995 3.195 1.00 0.00 C ATOM 1866 CD GLU B 9 -5.415 -4.574 4.490 1.00 0.00 C ATOM 1867 OE1 GLU B 9 -6.022 -3.778 5.238 1.00 0.00 O ATOM 1868 OE2 GLU B 9 -4.289 -5.040 4.757 1.00 0.00 O ATOM 0 H GLU B 9 -8.400 -3.816 0.485 1.00 0.00 H new ATOM 0 HA GLU B 9 -8.523 -4.250 3.411 1.00 0.00 H new ATOM 0 HB2 GLU B 9 -6.397 -3.926 1.369 1.00 0.00 H new ATOM 0 HB3 GLU B 9 -6.183 -2.900 2.774 1.00 0.00 H new ATOM 0 HG2 GLU B 9 -6.881 -5.703 3.416 1.00 0.00 H new ATOM 0 HG3 GLU B 9 -5.357 -5.516 2.570 1.00 0.00 H new ATOM 1875 N GLU B 10 -9.675 -2.030 3.500 1.00 0.00 N ATOM 1876 CA GLU B 10 -10.161 -0.690 3.808 1.00 0.00 C ATOM 1877 C GLU B 10 -9.325 -0.049 4.911 1.00 0.00 C ATOM 1878 O GLU B 10 -9.246 -0.566 6.025 1.00 0.00 O ATOM 1879 CB GLU B 10 -11.630 -0.741 4.231 1.00 0.00 C ATOM 1880 CG GLU B 10 -12.307 0.619 4.237 1.00 0.00 C ATOM 1881 CD GLU B 10 -12.274 1.280 5.602 1.00 0.00 C ATOM 1882 OE1 GLU B 10 -11.210 1.819 5.974 1.00 0.00 O ATOM 1883 OE2 GLU B 10 -13.311 1.259 6.297 1.00 0.00 O ATOM 0 H GLU B 10 -10.256 -2.784 3.867 1.00 0.00 H new ATOM 0 HA GLU B 10 -10.071 -0.082 2.908 1.00 0.00 H new ATOM 0 HB2 GLU B 10 -12.171 -1.404 3.556 1.00 0.00 H new ATOM 0 HB3 GLU B 10 -11.698 -1.176 5.228 1.00 0.00 H new ATOM 0 HG2 GLU B 10 -11.817 1.268 3.511 1.00 0.00 H new ATOM 0 HG3 GLU B 10 -13.343 0.507 3.916 1.00 0.00 H new ATOM 1890 N ALA B 11 -8.704 1.081 4.590 1.00 0.00 N ATOM 1891 CA ALA B 11 -7.874 1.799 5.548 1.00 0.00 C ATOM 1892 C ALA B 11 -8.535 3.106 5.968 1.00 0.00 C ATOM 1893 O ALA B 11 -9.464 3.581 5.315 1.00 0.00 O ATOM 1894 CB ALA B 11 -6.494 2.062 4.964 1.00 0.00 C ATOM 0 H ALA B 11 -8.761 1.520 3.671 1.00 0.00 H new ATOM 0 HA ALA B 11 -7.762 1.176 6.435 1.00 0.00 H new ATOM 0 HB1 ALA B 11 -5.887 2.599 5.693 1.00 0.00 H new ATOM 0 HB2 ALA B 11 -6.015 1.114 4.721 1.00 0.00 H new ATOM 0 HB3 ALA B 11 -6.590 2.662 4.059 1.00 0.00 H new ATOM 1900 N ALA B 12 -8.055 3.683 7.072 1.00 0.00 N ATOM 1901 CA ALA B 12 -8.594 4.940 7.603 1.00 0.00 C ATOM 1902 C ALA B 12 -9.896 4.696 8.359 1.00 0.00 C ATOM 1903 O ALA B 12 -10.857 4.160 7.808 1.00 0.00 O ATOM 1904 CB ALA B 12 -8.801 5.973 6.493 1.00 0.00 C ATOM 0 H ALA B 12 -7.287 3.296 7.621 1.00 0.00 H new ATOM 0 HA ALA B 12 -7.860 5.343 8.301 1.00 0.00 H new ATOM 0 HB1 ALA B 12 -9.201 6.892 6.921 1.00 0.00 H new ATOM 0 HB2 ALA B 12 -7.847 6.183 6.009 1.00 0.00 H new ATOM 0 HB3 ALA B 12 -9.502 5.580 5.757 1.00 0.00 H new ATOM 1910 N PHE B 13 -9.916 5.089 9.631 1.00 0.00 N ATOM 1911 CA PHE B 13 -11.096 4.909 10.469 1.00 0.00 C ATOM 1912 C PHE B 13 -11.727 6.250 10.839 1.00 0.00 C ATOM 1913 O PHE B 13 -12.925 6.321 11.115 1.00 0.00 O ATOM 1914 CB PHE B 13 -10.727 4.141 11.740 1.00 0.00 C ATOM 1915 CG PHE B 13 -11.809 3.214 12.217 1.00 0.00 C ATOM 1916 CD1 PHE B 13 -12.799 3.666 13.073 1.00 0.00 C ATOM 1917 CD2 PHE B 13 -11.833 1.891 11.807 1.00 0.00 C ATOM 1918 CE1 PHE B 13 -13.795 2.815 13.513 1.00 0.00 C ATOM 1919 CE2 PHE B 13 -12.828 1.035 12.243 1.00 0.00 C ATOM 1920 CZ PHE B 13 -13.809 1.498 13.097 1.00 0.00 C ATOM 0 H PHE B 13 -9.128 5.534 10.102 1.00 0.00 H new ATOM 0 HA PHE B 13 -11.827 4.336 9.898 1.00 0.00 H new ATOM 0 HB2 PHE B 13 -9.821 3.564 11.556 1.00 0.00 H new ATOM 0 HB3 PHE B 13 -10.496 4.854 12.531 1.00 0.00 H new ATOM 0 HD1 PHE B 13 -12.793 4.695 13.400 1.00 0.00 H new ATOM 0 HD2 PHE B 13 -11.067 1.524 11.140 1.00 0.00 H new ATOM 0 HE1 PHE B 13 -14.561 3.179 14.181 1.00 0.00 H new ATOM 0 HE2 PHE B 13 -12.838 0.006 11.916 1.00 0.00 H new ATOM 0 HZ PHE B 13 -14.586 0.831 13.439 1.00 0.00 H new ATOM 1930 N VAL B 14 -10.924 7.311 10.846 1.00 0.00 N ATOM 1931 CA VAL B 14 -11.424 8.637 11.186 1.00 0.00 C ATOM 1932 C VAL B 14 -11.859 9.393 9.937 1.00 0.00 C ATOM 1933 O VAL B 14 -11.433 9.075 8.826 1.00 0.00 O ATOM 1934 CB VAL B 14 -10.365 9.472 11.933 1.00 0.00 C ATOM 1935 CG1 VAL B 14 -10.986 10.739 12.499 1.00 0.00 C ATOM 1936 CG2 VAL B 14 -9.714 8.650 13.037 1.00 0.00 C ATOM 0 H VAL B 14 -9.930 7.277 10.621 1.00 0.00 H new ATOM 0 HA VAL B 14 -12.282 8.489 11.842 1.00 0.00 H new ATOM 0 HB VAL B 14 -9.590 9.760 11.222 1.00 0.00 H new ATOM 0 HG11 VAL B 14 -10.223 11.315 13.023 1.00 0.00 H new ATOM 0 HG12 VAL B 14 -11.398 11.337 11.686 1.00 0.00 H new ATOM 0 HG13 VAL B 14 -11.782 10.474 13.195 1.00 0.00 H new ATOM 0 HG21 VAL B 14 -8.970 9.257 13.552 1.00 0.00 H new ATOM 0 HG22 VAL B 14 -10.475 8.328 13.748 1.00 0.00 H new ATOM 0 HG23 VAL B 14 -9.231 7.775 12.602 1.00 0.00 H new ATOM 1946 N ALA B 15 -12.712 10.394 10.124 1.00 0.00 N ATOM 1947 CA ALA B 15 -13.206 11.192 9.010 1.00 0.00 C ATOM 1948 C ALA B 15 -13.956 10.320 8.007 1.00 0.00 C ATOM 1949 O ALA B 15 -13.711 10.385 6.802 1.00 0.00 O ATOM 1950 CB ALA B 15 -12.055 11.921 8.333 1.00 0.00 C ATOM 0 H ALA B 15 -13.075 10.671 11.036 1.00 0.00 H new ATOM 0 HA ALA B 15 -13.905 11.932 9.400 1.00 0.00 H new ATOM 0 HB1 ALA B 15 -12.438 12.514 7.502 1.00 0.00 H new ATOM 0 HB2 ALA B 15 -11.567 12.578 9.053 1.00 0.00 H new ATOM 0 HB3 ALA B 15 -11.334 11.194 7.958 1.00 0.00 H new ATOM 1956 N ASP B 16 -14.877 9.503 8.514 1.00 0.00 N ATOM 1957 CA ASP B 16 -15.667 8.614 7.666 1.00 0.00 C ATOM 1958 C ASP B 16 -16.397 9.398 6.579 1.00 0.00 C ATOM 1959 O ASP B 16 -16.636 8.888 5.483 1.00 0.00 O ATOM 1960 CB ASP B 16 -16.677 7.834 8.511 1.00 0.00 C ATOM 1961 CG ASP B 16 -17.278 6.663 7.759 1.00 0.00 C ATOM 1962 OD1 ASP B 16 -18.133 6.899 6.879 1.00 0.00 O ATOM 1963 OD2 ASP B 16 -16.895 5.511 8.049 1.00 0.00 O ATOM 0 H ASP B 16 -15.094 9.439 9.508 1.00 0.00 H new ATOM 0 HA ASP B 16 -14.984 7.914 7.185 1.00 0.00 H new ATOM 0 HB2 ASP B 16 -16.187 7.469 9.414 1.00 0.00 H new ATOM 0 HB3 ASP B 16 -17.474 8.505 8.830 1.00 0.00 H new ATOM 1968 N ASP B 17 -16.742 10.647 6.888 1.00 0.00 N ATOM 1969 CA ASP B 17 -17.439 11.509 5.940 1.00 0.00 C ATOM 1970 C ASP B 17 -16.645 11.643 4.643 1.00 0.00 C ATOM 1971 O ASP B 17 -17.194 11.521 3.551 1.00 0.00 O ATOM 1972 CB ASP B 17 -17.672 12.892 6.552 1.00 0.00 C ATOM 1973 CG ASP B 17 -18.939 13.546 6.038 1.00 0.00 C ATOM 1974 OD1 ASP B 17 -18.937 14.022 4.885 1.00 0.00 O ATOM 1975 OD2 ASP B 17 -19.936 13.582 6.792 1.00 0.00 O ATOM 0 H ASP B 17 -16.549 11.083 7.789 1.00 0.00 H new ATOM 0 HA ASP B 17 -18.402 11.053 5.712 1.00 0.00 H new ATOM 0 HB2 ASP B 17 -17.728 12.801 7.637 1.00 0.00 H new ATOM 0 HB3 ASP B 17 -16.819 13.533 6.329 1.00 0.00 H new ATOM 1980 N VAL B 18 -15.347 11.886 4.779 1.00 0.00 N ATOM 1981 CA VAL B 18 -14.464 12.030 3.627 1.00 0.00 C ATOM 1982 C VAL B 18 -14.048 10.669 3.085 1.00 0.00 C ATOM 1983 O VAL B 18 -13.823 10.506 1.885 1.00 0.00 O ATOM 1984 CB VAL B 18 -13.200 12.832 3.988 1.00 0.00 C ATOM 1985 CG1 VAL B 18 -12.375 13.126 2.742 1.00 0.00 C ATOM 1986 CG2 VAL B 18 -13.573 14.118 4.710 1.00 0.00 C ATOM 0 H VAL B 18 -14.880 11.988 5.680 1.00 0.00 H new ATOM 0 HA VAL B 18 -15.023 12.570 2.862 1.00 0.00 H new ATOM 0 HB VAL B 18 -12.590 12.230 4.661 1.00 0.00 H new ATOM 0 HG11 VAL B 18 -11.487 13.693 3.019 1.00 0.00 H new ATOM 0 HG12 VAL B 18 -12.075 12.188 2.274 1.00 0.00 H new ATOM 0 HG13 VAL B 18 -12.972 13.707 2.039 1.00 0.00 H new ATOM 0 HG21 VAL B 18 -12.668 14.672 4.958 1.00 0.00 H new ATOM 0 HG22 VAL B 18 -14.206 14.727 4.065 1.00 0.00 H new ATOM 0 HG23 VAL B 18 -14.113 13.878 5.626 1.00 0.00 H new ATOM 1996 N SER B 19 -13.942 9.694 3.981 1.00 0.00 N ATOM 1997 CA SER B 19 -13.544 8.344 3.603 1.00 0.00 C ATOM 1998 C SER B 19 -14.498 7.752 2.571 1.00 0.00 C ATOM 1999 O SER B 19 -14.067 7.136 1.599 1.00 0.00 O ATOM 2000 CB SER B 19 -13.489 7.443 4.837 1.00 0.00 C ATOM 2001 OG SER B 19 -12.637 6.331 4.620 1.00 0.00 O ATOM 0 H SER B 19 -14.127 9.814 4.977 1.00 0.00 H new ATOM 0 HA SER B 19 -12.552 8.403 3.155 1.00 0.00 H new ATOM 0 HB2 SER B 19 -13.133 8.016 5.694 1.00 0.00 H new ATOM 0 HB3 SER B 19 -14.492 7.094 5.081 1.00 0.00 H new ATOM 0 HG SER B 19 -12.618 5.772 5.424 1.00 0.00 H new ATOM 2007 N ASN B 20 -15.795 7.936 2.788 1.00 0.00 N ATOM 2008 CA ASN B 20 -16.797 7.405 1.868 1.00 0.00 C ATOM 2009 C ASN B 20 -16.739 8.111 0.516 1.00 0.00 C ATOM 2010 O ASN B 20 -16.894 7.478 -0.525 1.00 0.00 O ATOM 2011 CB ASN B 20 -18.202 7.528 2.473 1.00 0.00 C ATOM 2012 CG ASN B 20 -18.657 8.967 2.618 1.00 0.00 C ATOM 2013 OD1 ASN B 20 -18.952 9.640 1.630 1.00 0.00 O ATOM 2014 ND2 ASN B 20 -18.714 9.447 3.853 1.00 0.00 N ATOM 0 H ASN B 20 -16.177 8.444 3.586 1.00 0.00 H new ATOM 0 HA ASN B 20 -16.574 6.350 1.707 1.00 0.00 H new ATOM 0 HB2 ASN B 20 -18.911 6.989 1.845 1.00 0.00 H new ATOM 0 HB3 ASN B 20 -18.214 7.048 3.451 1.00 0.00 H new ATOM 0 HD21 ASN B 20 -19.012 10.409 4.013 1.00 0.00 H new ATOM 0 HD22 ASN B 20 -18.460 8.854 4.643 1.00 0.00 H new ATOM 2021 N ILE B 21 -16.515 9.422 0.541 1.00 0.00 N ATOM 2022 CA ILE B 21 -16.440 10.213 -0.686 1.00 0.00 C ATOM 2023 C ILE B 21 -15.375 9.663 -1.632 1.00 0.00 C ATOM 2024 O ILE B 21 -15.652 9.390 -2.800 1.00 0.00 O ATOM 2025 CB ILE B 21 -16.131 11.702 -0.367 1.00 0.00 C ATOM 2026 CG1 ILE B 21 -17.268 12.313 0.449 1.00 0.00 C ATOM 2027 CG2 ILE B 21 -15.902 12.521 -1.635 1.00 0.00 C ATOM 2028 CD1 ILE B 21 -17.015 13.748 0.852 1.00 0.00 C ATOM 0 H ILE B 21 -16.382 9.960 1.397 1.00 0.00 H new ATOM 0 HA ILE B 21 -17.412 10.147 -1.175 1.00 0.00 H new ATOM 0 HB ILE B 21 -15.210 11.727 0.215 1.00 0.00 H new ATOM 0 HG12 ILE B 21 -18.189 12.264 -0.132 1.00 0.00 H new ATOM 0 HG13 ILE B 21 -17.424 11.714 1.346 1.00 0.00 H new ATOM 0 HG21 ILE B 21 -15.689 13.556 -1.366 1.00 0.00 H new ATOM 0 HG22 ILE B 21 -15.058 12.108 -2.187 1.00 0.00 H new ATOM 0 HG23 ILE B 21 -16.796 12.484 -2.258 1.00 0.00 H new ATOM 0 HD11 ILE B 21 -17.862 14.119 1.429 1.00 0.00 H new ATOM 0 HD12 ILE B 21 -16.112 13.801 1.459 1.00 0.00 H new ATOM 0 HD13 ILE B 21 -16.888 14.360 -0.041 1.00 0.00 H new ATOM 2040 N ILE B 22 -14.156 9.511 -1.129 1.00 0.00 N ATOM 2041 CA ILE B 22 -13.067 9.005 -1.951 1.00 0.00 C ATOM 2042 C ILE B 22 -13.377 7.598 -2.467 1.00 0.00 C ATOM 2043 O ILE B 22 -13.322 7.355 -3.668 1.00 0.00 O ATOM 2044 CB ILE B 22 -11.716 9.033 -1.197 1.00 0.00 C ATOM 2045 CG1 ILE B 22 -10.574 8.604 -2.117 1.00 0.00 C ATOM 2046 CG2 ILE B 22 -11.757 8.162 0.046 1.00 0.00 C ATOM 2047 CD1 ILE B 22 -10.048 9.725 -2.987 1.00 0.00 C ATOM 0 H ILE B 22 -13.899 9.729 -0.166 1.00 0.00 H new ATOM 0 HA ILE B 22 -12.974 9.670 -2.810 1.00 0.00 H new ATOM 0 HB ILE B 22 -11.536 10.060 -0.878 1.00 0.00 H new ATOM 0 HG12 ILE B 22 -9.758 8.211 -1.511 1.00 0.00 H new ATOM 0 HG13 ILE B 22 -10.918 7.790 -2.755 1.00 0.00 H new ATOM 0 HG21 ILE B 22 -10.792 8.204 0.552 1.00 0.00 H new ATOM 0 HG22 ILE B 22 -12.535 8.523 0.718 1.00 0.00 H new ATOM 0 HG23 ILE B 22 -11.973 7.132 -0.238 1.00 0.00 H new ATOM 0 HD11 ILE B 22 -9.239 9.350 -3.614 1.00 0.00 H new ATOM 0 HD12 ILE B 22 -10.852 10.103 -3.619 1.00 0.00 H new ATOM 0 HD13 ILE B 22 -9.673 10.531 -2.355 1.00 0.00 H new ATOM 2059 N LYS B 23 -13.738 6.680 -1.570 1.00 0.00 N ATOM 2060 CA LYS B 23 -14.078 5.312 -1.974 1.00 0.00 C ATOM 2061 C LYS B 23 -15.226 5.325 -2.962 1.00 0.00 C ATOM 2062 O LYS B 23 -15.130 4.782 -4.062 1.00 0.00 O ATOM 2063 CB LYS B 23 -14.480 4.496 -0.758 1.00 0.00 C ATOM 2064 CG LYS B 23 -13.394 4.425 0.289 1.00 0.00 C ATOM 2065 CD LYS B 23 -13.859 3.718 1.554 1.00 0.00 C ATOM 2066 CE LYS B 23 -15.163 4.276 2.116 1.00 0.00 C ATOM 2067 NZ LYS B 23 -15.585 3.553 3.348 1.00 0.00 N ATOM 0 H LYS B 23 -13.803 6.854 -0.567 1.00 0.00 H new ATOM 0 HA LYS B 23 -13.202 4.864 -2.444 1.00 0.00 H new ATOM 0 HB2 LYS B 23 -15.376 4.931 -0.315 1.00 0.00 H new ATOM 0 HB3 LYS B 23 -14.739 3.486 -1.074 1.00 0.00 H new ATOM 0 HG2 LYS B 23 -12.530 3.901 -0.121 1.00 0.00 H new ATOM 0 HG3 LYS B 23 -13.066 5.434 0.539 1.00 0.00 H new ATOM 0 HD2 LYS B 23 -13.988 2.657 1.341 1.00 0.00 H new ATOM 0 HD3 LYS B 23 -13.081 3.799 2.313 1.00 0.00 H new ATOM 0 HE2 LYS B 23 -15.039 5.335 2.340 1.00 0.00 H new ATOM 0 HE3 LYS B 23 -15.947 4.199 1.362 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 -16.475 3.959 3.701 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 -15.727 2.546 3.128 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 -14.848 3.648 4.076 1.00 0.00 H new ATOM 2081 N GLU B 24 -16.307 5.978 -2.557 1.00 0.00 N ATOM 2082 CA GLU B 24 -17.496 6.109 -3.399 1.00 0.00 C ATOM 2083 C GLU B 24 -17.109 6.620 -4.782 1.00 0.00 C ATOM 2084 O GLU B 24 -17.699 6.240 -5.793 1.00 0.00 O ATOM 2085 CB GLU B 24 -18.500 7.070 -2.753 1.00 0.00 C ATOM 2086 CG GLU B 24 -19.265 6.461 -1.589 1.00 0.00 C ATOM 2087 CD GLU B 24 -20.594 5.869 -2.012 1.00 0.00 C ATOM 2088 OE1 GLU B 24 -21.448 6.628 -2.519 1.00 0.00 O ATOM 2089 OE2 GLU B 24 -20.783 4.647 -1.837 1.00 0.00 O ATOM 0 H GLU B 24 -16.388 6.429 -1.646 1.00 0.00 H new ATOM 0 HA GLU B 24 -17.959 5.127 -3.500 1.00 0.00 H new ATOM 0 HB2 GLU B 24 -17.969 7.956 -2.404 1.00 0.00 H new ATOM 0 HB3 GLU B 24 -19.211 7.402 -3.510 1.00 0.00 H new ATOM 0 HG2 GLU B 24 -18.656 5.684 -1.126 1.00 0.00 H new ATOM 0 HG3 GLU B 24 -19.437 7.226 -0.832 1.00 0.00 H new ATOM 2096 N SER B 25 -16.100 7.485 -4.807 1.00 0.00 N ATOM 2097 CA SER B 25 -15.610 8.055 -6.049 1.00 0.00 C ATOM 2098 C SER B 25 -14.902 7.000 -6.887 1.00 0.00 C ATOM 2099 O SER B 25 -15.157 6.902 -8.077 1.00 0.00 O ATOM 2100 CB SER B 25 -14.665 9.224 -5.765 1.00 0.00 C ATOM 2101 OG SER B 25 -15.365 10.456 -5.760 1.00 0.00 O ATOM 0 H SER B 25 -15.606 7.806 -3.974 1.00 0.00 H new ATOM 0 HA SER B 25 -16.467 8.425 -6.613 1.00 0.00 H new ATOM 0 HB2 SER B 25 -14.177 9.075 -4.802 1.00 0.00 H new ATOM 0 HB3 SER B 25 -13.879 9.252 -6.520 1.00 0.00 H new ATOM 0 HG SER B 25 -14.841 11.128 -5.276 1.00 0.00 H new ATOM 2107 N ILE B 26 -14.028 6.194 -6.273 1.00 0.00 N ATOM 2108 CA ILE B 26 -13.320 5.149 -7.023 1.00 0.00 C ATOM 2109 C ILE B 26 -14.326 4.220 -7.687 1.00 0.00 C ATOM 2110 O ILE B 26 -14.187 3.864 -8.853 1.00 0.00 O ATOM 2111 CB ILE B 26 -12.351 4.323 -6.123 1.00 0.00 C ATOM 2112 CG1 ILE B 26 -11.063 5.100 -5.891 1.00 0.00 C ATOM 2113 CG2 ILE B 26 -12.005 2.957 -6.731 1.00 0.00 C ATOM 2114 CD1 ILE B 26 -11.209 6.234 -4.913 1.00 0.00 C ATOM 0 H ILE B 26 -13.797 6.242 -5.281 1.00 0.00 H new ATOM 0 HA ILE B 26 -12.714 5.647 -7.780 1.00 0.00 H new ATOM 0 HB ILE B 26 -12.869 4.150 -5.179 1.00 0.00 H new ATOM 0 HG12 ILE B 26 -10.296 4.415 -5.528 1.00 0.00 H new ATOM 0 HG13 ILE B 26 -10.711 5.496 -6.844 1.00 0.00 H new ATOM 0 HG21 ILE B 26 -11.328 2.423 -6.064 1.00 0.00 H new ATOM 0 HG22 ILE B 26 -12.918 2.376 -6.863 1.00 0.00 H new ATOM 0 HG23 ILE B 26 -11.524 3.101 -7.698 1.00 0.00 H new ATOM 0 HD11 ILE B 26 -10.251 6.741 -4.798 1.00 0.00 H new ATOM 0 HD12 ILE B 26 -11.952 6.941 -5.283 1.00 0.00 H new ATOM 0 HD13 ILE B 26 -11.530 5.843 -3.948 1.00 0.00 H new ATOM 2126 N ASP B 27 -15.349 3.840 -6.941 1.00 0.00 N ATOM 2127 CA ASP B 27 -16.378 2.960 -7.468 1.00 0.00 C ATOM 2128 C ASP B 27 -16.906 3.493 -8.800 1.00 0.00 C ATOM 2129 O ASP B 27 -17.182 2.738 -9.722 1.00 0.00 O ATOM 2130 CB ASP B 27 -17.521 2.838 -6.457 1.00 0.00 C ATOM 2131 CG ASP B 27 -18.507 1.746 -6.824 1.00 0.00 C ATOM 2132 OD1 ASP B 27 -19.209 1.898 -7.846 1.00 0.00 O ATOM 2133 OD2 ASP B 27 -18.577 0.737 -6.090 1.00 0.00 O ATOM 0 H ASP B 27 -15.489 4.126 -5.972 1.00 0.00 H new ATOM 0 HA ASP B 27 -15.945 1.974 -7.639 1.00 0.00 H new ATOM 0 HB2 ASP B 27 -17.108 2.633 -5.469 1.00 0.00 H new ATOM 0 HB3 ASP B 27 -18.047 3.791 -6.391 1.00 0.00 H new ATOM 2138 N ALA B 28 -17.017 4.809 -8.887 1.00 0.00 N ATOM 2139 CA ALA B 28 -17.505 5.463 -10.100 1.00 0.00 C ATOM 2140 C ALA B 28 -16.374 5.800 -11.071 1.00 0.00 C ATOM 2141 O ALA B 28 -16.481 5.571 -12.279 1.00 0.00 O ATOM 2142 CB ALA B 28 -18.257 6.729 -9.718 1.00 0.00 C ATOM 0 H ALA B 28 -16.776 5.451 -8.132 1.00 0.00 H new ATOM 0 HA ALA B 28 -18.171 4.768 -10.612 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -18.623 7.221 -10.619 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -19.100 6.472 -9.077 1.00 0.00 H new ATOM 0 HB3 ALA B 28 -17.587 7.403 -9.184 1.00 0.00 H new ATOM 2148 N VAL B 29 -15.298 6.351 -10.521 1.00 0.00 N ATOM 2149 CA VAL B 29 -14.133 6.755 -11.284 1.00 0.00 C ATOM 2150 C VAL B 29 -13.357 5.539 -11.823 1.00 0.00 C ATOM 2151 O VAL B 29 -12.440 5.695 -12.628 1.00 0.00 O ATOM 2152 CB VAL B 29 -13.286 7.758 -10.418 1.00 0.00 C ATOM 2153 CG1 VAL B 29 -11.785 7.564 -10.465 1.00 0.00 C ATOM 2154 CG2 VAL B 29 -13.601 9.184 -10.829 1.00 0.00 C ATOM 0 H VAL B 29 -15.214 6.530 -9.520 1.00 0.00 H new ATOM 0 HA VAL B 29 -14.430 7.290 -12.186 1.00 0.00 H new ATOM 0 HB VAL B 29 -13.581 7.548 -9.390 1.00 0.00 H new ATOM 0 HG11 VAL B 29 -11.302 8.309 -9.833 1.00 0.00 H new ATOM 0 HG12 VAL B 29 -11.536 6.566 -10.105 1.00 0.00 H new ATOM 0 HG13 VAL B 29 -11.435 7.678 -11.491 1.00 0.00 H new ATOM 0 HG21 VAL B 29 -13.012 9.875 -10.226 1.00 0.00 H new ATOM 0 HG22 VAL B 29 -13.356 9.322 -11.882 1.00 0.00 H new ATOM 0 HG23 VAL B 29 -14.662 9.381 -10.674 1.00 0.00 H new ATOM 2164 N LEU B 30 -13.760 4.323 -11.422 1.00 0.00 N ATOM 2165 CA LEU B 30 -13.123 3.108 -11.922 1.00 0.00 C ATOM 2166 C LEU B 30 -14.146 2.179 -12.583 1.00 0.00 C ATOM 2167 O LEU B 30 -13.845 1.556 -13.602 1.00 0.00 O ATOM 2168 CB LEU B 30 -12.372 2.372 -10.810 1.00 0.00 C ATOM 2169 CG LEU B 30 -11.009 2.972 -10.462 1.00 0.00 C ATOM 2170 CD1 LEU B 30 -10.146 3.085 -11.701 1.00 0.00 C ATOM 2171 CD2 LEU B 30 -11.173 4.342 -9.851 1.00 0.00 C ATOM 0 H LEU B 30 -14.518 4.162 -10.759 1.00 0.00 H new ATOM 0 HA LEU B 30 -12.397 3.410 -12.677 1.00 0.00 H new ATOM 0 HB2 LEU B 30 -12.992 2.365 -9.913 1.00 0.00 H new ATOM 0 HB3 LEU B 30 -12.232 1.333 -11.109 1.00 0.00 H new ATOM 0 HG LEU B 30 -10.527 2.310 -9.743 1.00 0.00 H new ATOM 0 HD11 LEU B 30 -9.180 3.514 -11.434 1.00 0.00 H new ATOM 0 HD12 LEU B 30 -9.997 2.095 -12.132 1.00 0.00 H new ATOM 0 HD13 LEU B 30 -10.639 3.728 -12.430 1.00 0.00 H new ATOM 0 HD21 LEU B 30 -10.192 4.753 -9.610 1.00 0.00 H new ATOM 0 HD22 LEU B 30 -11.677 4.999 -10.560 1.00 0.00 H new ATOM 0 HD23 LEU B 30 -11.768 4.266 -8.941 1.00 0.00 H new ATOM 2183 N GLN B 31 -15.359 2.089 -12.024 1.00 0.00 N ATOM 2184 CA GLN B 31 -16.389 1.231 -12.610 1.00 0.00 C ATOM 2185 C GLN B 31 -17.079 1.910 -13.796 1.00 0.00 C ATOM 2186 O GLN B 31 -17.780 1.248 -14.563 1.00 0.00 O ATOM 2187 CB GLN B 31 -17.434 0.836 -11.572 1.00 0.00 C ATOM 2188 CG GLN B 31 -18.248 -0.365 -11.973 1.00 0.00 C ATOM 2189 CD GLN B 31 -19.143 -0.868 -10.857 1.00 0.00 C ATOM 2190 OE1 GLN B 31 -19.006 -0.461 -9.704 1.00 0.00 O ATOM 2191 NE2 GLN B 31 -20.066 -1.760 -11.197 1.00 0.00 N ATOM 0 H GLN B 31 -15.645 2.590 -11.183 1.00 0.00 H new ATOM 0 HA GLN B 31 -15.886 0.333 -12.967 1.00 0.00 H new ATOM 0 HB2 GLN B 31 -16.935 0.628 -10.625 1.00 0.00 H new ATOM 0 HB3 GLN B 31 -18.103 1.679 -11.401 1.00 0.00 H new ATOM 0 HG2 GLN B 31 -18.861 -0.110 -12.837 1.00 0.00 H new ATOM 0 HG3 GLN B 31 -17.577 -1.166 -12.283 1.00 0.00 H new ATOM 0 HE21 GLN B 31 -20.144 -2.069 -12.166 1.00 0.00 H new ATOM 0 HE22 GLN B 31 -20.697 -2.136 -10.489 1.00 0.00 H new ATOM 2200 N ASN B 32 -16.888 3.230 -13.943 1.00 0.00 N ATOM 2201 CA ASN B 32 -17.500 3.996 -15.040 1.00 0.00 C ATOM 2202 C ASN B 32 -17.469 3.245 -16.376 1.00 0.00 C ATOM 2203 O ASN B 32 -18.356 3.419 -17.211 1.00 0.00 O ATOM 2204 CB ASN B 32 -16.789 5.342 -15.199 1.00 0.00 C ATOM 2205 CG ASN B 32 -15.278 5.206 -15.177 1.00 0.00 C ATOM 2206 OD1 ASN B 32 -14.743 4.100 -15.094 1.00 0.00 O ATOM 2207 ND2 ASN B 32 -14.583 6.331 -15.255 1.00 0.00 N ATOM 0 H ASN B 32 -16.313 3.791 -13.314 1.00 0.00 H new ATOM 0 HA ASN B 32 -18.546 4.148 -14.773 1.00 0.00 H new ATOM 0 HB2 ASN B 32 -17.096 5.803 -16.138 1.00 0.00 H new ATOM 0 HB3 ASN B 32 -17.102 6.012 -14.398 1.00 0.00 H new ATOM 0 HD21 ASN B 32 -13.563 6.302 -15.248 1.00 0.00 H new ATOM 0 HD22 ASN B 32 -15.067 7.226 -15.322 1.00 0.00 H new ATOM 2214 N GLN B 33 -16.448 2.412 -16.574 1.00 0.00 N ATOM 2215 CA GLN B 33 -16.330 1.650 -17.813 1.00 0.00 C ATOM 2216 C GLN B 33 -15.662 0.283 -17.574 1.00 0.00 C ATOM 2217 O GLN B 33 -16.338 -0.677 -17.207 1.00 0.00 O ATOM 2218 CB GLN B 33 -15.579 2.470 -18.870 1.00 0.00 C ATOM 2219 CG GLN B 33 -15.358 1.728 -20.179 1.00 0.00 C ATOM 2220 CD GLN B 33 -16.606 1.686 -21.041 1.00 0.00 C ATOM 2221 OE1 GLN B 33 -17.103 0.613 -21.382 1.00 0.00 O ATOM 2222 NE2 GLN B 33 -17.117 2.857 -21.400 1.00 0.00 N ATOM 0 H GLN B 33 -15.700 2.250 -15.900 1.00 0.00 H new ATOM 0 HA GLN B 33 -17.333 1.449 -18.188 1.00 0.00 H new ATOM 0 HB2 GLN B 33 -16.137 3.384 -19.071 1.00 0.00 H new ATOM 0 HB3 GLN B 33 -14.612 2.769 -18.465 1.00 0.00 H new ATOM 0 HG2 GLN B 33 -14.553 2.209 -20.734 1.00 0.00 H new ATOM 0 HG3 GLN B 33 -15.033 0.710 -19.965 1.00 0.00 H new ATOM 0 HE21 GLN B 33 -16.672 3.723 -21.095 1.00 0.00 H new ATOM 0 HE22 GLN B 33 -17.954 2.891 -21.981 1.00 0.00 H new ATOM 2231 N GLN B 34 -14.344 0.186 -17.786 1.00 0.00 N ATOM 2232 CA GLN B 34 -13.635 -1.076 -17.590 1.00 0.00 C ATOM 2233 C GLN B 34 -12.257 -0.844 -16.977 1.00 0.00 C ATOM 2234 O GLN B 34 -11.872 0.293 -16.705 1.00 0.00 O ATOM 2235 CB GLN B 34 -13.497 -1.818 -18.921 1.00 0.00 C ATOM 2236 CG GLN B 34 -13.654 -3.325 -18.796 1.00 0.00 C ATOM 2237 CD GLN B 34 -14.998 -3.815 -19.297 1.00 0.00 C ATOM 2238 OE1 GLN B 34 -15.207 -3.969 -20.502 1.00 0.00 O ATOM 2239 NE2 GLN B 34 -15.919 -4.064 -18.374 1.00 0.00 N ATOM 0 H GLN B 34 -13.755 0.961 -18.090 1.00 0.00 H new ATOM 0 HA GLN B 34 -14.218 -1.685 -16.899 1.00 0.00 H new ATOM 0 HB2 GLN B 34 -14.245 -1.440 -19.618 1.00 0.00 H new ATOM 0 HB3 GLN B 34 -12.520 -1.597 -19.351 1.00 0.00 H new ATOM 0 HG2 GLN B 34 -12.860 -3.817 -19.357 1.00 0.00 H new ATOM 0 HG3 GLN B 34 -13.532 -3.614 -17.752 1.00 0.00 H new ATOM 0 HE21 GLN B 34 -15.703 -3.923 -17.387 1.00 0.00 H new ATOM 0 HE22 GLN B 34 -16.842 -4.397 -18.652 1.00 0.00 H new ATOM 2248 N TYR B 35 -11.516 -1.929 -16.766 1.00 0.00 N ATOM 2249 CA TYR B 35 -10.179 -1.840 -16.189 1.00 0.00 C ATOM 2250 C TYR B 35 -9.127 -1.655 -17.282 1.00 0.00 C ATOM 2251 O TYR B 35 -8.853 -2.569 -18.060 1.00 0.00 O ATOM 2252 CB TYR B 35 -9.879 -3.103 -15.369 1.00 0.00 C ATOM 2253 CG TYR B 35 -8.465 -3.176 -14.827 1.00 0.00 C ATOM 2254 CD1 TYR B 35 -8.000 -2.244 -13.907 1.00 0.00 C ATOM 2255 CD2 TYR B 35 -7.597 -4.182 -15.236 1.00 0.00 C ATOM 2256 CE1 TYR B 35 -6.710 -2.312 -13.411 1.00 0.00 C ATOM 2257 CE2 TYR B 35 -6.307 -4.256 -14.745 1.00 0.00 C ATOM 2258 CZ TYR B 35 -5.869 -3.320 -13.833 1.00 0.00 C ATOM 2259 OH TYR B 35 -4.585 -3.389 -13.343 1.00 0.00 O ATOM 0 H TYR B 35 -11.819 -2.878 -16.986 1.00 0.00 H new ATOM 0 HA TYR B 35 -10.142 -0.971 -15.532 1.00 0.00 H new ATOM 0 HB2 TYR B 35 -10.578 -3.154 -14.534 1.00 0.00 H new ATOM 0 HB3 TYR B 35 -10.062 -3.978 -15.992 1.00 0.00 H new ATOM 0 HD1 TYR B 35 -8.656 -1.454 -13.574 1.00 0.00 H new ATOM 0 HD2 TYR B 35 -7.936 -4.918 -15.950 1.00 0.00 H new ATOM 0 HE1 TYR B 35 -6.364 -1.579 -12.697 1.00 0.00 H new ATOM 0 HE2 TYR B 35 -5.645 -5.044 -15.074 1.00 0.00 H new ATOM 0 HH TYR B 35 -4.476 -4.214 -12.825 1.00 0.00 H new ATOM 2269 N SER B 36 -8.533 -0.467 -17.319 1.00 0.00 N ATOM 2270 CA SER B 36 -7.497 -0.150 -18.296 1.00 0.00 C ATOM 2271 C SER B 36 -6.314 0.518 -17.606 1.00 0.00 C ATOM 2272 O SER B 36 -6.496 1.453 -16.831 1.00 0.00 O ATOM 2273 CB SER B 36 -8.055 0.767 -19.388 1.00 0.00 C ATOM 2274 OG SER B 36 -8.504 0.018 -20.503 1.00 0.00 O ATOM 0 H SER B 36 -8.753 0.297 -16.680 1.00 0.00 H new ATOM 0 HA SER B 36 -7.160 -1.077 -18.759 1.00 0.00 H new ATOM 0 HB2 SER B 36 -8.879 1.356 -18.986 1.00 0.00 H new ATOM 0 HB3 SER B 36 -7.285 1.470 -19.705 1.00 0.00 H new ATOM 0 HG SER B 36 -8.857 0.627 -21.185 1.00 0.00 H new ATOM 2280 N GLU B 37 -5.103 0.041 -17.880 1.00 0.00 N ATOM 2281 CA GLU B 37 -3.914 0.619 -17.261 1.00 0.00 C ATOM 2282 C GLU B 37 -3.764 2.090 -17.630 1.00 0.00 C ATOM 2283 O GLU B 37 -3.397 2.916 -16.796 1.00 0.00 O ATOM 2284 CB GLU B 37 -2.656 -0.144 -17.665 1.00 0.00 C ATOM 2285 CG GLU B 37 -1.410 0.361 -16.953 1.00 0.00 C ATOM 2286 CD GLU B 37 -0.786 -0.681 -16.044 1.00 0.00 C ATOM 2287 OE1 GLU B 37 -1.261 -0.829 -14.898 1.00 0.00 O ATOM 2288 OE2 GLU B 37 0.177 -1.347 -16.478 1.00 0.00 O ATOM 0 H GLU B 37 -4.920 -0.734 -18.518 1.00 0.00 H new ATOM 0 HA GLU B 37 -4.040 0.539 -16.181 1.00 0.00 H new ATOM 0 HB2 GLU B 37 -2.792 -1.203 -17.445 1.00 0.00 H new ATOM 0 HB3 GLU B 37 -2.514 -0.058 -18.742 1.00 0.00 H new ATOM 0 HG2 GLU B 37 -0.676 0.675 -17.695 1.00 0.00 H new ATOM 0 HG3 GLU B 37 -1.666 1.242 -16.365 1.00 0.00 H new ATOM 2295 N ALA B 38 -4.062 2.420 -18.879 1.00 0.00 N ATOM 2296 CA ALA B 38 -3.975 3.802 -19.340 1.00 0.00 C ATOM 2297 C ALA B 38 -4.872 4.703 -18.499 1.00 0.00 C ATOM 2298 O ALA B 38 -4.580 5.879 -18.289 1.00 0.00 O ATOM 2299 CB ALA B 38 -4.369 3.890 -20.802 1.00 0.00 C ATOM 0 H ALA B 38 -4.365 1.754 -19.590 1.00 0.00 H new ATOM 0 HA ALA B 38 -2.945 4.140 -19.231 1.00 0.00 H new ATOM 0 HB1 ALA B 38 -4.301 4.925 -21.136 1.00 0.00 H new ATOM 0 HB2 ALA B 38 -3.697 3.272 -21.398 1.00 0.00 H new ATOM 0 HB3 ALA B 38 -5.393 3.536 -20.925 1.00 0.00 H new ATOM 2305 N LYS B 39 -5.966 4.124 -18.019 1.00 0.00 N ATOM 2306 CA LYS B 39 -6.926 4.837 -17.195 1.00 0.00 C ATOM 2307 C LYS B 39 -6.624 4.643 -15.703 1.00 0.00 C ATOM 2308 O LYS B 39 -7.055 5.436 -14.867 1.00 0.00 O ATOM 2309 CB LYS B 39 -8.332 4.331 -17.522 1.00 0.00 C ATOM 2310 CG LYS B 39 -9.153 5.293 -18.359 1.00 0.00 C ATOM 2311 CD LYS B 39 -8.501 5.554 -19.702 1.00 0.00 C ATOM 2312 CE LYS B 39 -8.846 4.467 -20.709 1.00 0.00 C ATOM 2313 NZ LYS B 39 -8.488 4.864 -22.098 1.00 0.00 N ATOM 0 H LYS B 39 -6.210 3.149 -18.191 1.00 0.00 H new ATOM 0 HA LYS B 39 -6.857 5.903 -17.410 1.00 0.00 H new ATOM 0 HB2 LYS B 39 -8.252 3.382 -18.052 1.00 0.00 H new ATOM 0 HB3 LYS B 39 -8.862 4.132 -16.590 1.00 0.00 H new ATOM 0 HG2 LYS B 39 -10.152 4.884 -18.511 1.00 0.00 H new ATOM 0 HG3 LYS B 39 -9.272 6.234 -17.822 1.00 0.00 H new ATOM 0 HD2 LYS B 39 -8.826 6.522 -20.084 1.00 0.00 H new ATOM 0 HD3 LYS B 39 -7.419 5.607 -19.578 1.00 0.00 H new ATOM 0 HE2 LYS B 39 -8.320 3.549 -20.447 1.00 0.00 H new ATOM 0 HE3 LYS B 39 -9.913 4.249 -20.657 1.00 0.00 H new ATOM 0 HZ1 LYS B 39 -8.739 4.097 -22.754 1.00 0.00 H new ATOM 0 HZ2 LYS B 39 -9.009 5.726 -22.358 1.00 0.00 H new ATOM 0 HZ3 LYS B 39 -7.466 5.047 -22.154 1.00 0.00 H new ATOM 2327 N VAL B 40 -5.885 3.579 -15.377 1.00 0.00 N ATOM 2328 CA VAL B 40 -5.526 3.267 -13.993 1.00 0.00 C ATOM 2329 C VAL B 40 -4.924 4.490 -13.279 1.00 0.00 C ATOM 2330 O VAL B 40 -4.998 4.599 -12.056 1.00 0.00 O ATOM 2331 CB VAL B 40 -4.552 2.042 -13.958 1.00 0.00 C ATOM 2332 CG1 VAL B 40 -3.633 2.023 -12.737 1.00 0.00 C ATOM 2333 CG2 VAL B 40 -5.347 0.747 -14.031 1.00 0.00 C ATOM 0 H VAL B 40 -5.522 2.915 -16.060 1.00 0.00 H new ATOM 0 HA VAL B 40 -6.433 3.001 -13.450 1.00 0.00 H new ATOM 0 HB VAL B 40 -3.903 2.139 -14.828 1.00 0.00 H new ATOM 0 HG11 VAL B 40 -2.987 1.146 -12.781 1.00 0.00 H new ATOM 0 HG12 VAL B 40 -3.021 2.925 -12.728 1.00 0.00 H new ATOM 0 HG13 VAL B 40 -4.235 1.985 -11.829 1.00 0.00 H new ATOM 0 HG21 VAL B 40 -4.663 -0.102 -14.006 1.00 0.00 H new ATOM 0 HG22 VAL B 40 -6.028 0.690 -13.182 1.00 0.00 H new ATOM 0 HG23 VAL B 40 -5.921 0.724 -14.958 1.00 0.00 H new ATOM 2343 N SER B 41 -4.335 5.399 -14.047 1.00 0.00 N ATOM 2344 CA SER B 41 -3.731 6.599 -13.477 1.00 0.00 C ATOM 2345 C SER B 41 -4.604 7.821 -13.728 1.00 0.00 C ATOM 2346 O SER B 41 -4.634 8.752 -12.923 1.00 0.00 O ATOM 2347 CB SER B 41 -2.339 6.825 -14.068 1.00 0.00 C ATOM 2348 OG SER B 41 -1.605 7.763 -13.301 1.00 0.00 O ATOM 0 H SER B 41 -4.262 5.329 -15.062 1.00 0.00 H new ATOM 0 HA SER B 41 -3.643 6.453 -12.400 1.00 0.00 H new ATOM 0 HB2 SER B 41 -1.799 5.879 -14.106 1.00 0.00 H new ATOM 0 HB3 SER B 41 -2.430 7.181 -15.094 1.00 0.00 H new ATOM 0 HG SER B 41 -1.996 7.830 -12.405 1.00 0.00 H new ATOM 2354 N GLN B 42 -5.308 7.814 -14.853 1.00 0.00 N ATOM 2355 CA GLN B 42 -6.177 8.925 -15.213 1.00 0.00 C ATOM 2356 C GLN B 42 -7.450 8.919 -14.386 1.00 0.00 C ATOM 2357 O GLN B 42 -7.959 9.974 -14.009 1.00 0.00 O ATOM 2358 CB GLN B 42 -6.518 8.867 -16.704 1.00 0.00 C ATOM 2359 CG GLN B 42 -5.440 9.446 -17.609 1.00 0.00 C ATOM 2360 CD GLN B 42 -4.053 8.910 -17.299 1.00 0.00 C ATOM 2361 OE1 GLN B 42 -3.524 9.123 -16.208 1.00 0.00 O ATOM 2362 NE2 GLN B 42 -3.459 8.214 -18.259 1.00 0.00 N ATOM 0 H GLN B 42 -5.294 7.052 -15.531 1.00 0.00 H new ATOM 0 HA GLN B 42 -5.643 9.852 -15.003 1.00 0.00 H new ATOM 0 HB2 GLN B 42 -6.695 7.829 -16.985 1.00 0.00 H new ATOM 0 HB3 GLN B 42 -7.449 9.407 -16.874 1.00 0.00 H new ATOM 0 HG2 GLN B 42 -5.686 9.222 -18.647 1.00 0.00 H new ATOM 0 HG3 GLN B 42 -5.434 10.531 -17.510 1.00 0.00 H new ATOM 0 HE21 GLN B 42 -3.935 8.062 -19.148 1.00 0.00 H new ATOM 0 HE22 GLN B 42 -2.526 7.831 -18.108 1.00 0.00 H new ATOM 2371 N TRP B 43 -7.963 7.732 -14.101 1.00 0.00 N ATOM 2372 CA TRP B 43 -9.176 7.615 -13.313 1.00 0.00 C ATOM 2373 C TRP B 43 -8.987 8.200 -11.929 1.00 0.00 C ATOM 2374 O TRP B 43 -9.753 9.056 -11.502 1.00 0.00 O ATOM 2375 CB TRP B 43 -9.604 6.166 -13.175 1.00 0.00 C ATOM 2376 CG TRP B 43 -10.323 5.599 -14.360 1.00 0.00 C ATOM 2377 CD1 TRP B 43 -10.341 4.286 -14.693 1.00 0.00 C ATOM 2378 CD2 TRP B 43 -11.133 6.278 -15.355 1.00 0.00 C ATOM 2379 NE1 TRP B 43 -11.073 4.094 -15.824 1.00 0.00 N ATOM 2380 CE2 TRP B 43 -11.574 5.287 -16.252 1.00 0.00 C ATOM 2381 CE3 TRP B 43 -11.532 7.608 -15.594 1.00 0.00 C ATOM 2382 CZ2 TRP B 43 -12.378 5.570 -17.353 1.00 0.00 C ATOM 2383 CZ3 TRP B 43 -12.332 7.881 -16.687 1.00 0.00 C ATOM 2384 CH2 TRP B 43 -12.746 6.867 -17.554 1.00 0.00 C ATOM 0 H TRP B 43 -7.561 6.844 -14.401 1.00 0.00 H new ATOM 0 HA TRP B 43 -9.950 8.172 -13.840 1.00 0.00 H new ATOM 0 HB2 TRP B 43 -8.719 5.559 -12.982 1.00 0.00 H new ATOM 0 HB3 TRP B 43 -10.249 6.076 -12.301 1.00 0.00 H new ATOM 0 HD1 TRP B 43 -9.845 3.503 -14.139 1.00 0.00 H new ATOM 0 HE1 TRP B 43 -11.224 3.195 -16.281 1.00 0.00 H new ATOM 0 HE3 TRP B 43 -11.217 8.402 -14.933 1.00 0.00 H new ATOM 0 HZ2 TRP B 43 -12.699 4.788 -18.025 1.00 0.00 H new ATOM 0 HZ3 TRP B 43 -12.643 8.898 -16.875 1.00 0.00 H new ATOM 0 HH2 TRP B 43 -13.370 7.115 -18.400 1.00 0.00 H new ATOM 2395 N THR B 44 -7.959 7.735 -11.229 1.00 0.00 N ATOM 2396 CA THR B 44 -7.689 8.211 -9.878 1.00 0.00 C ATOM 2397 C THR B 44 -7.582 9.737 -9.842 1.00 0.00 C ATOM 2398 O THR B 44 -7.860 10.367 -8.822 1.00 0.00 O ATOM 2399 CB THR B 44 -6.429 7.536 -9.319 1.00 0.00 C ATOM 2400 OG1 THR B 44 -6.463 7.515 -7.907 1.00 0.00 O ATOM 2401 CG2 THR B 44 -5.130 8.189 -9.739 1.00 0.00 C ATOM 0 H THR B 44 -7.303 7.033 -11.572 1.00 0.00 H new ATOM 0 HA THR B 44 -8.527 7.937 -9.238 1.00 0.00 H new ATOM 0 HB THR B 44 -6.445 6.530 -9.739 1.00 0.00 H new ATOM 0 HG1 THR B 44 -6.704 8.404 -7.572 1.00 0.00 H new ATOM 0 HG21 THR B 44 -4.292 7.648 -9.299 1.00 0.00 H new ATOM 0 HG22 THR B 44 -5.046 8.167 -10.826 1.00 0.00 H new ATOM 0 HG23 THR B 44 -5.115 9.223 -9.395 1.00 0.00 H new ATOM 2409 N SER B 45 -7.225 10.325 -10.979 1.00 0.00 N ATOM 2410 CA SER B 45 -7.144 11.770 -11.081 1.00 0.00 C ATOM 2411 C SER B 45 -8.565 12.314 -11.088 1.00 0.00 C ATOM 2412 O SER B 45 -8.872 13.311 -10.435 1.00 0.00 O ATOM 2413 CB SER B 45 -6.383 12.188 -12.339 1.00 0.00 C ATOM 2414 OG SER B 45 -5.214 12.917 -12.007 1.00 0.00 O ATOM 0 H SER B 45 -6.989 9.824 -11.835 1.00 0.00 H new ATOM 0 HA SER B 45 -6.594 12.178 -10.233 1.00 0.00 H new ATOM 0 HB2 SER B 45 -6.113 11.303 -12.916 1.00 0.00 H new ATOM 0 HB3 SER B 45 -7.028 12.797 -12.973 1.00 0.00 H new ATOM 0 HG SER B 45 -4.743 13.172 -12.828 1.00 0.00 H new ATOM 2420 N SER B 46 -9.441 11.604 -11.798 1.00 0.00 N ATOM 2421 CA SER B 46 -10.851 11.961 -11.851 1.00 0.00 C ATOM 2422 C SER B 46 -11.451 11.777 -10.468 1.00 0.00 C ATOM 2423 O SER B 46 -12.288 12.562 -10.029 1.00 0.00 O ATOM 2424 CB SER B 46 -11.590 11.101 -12.876 1.00 0.00 C ATOM 2425 OG SER B 46 -11.510 11.668 -14.172 1.00 0.00 O ATOM 0 H SER B 46 -9.195 10.778 -12.344 1.00 0.00 H new ATOM 0 HA SER B 46 -10.952 13.001 -12.161 1.00 0.00 H new ATOM 0 HB2 SER B 46 -11.164 10.098 -12.888 1.00 0.00 H new ATOM 0 HB3 SER B 46 -12.635 11.000 -12.584 1.00 0.00 H new ATOM 0 HG SER B 46 -11.989 11.098 -14.809 1.00 0.00 H new ATOM 2431 N CYS B 47 -10.969 10.752 -9.761 1.00 0.00 N ATOM 2432 CA CYS B 47 -11.403 10.476 -8.395 1.00 0.00 C ATOM 2433 C CYS B 47 -11.070 11.686 -7.542 1.00 0.00 C ATOM 2434 O CYS B 47 -11.843 12.097 -6.682 1.00 0.00 O ATOM 2435 CB CYS B 47 -10.674 9.220 -7.870 1.00 0.00 C ATOM 2436 SG CYS B 47 -10.488 9.089 -6.066 1.00 0.00 S ATOM 0 H CYS B 47 -10.273 10.097 -10.118 1.00 0.00 H new ATOM 0 HA CYS B 47 -12.476 10.288 -8.358 1.00 0.00 H new ATOM 0 HB2 CYS B 47 -11.212 8.340 -8.223 1.00 0.00 H new ATOM 0 HB3 CYS B 47 -9.681 9.188 -8.319 1.00 0.00 H new ATOM 0 HG CYS B 47 -9.636 9.979 -5.652 1.00 0.00 H new ATOM 2442 N LEU B 48 -9.899 12.240 -7.805 1.00 0.00 N ATOM 2443 CA LEU B 48 -9.428 13.396 -7.086 1.00 0.00 C ATOM 2444 C LEU B 48 -10.311 14.584 -7.360 1.00 0.00 C ATOM 2445 O LEU B 48 -10.594 15.363 -6.451 1.00 0.00 O ATOM 2446 CB LEU B 48 -7.972 13.678 -7.458 1.00 0.00 C ATOM 2447 CG LEU B 48 -6.914 13.011 -6.564 1.00 0.00 C ATOM 2448 CD1 LEU B 48 -7.452 11.734 -5.918 1.00 0.00 C ATOM 2449 CD2 LEU B 48 -5.652 12.715 -7.370 1.00 0.00 C ATOM 0 H LEU B 48 -9.256 11.899 -8.520 1.00 0.00 H new ATOM 0 HA LEU B 48 -9.473 13.198 -6.015 1.00 0.00 H new ATOM 0 HB2 LEU B 48 -7.809 13.353 -8.486 1.00 0.00 H new ATOM 0 HB3 LEU B 48 -7.813 14.756 -7.435 1.00 0.00 H new ATOM 0 HG LEU B 48 -6.665 13.706 -5.762 1.00 0.00 H new ATOM 0 HD11 LEU B 48 -6.678 11.289 -5.293 1.00 0.00 H new ATOM 0 HD12 LEU B 48 -8.320 11.975 -5.304 1.00 0.00 H new ATOM 0 HD13 LEU B 48 -7.742 11.027 -6.695 1.00 0.00 H new ATOM 0 HD21 LEU B 48 -4.911 12.243 -6.725 1.00 0.00 H new ATOM 0 HD22 LEU B 48 -5.896 12.045 -8.194 1.00 0.00 H new ATOM 0 HD23 LEU B 48 -5.247 13.646 -7.767 1.00 0.00 H new ATOM 2461 N GLU B 49 -10.783 14.708 -8.596 1.00 0.00 N ATOM 2462 CA GLU B 49 -11.677 15.803 -8.908 1.00 0.00 C ATOM 2463 C GLU B 49 -13.060 15.488 -8.380 1.00 0.00 C ATOM 2464 O GLU B 49 -13.769 16.359 -7.912 1.00 0.00 O ATOM 2465 CB GLU B 49 -11.760 16.121 -10.389 1.00 0.00 C ATOM 2466 CG GLU B 49 -12.482 17.438 -10.621 1.00 0.00 C ATOM 2467 CD GLU B 49 -12.942 17.617 -12.053 1.00 0.00 C ATOM 2468 OE1 GLU B 49 -13.908 16.936 -12.457 1.00 0.00 O ATOM 2469 OE2 GLU B 49 -12.336 18.438 -12.774 1.00 0.00 O ATOM 0 H GLU B 49 -10.567 14.083 -9.372 1.00 0.00 H new ATOM 0 HA GLU B 49 -11.265 16.689 -8.425 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -10.756 16.173 -10.811 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -12.283 15.318 -10.909 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -13.346 17.494 -9.958 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -11.820 18.261 -10.352 1.00 0.00 H new ATOM 2476 N HIS B 50 -13.431 14.224 -8.430 1.00 0.00 N ATOM 2477 CA HIS B 50 -14.727 13.805 -7.924 1.00 0.00 C ATOM 2478 C HIS B 50 -14.676 13.602 -6.404 1.00 0.00 C ATOM 2479 O HIS B 50 -15.688 13.273 -5.785 1.00 0.00 O ATOM 2480 CB HIS B 50 -15.169 12.514 -8.615 1.00 0.00 C ATOM 2481 CG HIS B 50 -15.679 12.722 -10.006 1.00 0.00 C ATOM 2482 ND1 HIS B 50 -16.961 13.146 -10.284 1.00 0.00 N ATOM 2483 CD2 HIS B 50 -15.069 12.561 -11.205 1.00 0.00 C ATOM 2484 CE1 HIS B 50 -17.118 13.235 -11.593 1.00 0.00 C ATOM 2485 NE2 HIS B 50 -15.985 12.887 -12.174 1.00 0.00 N ATOM 0 H HIS B 50 -12.859 13.472 -8.813 1.00 0.00 H new ATOM 0 HA HIS B 50 -15.452 14.589 -8.141 1.00 0.00 H new ATOM 0 HB2 HIS B 50 -14.327 11.822 -8.646 1.00 0.00 H new ATOM 0 HB3 HIS B 50 -15.949 12.041 -8.018 1.00 0.00 H new ATOM 0 HD2 HIS B 50 -14.052 12.237 -11.368 1.00 0.00 H new ATOM 0 HE1 HIS B 50 -18.020 13.541 -12.101 1.00 0.00 H new ATOM 0 HE2 HIS B 50 -15.817 12.864 -13.180 1.00 0.00 H new ATOM 2494 N CYS B 51 -13.505 13.840 -5.800 1.00 0.00 N ATOM 2495 CA CYS B 51 -13.349 13.725 -4.364 1.00 0.00 C ATOM 2496 C CYS B 51 -13.491 15.126 -3.805 1.00 0.00 C ATOM 2497 O CYS B 51 -14.309 15.398 -2.928 1.00 0.00 O ATOM 2498 CB CYS B 51 -11.973 13.130 -3.998 1.00 0.00 C ATOM 2499 SG CYS B 51 -11.727 12.918 -2.220 1.00 0.00 S ATOM 0 H CYS B 51 -12.656 14.114 -6.294 1.00 0.00 H new ATOM 0 HA CYS B 51 -14.099 13.053 -3.946 1.00 0.00 H new ATOM 0 HB2 CYS B 51 -11.862 12.164 -4.490 1.00 0.00 H new ATOM 0 HB3 CYS B 51 -11.190 13.779 -4.390 1.00 0.00 H new ATOM 0 HG CYS B 51 -12.494 11.962 -1.787 1.00 0.00 H new ATOM 2505 N ILE B 52 -12.703 16.020 -4.386 1.00 0.00 N ATOM 2506 CA ILE B 52 -12.719 17.430 -4.032 1.00 0.00 C ATOM 2507 C ILE B 52 -14.118 18.023 -4.211 1.00 0.00 C ATOM 2508 O ILE B 52 -14.624 18.715 -3.329 1.00 0.00 O ATOM 2509 CB ILE B 52 -11.712 18.214 -4.913 1.00 0.00 C ATOM 2510 CG1 ILE B 52 -11.803 19.735 -4.641 1.00 0.00 C ATOM 2511 CG2 ILE B 52 -11.930 17.889 -6.390 1.00 0.00 C ATOM 2512 CD1 ILE B 52 -11.783 20.609 -5.864 1.00 0.00 C ATOM 0 H ILE B 52 -12.033 15.786 -5.118 1.00 0.00 H new ATOM 0 HA ILE B 52 -12.432 17.517 -2.984 1.00 0.00 H new ATOM 0 HB ILE B 52 -10.702 17.900 -4.649 1.00 0.00 H new ATOM 0 HG12 ILE B 52 -12.721 19.934 -4.087 1.00 0.00 H new ATOM 0 HG13 ILE B 52 -10.973 20.022 -3.996 1.00 0.00 H new ATOM 0 HG21 ILE B 52 -11.215 18.447 -6.995 1.00 0.00 H new ATOM 0 HG22 ILE B 52 -11.786 16.821 -6.553 1.00 0.00 H new ATOM 0 HG23 ILE B 52 -12.944 18.167 -6.678 1.00 0.00 H new ATOM 0 HD11 ILE B 52 -11.851 21.655 -5.565 1.00 0.00 H new ATOM 0 HD12 ILE B 52 -10.854 20.448 -6.411 1.00 0.00 H new ATOM 0 HD13 ILE B 52 -12.629 20.359 -6.504 1.00 0.00 H new ATOM 2524 N LYS B 53 -14.723 17.762 -5.361 1.00 0.00 N ATOM 2525 CA LYS B 53 -16.043 18.287 -5.670 1.00 0.00 C ATOM 2526 C LYS B 53 -17.070 17.834 -4.648 1.00 0.00 C ATOM 2527 O LYS B 53 -18.006 18.566 -4.327 1.00 0.00 O ATOM 2528 CB LYS B 53 -16.429 17.871 -7.083 1.00 0.00 C ATOM 2529 CG LYS B 53 -15.463 18.415 -8.122 1.00 0.00 C ATOM 2530 CD LYS B 53 -15.720 19.867 -8.428 1.00 0.00 C ATOM 2531 CE LYS B 53 -15.020 20.791 -7.437 1.00 0.00 C ATOM 2532 NZ LYS B 53 -15.976 21.719 -6.774 1.00 0.00 N ATOM 0 H LYS B 53 -14.317 17.186 -6.099 1.00 0.00 H new ATOM 0 HA LYS B 53 -16.017 19.376 -5.621 1.00 0.00 H new ATOM 0 HB2 LYS B 53 -16.454 16.783 -7.146 1.00 0.00 H new ATOM 0 HB3 LYS B 53 -17.436 18.226 -7.303 1.00 0.00 H new ATOM 0 HG2 LYS B 53 -14.441 18.296 -7.764 1.00 0.00 H new ATOM 0 HG3 LYS B 53 -15.550 17.831 -9.038 1.00 0.00 H new ATOM 0 HD2 LYS B 53 -15.377 20.091 -9.438 1.00 0.00 H new ATOM 0 HD3 LYS B 53 -16.793 20.058 -8.406 1.00 0.00 H new ATOM 0 HE2 LYS B 53 -14.510 20.194 -6.681 1.00 0.00 H new ATOM 0 HE3 LYS B 53 -14.255 21.368 -7.956 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 -15.467 22.563 -6.443 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 -16.712 22.002 -7.452 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 -16.418 21.241 -5.963 1.00 0.00 H new ATOM 2546 N ARG B 54 -16.868 16.644 -4.107 1.00 0.00 N ATOM 2547 CA ARG B 54 -17.762 16.126 -3.085 1.00 0.00 C ATOM 2548 C ARG B 54 -17.468 16.820 -1.761 1.00 0.00 C ATOM 2549 O ARG B 54 -18.373 17.081 -0.961 1.00 0.00 O ATOM 2550 CB ARG B 54 -17.601 14.609 -2.942 1.00 0.00 C ATOM 2551 CG ARG B 54 -18.695 13.811 -3.632 1.00 0.00 C ATOM 2552 CD ARG B 54 -20.084 14.248 -3.183 1.00 0.00 C ATOM 2553 NE ARG B 54 -20.783 15.003 -4.222 1.00 0.00 N ATOM 2554 CZ ARG B 54 -22.024 15.472 -4.096 1.00 0.00 C ATOM 2555 NH1 ARG B 54 -22.716 15.270 -2.979 1.00 0.00 N ATOM 2556 NH2 ARG B 54 -22.579 16.147 -5.094 1.00 0.00 N ATOM 0 H ARG B 54 -16.099 16.022 -4.356 1.00 0.00 H new ATOM 0 HA ARG B 54 -18.793 16.327 -3.377 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -16.635 14.315 -3.352 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -17.589 14.352 -1.883 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -18.607 13.932 -4.712 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -18.561 12.751 -3.418 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -20.672 13.370 -2.916 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -19.999 14.860 -2.285 1.00 0.00 H new ATOM 0 HE ARG B 54 -20.290 15.182 -5.097 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -22.298 14.751 -2.207 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -23.665 15.634 -2.894 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -22.056 16.306 -5.955 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -23.529 16.507 -5.000 1.00 0.00 H new ATOM 2570 N LEU B 55 -16.192 17.132 -1.544 1.00 0.00 N ATOM 2571 CA LEU B 55 -15.769 17.808 -0.327 1.00 0.00 C ATOM 2572 C LEU B 55 -16.277 19.243 -0.309 1.00 0.00 C ATOM 2573 O LEU B 55 -16.545 19.805 0.752 1.00 0.00 O ATOM 2574 CB LEU B 55 -14.248 17.770 -0.217 1.00 0.00 C ATOM 2575 CG LEU B 55 -13.677 16.370 -0.014 1.00 0.00 C ATOM 2576 CD1 LEU B 55 -12.162 16.373 -0.123 1.00 0.00 C ATOM 2577 CD2 LEU B 55 -14.123 15.819 1.324 1.00 0.00 C ATOM 0 H LEU B 55 -15.436 16.926 -2.197 1.00 0.00 H new ATOM 0 HA LEU B 55 -16.195 17.290 0.533 1.00 0.00 H new ATOM 0 HB2 LEU B 55 -13.817 18.200 -1.122 1.00 0.00 H new ATOM 0 HB3 LEU B 55 -13.938 18.402 0.615 1.00 0.00 H new ATOM 0 HG LEU B 55 -14.059 15.723 -0.804 1.00 0.00 H new ATOM 0 HD11 LEU B 55 -11.784 15.361 0.026 1.00 0.00 H new ATOM 0 HD12 LEU B 55 -11.869 16.728 -1.111 1.00 0.00 H new ATOM 0 HD13 LEU B 55 -11.744 17.032 0.638 1.00 0.00 H new ATOM 0 HD21 LEU B 55 -13.711 14.819 1.461 1.00 0.00 H new ATOM 0 HD22 LEU B 55 -13.768 16.471 2.122 1.00 0.00 H new ATOM 0 HD23 LEU B 55 -15.212 15.770 1.353 1.00 0.00 H new ATOM 2589 N THR B 56 -16.425 19.821 -1.494 1.00 0.00 N ATOM 2590 CA THR B 56 -16.923 21.181 -1.624 1.00 0.00 C ATOM 2591 C THR B 56 -18.426 21.196 -1.386 1.00 0.00 C ATOM 2592 O THR B 56 -18.967 22.129 -0.793 1.00 0.00 O ATOM 2593 CB THR B 56 -16.597 21.742 -3.010 1.00 0.00 C ATOM 2594 OG1 THR B 56 -17.520 21.268 -3.974 1.00 0.00 O ATOM 2595 CG2 THR B 56 -15.206 21.381 -3.488 1.00 0.00 C ATOM 0 H THR B 56 -16.206 19.366 -2.380 1.00 0.00 H new ATOM 0 HA THR B 56 -16.436 21.811 -0.880 1.00 0.00 H new ATOM 0 HB THR B 56 -16.659 22.825 -2.906 1.00 0.00 H new ATOM 0 HG1 THR B 56 -17.549 20.289 -3.946 1.00 0.00 H new ATOM 0 HG21 THR B 56 -15.038 21.809 -4.476 1.00 0.00 H new ATOM 0 HG22 THR B 56 -14.468 21.777 -2.791 1.00 0.00 H new ATOM 0 HG23 THR B 56 -15.110 20.297 -3.541 1.00 0.00 H new ATOM 2603 N ALA B 57 -19.091 20.134 -1.835 1.00 0.00 N ATOM 2604 CA ALA B 57 -20.527 20.001 -1.654 1.00 0.00 C ATOM 2605 C ALA B 57 -20.845 19.858 -0.173 1.00 0.00 C ATOM 2606 O ALA B 57 -21.812 20.433 0.327 1.00 0.00 O ATOM 2607 CB ALA B 57 -21.052 18.802 -2.432 1.00 0.00 C ATOM 0 H ALA B 57 -18.654 19.354 -2.327 1.00 0.00 H new ATOM 0 HA ALA B 57 -21.019 20.895 -2.037 1.00 0.00 H new ATOM 0 HB1 ALA B 57 -22.129 18.717 -2.286 1.00 0.00 H new ATOM 0 HB2 ALA B 57 -20.839 18.935 -3.493 1.00 0.00 H new ATOM 0 HB3 ALA B 57 -20.564 17.895 -2.075 1.00 0.00 H new ATOM 2613 N LEU B 58 -20.011 19.092 0.525 1.00 0.00 N ATOM 2614 CA LEU B 58 -20.178 18.877 1.951 1.00 0.00 C ATOM 2615 C LEU B 58 -19.705 20.100 2.737 1.00 0.00 C ATOM 2616 O LEU B 58 -20.240 20.412 3.800 1.00 0.00 O ATOM 2617 CB LEU B 58 -19.396 17.632 2.376 1.00 0.00 C ATOM 2618 CG LEU B 58 -20.239 16.365 2.542 1.00 0.00 C ATOM 2619 CD1 LEU B 58 -19.478 15.145 2.046 1.00 0.00 C ATOM 2620 CD2 LEU B 58 -20.645 16.186 3.997 1.00 0.00 C ATOM 0 H LEU B 58 -19.209 18.609 0.119 1.00 0.00 H new ATOM 0 HA LEU B 58 -21.236 18.725 2.166 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -18.619 17.439 1.636 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -18.893 17.842 3.320 1.00 0.00 H new ATOM 0 HG LEU B 58 -21.142 16.471 1.941 1.00 0.00 H new ATOM 0 HD11 LEU B 58 -20.095 14.255 2.173 1.00 0.00 H new ATOM 0 HD12 LEU B 58 -19.236 15.271 0.991 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -18.557 15.033 2.618 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -21.244 15.281 4.099 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -19.752 16.102 4.616 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -21.231 17.047 4.320 1.00 0.00 H new ATOM 2632 N ASN B 59 -18.694 20.786 2.196 1.00 0.00 N ATOM 2633 CA ASN B 59 -18.125 21.986 2.821 1.00 0.00 C ATOM 2634 C ASN B 59 -17.920 21.813 4.327 1.00 0.00 C ATOM 2635 O ASN B 59 -18.659 22.376 5.135 1.00 0.00 O ATOM 2636 CB ASN B 59 -19.015 23.204 2.547 1.00 0.00 C ATOM 2637 CG ASN B 59 -20.414 23.047 3.110 1.00 0.00 C ATOM 2638 OD1 ASN B 59 -20.699 23.479 4.227 1.00 0.00 O ATOM 2639 ND2 ASN B 59 -21.297 22.426 2.336 1.00 0.00 N ATOM 0 H ASN B 59 -18.248 20.527 1.316 1.00 0.00 H new ATOM 0 HA ASN B 59 -17.144 22.146 2.374 1.00 0.00 H new ATOM 0 HB2 ASN B 59 -18.552 24.091 2.979 1.00 0.00 H new ATOM 0 HB3 ASN B 59 -19.077 23.368 1.471 1.00 0.00 H new ATOM 0 HD21 ASN B 59 -22.254 22.291 2.661 1.00 0.00 H new ATOM 0 HD22 ASN B 59 -21.018 22.084 1.417 1.00 0.00 H new ATOM 2646 N LYS B 60 -16.908 21.032 4.698 1.00 0.00 N ATOM 2647 CA LYS B 60 -16.604 20.789 6.105 1.00 0.00 C ATOM 2648 C LYS B 60 -15.381 19.871 6.253 1.00 0.00 C ATOM 2649 O LYS B 60 -15.465 18.683 5.938 1.00 0.00 O ATOM 2650 CB LYS B 60 -17.810 20.159 6.807 1.00 0.00 C ATOM 2651 CG LYS B 60 -18.032 20.680 8.219 1.00 0.00 C ATOM 2652 CD LYS B 60 -19.055 21.803 8.243 1.00 0.00 C ATOM 2653 CE LYS B 60 -19.250 22.349 9.649 1.00 0.00 C ATOM 2654 NZ LYS B 60 -20.591 22.973 9.822 1.00 0.00 N ATOM 0 H LYS B 60 -16.285 20.557 4.044 1.00 0.00 H new ATOM 0 HA LYS B 60 -16.376 21.748 6.570 1.00 0.00 H new ATOM 0 HB2 LYS B 60 -18.705 20.348 6.214 1.00 0.00 H new ATOM 0 HB3 LYS B 60 -17.675 19.078 6.844 1.00 0.00 H new ATOM 0 HG2 LYS B 60 -18.369 19.865 8.860 1.00 0.00 H new ATOM 0 HG3 LYS B 60 -17.087 21.038 8.629 1.00 0.00 H new ATOM 0 HD2 LYS B 60 -18.731 22.606 7.581 1.00 0.00 H new ATOM 0 HD3 LYS B 60 -20.007 21.438 7.858 1.00 0.00 H new ATOM 0 HE2 LYS B 60 -19.129 21.542 10.372 1.00 0.00 H new ATOM 0 HE3 LYS B 60 -18.476 23.086 9.863 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 -20.684 23.333 10.793 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 -20.697 23.760 9.150 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 -21.330 22.263 9.644 1.00 0.00 H new ATOM 2668 N PRO B 61 -14.221 20.387 6.731 1.00 0.00 N ATOM 2669 CA PRO B 61 -14.045 21.792 7.128 1.00 0.00 C ATOM 2670 C PRO B 61 -13.943 22.740 5.917 1.00 0.00 C ATOM 2671 O PRO B 61 -14.962 23.241 5.441 1.00 0.00 O ATOM 2672 CB PRO B 61 -12.753 21.775 7.946 1.00 0.00 C ATOM 2673 CG PRO B 61 -11.984 20.601 7.441 1.00 0.00 C ATOM 2674 CD PRO B 61 -12.987 19.605 6.918 1.00 0.00 C ATOM 0 HA PRO B 61 -14.899 22.171 7.690 1.00 0.00 H new ATOM 0 HB2 PRO B 61 -12.191 22.700 7.814 1.00 0.00 H new ATOM 0 HB3 PRO B 61 -12.963 21.679 9.011 1.00 0.00 H new ATOM 0 HG2 PRO B 61 -11.294 20.903 6.653 1.00 0.00 H new ATOM 0 HG3 PRO B 61 -11.385 20.161 8.238 1.00 0.00 H new ATOM 0 HD2 PRO B 61 -12.653 19.161 5.980 1.00 0.00 H new ATOM 0 HD3 PRO B 61 -13.138 18.787 7.622 1.00 0.00 H new ATOM 2682 N PHE B 62 -12.725 22.991 5.420 1.00 0.00 N ATOM 2683 CA PHE B 62 -12.537 23.878 4.278 1.00 0.00 C ATOM 2684 C PHE B 62 -11.412 23.378 3.375 1.00 0.00 C ATOM 2685 O PHE B 62 -11.638 23.048 2.210 1.00 0.00 O ATOM 2686 CB PHE B 62 -12.229 25.297 4.756 1.00 0.00 C ATOM 2687 CG PHE B 62 -12.525 26.355 3.733 1.00 0.00 C ATOM 2688 CD1 PHE B 62 -13.761 26.408 3.109 1.00 0.00 C ATOM 2689 CD2 PHE B 62 -11.567 27.298 3.395 1.00 0.00 C ATOM 2690 CE1 PHE B 62 -14.036 27.381 2.167 1.00 0.00 C ATOM 2691 CE2 PHE B 62 -11.836 28.273 2.453 1.00 0.00 C ATOM 2692 CZ PHE B 62 -13.073 28.315 1.839 1.00 0.00 C ATOM 0 H PHE B 62 -11.863 22.592 5.792 1.00 0.00 H new ATOM 0 HA PHE B 62 -13.462 23.887 3.702 1.00 0.00 H new ATOM 0 HB2 PHE B 62 -12.809 25.502 5.656 1.00 0.00 H new ATOM 0 HB3 PHE B 62 -11.177 25.357 5.034 1.00 0.00 H new ATOM 0 HD1 PHE B 62 -14.518 25.681 3.362 1.00 0.00 H new ATOM 0 HD2 PHE B 62 -10.599 27.271 3.873 1.00 0.00 H new ATOM 0 HE1 PHE B 62 -15.003 27.411 1.688 1.00 0.00 H new ATOM 0 HE2 PHE B 62 -11.080 29.001 2.197 1.00 0.00 H new ATOM 0 HZ PHE B 62 -13.286 29.077 1.104 1.00 0.00 H new ATOM 2702 N LYS B 63 -10.198 23.333 3.919 1.00 0.00 N ATOM 2703 CA LYS B 63 -9.034 22.882 3.160 1.00 0.00 C ATOM 2704 C LYS B 63 -8.973 21.358 3.094 1.00 0.00 C ATOM 2705 O LYS B 63 -8.681 20.691 4.091 1.00 0.00 O ATOM 2706 CB LYS B 63 -7.749 23.427 3.788 1.00 0.00 C ATOM 2707 CG LYS B 63 -6.509 23.181 2.943 1.00 0.00 C ATOM 2708 CD LYS B 63 -5.470 24.271 3.150 1.00 0.00 C ATOM 2709 CE LYS B 63 -4.058 23.732 2.984 1.00 0.00 C ATOM 2710 NZ LYS B 63 -3.108 24.356 3.945 1.00 0.00 N ATOM 0 H LYS B 63 -9.995 23.603 4.881 1.00 0.00 H new ATOM 0 HA LYS B 63 -9.129 23.264 2.144 1.00 0.00 H new ATOM 0 HB2 LYS B 63 -7.860 24.499 3.952 1.00 0.00 H new ATOM 0 HB3 LYS B 63 -7.609 22.968 4.767 1.00 0.00 H new ATOM 0 HG2 LYS B 63 -6.079 22.213 3.199 1.00 0.00 H new ATOM 0 HG3 LYS B 63 -6.787 23.137 1.890 1.00 0.00 H new ATOM 0 HD2 LYS B 63 -5.639 25.077 2.436 1.00 0.00 H new ATOM 0 HD3 LYS B 63 -5.583 24.699 4.146 1.00 0.00 H new ATOM 0 HE2 LYS B 63 -4.063 22.652 3.128 1.00 0.00 H new ATOM 0 HE3 LYS B 63 -3.717 23.916 1.965 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 -2.172 23.913 3.845 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 -3.032 25.374 3.747 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 -3.455 24.217 4.916 1.00 0.00 H new ATOM 2724 N TYR B 64 -9.249 20.811 1.913 1.00 0.00 N ATOM 2725 CA TYR B 64 -9.226 19.367 1.718 1.00 0.00 C ATOM 2726 C TYR B 64 -8.166 18.966 0.692 1.00 0.00 C ATOM 2727 O TYR B 64 -8.100 19.531 -0.400 1.00 0.00 O ATOM 2728 CB TYR B 64 -10.604 18.878 1.263 1.00 0.00 C ATOM 2729 CG TYR B 64 -11.448 18.314 2.383 1.00 0.00 C ATOM 2730 CD1 TYR B 64 -11.022 17.210 3.108 1.00 0.00 C ATOM 2731 CD2 TYR B 64 -12.672 18.882 2.709 1.00 0.00 C ATOM 2732 CE1 TYR B 64 -11.791 16.688 4.130 1.00 0.00 C ATOM 2733 CE2 TYR B 64 -13.447 18.366 3.730 1.00 0.00 C ATOM 2734 CZ TYR B 64 -13.003 17.269 4.437 1.00 0.00 C ATOM 2735 OH TYR B 64 -13.772 16.752 5.454 1.00 0.00 O ATOM 0 H TYR B 64 -9.491 21.346 1.079 1.00 0.00 H new ATOM 0 HA TYR B 64 -8.972 18.900 2.670 1.00 0.00 H new ATOM 0 HB2 TYR B 64 -11.139 19.706 0.799 1.00 0.00 H new ATOM 0 HB3 TYR B 64 -10.474 18.113 0.497 1.00 0.00 H new ATOM 0 HD1 TYR B 64 -10.074 16.751 2.869 1.00 0.00 H new ATOM 0 HD2 TYR B 64 -13.024 19.740 2.156 1.00 0.00 H new ATOM 0 HE1 TYR B 64 -11.445 15.829 4.686 1.00 0.00 H new ATOM 0 HE2 TYR B 64 -14.396 18.820 3.973 1.00 0.00 H new ATOM 0 HH TYR B 64 -14.521 17.357 5.638 1.00 0.00 H new ATOM 2745 N VAL B 65 -7.354 17.974 1.047 1.00 0.00 N ATOM 2746 CA VAL B 65 -6.311 17.479 0.156 1.00 0.00 C ATOM 2747 C VAL B 65 -6.680 16.084 -0.333 1.00 0.00 C ATOM 2748 O VAL B 65 -7.105 15.244 0.453 1.00 0.00 O ATOM 2749 CB VAL B 65 -4.913 17.483 0.860 1.00 0.00 C ATOM 2750 CG1 VAL B 65 -4.204 16.121 0.869 1.00 0.00 C ATOM 2751 CG2 VAL B 65 -3.999 18.485 0.217 1.00 0.00 C ATOM 0 H VAL B 65 -7.399 17.497 1.947 1.00 0.00 H new ATOM 0 HA VAL B 65 -6.236 18.145 -0.703 1.00 0.00 H new ATOM 0 HB VAL B 65 -5.124 17.747 1.896 1.00 0.00 H new ATOM 0 HG11 VAL B 65 -3.243 16.214 1.376 1.00 0.00 H new ATOM 0 HG12 VAL B 65 -4.822 15.393 1.394 1.00 0.00 H new ATOM 0 HG13 VAL B 65 -4.043 15.788 -0.156 1.00 0.00 H new ATOM 0 HG21 VAL B 65 -3.033 18.472 0.721 1.00 0.00 H new ATOM 0 HG22 VAL B 65 -3.863 18.232 -0.834 1.00 0.00 H new ATOM 0 HG23 VAL B 65 -4.436 19.480 0.297 1.00 0.00 H new ATOM 2761 N VAL B 66 -6.509 15.840 -1.622 1.00 0.00 N ATOM 2762 CA VAL B 66 -6.819 14.533 -2.180 1.00 0.00 C ATOM 2763 C VAL B 66 -5.707 14.037 -3.093 1.00 0.00 C ATOM 2764 O VAL B 66 -5.472 14.606 -4.155 1.00 0.00 O ATOM 2765 CB VAL B 66 -8.143 14.529 -2.967 1.00 0.00 C ATOM 2766 CG1 VAL B 66 -8.668 13.110 -3.070 1.00 0.00 C ATOM 2767 CG2 VAL B 66 -9.181 15.441 -2.320 1.00 0.00 C ATOM 0 H VAL B 66 -6.161 16.522 -2.296 1.00 0.00 H new ATOM 0 HA VAL B 66 -6.918 13.863 -1.326 1.00 0.00 H new ATOM 0 HB VAL B 66 -7.950 14.916 -3.968 1.00 0.00 H new ATOM 0 HG11 VAL B 66 -9.605 13.108 -3.627 1.00 0.00 H new ATOM 0 HG12 VAL B 66 -7.937 12.488 -3.587 1.00 0.00 H new ATOM 0 HG13 VAL B 66 -8.840 12.712 -2.070 1.00 0.00 H new ATOM 0 HG21 VAL B 66 -10.102 15.414 -2.902 1.00 0.00 H new ATOM 0 HG22 VAL B 66 -9.383 15.100 -1.305 1.00 0.00 H new ATOM 0 HG23 VAL B 66 -8.801 16.462 -2.291 1.00 0.00 H new ATOM 2777 N THR B 67 -5.033 12.965 -2.691 1.00 0.00 N ATOM 2778 CA THR B 67 -3.965 12.396 -3.510 1.00 0.00 C ATOM 2779 C THR B 67 -4.069 10.881 -3.572 1.00 0.00 C ATOM 2780 O THR B 67 -4.450 10.227 -2.602 1.00 0.00 O ATOM 2781 CB THR B 67 -2.586 12.815 -3.003 1.00 0.00 C ATOM 2782 OG1 THR B 67 -1.567 12.078 -3.657 1.00 0.00 O ATOM 2783 CG2 THR B 67 -2.410 12.620 -1.519 1.00 0.00 C ATOM 0 H THR B 67 -5.203 12.476 -1.812 1.00 0.00 H new ATOM 0 HA THR B 67 -4.087 12.791 -4.519 1.00 0.00 H new ATOM 0 HB THR B 67 -2.509 13.880 -3.224 1.00 0.00 H new ATOM 0 HG1 THR B 67 -1.732 12.077 -4.623 1.00 0.00 H new ATOM 0 HG21 THR B 67 -1.409 12.937 -1.227 1.00 0.00 H new ATOM 0 HG22 THR B 67 -3.150 13.215 -0.984 1.00 0.00 H new ATOM 0 HG23 THR B 67 -2.543 11.567 -1.272 1.00 0.00 H new ATOM 2791 N CYS B 68 -3.741 10.337 -4.737 1.00 0.00 N ATOM 2792 CA CYS B 68 -3.805 8.902 -4.961 1.00 0.00 C ATOM 2793 C CYS B 68 -2.493 8.370 -5.522 1.00 0.00 C ATOM 2794 O CYS B 68 -1.738 9.096 -6.167 1.00 0.00 O ATOM 2795 CB CYS B 68 -4.937 8.582 -5.933 1.00 0.00 C ATOM 2796 SG CYS B 68 -6.581 8.599 -5.191 1.00 0.00 S ATOM 0 H CYS B 68 -3.426 10.874 -5.545 1.00 0.00 H new ATOM 0 HA CYS B 68 -3.990 8.419 -4.001 1.00 0.00 H new ATOM 0 HB2 CYS B 68 -4.913 9.303 -6.750 1.00 0.00 H new ATOM 0 HB3 CYS B 68 -4.758 7.599 -6.369 1.00 0.00 H new ATOM 0 HG CYS B 68 -7.376 7.836 -5.881 1.00 0.00 H new ATOM 2802 N ILE B 69 -2.237 7.093 -5.281 1.00 0.00 N ATOM 2803 CA ILE B 69 -1.030 6.441 -5.769 1.00 0.00 C ATOM 2804 C ILE B 69 -1.378 5.029 -6.250 1.00 0.00 C ATOM 2805 O ILE B 69 -1.894 4.214 -5.486 1.00 0.00 O ATOM 2806 CB ILE B 69 0.065 6.397 -4.667 1.00 0.00 C ATOM 2807 CG1 ILE B 69 0.574 7.807 -4.365 1.00 0.00 C ATOM 2808 CG2 ILE B 69 1.230 5.494 -5.056 1.00 0.00 C ATOM 2809 CD1 ILE B 69 0.973 8.006 -2.920 1.00 0.00 C ATOM 0 H ILE B 69 -2.855 6.483 -4.746 1.00 0.00 H new ATOM 0 HA ILE B 69 -0.628 7.015 -6.604 1.00 0.00 H new ATOM 0 HB ILE B 69 -0.394 5.979 -3.771 1.00 0.00 H new ATOM 0 HG12 ILE B 69 1.431 8.020 -5.003 1.00 0.00 H new ATOM 0 HG13 ILE B 69 -0.202 8.528 -4.622 1.00 0.00 H new ATOM 0 HG21 ILE B 69 1.972 5.493 -4.257 1.00 0.00 H new ATOM 0 HG22 ILE B 69 0.866 4.479 -5.215 1.00 0.00 H new ATOM 0 HG23 ILE B 69 1.686 5.864 -5.974 1.00 0.00 H new ATOM 0 HD11 ILE B 69 1.324 9.028 -2.777 1.00 0.00 H new ATOM 0 HD12 ILE B 69 0.112 7.825 -2.277 1.00 0.00 H new ATOM 0 HD13 ILE B 69 1.771 7.309 -2.664 1.00 0.00 H new ATOM 2821 N ILE B 70 -1.109 4.757 -7.524 1.00 0.00 N ATOM 2822 CA ILE B 70 -1.415 3.453 -8.103 1.00 0.00 C ATOM 2823 C ILE B 70 -0.187 2.551 -8.161 1.00 0.00 C ATOM 2824 O ILE B 70 0.917 3.000 -8.471 1.00 0.00 O ATOM 2825 CB ILE B 70 -2.007 3.593 -9.521 1.00 0.00 C ATOM 2826 CG1 ILE B 70 -1.000 4.259 -10.467 1.00 0.00 C ATOM 2827 CG2 ILE B 70 -3.307 4.385 -9.473 1.00 0.00 C ATOM 2828 CD1 ILE B 70 -0.331 3.287 -11.414 1.00 0.00 C ATOM 0 H ILE B 70 -0.682 5.419 -8.172 1.00 0.00 H new ATOM 0 HA ILE B 70 -2.154 2.993 -7.447 1.00 0.00 H new ATOM 0 HB ILE B 70 -2.222 2.596 -9.906 1.00 0.00 H new ATOM 0 HG12 ILE B 70 -1.511 5.027 -11.048 1.00 0.00 H new ATOM 0 HG13 ILE B 70 -0.236 4.763 -9.876 1.00 0.00 H new ATOM 0 HG21 ILE B 70 -3.715 4.477 -10.480 1.00 0.00 H new ATOM 0 HG22 ILE B 70 -4.025 3.868 -8.837 1.00 0.00 H new ATOM 0 HG23 ILE B 70 -3.113 5.378 -9.068 1.00 0.00 H new ATOM 0 HD11 ILE B 70 0.368 3.825 -12.054 1.00 0.00 H new ATOM 0 HD12 ILE B 70 0.208 2.533 -10.841 1.00 0.00 H new ATOM 0 HD13 ILE B 70 -1.087 2.801 -12.031 1.00 0.00 H new ATOM 2840 N MET B 71 -0.397 1.273 -7.866 1.00 0.00 N ATOM 2841 CA MET B 71 0.676 0.288 -7.887 1.00 0.00 C ATOM 2842 C MET B 71 0.327 -0.862 -8.827 1.00 0.00 C ATOM 2843 O MET B 71 -0.647 -1.584 -8.606 1.00 0.00 O ATOM 2844 CB MET B 71 0.935 -0.248 -6.478 1.00 0.00 C ATOM 2845 CG MET B 71 1.489 0.796 -5.522 1.00 0.00 C ATOM 2846 SD MET B 71 0.201 1.594 -4.544 1.00 0.00 S ATOM 2847 CE MET B 71 0.129 0.503 -3.126 1.00 0.00 C ATOM 0 H MET B 71 -1.308 0.894 -7.608 1.00 0.00 H new ATOM 0 HA MET B 71 1.581 0.775 -8.250 1.00 0.00 H new ATOM 0 HB2 MET B 71 0.004 -0.643 -6.072 1.00 0.00 H new ATOM 0 HB3 MET B 71 1.635 -1.081 -6.538 1.00 0.00 H new ATOM 0 HG2 MET B 71 2.209 0.325 -4.853 1.00 0.00 H new ATOM 0 HG3 MET B 71 2.030 1.553 -6.090 1.00 0.00 H new ATOM 0 HE1 MET B 71 -0.625 0.864 -2.427 1.00 0.00 H new ATOM 0 HE2 MET B 71 -0.133 -0.503 -3.454 1.00 0.00 H new ATOM 0 HE3 MET B 71 1.101 0.482 -2.633 1.00 0.00 H new ATOM 2857 N GLN B 72 1.126 -1.025 -9.878 1.00 0.00 N ATOM 2858 CA GLN B 72 0.904 -2.084 -10.858 1.00 0.00 C ATOM 2859 C GLN B 72 0.902 -3.457 -10.193 1.00 0.00 C ATOM 2860 O GLN B 72 1.534 -3.655 -9.155 1.00 0.00 O ATOM 2861 CB GLN B 72 1.980 -2.033 -11.945 1.00 0.00 C ATOM 2862 CG GLN B 72 1.482 -2.470 -13.314 1.00 0.00 C ATOM 2863 CD GLN B 72 2.476 -2.166 -14.418 1.00 0.00 C ATOM 2864 OE1 GLN B 72 3.454 -1.449 -14.209 1.00 0.00 O ATOM 2865 NE2 GLN B 72 2.227 -2.711 -15.603 1.00 0.00 N ATOM 0 H GLN B 72 1.935 -0.435 -10.073 1.00 0.00 H new ATOM 0 HA GLN B 72 -0.073 -1.922 -11.312 1.00 0.00 H new ATOM 0 HB2 GLN B 72 2.366 -1.016 -12.015 1.00 0.00 H new ATOM 0 HB3 GLN B 72 2.813 -2.671 -11.650 1.00 0.00 H new ATOM 0 HG2 GLN B 72 1.278 -3.541 -13.298 1.00 0.00 H new ATOM 0 HG3 GLN B 72 0.539 -1.969 -13.531 1.00 0.00 H new ATOM 0 HE21 GLN B 72 1.404 -3.299 -15.731 1.00 0.00 H new ATOM 0 HE22 GLN B 72 2.859 -2.541 -16.385 1.00 0.00 H new ATOM 2874 N LYS B 73 0.186 -4.402 -10.797 1.00 0.00 N ATOM 2875 CA LYS B 73 0.099 -5.759 -10.263 1.00 0.00 C ATOM 2876 C LYS B 73 1.483 -6.384 -10.116 1.00 0.00 C ATOM 2877 O LYS B 73 1.979 -7.041 -11.030 1.00 0.00 O ATOM 2878 CB LYS B 73 -0.768 -6.633 -11.172 1.00 0.00 C ATOM 2879 CG LYS B 73 -1.504 -7.736 -10.430 1.00 0.00 C ATOM 2880 CD LYS B 73 -0.613 -8.948 -10.208 1.00 0.00 C ATOM 2881 CE LYS B 73 -0.858 -9.577 -8.846 1.00 0.00 C ATOM 2882 NZ LYS B 73 -0.773 -11.063 -8.898 1.00 0.00 N ATOM 0 H LYS B 73 -0.343 -4.253 -11.657 1.00 0.00 H new ATOM 0 HA LYS B 73 -0.359 -5.700 -9.276 1.00 0.00 H new ATOM 0 HB2 LYS B 73 -1.495 -6.002 -11.683 1.00 0.00 H new ATOM 0 HB3 LYS B 73 -0.138 -7.081 -11.941 1.00 0.00 H new ATOM 0 HG2 LYS B 73 -1.854 -7.359 -9.469 1.00 0.00 H new ATOM 0 HG3 LYS B 73 -2.387 -8.031 -10.997 1.00 0.00 H new ATOM 0 HD2 LYS B 73 -0.798 -9.685 -10.989 1.00 0.00 H new ATOM 0 HD3 LYS B 73 0.433 -8.652 -10.291 1.00 0.00 H new ATOM 0 HE2 LYS B 73 -0.127 -9.196 -8.133 1.00 0.00 H new ATOM 0 HE3 LYS B 73 -1.842 -9.282 -8.481 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 -0.946 -11.454 -7.950 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 -1.488 -11.429 -9.559 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 0.174 -11.345 -9.221 1.00 0.00 H new ATOM 2896 N ASN B 74 2.099 -6.176 -8.958 1.00 0.00 N ATOM 2897 CA ASN B 74 3.424 -6.719 -8.688 1.00 0.00 C ATOM 2898 C ASN B 74 3.818 -6.488 -7.233 1.00 0.00 C ATOM 2899 O ASN B 74 4.011 -5.350 -6.804 1.00 0.00 O ATOM 2900 CB ASN B 74 4.461 -6.088 -9.620 1.00 0.00 C ATOM 2901 CG ASN B 74 4.585 -4.589 -9.422 1.00 0.00 C ATOM 2902 OD1 ASN B 74 3.857 -3.808 -10.032 1.00 0.00 O ATOM 2903 ND2 ASN B 74 5.514 -4.181 -8.564 1.00 0.00 N ATOM 0 H ASN B 74 1.701 -5.635 -8.191 1.00 0.00 H new ATOM 0 HA ASN B 74 3.393 -7.793 -8.871 1.00 0.00 H new ATOM 0 HB2 ASN B 74 5.431 -6.555 -9.448 1.00 0.00 H new ATOM 0 HB3 ASN B 74 4.187 -6.293 -10.655 1.00 0.00 H new ATOM 0 HD21 ASN B 74 5.645 -3.185 -8.390 1.00 0.00 H new ATOM 0 HD22 ASN B 74 6.096 -4.864 -8.080 1.00 0.00 H new ATOM 2910 N GLY B 75 3.933 -7.575 -6.478 1.00 0.00 N ATOM 2911 CA GLY B 75 4.302 -7.471 -5.079 1.00 0.00 C ATOM 2912 C GLY B 75 5.702 -6.923 -4.887 1.00 0.00 C ATOM 2913 O GLY B 75 6.661 -7.683 -4.760 1.00 0.00 O ATOM 0 H GLY B 75 3.777 -8.527 -6.810 1.00 0.00 H new ATOM 0 HA2 GLY B 75 3.589 -6.826 -4.566 1.00 0.00 H new ATOM 0 HA3 GLY B 75 4.233 -8.455 -4.614 1.00 0.00 H new ATOM 2917 N ALA B 76 5.818 -5.599 -4.865 1.00 0.00 N ATOM 2918 CA ALA B 76 7.109 -4.946 -4.688 1.00 0.00 C ATOM 2919 C ALA B 76 7.153 -4.166 -3.378 1.00 0.00 C ATOM 2920 O ALA B 76 6.176 -3.524 -2.993 1.00 0.00 O ATOM 2921 CB ALA B 76 7.400 -4.023 -5.862 1.00 0.00 C ATOM 0 H ALA B 76 5.032 -4.957 -4.968 1.00 0.00 H new ATOM 0 HA ALA B 76 7.877 -5.719 -4.649 1.00 0.00 H new ATOM 0 HB1 ALA B 76 8.367 -3.542 -5.716 1.00 0.00 H new ATOM 0 HB2 ALA B 76 7.419 -4.603 -6.785 1.00 0.00 H new ATOM 0 HB3 ALA B 76 6.623 -3.262 -5.928 1.00 0.00 H new ATOM 2927 N GLY B 77 8.293 -4.226 -2.696 1.00 0.00 N ATOM 2928 CA GLY B 77 8.441 -3.522 -1.437 1.00 0.00 C ATOM 2929 C GLY B 77 8.381 -2.016 -1.602 1.00 0.00 C ATOM 2930 O GLY B 77 9.309 -1.405 -2.131 1.00 0.00 O ATOM 0 H GLY B 77 9.116 -4.750 -2.994 1.00 0.00 H new ATOM 0 HA2 GLY B 77 7.655 -3.841 -0.752 1.00 0.00 H new ATOM 0 HA3 GLY B 77 9.392 -3.796 -0.981 1.00 0.00 H new ATOM 2934 N LEU B 78 7.285 -1.416 -1.147 1.00 0.00 N ATOM 2935 CA LEU B 78 7.106 0.029 -1.245 1.00 0.00 C ATOM 2936 C LEU B 78 6.870 0.641 0.132 1.00 0.00 C ATOM 2937 O LEU B 78 5.848 0.387 0.769 1.00 0.00 O ATOM 2938 CB LEU B 78 5.929 0.355 -2.167 1.00 0.00 C ATOM 2939 CG LEU B 78 5.914 1.784 -2.714 1.00 0.00 C ATOM 2940 CD1 LEU B 78 6.842 1.907 -3.912 1.00 0.00 C ATOM 2941 CD2 LEU B 78 4.498 2.193 -3.090 1.00 0.00 C ATOM 0 H LEU B 78 6.507 -1.908 -0.707 1.00 0.00 H new ATOM 0 HA LEU B 78 8.017 0.457 -1.663 1.00 0.00 H new ATOM 0 HB2 LEU B 78 5.941 -0.340 -3.007 1.00 0.00 H new ATOM 0 HB3 LEU B 78 5.001 0.180 -1.623 1.00 0.00 H new ATOM 0 HG LEU B 78 6.272 2.456 -1.934 1.00 0.00 H new ATOM 0 HD11 LEU B 78 6.818 2.930 -4.287 1.00 0.00 H new ATOM 0 HD12 LEU B 78 7.859 1.654 -3.612 1.00 0.00 H new ATOM 0 HD13 LEU B 78 6.515 1.225 -4.697 1.00 0.00 H new ATOM 0 HD21 LEU B 78 4.504 3.212 -3.477 1.00 0.00 H new ATOM 0 HD22 LEU B 78 4.115 1.517 -3.854 1.00 0.00 H new ATOM 0 HD23 LEU B 78 3.859 2.144 -2.208 1.00 0.00 H new ATOM 2953 N HIS B 79 7.824 1.447 0.586 1.00 0.00 N ATOM 2954 CA HIS B 79 7.722 2.097 1.889 1.00 0.00 C ATOM 2955 C HIS B 79 7.642 3.612 1.738 1.00 0.00 C ATOM 2956 O HIS B 79 8.237 4.188 0.827 1.00 0.00 O ATOM 2957 CB HIS B 79 8.918 1.721 2.765 1.00 0.00 C ATOM 2958 CG HIS B 79 8.677 0.516 3.622 1.00 0.00 C ATOM 2959 ND1 HIS B 79 9.533 -0.565 3.659 1.00 0.00 N ATOM 2960 CD2 HIS B 79 7.669 0.225 4.477 1.00 0.00 C ATOM 2961 CE1 HIS B 79 9.061 -1.469 4.499 1.00 0.00 C ATOM 2962 NE2 HIS B 79 7.932 -1.013 5.009 1.00 0.00 N ATOM 0 H HIS B 79 8.677 1.666 0.071 1.00 0.00 H new ATOM 0 HA HIS B 79 6.807 1.751 2.369 1.00 0.00 H new ATOM 0 HB2 HIS B 79 9.782 1.536 2.126 1.00 0.00 H new ATOM 0 HB3 HIS B 79 9.170 2.567 3.404 1.00 0.00 H new ATOM 0 HD2 HIS B 79 6.817 0.850 4.699 1.00 0.00 H new ATOM 0 HE1 HIS B 79 9.520 -2.419 4.729 1.00 0.00 H new ATOM 0 HE2 HIS B 79 7.349 -1.502 5.689 1.00 0.00 H new ATOM 2971 N THR B 80 6.903 4.252 2.638 1.00 0.00 N ATOM 2972 CA THR B 80 6.742 5.701 2.609 1.00 0.00 C ATOM 2973 C THR B 80 7.140 6.321 3.945 1.00 0.00 C ATOM 2974 O THR B 80 7.062 5.674 4.988 1.00 0.00 O ATOM 2975 CB THR B 80 5.296 6.068 2.275 1.00 0.00 C ATOM 2976 OG1 THR B 80 4.836 5.328 1.157 1.00 0.00 O ATOM 2977 CG2 THR B 80 5.108 7.537 1.962 1.00 0.00 C ATOM 0 H THR B 80 6.405 3.789 3.398 1.00 0.00 H new ATOM 0 HA THR B 80 7.399 6.098 1.835 1.00 0.00 H new ATOM 0 HB THR B 80 4.723 5.828 3.171 1.00 0.00 H new ATOM 0 HG1 THR B 80 3.908 5.576 0.960 1.00 0.00 H new ATOM 0 HG21 THR B 80 4.060 7.729 1.734 1.00 0.00 H new ATOM 0 HG22 THR B 80 5.407 8.134 2.824 1.00 0.00 H new ATOM 0 HG23 THR B 80 5.722 7.807 1.103 1.00 0.00 H new ATOM 2985 N ALA B 81 7.562 7.581 3.904 1.00 0.00 N ATOM 2986 CA ALA B 81 7.965 8.294 5.110 1.00 0.00 C ATOM 2987 C ALA B 81 7.442 9.719 5.072 1.00 0.00 C ATOM 2988 O ALA B 81 7.325 10.313 4.001 1.00 0.00 O ATOM 2989 CB ALA B 81 9.480 8.288 5.253 1.00 0.00 C ATOM 0 H ALA B 81 7.634 8.129 3.047 1.00 0.00 H new ATOM 0 HA ALA B 81 7.538 7.786 5.975 1.00 0.00 H new ATOM 0 HB1 ALA B 81 9.762 8.825 6.159 1.00 0.00 H new ATOM 0 HB2 ALA B 81 9.836 7.259 5.315 1.00 0.00 H new ATOM 0 HB3 ALA B 81 9.929 8.775 4.388 1.00 0.00 H new ATOM 2995 N ALA B 82 7.115 10.268 6.235 1.00 0.00 N ATOM 2996 CA ALA B 82 6.597 11.624 6.290 1.00 0.00 C ATOM 2997 C ALA B 82 6.759 12.259 7.661 1.00 0.00 C ATOM 2998 O ALA B 82 6.580 11.614 8.694 1.00 0.00 O ATOM 2999 CB ALA B 82 5.145 11.641 5.863 1.00 0.00 C ATOM 0 H ALA B 82 7.198 9.802 7.138 1.00 0.00 H new ATOM 0 HA ALA B 82 7.187 12.224 5.597 1.00 0.00 H new ATOM 0 HB1 ALA B 82 4.765 12.662 5.907 1.00 0.00 H new ATOM 0 HB2 ALA B 82 5.061 11.266 4.843 1.00 0.00 H new ATOM 0 HB3 ALA B 82 4.562 11.007 6.531 1.00 0.00 H new ATOM 3005 N SER B 83 7.090 13.542 7.645 1.00 0.00 N ATOM 3006 CA SER B 83 7.276 14.316 8.858 1.00 0.00 C ATOM 3007 C SER B 83 6.770 15.735 8.642 1.00 0.00 C ATOM 3008 O SER B 83 7.284 16.463 7.793 1.00 0.00 O ATOM 3009 CB SER B 83 8.754 14.336 9.244 1.00 0.00 C ATOM 3010 OG SER B 83 8.928 14.737 10.591 1.00 0.00 O ATOM 0 H SER B 83 7.237 14.074 6.787 1.00 0.00 H new ATOM 0 HA SER B 83 6.710 13.856 9.668 1.00 0.00 H new ATOM 0 HB2 SER B 83 9.184 13.345 9.099 1.00 0.00 H new ATOM 0 HB3 SER B 83 9.295 15.017 8.587 1.00 0.00 H new ATOM 0 HG SER B 83 9.883 14.739 10.811 1.00 0.00 H new ATOM 3016 N CYS B 84 5.756 16.122 9.403 1.00 0.00 N ATOM 3017 CA CYS B 84 5.178 17.452 9.277 1.00 0.00 C ATOM 3018 C CYS B 84 5.448 18.287 10.519 1.00 0.00 C ATOM 3019 O CYS B 84 5.725 17.753 11.593 1.00 0.00 O ATOM 3020 CB CYS B 84 3.676 17.361 9.032 1.00 0.00 C ATOM 3021 SG CYS B 84 3.196 16.131 7.794 1.00 0.00 S ATOM 0 H CYS B 84 5.317 15.535 10.113 1.00 0.00 H new ATOM 0 HA CYS B 84 5.650 17.940 8.424 1.00 0.00 H new ATOM 0 HB2 CYS B 84 3.180 17.125 9.973 1.00 0.00 H new ATOM 0 HB3 CYS B 84 3.311 18.338 8.716 1.00 0.00 H new ATOM 0 HG CYS B 84 1.903 16.131 7.661 1.00 0.00 H new ATOM 3027 N TRP B 85 5.362 19.601 10.364 1.00 0.00 N ATOM 3028 CA TRP B 85 5.595 20.513 11.472 1.00 0.00 C ATOM 3029 C TRP B 85 4.375 20.526 12.398 1.00 0.00 C ATOM 3030 O TRP B 85 3.608 19.563 12.422 1.00 0.00 O ATOM 3031 CB TRP B 85 5.887 21.916 10.932 1.00 0.00 C ATOM 3032 CG TRP B 85 7.001 22.602 11.657 1.00 0.00 C ATOM 3033 CD1 TRP B 85 8.313 22.233 11.660 1.00 0.00 C ATOM 3034 CD2 TRP B 85 6.907 23.769 12.481 1.00 0.00 C ATOM 3035 NE1 TRP B 85 9.044 23.096 12.436 1.00 0.00 N ATOM 3036 CE2 TRP B 85 8.204 24.048 12.952 1.00 0.00 C ATOM 3037 CE3 TRP B 85 5.855 24.604 12.868 1.00 0.00 C ATOM 3038 CZ2 TRP B 85 8.476 25.129 13.788 1.00 0.00 C ATOM 3039 CZ3 TRP B 85 6.127 25.675 13.699 1.00 0.00 C ATOM 3040 CH2 TRP B 85 7.428 25.929 14.150 1.00 0.00 C ATOM 0 H TRP B 85 5.133 20.058 9.481 1.00 0.00 H new ATOM 0 HA TRP B 85 6.458 20.178 12.047 1.00 0.00 H new ATOM 0 HB2 TRP B 85 6.138 21.847 9.874 1.00 0.00 H new ATOM 0 HB3 TRP B 85 4.985 22.523 11.006 1.00 0.00 H new ATOM 0 HD1 TRP B 85 8.718 21.385 11.129 1.00 0.00 H new ATOM 0 HE1 TRP B 85 10.049 23.039 12.602 1.00 0.00 H new ATOM 0 HE3 TRP B 85 4.849 24.416 12.524 1.00 0.00 H new ATOM 0 HZ2 TRP B 85 9.478 25.328 14.137 1.00 0.00 H new ATOM 0 HZ3 TRP B 85 5.322 26.327 14.005 1.00 0.00 H new ATOM 0 HH2 TRP B 85 7.607 26.775 14.797 1.00 0.00 H new ATOM 3051 N TRP B 86 4.192 21.600 13.164 1.00 0.00 N ATOM 3052 CA TRP B 86 3.059 21.684 14.077 1.00 0.00 C ATOM 3053 C TRP B 86 1.825 22.233 13.367 1.00 0.00 C ATOM 3054 O TRP B 86 1.911 23.193 12.600 1.00 0.00 O ATOM 3055 CB TRP B 86 3.409 22.568 15.275 1.00 0.00 C ATOM 3056 CG TRP B 86 4.071 21.820 16.392 1.00 0.00 C ATOM 3057 CD1 TRP B 86 4.802 20.670 16.293 1.00 0.00 C ATOM 3058 CD2 TRP B 86 4.061 22.170 17.780 1.00 0.00 C ATOM 3059 NE1 TRP B 86 5.245 20.285 17.534 1.00 0.00 N ATOM 3060 CE2 TRP B 86 4.804 21.190 18.464 1.00 0.00 C ATOM 3061 CE3 TRP B 86 3.497 23.219 18.511 1.00 0.00 C ATOM 3062 CZ2 TRP B 86 4.997 21.228 19.843 1.00 0.00 C ATOM 3063 CZ3 TRP B 86 3.688 23.256 19.879 1.00 0.00 C ATOM 3064 CH2 TRP B 86 4.433 22.266 20.533 1.00 0.00 C ATOM 0 H TRP B 86 4.807 22.414 13.170 1.00 0.00 H new ATOM 0 HA TRP B 86 2.833 20.678 14.430 1.00 0.00 H new ATOM 0 HB2 TRP B 86 4.068 23.371 14.945 1.00 0.00 H new ATOM 0 HB3 TRP B 86 2.499 23.036 15.650 1.00 0.00 H new ATOM 0 HD1 TRP B 86 5.002 20.141 15.373 1.00 0.00 H new ATOM 0 HE1 TRP B 86 5.811 19.459 17.732 1.00 0.00 H new ATOM 0 HE3 TRP B 86 2.922 23.987 18.015 1.00 0.00 H new ATOM 0 HZ2 TRP B 86 5.571 20.466 20.349 1.00 0.00 H new ATOM 0 HZ3 TRP B 86 3.256 24.062 20.454 1.00 0.00 H new ATOM 0 HH2 TRP B 86 4.565 22.323 21.603 1.00 0.00 H new ATOM 3075 N ASP B 87 0.677 21.613 13.634 1.00 0.00 N ATOM 3076 CA ASP B 87 -0.589 22.024 13.030 1.00 0.00 C ATOM 3077 C ASP B 87 -1.716 21.093 13.469 1.00 0.00 C ATOM 3078 O ASP B 87 -2.052 20.137 12.772 1.00 0.00 O ATOM 3079 CB ASP B 87 -0.485 22.031 11.500 1.00 0.00 C ATOM 3080 CG ASP B 87 -1.204 23.212 10.878 1.00 0.00 C ATOM 3081 OD1 ASP B 87 -2.107 23.771 11.536 1.00 0.00 O ATOM 3082 OD2 ASP B 87 -0.866 23.576 9.733 1.00 0.00 O ATOM 0 H ASP B 87 0.598 20.819 14.269 1.00 0.00 H new ATOM 0 HA ASP B 87 -0.812 23.036 13.369 1.00 0.00 H new ATOM 0 HB2 ASP B 87 0.565 22.055 11.210 1.00 0.00 H new ATOM 0 HB3 ASP B 87 -0.904 21.105 11.106 1.00 0.00 H new ATOM 3087 N SER B 88 -2.291 21.374 14.632 1.00 0.00 N ATOM 3088 CA SER B 88 -3.376 20.556 15.169 1.00 0.00 C ATOM 3089 C SER B 88 -4.732 20.920 14.557 1.00 0.00 C ATOM 3090 O SER B 88 -5.759 20.369 14.954 1.00 0.00 O ATOM 3091 CB SER B 88 -3.440 20.702 16.690 1.00 0.00 C ATOM 3092 OG SER B 88 -3.993 19.544 17.291 1.00 0.00 O ATOM 0 H SER B 88 -2.025 22.162 15.223 1.00 0.00 H new ATOM 0 HA SER B 88 -3.162 19.520 14.905 1.00 0.00 H new ATOM 0 HB2 SER B 88 -2.439 20.877 17.084 1.00 0.00 H new ATOM 0 HB3 SER B 88 -4.042 21.573 16.950 1.00 0.00 H new ATOM 0 HG SER B 88 -4.810 19.286 16.814 1.00 0.00 H new ATOM 3098 N THR B 89 -4.746 21.850 13.600 1.00 0.00 N ATOM 3099 CA THR B 89 -5.994 22.266 12.967 1.00 0.00 C ATOM 3100 C THR B 89 -6.112 21.716 11.543 1.00 0.00 C ATOM 3101 O THR B 89 -7.125 21.116 11.181 1.00 0.00 O ATOM 3102 CB THR B 89 -6.109 23.800 12.964 1.00 0.00 C ATOM 3103 OG1 THR B 89 -7.076 24.233 12.025 1.00 0.00 O ATOM 3104 CG2 THR B 89 -4.814 24.517 12.644 1.00 0.00 C ATOM 0 H THR B 89 -3.914 22.325 13.250 1.00 0.00 H new ATOM 0 HA THR B 89 -6.817 21.853 13.550 1.00 0.00 H new ATOM 0 HB THR B 89 -6.397 24.055 13.984 1.00 0.00 H new ATOM 0 HG1 THR B 89 -7.133 25.211 12.042 1.00 0.00 H new ATOM 0 HG21 THR B 89 -4.980 25.594 12.662 1.00 0.00 H new ATOM 0 HG22 THR B 89 -4.060 24.254 13.385 1.00 0.00 H new ATOM 0 HG23 THR B 89 -4.469 24.220 11.654 1.00 0.00 H new ATOM 3112 N THR B 90 -5.077 21.915 10.738 1.00 0.00 N ATOM 3113 CA THR B 90 -5.078 21.441 9.375 1.00 0.00 C ATOM 3114 C THR B 90 -4.613 19.995 9.316 1.00 0.00 C ATOM 3115 O THR B 90 -5.144 19.188 8.564 1.00 0.00 O ATOM 3116 CB THR B 90 -4.160 22.324 8.518 1.00 0.00 C ATOM 3117 OG1 THR B 90 -2.802 21.987 8.729 1.00 0.00 O ATOM 3118 CG2 THR B 90 -4.311 23.806 8.795 1.00 0.00 C ATOM 0 H THR B 90 -4.226 22.405 11.014 1.00 0.00 H new ATOM 0 HA THR B 90 -6.094 21.495 8.985 1.00 0.00 H new ATOM 0 HB THR B 90 -4.463 22.133 7.488 1.00 0.00 H new ATOM 0 HG1 THR B 90 -2.275 22.806 8.840 1.00 0.00 H new ATOM 0 HG21 THR B 90 -3.632 24.367 8.153 1.00 0.00 H new ATOM 0 HG22 THR B 90 -5.337 24.111 8.592 1.00 0.00 H new ATOM 0 HG23 THR B 90 -4.073 24.007 9.839 1.00 0.00 H new ATOM 3126 N ASP B 91 -3.600 19.666 10.087 1.00 0.00 N ATOM 3127 CA ASP B 91 -3.073 18.318 10.050 1.00 0.00 C ATOM 3128 C ASP B 91 -4.075 17.263 10.508 1.00 0.00 C ATOM 3129 O ASP B 91 -4.599 17.306 11.622 1.00 0.00 O ATOM 3130 CB ASP B 91 -1.775 18.212 10.850 1.00 0.00 C ATOM 3131 CG ASP B 91 -0.814 17.197 10.262 1.00 0.00 C ATOM 3132 OD1 ASP B 91 -0.429 17.358 9.085 1.00 0.00 O ATOM 3133 OD2 ASP B 91 -0.446 16.244 10.979 1.00 0.00 O ATOM 0 H ASP B 91 -3.132 20.299 10.736 1.00 0.00 H new ATOM 0 HA ASP B 91 -2.861 18.108 9.002 1.00 0.00 H new ATOM 0 HB2 ASP B 91 -1.292 19.188 10.884 1.00 0.00 H new ATOM 0 HB3 ASP B 91 -2.007 17.935 11.878 1.00 0.00 H new ATOM 3138 N GLY B 92 -4.300 16.298 9.617 1.00 0.00 N ATOM 3139 CA GLY B 92 -5.198 15.190 9.877 1.00 0.00 C ATOM 3140 C GLY B 92 -4.764 13.972 9.084 1.00 0.00 C ATOM 3141 O GLY B 92 -4.271 12.997 9.649 1.00 0.00 O ATOM 0 H GLY B 92 -3.861 16.269 8.697 1.00 0.00 H new ATOM 0 HA2 GLY B 92 -5.203 14.958 10.942 1.00 0.00 H new ATOM 0 HA3 GLY B 92 -6.217 15.466 9.606 1.00 0.00 H new ATOM 3145 N SER B 93 -4.903 14.068 7.762 1.00 0.00 N ATOM 3146 CA SER B 93 -4.486 13.012 6.837 1.00 0.00 C ATOM 3147 C SER B 93 -5.092 11.641 7.144 1.00 0.00 C ATOM 3148 O SER B 93 -4.979 11.122 8.252 1.00 0.00 O ATOM 3149 CB SER B 93 -2.961 12.902 6.831 1.00 0.00 C ATOM 3150 OG SER B 93 -2.366 14.086 6.330 1.00 0.00 O ATOM 0 H SER B 93 -5.309 14.882 7.300 1.00 0.00 H new ATOM 0 HA SER B 93 -4.861 13.304 5.856 1.00 0.00 H new ATOM 0 HB2 SER B 93 -2.603 12.712 7.843 1.00 0.00 H new ATOM 0 HB3 SER B 93 -2.657 12.052 6.220 1.00 0.00 H new ATOM 0 HG SER B 93 -2.535 14.155 5.367 1.00 0.00 H new ATOM 3156 N ARG B 94 -5.707 11.046 6.122 1.00 0.00 N ATOM 3157 CA ARG B 94 -6.301 9.717 6.246 1.00 0.00 C ATOM 3158 C ARG B 94 -6.227 8.982 4.905 1.00 0.00 C ATOM 3159 O ARG B 94 -6.929 9.333 3.957 1.00 0.00 O ATOM 3160 CB ARG B 94 -7.750 9.812 6.737 1.00 0.00 C ATOM 3161 CG ARG B 94 -8.016 8.994 7.990 1.00 0.00 C ATOM 3162 CD ARG B 94 -7.754 9.801 9.252 1.00 0.00 C ATOM 3163 NE ARG B 94 -7.291 8.958 10.354 1.00 0.00 N ATOM 3164 CZ ARG B 94 -6.025 8.575 10.525 1.00 0.00 C ATOM 3165 NH1 ARG B 94 -5.080 8.951 9.670 1.00 0.00 N ATOM 3166 NH2 ARG B 94 -5.701 7.809 11.559 1.00 0.00 N ATOM 0 H ARG B 94 -5.806 11.465 5.197 1.00 0.00 H new ATOM 0 HA ARG B 94 -5.735 9.150 6.985 1.00 0.00 H new ATOM 0 HB2 ARG B 94 -7.991 10.856 6.935 1.00 0.00 H new ATOM 0 HB3 ARG B 94 -8.418 9.476 5.944 1.00 0.00 H new ATOM 0 HG2 ARG B 94 -9.050 8.648 7.987 1.00 0.00 H new ATOM 0 HG3 ARG B 94 -7.383 8.107 7.987 1.00 0.00 H new ATOM 0 HD2 ARG B 94 -7.008 10.568 9.044 1.00 0.00 H new ATOM 0 HD3 ARG B 94 -8.667 10.317 9.549 1.00 0.00 H new ATOM 0 HE ARG B 94 -7.981 8.643 11.036 1.00 0.00 H new ATOM 0 HH11 ARG B 94 -5.319 9.539 8.872 1.00 0.00 H new ATOM 0 HH12 ARG B 94 -4.115 8.651 9.812 1.00 0.00 H new ATOM 0 HH21 ARG B 94 -6.419 7.515 12.221 1.00 0.00 H new ATOM 0 HH22 ARG B 94 -4.734 7.515 11.692 1.00 0.00 H new ATOM 3180 N THR B 95 -5.355 7.974 4.826 1.00 0.00 N ATOM 3181 CA THR B 95 -5.177 7.210 3.593 1.00 0.00 C ATOM 3182 C THR B 95 -6.091 5.986 3.540 1.00 0.00 C ATOM 3183 O THR B 95 -6.453 5.423 4.573 1.00 0.00 O ATOM 3184 CB THR B 95 -3.716 6.792 3.420 1.00 0.00 C ATOM 3185 OG1 THR B 95 -3.497 6.251 2.128 1.00 0.00 O ATOM 3186 CG2 THR B 95 -3.262 5.764 4.423 1.00 0.00 C ATOM 0 H THR B 95 -4.764 7.670 5.600 1.00 0.00 H new ATOM 0 HA THR B 95 -5.456 7.864 2.767 1.00 0.00 H new ATOM 0 HB THR B 95 -3.140 7.705 3.573 1.00 0.00 H new ATOM 0 HG1 THR B 95 -4.214 6.541 1.526 1.00 0.00 H new ATOM 0 HG21 THR B 95 -2.217 5.515 4.241 1.00 0.00 H new ATOM 0 HG22 THR B 95 -3.369 6.167 5.430 1.00 0.00 H new ATOM 0 HG23 THR B 95 -3.872 4.866 4.325 1.00 0.00 H new ATOM 3194 N VAL B 96 -6.462 5.586 2.324 1.00 0.00 N ATOM 3195 CA VAL B 96 -7.339 4.435 2.125 1.00 0.00 C ATOM 3196 C VAL B 96 -6.826 3.544 0.996 1.00 0.00 C ATOM 3197 O VAL B 96 -6.802 3.956 -0.162 1.00 0.00 O ATOM 3198 CB VAL B 96 -8.776 4.888 1.785 1.00 0.00 C ATOM 3199 CG1 VAL B 96 -9.719 3.698 1.685 1.00 0.00 C ATOM 3200 CG2 VAL B 96 -9.280 5.892 2.809 1.00 0.00 C ATOM 0 H VAL B 96 -6.168 6.044 1.461 1.00 0.00 H new ATOM 0 HA VAL B 96 -7.346 3.871 3.058 1.00 0.00 H new ATOM 0 HB VAL B 96 -8.751 5.376 0.811 1.00 0.00 H new ATOM 0 HG11 VAL B 96 -10.723 4.048 1.445 1.00 0.00 H new ATOM 0 HG12 VAL B 96 -9.373 3.024 0.901 1.00 0.00 H new ATOM 0 HG13 VAL B 96 -9.738 3.168 2.637 1.00 0.00 H new ATOM 0 HG21 VAL B 96 -10.294 6.198 2.550 1.00 0.00 H new ATOM 0 HG22 VAL B 96 -9.280 5.434 3.798 1.00 0.00 H new ATOM 0 HG23 VAL B 96 -8.628 6.765 2.814 1.00 0.00 H new ATOM 3210 N ARG B 97 -6.426 2.321 1.331 1.00 0.00 N ATOM 3211 CA ARG B 97 -5.929 1.391 0.323 1.00 0.00 C ATOM 3212 C ARG B 97 -7.096 0.718 -0.395 1.00 0.00 C ATOM 3213 O ARG B 97 -7.783 -0.123 0.176 1.00 0.00 O ATOM 3214 CB ARG B 97 -5.024 0.338 0.971 1.00 0.00 C ATOM 3215 CG ARG B 97 -3.724 0.108 0.218 1.00 0.00 C ATOM 3216 CD ARG B 97 -2.683 1.158 0.569 1.00 0.00 C ATOM 3217 NE ARG B 97 -2.205 1.016 1.944 1.00 0.00 N ATOM 3218 CZ ARG B 97 -1.292 0.123 2.329 1.00 0.00 C ATOM 3219 NH1 ARG B 97 -0.752 -0.714 1.451 1.00 0.00 N ATOM 3220 NH2 ARG B 97 -0.918 0.069 3.600 1.00 0.00 N ATOM 0 H ARG B 97 -6.436 1.954 2.283 1.00 0.00 H new ATOM 0 HA ARG B 97 -5.344 1.949 -0.409 1.00 0.00 H new ATOM 0 HB2 ARG B 97 -4.794 0.646 1.991 1.00 0.00 H new ATOM 0 HB3 ARG B 97 -5.567 -0.605 1.038 1.00 0.00 H new ATOM 0 HG2 ARG B 97 -3.336 -0.883 0.454 1.00 0.00 H new ATOM 0 HG3 ARG B 97 -3.915 0.128 -0.855 1.00 0.00 H new ATOM 0 HD2 ARG B 97 -1.841 1.077 -0.118 1.00 0.00 H new ATOM 0 HD3 ARG B 97 -3.110 2.152 0.434 1.00 0.00 H new ATOM 0 HE ARG B 97 -2.594 1.638 2.652 1.00 0.00 H new ATOM 0 HH11 ARG B 97 -1.035 -0.678 0.472 1.00 0.00 H new ATOM 0 HH12 ARG B 97 -0.055 -1.393 1.756 1.00 0.00 H new ATOM 0 HH21 ARG B 97 -1.328 0.709 4.280 1.00 0.00 H new ATOM 0 HH22 ARG B 97 -0.220 -0.613 3.898 1.00 0.00 H new ATOM 3234 N TRP B 98 -7.301 1.105 -1.651 1.00 0.00 N ATOM 3235 CA TRP B 98 -8.381 0.570 -2.476 1.00 0.00 C ATOM 3236 C TRP B 98 -7.804 -0.264 -3.622 1.00 0.00 C ATOM 3237 O TRP B 98 -6.974 0.216 -4.390 1.00 0.00 O ATOM 3238 CB TRP B 98 -9.190 1.751 -3.035 1.00 0.00 C ATOM 3239 CG TRP B 98 -10.651 1.800 -2.664 1.00 0.00 C ATOM 3240 CD1 TRP B 98 -11.622 2.402 -3.405 1.00 0.00 C ATOM 3241 CD2 TRP B 98 -11.311 1.275 -1.495 1.00 0.00 C ATOM 3242 NE1 TRP B 98 -12.841 2.284 -2.791 1.00 0.00 N ATOM 3243 CE2 TRP B 98 -12.682 1.594 -1.619 1.00 0.00 C ATOM 3244 CE3 TRP B 98 -10.895 0.567 -0.362 1.00 0.00 C ATOM 3245 CZ2 TRP B 98 -13.623 1.229 -0.662 1.00 0.00 C ATOM 3246 CZ3 TRP B 98 -11.834 0.208 0.586 1.00 0.00 C ATOM 3247 CH2 TRP B 98 -13.183 0.537 0.431 1.00 0.00 C ATOM 0 H TRP B 98 -6.723 1.798 -2.126 1.00 0.00 H new ATOM 0 HA TRP B 98 -9.025 -0.074 -1.878 1.00 0.00 H new ATOM 0 HB2 TRP B 98 -8.721 2.676 -2.698 1.00 0.00 H new ATOM 0 HB3 TRP B 98 -9.114 1.733 -4.122 1.00 0.00 H new ATOM 0 HD1 TRP B 98 -11.454 2.903 -4.347 1.00 0.00 H new ATOM 0 HE1 TRP B 98 -13.723 2.650 -3.149 1.00 0.00 H new ATOM 0 HE3 TRP B 98 -9.856 0.305 -0.230 1.00 0.00 H new ATOM 0 HZ2 TRP B 98 -14.666 1.484 -0.779 1.00 0.00 H new ATOM 0 HZ3 TRP B 98 -11.519 -0.337 1.463 1.00 0.00 H new ATOM 0 HH2 TRP B 98 -13.892 0.239 1.190 1.00 0.00 H new ATOM 3258 N GLU B 99 -8.251 -1.509 -3.737 1.00 0.00 N ATOM 3259 CA GLU B 99 -7.774 -2.392 -4.797 1.00 0.00 C ATOM 3260 C GLU B 99 -8.944 -2.991 -5.564 1.00 0.00 C ATOM 3261 O GLU B 99 -10.082 -2.955 -5.099 1.00 0.00 O ATOM 3262 CB GLU B 99 -6.901 -3.509 -4.219 1.00 0.00 C ATOM 3263 CG GLU B 99 -5.924 -3.034 -3.155 1.00 0.00 C ATOM 3264 CD GLU B 99 -5.257 -4.182 -2.423 1.00 0.00 C ATOM 3265 OE1 GLU B 99 -5.971 -5.124 -2.018 1.00 0.00 O ATOM 3266 OE2 GLU B 99 -4.020 -4.138 -2.251 1.00 0.00 O ATOM 0 H GLU B 99 -8.940 -1.929 -3.113 1.00 0.00 H new ATOM 0 HA GLU B 99 -7.172 -1.798 -5.484 1.00 0.00 H new ATOM 0 HB2 GLU B 99 -7.545 -4.277 -3.791 1.00 0.00 H new ATOM 0 HB3 GLU B 99 -6.342 -3.977 -5.029 1.00 0.00 H new ATOM 0 HG2 GLU B 99 -5.160 -2.412 -3.620 1.00 0.00 H new ATOM 0 HG3 GLU B 99 -6.452 -2.407 -2.436 1.00 0.00 H new ATOM 3273 N ASN B 100 -8.659 -3.536 -6.744 1.00 0.00 N ATOM 3274 CA ASN B 100 -9.694 -4.138 -7.579 1.00 0.00 C ATOM 3275 C ASN B 100 -9.431 -5.625 -7.804 1.00 0.00 C ATOM 3276 O ASN B 100 -10.293 -6.460 -7.533 1.00 0.00 O ATOM 3277 CB ASN B 100 -9.789 -3.411 -8.925 1.00 0.00 C ATOM 3278 CG ASN B 100 -8.431 -3.148 -9.547 1.00 0.00 C ATOM 3279 OD1 ASN B 100 -7.523 -2.634 -8.892 1.00 0.00 O ATOM 3280 ND2 ASN B 100 -8.284 -3.501 -10.819 1.00 0.00 N ATOM 0 H ASN B 100 -7.721 -3.573 -7.143 1.00 0.00 H new ATOM 0 HA ASN B 100 -10.644 -4.037 -7.053 1.00 0.00 H new ATOM 0 HB2 ASN B 100 -10.390 -4.006 -9.613 1.00 0.00 H new ATOM 0 HB3 ASN B 100 -10.309 -2.464 -8.785 1.00 0.00 H new ATOM 0 HD21 ASN B 100 -7.392 -3.349 -11.291 1.00 0.00 H new ATOM 0 HD22 ASN B 100 -9.063 -3.924 -11.324 1.00 0.00 H new ATOM 3287 N LYS B 101 -8.241 -5.951 -8.306 1.00 0.00 N ATOM 3288 CA LYS B 101 -7.879 -7.341 -8.569 1.00 0.00 C ATOM 3289 C LYS B 101 -6.454 -7.442 -9.111 1.00 0.00 C ATOM 3290 O LYS B 101 -5.638 -8.208 -8.598 1.00 0.00 O ATOM 3291 CB LYS B 101 -8.865 -7.964 -9.567 1.00 0.00 C ATOM 3292 CG LYS B 101 -8.517 -9.389 -9.977 1.00 0.00 C ATOM 3293 CD LYS B 101 -7.729 -9.414 -11.277 1.00 0.00 C ATOM 3294 CE LYS B 101 -8.538 -8.846 -12.431 1.00 0.00 C ATOM 3295 NZ LYS B 101 -8.142 -9.446 -13.735 1.00 0.00 N ATOM 0 H LYS B 101 -7.514 -5.274 -8.538 1.00 0.00 H new ATOM 0 HA LYS B 101 -7.927 -7.889 -7.628 1.00 0.00 H new ATOM 0 HB2 LYS B 101 -9.863 -7.957 -9.128 1.00 0.00 H new ATOM 0 HB3 LYS B 101 -8.905 -7.340 -10.460 1.00 0.00 H new ATOM 0 HG2 LYS B 101 -7.935 -9.865 -9.188 1.00 0.00 H new ATOM 0 HG3 LYS B 101 -9.432 -9.970 -10.093 1.00 0.00 H new ATOM 0 HD2 LYS B 101 -6.811 -8.839 -11.158 1.00 0.00 H new ATOM 0 HD3 LYS B 101 -7.436 -10.439 -11.506 1.00 0.00 H new ATOM 0 HE2 LYS B 101 -9.598 -9.027 -12.255 1.00 0.00 H new ATOM 0 HE3 LYS B 101 -8.402 -7.765 -12.472 1.00 0.00 H new ATOM 0 HZ1 LYS B 101 -8.717 -9.032 -14.496 1.00 0.00 H new ATOM 0 HZ2 LYS B 101 -7.136 -9.251 -13.916 1.00 0.00 H new ATOM 0 HZ3 LYS B 101 -8.296 -10.474 -13.705 1.00 0.00 H new ATOM 3309 N SER B 102 -6.166 -6.673 -10.155 1.00 0.00 N ATOM 3310 CA SER B 102 -4.844 -6.686 -10.775 1.00 0.00 C ATOM 3311 C SER B 102 -4.161 -5.329 -10.646 1.00 0.00 C ATOM 3312 O SER B 102 -3.439 -4.900 -11.546 1.00 0.00 O ATOM 3313 CB SER B 102 -4.959 -7.074 -12.250 1.00 0.00 C ATOM 3314 OG SER B 102 -3.895 -7.925 -12.640 1.00 0.00 O ATOM 0 H SER B 102 -6.829 -6.032 -10.591 1.00 0.00 H new ATOM 0 HA SER B 102 -4.235 -7.424 -10.254 1.00 0.00 H new ATOM 0 HB2 SER B 102 -5.911 -7.575 -12.424 1.00 0.00 H new ATOM 0 HB3 SER B 102 -4.954 -6.175 -12.867 1.00 0.00 H new ATOM 0 HG SER B 102 -3.993 -8.159 -13.587 1.00 0.00 H new ATOM 3320 N MET B 103 -4.390 -4.656 -9.522 1.00 0.00 N ATOM 3321 CA MET B 103 -3.793 -3.346 -9.280 1.00 0.00 C ATOM 3322 C MET B 103 -4.198 -2.806 -7.912 1.00 0.00 C ATOM 3323 O MET B 103 -5.352 -2.929 -7.501 1.00 0.00 O ATOM 3324 CB MET B 103 -4.215 -2.356 -10.373 1.00 0.00 C ATOM 3325 CG MET B 103 -3.665 -0.948 -10.176 1.00 0.00 C ATOM 3326 SD MET B 103 -4.920 0.335 -10.377 1.00 0.00 S ATOM 3327 CE MET B 103 -6.199 -0.260 -9.274 1.00 0.00 C ATOM 0 H MET B 103 -4.984 -4.995 -8.765 1.00 0.00 H new ATOM 0 HA MET B 103 -2.709 -3.462 -9.301 1.00 0.00 H new ATOM 0 HB2 MET B 103 -3.882 -2.734 -11.340 1.00 0.00 H new ATOM 0 HB3 MET B 103 -5.303 -2.309 -10.407 1.00 0.00 H new ATOM 0 HG2 MET B 103 -3.230 -0.870 -9.180 1.00 0.00 H new ATOM 0 HG3 MET B 103 -2.859 -0.775 -10.890 1.00 0.00 H new ATOM 0 HE1 MET B 103 -6.709 0.588 -8.817 1.00 0.00 H new ATOM 0 HE2 MET B 103 -6.918 -0.854 -9.838 1.00 0.00 H new ATOM 0 HE3 MET B 103 -5.750 -0.876 -8.495 1.00 0.00 H new ATOM 3337 N TYR B 104 -3.244 -2.193 -7.220 1.00 0.00 N ATOM 3338 CA TYR B 104 -3.507 -1.616 -5.907 1.00 0.00 C ATOM 3339 C TYR B 104 -3.496 -0.096 -5.998 1.00 0.00 C ATOM 3340 O TYR B 104 -2.507 0.499 -6.419 1.00 0.00 O ATOM 3341 CB TYR B 104 -2.462 -2.088 -4.895 1.00 0.00 C ATOM 3342 CG TYR B 104 -2.264 -3.587 -4.884 1.00 0.00 C ATOM 3343 CD1 TYR B 104 -3.352 -4.451 -4.926 1.00 0.00 C ATOM 3344 CD2 TYR B 104 -0.991 -4.137 -4.833 1.00 0.00 C ATOM 3345 CE1 TYR B 104 -3.175 -5.821 -4.918 1.00 0.00 C ATOM 3346 CE2 TYR B 104 -0.805 -5.506 -4.824 1.00 0.00 C ATOM 3347 CZ TYR B 104 -1.900 -6.344 -4.866 1.00 0.00 C ATOM 3348 OH TYR B 104 -1.720 -7.707 -4.858 1.00 0.00 O ATOM 0 H TYR B 104 -2.284 -2.083 -7.546 1.00 0.00 H new ATOM 0 HA TYR B 104 -4.489 -1.947 -5.570 1.00 0.00 H new ATOM 0 HB2 TYR B 104 -1.510 -1.606 -5.117 1.00 0.00 H new ATOM 0 HB3 TYR B 104 -2.760 -1.762 -3.899 1.00 0.00 H new ATOM 0 HD1 TYR B 104 -4.352 -4.045 -4.966 1.00 0.00 H new ATOM 0 HD2 TYR B 104 -0.131 -3.484 -4.800 1.00 0.00 H new ATOM 0 HE1 TYR B 104 -4.031 -6.479 -4.952 1.00 0.00 H new ATOM 0 HE2 TYR B 104 0.193 -5.918 -4.784 1.00 0.00 H new ATOM 0 HH TYR B 104 -0.762 -7.910 -4.820 1.00 0.00 H new ATOM 3358 N CYS B 105 -4.603 0.530 -5.618 1.00 0.00 N ATOM 3359 CA CYS B 105 -4.710 1.982 -5.680 1.00 0.00 C ATOM 3360 C CYS B 105 -5.001 2.587 -4.312 1.00 0.00 C ATOM 3361 O CYS B 105 -6.105 2.459 -3.785 1.00 0.00 O ATOM 3362 CB CYS B 105 -5.808 2.387 -6.667 1.00 0.00 C ATOM 3363 SG CYS B 105 -5.975 4.174 -6.891 1.00 0.00 S ATOM 0 H CYS B 105 -5.435 0.058 -5.265 1.00 0.00 H new ATOM 0 HA CYS B 105 -3.749 2.368 -6.020 1.00 0.00 H new ATOM 0 HB2 CYS B 105 -5.600 1.928 -7.634 1.00 0.00 H new ATOM 0 HB3 CYS B 105 -6.760 1.984 -6.321 1.00 0.00 H new ATOM 0 HG CYS B 105 -6.926 4.417 -7.744 1.00 0.00 H new ATOM 3369 N ILE B 106 -4.008 3.268 -3.754 1.00 0.00 N ATOM 3370 CA ILE B 106 -4.164 3.918 -2.461 1.00 0.00 C ATOM 3371 C ILE B 106 -4.648 5.350 -2.670 1.00 0.00 C ATOM 3372 O ILE B 106 -4.128 6.078 -3.516 1.00 0.00 O ATOM 3373 CB ILE B 106 -2.842 3.898 -1.646 1.00 0.00 C ATOM 3374 CG1 ILE B 106 -2.932 4.778 -0.392 1.00 0.00 C ATOM 3375 CG2 ILE B 106 -1.679 4.339 -2.511 1.00 0.00 C ATOM 3376 CD1 ILE B 106 -1.992 4.352 0.713 1.00 0.00 C ATOM 0 H ILE B 106 -3.087 3.384 -4.177 1.00 0.00 H new ATOM 0 HA ILE B 106 -4.904 3.365 -1.883 1.00 0.00 H new ATOM 0 HB ILE B 106 -2.676 2.871 -1.320 1.00 0.00 H new ATOM 0 HG12 ILE B 106 -2.714 5.810 -0.666 1.00 0.00 H new ATOM 0 HG13 ILE B 106 -3.955 4.757 -0.016 1.00 0.00 H new ATOM 0 HG21 ILE B 106 -0.761 4.319 -1.924 1.00 0.00 H new ATOM 0 HG22 ILE B 106 -1.581 3.664 -3.361 1.00 0.00 H new ATOM 0 HG23 ILE B 106 -1.857 5.352 -2.871 1.00 0.00 H new ATOM 0 HD11 ILE B 106 -2.110 5.018 1.568 1.00 0.00 H new ATOM 0 HD12 ILE B 106 -2.224 3.331 1.014 1.00 0.00 H new ATOM 0 HD13 ILE B 106 -0.964 4.400 0.355 1.00 0.00 H new ATOM 3388 N CYS B 107 -5.655 5.738 -1.903 1.00 0.00 N ATOM 3389 CA CYS B 107 -6.228 7.071 -2.004 1.00 0.00 C ATOM 3390 C CYS B 107 -6.293 7.726 -0.633 1.00 0.00 C ATOM 3391 O CYS B 107 -6.989 7.243 0.261 1.00 0.00 O ATOM 3392 CB CYS B 107 -7.627 6.985 -2.619 1.00 0.00 C ATOM 3393 SG CYS B 107 -8.721 5.804 -1.800 1.00 0.00 S ATOM 0 H CYS B 107 -6.095 5.144 -1.200 1.00 0.00 H new ATOM 0 HA CYS B 107 -5.593 7.682 -2.646 1.00 0.00 H new ATOM 0 HB2 CYS B 107 -8.087 7.973 -2.588 1.00 0.00 H new ATOM 0 HB3 CYS B 107 -7.534 6.710 -3.670 1.00 0.00 H new ATOM 0 HG CYS B 107 -8.011 4.954 -1.120 1.00 0.00 H new ATOM 3399 N THR B 108 -5.558 8.822 -0.460 1.00 0.00 N ATOM 3400 CA THR B 108 -5.538 9.518 0.819 1.00 0.00 C ATOM 3401 C THR B 108 -6.203 10.883 0.735 1.00 0.00 C ATOM 3402 O THR B 108 -6.157 11.556 -0.296 1.00 0.00 O ATOM 3403 CB THR B 108 -4.095 9.652 1.341 1.00 0.00 C ATOM 3404 OG1 THR B 108 -4.090 9.877 2.739 1.00 0.00 O ATOM 3405 CG2 THR B 108 -3.296 10.776 0.699 1.00 0.00 C ATOM 0 H THR B 108 -4.974 9.242 -1.183 1.00 0.00 H new ATOM 0 HA THR B 108 -6.114 8.918 1.524 1.00 0.00 H new ATOM 0 HB THR B 108 -3.620 8.707 1.077 1.00 0.00 H new ATOM 0 HG1 THR B 108 -4.576 10.704 2.939 1.00 0.00 H new ATOM 0 HG21 THR B 108 -2.293 10.798 1.125 1.00 0.00 H new ATOM 0 HG22 THR B 108 -3.230 10.608 -0.376 1.00 0.00 H new ATOM 0 HG23 THR B 108 -3.792 11.728 0.888 1.00 0.00 H new ATOM 3413 N VAL B 109 -6.797 11.288 1.847 1.00 0.00 N ATOM 3414 CA VAL B 109 -7.453 12.580 1.937 1.00 0.00 C ATOM 3415 C VAL B 109 -6.999 13.299 3.195 1.00 0.00 C ATOM 3416 O VAL B 109 -7.131 12.772 4.303 1.00 0.00 O ATOM 3417 CB VAL B 109 -9.009 12.487 1.954 1.00 0.00 C ATOM 3418 CG1 VAL B 109 -9.616 13.599 1.111 1.00 0.00 C ATOM 3419 CG2 VAL B 109 -9.509 11.132 1.474 1.00 0.00 C ATOM 0 H VAL B 109 -6.837 10.736 2.704 1.00 0.00 H new ATOM 0 HA VAL B 109 -7.168 13.129 1.040 1.00 0.00 H new ATOM 0 HB VAL B 109 -9.328 12.605 2.990 1.00 0.00 H new ATOM 0 HG11 VAL B 109 -10.703 13.520 1.133 1.00 0.00 H new ATOM 0 HG12 VAL B 109 -9.314 14.566 1.513 1.00 0.00 H new ATOM 0 HG13 VAL B 109 -9.266 13.508 0.083 1.00 0.00 H new ATOM 0 HG21 VAL B 109 -10.598 11.115 1.504 1.00 0.00 H new ATOM 0 HG22 VAL B 109 -9.171 10.961 0.452 1.00 0.00 H new ATOM 0 HG23 VAL B 109 -9.116 10.349 2.122 1.00 0.00 H new ATOM 3429 N PHE B 110 -6.481 14.512 3.037 1.00 0.00 N ATOM 3430 CA PHE B 110 -6.048 15.293 4.185 1.00 0.00 C ATOM 3431 C PHE B 110 -7.100 16.349 4.476 1.00 0.00 C ATOM 3432 O PHE B 110 -7.185 17.373 3.800 1.00 0.00 O ATOM 3433 CB PHE B 110 -4.666 15.939 3.994 1.00 0.00 C ATOM 3434 CG PHE B 110 -3.527 14.990 3.666 1.00 0.00 C ATOM 3435 CD1 PHE B 110 -3.695 13.609 3.655 1.00 0.00 C ATOM 3436 CD2 PHE B 110 -2.273 15.500 3.366 1.00 0.00 C ATOM 3437 CE1 PHE B 110 -2.641 12.768 3.354 1.00 0.00 C ATOM 3438 CE2 PHE B 110 -1.216 14.662 3.064 1.00 0.00 C ATOM 3439 CZ PHE B 110 -1.402 13.295 3.057 1.00 0.00 C ATOM 0 H PHE B 110 -6.352 14.970 2.135 1.00 0.00 H new ATOM 0 HA PHE B 110 -5.941 14.615 5.031 1.00 0.00 H new ATOM 0 HB2 PHE B 110 -4.739 16.677 3.195 1.00 0.00 H new ATOM 0 HB3 PHE B 110 -4.411 16.480 4.905 1.00 0.00 H new ATOM 0 HD1 PHE B 110 -4.663 13.188 3.885 1.00 0.00 H new ATOM 0 HD2 PHE B 110 -2.120 16.569 3.368 1.00 0.00 H new ATOM 0 HE1 PHE B 110 -2.788 11.698 3.351 1.00 0.00 H new ATOM 0 HE2 PHE B 110 -0.246 15.077 2.834 1.00 0.00 H new ATOM 0 HZ PHE B 110 -0.578 12.638 2.819 1.00 0.00 H new ATOM 3449 N GLY B 111 -7.910 16.069 5.483 1.00 0.00 N ATOM 3450 CA GLY B 111 -8.973 16.972 5.869 1.00 0.00 C ATOM 3451 C GLY B 111 -8.466 18.058 6.774 1.00 0.00 C ATOM 3452 O GLY B 111 -8.529 17.943 7.999 1.00 0.00 O ATOM 0 H GLY B 111 -7.849 15.221 6.047 1.00 0.00 H new ATOM 0 HA2 GLY B 111 -9.417 17.416 4.978 1.00 0.00 H new ATOM 0 HA3 GLY B 111 -9.762 16.414 6.374 1.00 0.00 H new ATOM 3456 N LEU B 112 -7.937 19.107 6.172 1.00 0.00 N ATOM 3457 CA LEU B 112 -7.388 20.207 6.932 1.00 0.00 C ATOM 3458 C LEU B 112 -8.473 21.180 7.343 1.00 0.00 C ATOM 3459 O LEU B 112 -9.225 21.681 6.509 1.00 0.00 O ATOM 3460 CB LEU B 112 -6.295 20.894 6.114 1.00 0.00 C ATOM 3461 CG LEU B 112 -4.960 20.127 6.007 1.00 0.00 C ATOM 3462 CD1 LEU B 112 -5.158 18.621 5.896 1.00 0.00 C ATOM 3463 CD2 LEU B 112 -4.181 20.606 4.816 1.00 0.00 C ATOM 0 H LEU B 112 -7.877 19.218 5.160 1.00 0.00 H new ATOM 0 HA LEU B 112 -6.945 19.822 7.850 1.00 0.00 H new ATOM 0 HB2 LEU B 112 -6.675 21.068 5.107 1.00 0.00 H new ATOM 0 HB3 LEU B 112 -6.097 21.872 6.554 1.00 0.00 H new ATOM 0 HG LEU B 112 -4.410 20.327 6.927 1.00 0.00 H new ATOM 0 HD11 LEU B 112 -4.187 18.131 5.823 1.00 0.00 H new ATOM 0 HD12 LEU B 112 -5.683 18.257 6.779 1.00 0.00 H new ATOM 0 HD13 LEU B 112 -5.746 18.396 5.006 1.00 0.00 H new ATOM 0 HD21 LEU B 112 -3.241 20.057 4.751 1.00 0.00 H new ATOM 0 HD22 LEU B 112 -4.762 20.438 3.909 1.00 0.00 H new ATOM 0 HD23 LEU B 112 -3.973 21.671 4.922 1.00 0.00 H new ATOM 3475 N ALA B 113 -8.562 21.427 8.648 1.00 0.00 N ATOM 3476 CA ALA B 113 -9.584 22.333 9.181 1.00 0.00 C ATOM 3477 C ALA B 113 -9.575 23.685 8.464 1.00 0.00 C ATOM 3478 O ALA B 113 -10.394 23.937 7.582 1.00 0.00 O ATOM 3479 CB ALA B 113 -9.408 22.521 10.680 1.00 0.00 C ATOM 0 H ALA B 113 -7.947 21.019 9.352 1.00 0.00 H new ATOM 0 HA ALA B 113 -10.555 21.872 8.999 1.00 0.00 H new ATOM 0 HB1 ALA B 113 -10.177 23.197 11.055 1.00 0.00 H new ATOM 0 HB2 ALA B 113 -9.497 21.557 11.181 1.00 0.00 H new ATOM 0 HB3 ALA B 113 -8.424 22.944 10.881 1.00 0.00 H new ATOM 3485 N ILE B 114 -8.644 24.544 8.846 1.00 0.00 N ATOM 3486 CA ILE B 114 -8.525 25.866 8.243 1.00 0.00 C ATOM 3487 C ILE B 114 -7.233 25.989 7.441 1.00 0.00 C ATOM 3488 O ILE B 114 -6.877 25.014 6.748 1.00 0.00 O ATOM 3489 CB ILE B 114 -8.560 26.978 9.309 1.00 0.00 C ATOM 3490 CG1 ILE B 114 -9.734 26.760 10.266 1.00 0.00 C ATOM 3491 CG2 ILE B 114 -8.654 28.344 8.648 1.00 0.00 C ATOM 3492 CD1 ILE B 114 -11.085 26.832 9.589 1.00 0.00 C ATOM 0 H ILE B 114 -7.956 24.350 9.574 1.00 0.00 H new ATOM 0 HA ILE B 114 -9.379 25.986 7.576 1.00 0.00 H new ATOM 0 HB ILE B 114 -7.635 26.939 9.884 1.00 0.00 H new ATOM 0 HG12 ILE B 114 -9.627 25.786 10.744 1.00 0.00 H new ATOM 0 HG13 ILE B 114 -9.692 27.509 11.057 1.00 0.00 H new ATOM 0 HG21 ILE B 114 -8.678 29.118 9.415 1.00 0.00 H new ATOM 0 HG22 ILE B 114 -7.788 28.497 8.004 1.00 0.00 H new ATOM 0 HG23 ILE B 114 -9.564 28.397 8.050 1.00 0.00 H new ATOM 0 HD11 ILE B 114 -11.871 26.668 10.327 1.00 0.00 H new ATOM 0 HD12 ILE B 114 -11.212 27.815 9.135 1.00 0.00 H new ATOM 0 HD13 ILE B 114 -11.147 26.065 8.817 1.00 0.00 H new TER 3504 ILE B 114