USER MOD reduce.3.24.130724 H: found=0, std=0, add=1296, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1286 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 7 MET CE :methyl -168:sc= 0 (180deg=0) USER MOD Set 1.2: B 81 THR OG1 : rot 81:sc= 0.44 USER MOD Set 2.1: A 71 GLN : amide:sc= 0.352 K(o=1.9,f=-0.012) USER MOD Set 2.2: B 78 SER OG : rot -79:sc= 1.52 USER MOD Set 3.1: A 74 MET CE :methyl -157:sc= -0.147 (180deg=-0.508) USER MOD Set 3.2: B 74 MET CE :methyl -156:sc= -0.171 (180deg=-0.527) USER MOD Set 4.1: A 78 SER OG : rot -77:sc= 1.35 USER MOD Set 4.2: B 71 GLN : amide:sc= 0.451 K(o=1.8,f=0.02) USER MOD Set 5.1: B 41 SER OG : rot 180:sc=-0.00789 USER MOD Set 5.2: B 42 HIS : no HD1:sc= -0.25 X(o=-0.26,f=0.01) USER MOD Set 6.1: B 37 ASN : amide:sc= 0.127 X(o=0.0087,f=-0.25) USER MOD Set 6.2: B 38 ASN : amide:sc= -0.118 K(o=0.0087,f=-3.5!) USER MOD Set 7.1: B 29 LYS NZ :NH3+ -163:sc= 0.0584 (180deg=-0.596) USER MOD Set 7.2: B 30 SER OG : rot 180:sc= 0.0987 USER MOD Set 8.1: A 81 THR OG1 : rot 80:sc= 0.436 USER MOD Set 8.2: B 7 MET CE :methyl -160:sc= 0 (180deg=0) USER MOD Set 9.1: A 41 SER OG : rot 180:sc=-0.00704 USER MOD Set 9.2: A 42 HIS : no HD1:sc= -0.259 X(o=-0.27,f=-0.00055) USER MOD Set10.1: A 37 ASN : amide:sc= 0.129 X(o=0.012,f=-0.24) USER MOD Set10.2: A 38 ASN : amide:sc= -0.117 K(o=0.012,f=-3.6!) USER MOD Set11.1: A 29 LYS NZ :NH3+ -158:sc= 0.0572 (180deg=-0.379) USER MOD Set11.2: A 30 SER OG : rot 180:sc= 0.0859 USER MOD Single : A 1 SER N :NH3+ -157:sc= 1.2 (180deg=0.777) USER MOD Single : A 1 SER OG : rot -106:sc= 0.221 USER MOD Single : A 5 LYS NZ :NH3+ 139:sc= -0.191 (180deg=-1.1) USER MOD Single : A 15 HIS : no HD1:sc= -0.12 X(o=-0.12,f=-0.28) USER MOD Single : A 16 GLN : amide:sc= -0.145 X(o=-0.14,f=-0.25) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 SER OG : rot -67:sc= 1.07 USER MOD Single : A 24 LYS NZ :NH3+ -142:sc= -0.272 (180deg=-1.31!) USER MOD Single : A 25 HIS : no HD1:sc= -2.13 K(o=-2.1,f=-4.1!) USER MOD Single : A 26 LYS NZ :NH3+ 158:sc= -0.126 (180deg=-0.925) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot -81:sc= 0.267 USER MOD Single : A 68 CYS SG : rot -31:sc= -0.953 USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 82 THR OG1 : rot -80:sc= 0.827 USER MOD Single : B 1 SER N :NH3+ -158:sc= 1.2 (180deg=0.797) USER MOD Single : B 1 SER OG : rot -113:sc= 0.168 USER MOD Single : B 5 LYS NZ :NH3+ 152:sc= -0.196 (180deg=-1.12) USER MOD Single : B 15 HIS : no HD1:sc= -0.0687 X(o=-0.069,f=-0.27) USER MOD Single : B 16 GLN : amide:sc= -0.122 X(o=-0.12,f=-0.26) USER MOD Single : B 17 TYR OH : rot 180:sc= 0 USER MOD Single : B 18 SER OG : rot -73:sc= 1.1 USER MOD Single : B 24 LYS NZ :NH3+ -157:sc= -0.26 (180deg=-1.37!) USER MOD Single : B 25 HIS : no HD1:sc= -2.09 K(o=-2.1,f=-4!) USER MOD Single : B 26 LYS NZ :NH3+ 155:sc= -0.171 (180deg=-0.918) USER MOD Single : B 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 59 THR OG1 : rot -89:sc= 0.305 USER MOD Single : B 68 CYS SG : rot -40:sc= -0.947 USER MOD Single : B 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 82 THR OG1 : rot -81:sc= 0.809 USER MOD ----------------------------------------------------------------- ATOM 20 N SER A 1 -10.618 4.659 12.682 1.00 0.00 N ATOM 21 CA SER A 1 -10.625 3.169 12.700 1.00 0.00 C ATOM 22 C SER A 1 -9.198 2.660 12.894 1.00 0.00 C ATOM 23 O SER A 1 -8.241 3.391 12.737 1.00 0.00 O ATOM 24 CB SER A 1 -11.173 2.642 11.372 1.00 0.00 C ATOM 25 OG SER A 1 -10.108 2.559 10.430 1.00 0.00 O ATOM 0 H1 SER A 1 -11.561 5.014 12.940 1.00 0.00 H new ATOM 0 H2 SER A 1 -9.917 5.011 13.365 1.00 0.00 H new ATOM 0 H3 SER A 1 -10.371 4.994 11.729 1.00 0.00 H new ATOM 0 HA SER A 1 -11.256 2.819 13.517 1.00 0.00 H new ATOM 0 HB2 SER A 1 -11.626 1.661 11.515 1.00 0.00 H new ATOM 0 HB3 SER A 1 -11.955 3.303 10.999 1.00 0.00 H new ATOM 0 HG SER A 1 -10.194 3.283 9.775 1.00 0.00 H new ATOM 31 N GLU A 2 -9.046 1.410 13.234 1.00 0.00 N ATOM 32 CA GLU A 2 -7.677 0.864 13.435 1.00 0.00 C ATOM 33 C GLU A 2 -6.852 1.096 12.169 1.00 0.00 C ATOM 34 O GLU A 2 -5.654 1.289 12.221 1.00 0.00 O ATOM 35 CB GLU A 2 -7.765 -0.634 13.727 1.00 0.00 C ATOM 36 CG GLU A 2 -8.718 -0.866 14.902 1.00 0.00 C ATOM 37 CD GLU A 2 -8.761 -2.357 15.240 1.00 0.00 C ATOM 38 OE1 GLU A 2 -8.940 -3.146 14.327 1.00 0.00 O ATOM 39 OE2 GLU A 2 -8.614 -2.684 16.406 1.00 0.00 O ATOM 0 H GLU A 2 -9.807 0.747 13.380 1.00 0.00 H new ATOM 0 HA GLU A 2 -7.200 1.366 14.276 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -8.120 -1.168 12.845 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -6.777 -1.029 13.962 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -8.387 -0.295 15.770 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -9.717 -0.511 14.649 1.00 0.00 H new ATOM 46 N LEU A 3 -7.484 1.071 11.027 1.00 0.00 N ATOM 47 CA LEU A 3 -6.736 1.284 9.757 1.00 0.00 C ATOM 48 C LEU A 3 -6.034 2.645 9.798 1.00 0.00 C ATOM 49 O LEU A 3 -4.843 2.745 9.578 1.00 0.00 O ATOM 50 CB LEU A 3 -7.719 1.237 8.572 1.00 0.00 C ATOM 51 CG LEU A 3 -6.992 0.789 7.297 1.00 0.00 C ATOM 52 CD1 LEU A 3 -7.986 0.750 6.134 1.00 0.00 C ATOM 53 CD2 LEU A 3 -5.858 1.772 6.971 1.00 0.00 C ATOM 0 H LEU A 3 -8.486 0.912 10.919 1.00 0.00 H new ATOM 0 HA LEU A 3 -5.988 0.500 9.636 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -8.535 0.550 8.794 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -8.163 2.221 8.419 1.00 0.00 H new ATOM 0 HG LEU A 3 -6.570 -0.204 7.452 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -7.472 0.432 5.227 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -8.787 0.047 6.363 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -8.408 1.743 5.983 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -5.346 1.449 6.065 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -6.273 2.768 6.817 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -5.150 1.798 7.799 1.00 0.00 H new ATOM 65 N GLU A 4 -6.758 3.696 10.075 1.00 0.00 N ATOM 66 CA GLU A 4 -6.115 5.040 10.116 1.00 0.00 C ATOM 67 C GLU A 4 -4.881 4.987 11.022 1.00 0.00 C ATOM 68 O GLU A 4 -3.813 5.446 10.671 1.00 0.00 O ATOM 69 CB GLU A 4 -7.111 6.071 10.656 1.00 0.00 C ATOM 70 CG GLU A 4 -8.138 6.409 9.572 1.00 0.00 C ATOM 71 CD GLU A 4 -8.973 5.168 9.253 1.00 0.00 C ATOM 72 OE1 GLU A 4 -9.894 4.889 10.004 1.00 0.00 O ATOM 73 OE2 GLU A 4 -8.678 4.517 8.265 1.00 0.00 O ATOM 0 H GLU A 4 -7.758 3.683 10.273 1.00 0.00 H new ATOM 0 HA GLU A 4 -5.812 5.329 9.110 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -7.615 5.677 11.539 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -6.584 6.973 10.966 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -8.785 7.219 9.910 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -7.631 6.760 8.673 1.00 0.00 H new ATOM 80 N LYS A 5 -5.029 4.411 12.184 1.00 0.00 N ATOM 81 CA LYS A 5 -3.881 4.300 13.128 1.00 0.00 C ATOM 82 C LYS A 5 -2.678 3.700 12.399 1.00 0.00 C ATOM 83 O LYS A 5 -1.556 4.147 12.538 1.00 0.00 O ATOM 84 CB LYS A 5 -4.268 3.360 14.279 1.00 0.00 C ATOM 85 CG LYS A 5 -5.569 3.835 14.947 1.00 0.00 C ATOM 86 CD LYS A 5 -5.295 5.053 15.840 1.00 0.00 C ATOM 87 CE LYS A 5 -6.520 5.327 16.716 1.00 0.00 C ATOM 88 NZ LYS A 5 -6.796 4.139 17.573 1.00 0.00 N ATOM 0 H LYS A 5 -5.903 4.009 12.522 1.00 0.00 H new ATOM 0 HA LYS A 5 -3.630 5.289 13.511 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -4.396 2.346 13.901 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -3.465 3.327 15.015 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -6.304 4.092 14.185 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -5.996 3.028 15.542 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -4.421 4.870 16.465 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -5.071 5.925 15.226 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -6.346 6.205 17.338 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -7.385 5.546 16.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -7.058 4.454 18.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -7.578 3.589 17.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -5.945 3.544 17.626 1.00 0.00 H new ATOM 102 N ALA A 6 -2.918 2.669 11.634 1.00 0.00 N ATOM 103 CA ALA A 6 -1.823 1.985 10.887 1.00 0.00 C ATOM 104 C ALA A 6 -1.390 2.809 9.666 1.00 0.00 C ATOM 105 O ALA A 6 -0.250 2.743 9.251 1.00 0.00 O ATOM 106 CB ALA A 6 -2.327 0.601 10.441 1.00 0.00 C ATOM 0 H ALA A 6 -3.844 2.265 11.493 1.00 0.00 H new ATOM 0 HA ALA A 6 -0.955 1.878 11.538 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -1.538 0.086 9.893 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -2.602 0.014 11.317 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -3.198 0.721 9.797 1.00 0.00 H new ATOM 112 N MET A 7 -2.257 3.587 9.087 1.00 0.00 N ATOM 113 CA MET A 7 -1.823 4.392 7.909 1.00 0.00 C ATOM 114 C MET A 7 -0.788 5.425 8.376 1.00 0.00 C ATOM 115 O MET A 7 0.295 5.542 7.823 1.00 0.00 O ATOM 116 CB MET A 7 -3.041 5.102 7.297 1.00 0.00 C ATOM 117 CG MET A 7 -2.765 5.442 5.829 1.00 0.00 C ATOM 118 SD MET A 7 -2.757 3.918 4.851 1.00 0.00 S ATOM 119 CE MET A 7 -1.929 4.587 3.387 1.00 0.00 C ATOM 0 H MET A 7 -3.230 3.702 9.369 1.00 0.00 H new ATOM 0 HA MET A 7 -1.378 3.745 7.153 1.00 0.00 H new ATOM 0 HB2 MET A 7 -3.921 4.463 7.372 1.00 0.00 H new ATOM 0 HB3 MET A 7 -3.260 6.012 7.855 1.00 0.00 H new ATOM 0 HG2 MET A 7 -3.527 6.125 5.453 1.00 0.00 H new ATOM 0 HG3 MET A 7 -1.806 5.952 5.736 1.00 0.00 H new ATOM 0 HE1 MET A 7 -2.007 3.873 2.567 1.00 0.00 H new ATOM 0 HE2 MET A 7 -2.403 5.525 3.098 1.00 0.00 H new ATOM 0 HE3 MET A 7 -0.878 4.766 3.613 1.00 0.00 H new ATOM 129 N VAL A 8 -1.109 6.164 9.404 1.00 0.00 N ATOM 130 CA VAL A 8 -0.152 7.181 9.923 1.00 0.00 C ATOM 131 C VAL A 8 1.132 6.482 10.367 1.00 0.00 C ATOM 132 O VAL A 8 2.219 7.003 10.211 1.00 0.00 O ATOM 133 CB VAL A 8 -0.774 7.907 11.119 1.00 0.00 C ATOM 134 CG1 VAL A 8 0.086 9.116 11.488 1.00 0.00 C ATOM 135 CG2 VAL A 8 -2.182 8.385 10.755 1.00 0.00 C ATOM 0 H VAL A 8 -1.995 6.106 9.907 1.00 0.00 H new ATOM 0 HA VAL A 8 0.074 7.903 9.139 1.00 0.00 H new ATOM 0 HB VAL A 8 -0.827 7.222 11.965 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -0.358 9.632 12.339 1.00 0.00 H new ATOM 0 HG12 VAL A 8 1.090 8.782 11.749 1.00 0.00 H new ATOM 0 HG13 VAL A 8 0.140 9.797 10.639 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -2.623 8.901 11.608 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -2.127 9.067 9.907 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -2.801 7.527 10.491 1.00 0.00 H new ATOM 145 N ALA A 9 1.018 5.303 10.915 1.00 0.00 N ATOM 146 CA ALA A 9 2.234 4.568 11.363 1.00 0.00 C ATOM 147 C ALA A 9 3.173 4.380 10.170 1.00 0.00 C ATOM 148 O ALA A 9 4.358 4.618 10.259 1.00 0.00 O ATOM 149 CB ALA A 9 1.822 3.199 11.908 1.00 0.00 C ATOM 0 H ALA A 9 0.135 4.817 11.072 1.00 0.00 H new ATOM 0 HA ALA A 9 2.743 5.133 12.144 1.00 0.00 H new ATOM 0 HB1 ALA A 9 2.708 2.657 12.237 1.00 0.00 H new ATOM 0 HB2 ALA A 9 1.144 3.332 12.751 1.00 0.00 H new ATOM 0 HB3 ALA A 9 1.320 2.632 11.124 1.00 0.00 H new ATOM 155 N LEU A 10 2.655 3.938 9.060 1.00 0.00 N ATOM 156 CA LEU A 10 3.529 3.719 7.868 1.00 0.00 C ATOM 157 C LEU A 10 4.447 4.924 7.683 1.00 0.00 C ATOM 158 O LEU A 10 5.627 4.786 7.428 1.00 0.00 O ATOM 159 CB LEU A 10 2.651 3.575 6.619 1.00 0.00 C ATOM 160 CG LEU A 10 1.881 2.243 6.654 1.00 0.00 C ATOM 161 CD1 LEU A 10 0.830 2.243 5.536 1.00 0.00 C ATOM 162 CD2 LEU A 10 2.845 1.053 6.453 1.00 0.00 C ATOM 0 H LEU A 10 1.668 3.719 8.923 1.00 0.00 H new ATOM 0 HA LEU A 10 4.124 2.818 8.016 1.00 0.00 H new ATOM 0 HB2 LEU A 10 1.949 4.407 6.563 1.00 0.00 H new ATOM 0 HB3 LEU A 10 3.271 3.620 5.724 1.00 0.00 H new ATOM 0 HG LEU A 10 1.397 2.138 7.625 1.00 0.00 H new ATOM 0 HD11 LEU A 10 0.280 1.302 5.554 1.00 0.00 H new ATOM 0 HD12 LEU A 10 0.138 3.071 5.687 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.325 2.356 4.571 1.00 0.00 H new ATOM 0 HD21 LEU A 10 2.282 0.120 6.481 1.00 0.00 H new ATOM 0 HD22 LEU A 10 3.343 1.147 5.488 1.00 0.00 H new ATOM 0 HD23 LEU A 10 3.591 1.051 7.248 1.00 0.00 H new ATOM 174 N ILE A 11 3.917 6.109 7.829 1.00 0.00 N ATOM 175 CA ILE A 11 4.780 7.317 7.680 1.00 0.00 C ATOM 176 C ILE A 11 5.813 7.303 8.812 1.00 0.00 C ATOM 177 O ILE A 11 6.970 7.624 8.624 1.00 0.00 O ATOM 178 CB ILE A 11 3.919 8.587 7.767 1.00 0.00 C ATOM 179 CG1 ILE A 11 3.111 8.746 6.473 1.00 0.00 C ATOM 180 CG2 ILE A 11 4.816 9.817 7.949 1.00 0.00 C ATOM 181 CD1 ILE A 11 2.130 7.580 6.316 1.00 0.00 C ATOM 0 H ILE A 11 2.937 6.292 8.042 1.00 0.00 H new ATOM 0 HA ILE A 11 5.282 7.309 6.713 1.00 0.00 H new ATOM 0 HB ILE A 11 3.245 8.500 8.619 1.00 0.00 H new ATOM 0 HG12 ILE A 11 2.566 9.690 6.490 1.00 0.00 H new ATOM 0 HG13 ILE A 11 3.785 8.782 5.617 1.00 0.00 H new ATOM 0 HG21 ILE A 11 4.198 10.713 8.010 1.00 0.00 H new ATOM 0 HG22 ILE A 11 5.395 9.713 8.867 1.00 0.00 H new ATOM 0 HG23 ILE A 11 5.494 9.901 7.100 1.00 0.00 H new ATOM 0 HD11 ILE A 11 1.562 7.704 5.394 1.00 0.00 H new ATOM 0 HD12 ILE A 11 2.683 6.642 6.278 1.00 0.00 H new ATOM 0 HD13 ILE A 11 1.446 7.564 7.164 1.00 0.00 H new ATOM 193 N ASP A 12 5.389 6.922 9.987 1.00 0.00 N ATOM 194 CA ASP A 12 6.314 6.865 11.152 1.00 0.00 C ATOM 195 C ASP A 12 7.566 6.072 10.785 1.00 0.00 C ATOM 196 O ASP A 12 8.681 6.519 10.969 1.00 0.00 O ATOM 197 CB ASP A 12 5.607 6.148 12.313 1.00 0.00 C ATOM 198 CG ASP A 12 6.343 6.439 13.625 1.00 0.00 C ATOM 199 OD1 ASP A 12 7.383 5.841 13.844 1.00 0.00 O ATOM 200 OD2 ASP A 12 5.852 7.255 14.388 1.00 0.00 O ATOM 0 H ASP A 12 4.429 6.645 10.190 1.00 0.00 H new ATOM 0 HA ASP A 12 6.594 7.879 11.438 1.00 0.00 H new ATOM 0 HB2 ASP A 12 4.572 6.483 12.383 1.00 0.00 H new ATOM 0 HB3 ASP A 12 5.583 5.074 12.129 1.00 0.00 H new ATOM 205 N VAL A 13 7.381 4.873 10.294 1.00 0.00 N ATOM 206 CA VAL A 13 8.549 4.019 9.944 1.00 0.00 C ATOM 207 C VAL A 13 9.186 4.462 8.623 1.00 0.00 C ATOM 208 O VAL A 13 10.394 4.542 8.522 1.00 0.00 O ATOM 209 CB VAL A 13 8.101 2.557 9.862 1.00 0.00 C ATOM 210 CG1 VAL A 13 9.252 1.689 9.348 1.00 0.00 C ATOM 211 CG2 VAL A 13 7.685 2.080 11.256 1.00 0.00 C ATOM 0 H VAL A 13 6.469 4.451 10.121 1.00 0.00 H new ATOM 0 HA VAL A 13 9.305 4.124 10.722 1.00 0.00 H new ATOM 0 HB VAL A 13 7.258 2.474 9.176 1.00 0.00 H new ATOM 0 HG11 VAL A 13 8.927 0.650 9.292 1.00 0.00 H new ATOM 0 HG12 VAL A 13 9.550 2.030 8.357 1.00 0.00 H new ATOM 0 HG13 VAL A 13 10.099 1.768 10.029 1.00 0.00 H new ATOM 0 HG21 VAL A 13 7.365 1.039 11.204 1.00 0.00 H new ATOM 0 HG22 VAL A 13 8.531 2.166 11.937 1.00 0.00 H new ATOM 0 HG23 VAL A 13 6.862 2.695 11.620 1.00 0.00 H new ATOM 221 N PHE A 14 8.422 4.738 7.605 1.00 0.00 N ATOM 222 CA PHE A 14 9.073 5.150 6.330 1.00 0.00 C ATOM 223 C PHE A 14 9.933 6.387 6.591 1.00 0.00 C ATOM 224 O PHE A 14 10.988 6.562 6.011 1.00 0.00 O ATOM 225 CB PHE A 14 8.024 5.472 5.263 1.00 0.00 C ATOM 226 CG PHE A 14 8.730 5.806 3.968 1.00 0.00 C ATOM 227 CD1 PHE A 14 9.137 4.778 3.108 1.00 0.00 C ATOM 228 CD2 PHE A 14 8.981 7.142 3.629 1.00 0.00 C ATOM 229 CE1 PHE A 14 9.795 5.087 1.909 1.00 0.00 C ATOM 230 CE2 PHE A 14 9.639 7.449 2.429 1.00 0.00 C ATOM 231 CZ PHE A 14 10.046 6.422 1.571 1.00 0.00 C ATOM 0 H PHE A 14 7.403 4.699 7.596 1.00 0.00 H new ATOM 0 HA PHE A 14 9.691 4.330 5.966 1.00 0.00 H new ATOM 0 HB2 PHE A 14 7.358 4.621 5.121 1.00 0.00 H new ATOM 0 HB3 PHE A 14 7.406 6.311 5.583 1.00 0.00 H new ATOM 0 HD1 PHE A 14 8.944 3.748 3.368 1.00 0.00 H new ATOM 0 HD2 PHE A 14 8.668 7.935 4.292 1.00 0.00 H new ATOM 0 HE1 PHE A 14 10.108 4.294 1.246 1.00 0.00 H new ATOM 0 HE2 PHE A 14 9.832 8.479 2.167 1.00 0.00 H new ATOM 0 HZ PHE A 14 10.554 6.659 0.648 1.00 0.00 H new ATOM 241 N HIS A 15 9.486 7.248 7.466 1.00 0.00 N ATOM 242 CA HIS A 15 10.269 8.476 7.771 1.00 0.00 C ATOM 243 C HIS A 15 11.422 8.132 8.715 1.00 0.00 C ATOM 244 O HIS A 15 12.463 8.759 8.697 1.00 0.00 O ATOM 245 CB HIS A 15 9.361 9.514 8.434 1.00 0.00 C ATOM 246 CG HIS A 15 10.043 10.855 8.424 1.00 0.00 C ATOM 247 ND1 HIS A 15 10.575 11.404 7.268 1.00 0.00 N ATOM 248 CD2 HIS A 15 10.294 11.766 9.421 1.00 0.00 C ATOM 249 CE1 HIS A 15 11.114 12.593 7.593 1.00 0.00 C ATOM 250 NE2 HIS A 15 10.971 12.862 8.894 1.00 0.00 N ATOM 0 H HIS A 15 8.611 7.152 7.982 1.00 0.00 H new ATOM 0 HA HIS A 15 10.670 8.884 6.843 1.00 0.00 H new ATOM 0 HB2 HIS A 15 8.411 9.573 7.904 1.00 0.00 H new ATOM 0 HB3 HIS A 15 9.137 9.216 9.458 1.00 0.00 H new ATOM 0 HD2 HIS A 15 10.009 11.650 10.456 1.00 0.00 H new ATOM 0 HE1 HIS A 15 11.603 13.250 6.888 1.00 0.00 H new ATOM 0 HE2 HIS A 15 11.290 13.692 9.394 1.00 0.00 H new ATOM 258 N GLN A 16 11.237 7.145 9.553 1.00 0.00 N ATOM 259 CA GLN A 16 12.314 6.768 10.512 1.00 0.00 C ATOM 260 C GLN A 16 13.612 6.514 9.748 1.00 0.00 C ATOM 261 O GLN A 16 14.672 6.949 10.151 1.00 0.00 O ATOM 262 CB GLN A 16 11.907 5.505 11.277 1.00 0.00 C ATOM 263 CG GLN A 16 12.875 5.277 12.441 1.00 0.00 C ATOM 264 CD GLN A 16 12.586 6.287 13.553 1.00 0.00 C ATOM 265 OE1 GLN A 16 11.476 6.370 14.041 1.00 0.00 O ATOM 266 NE2 GLN A 16 13.545 7.064 13.979 1.00 0.00 N ATOM 0 H GLN A 16 10.387 6.585 9.614 1.00 0.00 H new ATOM 0 HA GLN A 16 12.467 7.581 11.222 1.00 0.00 H new ATOM 0 HB2 GLN A 16 10.889 5.607 11.652 1.00 0.00 H new ATOM 0 HB3 GLN A 16 11.916 4.644 10.609 1.00 0.00 H new ATOM 0 HG2 GLN A 16 12.769 4.261 12.822 1.00 0.00 H new ATOM 0 HG3 GLN A 16 13.904 5.383 12.098 1.00 0.00 H new ATOM 0 HE21 GLN A 16 14.477 6.995 13.570 1.00 0.00 H new ATOM 0 HE22 GLN A 16 13.362 7.740 14.721 1.00 0.00 H new ATOM 275 N TYR A 17 13.544 5.818 8.647 1.00 0.00 N ATOM 276 CA TYR A 17 14.782 5.548 7.866 1.00 0.00 C ATOM 277 C TYR A 17 15.243 6.843 7.198 1.00 0.00 C ATOM 278 O TYR A 17 16.400 7.210 7.263 1.00 0.00 O ATOM 279 CB TYR A 17 14.490 4.491 6.791 1.00 0.00 C ATOM 280 CG TYR A 17 14.488 3.113 7.415 1.00 0.00 C ATOM 281 CD1 TYR A 17 13.380 2.678 8.150 1.00 0.00 C ATOM 282 CD2 TYR A 17 15.596 2.270 7.254 1.00 0.00 C ATOM 283 CE1 TYR A 17 13.378 1.402 8.726 1.00 0.00 C ATOM 284 CE2 TYR A 17 15.594 0.994 7.830 1.00 0.00 C ATOM 285 CZ TYR A 17 14.485 0.560 8.566 1.00 0.00 C ATOM 286 OH TYR A 17 14.483 -0.698 9.134 1.00 0.00 O ATOM 0 H TYR A 17 12.687 5.426 8.256 1.00 0.00 H new ATOM 0 HA TYR A 17 15.563 5.179 8.530 1.00 0.00 H new ATOM 0 HB2 TYR A 17 13.525 4.690 6.324 1.00 0.00 H new ATOM 0 HB3 TYR A 17 15.242 4.543 6.003 1.00 0.00 H new ATOM 0 HD1 TYR A 17 12.526 3.327 8.273 1.00 0.00 H new ATOM 0 HD2 TYR A 17 16.451 2.605 6.686 1.00 0.00 H new ATOM 0 HE1 TYR A 17 12.522 1.067 9.294 1.00 0.00 H new ATOM 0 HE2 TYR A 17 16.448 0.344 7.707 1.00 0.00 H new ATOM 0 HH TYR A 17 15.326 -1.152 8.926 1.00 0.00 H new ATOM 296 N SER A 18 14.345 7.539 6.549 1.00 0.00 N ATOM 297 CA SER A 18 14.728 8.810 5.865 1.00 0.00 C ATOM 298 C SER A 18 14.408 10.013 6.761 1.00 0.00 C ATOM 299 O SER A 18 13.643 10.879 6.388 1.00 0.00 O ATOM 300 CB SER A 18 13.941 8.935 4.559 1.00 0.00 C ATOM 301 OG SER A 18 13.969 10.287 4.123 1.00 0.00 O ATOM 0 H SER A 18 13.362 7.281 6.463 1.00 0.00 H new ATOM 0 HA SER A 18 15.798 8.794 5.659 1.00 0.00 H new ATOM 0 HB2 SER A 18 14.373 8.286 3.797 1.00 0.00 H new ATOM 0 HB3 SER A 18 12.911 8.610 4.709 1.00 0.00 H new ATOM 0 HG SER A 18 13.460 10.843 4.749 1.00 0.00 H new ATOM 307 N GLY A 19 15.010 10.092 7.928 1.00 0.00 N ATOM 308 CA GLY A 19 14.770 11.257 8.846 1.00 0.00 C ATOM 309 C GLY A 19 16.097 11.998 9.016 1.00 0.00 C ATOM 310 O GLY A 19 16.140 13.133 9.447 1.00 0.00 O ATOM 0 H GLY A 19 15.662 9.394 8.286 1.00 0.00 H new ATOM 0 HA2 GLY A 19 14.012 11.921 8.431 1.00 0.00 H new ATOM 0 HA3 GLY A 19 14.398 10.913 9.811 1.00 0.00 H new ATOM 314 N ARG A 20 17.175 11.371 8.639 1.00 0.00 N ATOM 315 CA ARG A 20 18.510 12.028 8.725 1.00 0.00 C ATOM 316 C ARG A 20 18.516 13.276 7.846 1.00 0.00 C ATOM 317 O ARG A 20 19.183 14.242 8.158 1.00 0.00 O ATOM 318 CB ARG A 20 19.588 11.059 8.237 1.00 0.00 C ATOM 319 CG ARG A 20 19.407 9.705 8.926 1.00 0.00 C ATOM 320 CD ARG A 20 20.650 8.845 8.695 1.00 0.00 C ATOM 321 NE ARG A 20 21.044 8.914 7.259 1.00 0.00 N ATOM 322 CZ ARG A 20 22.172 8.387 6.865 1.00 0.00 C ATOM 323 NH1 ARG A 20 22.636 7.322 7.459 1.00 0.00 N ATOM 324 NH2 ARG A 20 22.835 8.925 5.878 1.00 0.00 N ATOM 0 H ARG A 20 17.189 10.420 8.270 1.00 0.00 H new ATOM 0 HA ARG A 20 18.713 12.307 9.759 1.00 0.00 H new ATOM 0 HB2 ARG A 20 19.523 10.940 7.155 1.00 0.00 H new ATOM 0 HB3 ARG A 20 20.578 11.460 8.454 1.00 0.00 H new ATOM 0 HG2 ARG A 20 19.244 9.848 9.994 1.00 0.00 H new ATOM 0 HG3 ARG A 20 18.524 9.200 8.533 1.00 0.00 H new ATOM 0 HD2 ARG A 20 21.469 9.194 9.325 1.00 0.00 H new ATOM 0 HD3 ARG A 20 20.448 7.812 8.978 1.00 0.00 H new ATOM 0 HE ARG A 20 20.432 9.373 6.584 1.00 0.00 H new ATOM 0 HH11 ARG A 20 22.118 6.902 8.230 1.00 0.00 H new ATOM 0 HH12 ARG A 20 23.517 6.910 7.152 1.00 0.00 H new ATOM 0 HH21 ARG A 20 22.472 9.758 5.414 1.00 0.00 H new ATOM 0 HH22 ARG A 20 23.716 8.513 5.571 1.00 0.00 H new ATOM 338 N GLU A 21 17.780 13.296 6.767 1.00 0.00 N ATOM 339 CA GLU A 21 17.770 14.528 5.919 1.00 0.00 C ATOM 340 C GLU A 21 16.411 14.694 5.239 1.00 0.00 C ATOM 341 O GLU A 21 15.862 15.777 5.198 1.00 0.00 O ATOM 342 CB GLU A 21 18.862 14.421 4.854 1.00 0.00 C ATOM 343 CG GLU A 21 20.233 14.396 5.532 1.00 0.00 C ATOM 344 CD GLU A 21 21.326 14.603 4.482 1.00 0.00 C ATOM 345 OE1 GLU A 21 21.418 15.701 3.960 1.00 0.00 O ATOM 346 OE2 GLU A 21 22.053 13.659 4.219 1.00 0.00 O ATOM 0 H GLU A 21 17.194 12.528 6.438 1.00 0.00 H new ATOM 0 HA GLU A 21 17.956 15.395 6.553 1.00 0.00 H new ATOM 0 HB2 GLU A 21 18.720 13.517 4.262 1.00 0.00 H new ATOM 0 HB3 GLU A 21 18.799 15.265 4.167 1.00 0.00 H new ATOM 0 HG2 GLU A 21 20.290 15.177 6.290 1.00 0.00 H new ATOM 0 HG3 GLU A 21 20.380 13.445 6.043 1.00 0.00 H new ATOM 353 N GLY A 22 15.860 13.641 4.698 1.00 0.00 N ATOM 354 CA GLY A 22 14.536 13.764 4.019 1.00 0.00 C ATOM 355 C GLY A 22 14.566 14.960 3.064 1.00 0.00 C ATOM 356 O GLY A 22 13.544 15.390 2.567 1.00 0.00 O ATOM 0 H GLY A 22 16.266 12.705 4.696 1.00 0.00 H new ATOM 0 HA2 GLY A 22 14.310 12.850 3.469 1.00 0.00 H new ATOM 0 HA3 GLY A 22 13.746 13.894 4.759 1.00 0.00 H new ATOM 360 N ASP A 23 15.727 15.500 2.799 1.00 0.00 N ATOM 361 CA ASP A 23 15.806 16.665 1.871 1.00 0.00 C ATOM 362 C ASP A 23 15.011 16.330 0.610 1.00 0.00 C ATOM 363 O ASP A 23 14.095 17.034 0.234 1.00 0.00 O ATOM 364 CB ASP A 23 17.268 16.933 1.504 1.00 0.00 C ATOM 365 CG ASP A 23 17.360 18.227 0.693 1.00 0.00 C ATOM 366 OD1 ASP A 23 16.387 18.963 0.677 1.00 0.00 O ATOM 367 OD2 ASP A 23 18.401 18.459 0.102 1.00 0.00 O ATOM 0 H ASP A 23 16.619 15.186 3.183 1.00 0.00 H new ATOM 0 HA ASP A 23 15.395 17.554 2.348 1.00 0.00 H new ATOM 0 HB2 ASP A 23 17.872 17.014 2.408 1.00 0.00 H new ATOM 0 HB3 ASP A 23 17.668 16.100 0.926 1.00 0.00 H new ATOM 372 N LYS A 24 15.337 15.240 -0.031 1.00 0.00 N ATOM 373 CA LYS A 24 14.584 14.830 -1.248 1.00 0.00 C ATOM 374 C LYS A 24 13.432 13.914 -0.817 1.00 0.00 C ATOM 375 O LYS A 24 13.246 13.638 0.352 1.00 0.00 O ATOM 376 CB LYS A 24 15.524 14.088 -2.215 1.00 0.00 C ATOM 377 CG LYS A 24 16.586 13.304 -1.432 1.00 0.00 C ATOM 378 CD LYS A 24 15.910 12.328 -0.463 1.00 0.00 C ATOM 379 CE LYS A 24 16.944 11.330 0.062 1.00 0.00 C ATOM 380 NZ LYS A 24 17.575 10.613 -1.083 1.00 0.00 N ATOM 0 H LYS A 24 16.096 14.614 0.238 1.00 0.00 H new ATOM 0 HA LYS A 24 14.186 15.706 -1.760 1.00 0.00 H new ATOM 0 HB2 LYS A 24 14.948 13.407 -2.841 1.00 0.00 H new ATOM 0 HB3 LYS A 24 16.008 14.802 -2.882 1.00 0.00 H new ATOM 0 HG2 LYS A 24 17.228 12.757 -2.122 1.00 0.00 H new ATOM 0 HG3 LYS A 24 17.225 13.993 -0.880 1.00 0.00 H new ATOM 0 HD2 LYS A 24 15.463 12.875 0.367 1.00 0.00 H new ATOM 0 HD3 LYS A 24 15.102 11.799 -0.968 1.00 0.00 H new ATOM 0 HE2 LYS A 24 17.706 11.852 0.642 1.00 0.00 H new ATOM 0 HE3 LYS A 24 16.467 10.616 0.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 17.733 9.618 -0.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 16.947 10.661 -1.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 18.486 11.060 -1.313 1.00 0.00 H new ATOM 394 N HIS A 25 12.680 13.424 -1.764 1.00 0.00 N ATOM 395 CA HIS A 25 11.549 12.493 -1.456 1.00 0.00 C ATOM 396 C HIS A 25 11.685 11.293 -2.389 1.00 0.00 C ATOM 397 O HIS A 25 10.736 10.864 -3.015 1.00 0.00 O ATOM 398 CB HIS A 25 10.215 13.199 -1.713 1.00 0.00 C ATOM 399 CG HIS A 25 10.141 14.454 -0.886 1.00 0.00 C ATOM 400 ND1 HIS A 25 11.021 15.510 -1.064 1.00 0.00 N ATOM 401 CD2 HIS A 25 9.296 14.837 0.126 1.00 0.00 C ATOM 402 CE1 HIS A 25 10.688 16.469 -0.181 1.00 0.00 C ATOM 403 NE2 HIS A 25 9.643 16.110 0.570 1.00 0.00 N ATOM 0 H HIS A 25 12.801 13.631 -2.755 1.00 0.00 H new ATOM 0 HA HIS A 25 11.577 12.179 -0.413 1.00 0.00 H new ATOM 0 HB2 HIS A 25 10.119 13.442 -2.771 1.00 0.00 H new ATOM 0 HB3 HIS A 25 9.387 12.536 -1.462 1.00 0.00 H new ATOM 0 HD2 HIS A 25 8.485 14.241 0.518 1.00 0.00 H new ATOM 0 HE1 HIS A 25 11.203 17.414 -0.090 1.00 0.00 H new ATOM 0 HE2 HIS A 25 9.196 16.652 1.309 1.00 0.00 H new ATOM 411 N LYS A 26 12.875 10.756 -2.484 1.00 0.00 N ATOM 412 CA LYS A 26 13.122 9.583 -3.374 1.00 0.00 C ATOM 413 C LYS A 26 13.936 8.530 -2.618 1.00 0.00 C ATOM 414 O LYS A 26 14.724 8.856 -1.752 1.00 0.00 O ATOM 415 CB LYS A 26 13.914 10.044 -4.601 1.00 0.00 C ATOM 416 CG LYS A 26 13.136 11.138 -5.337 1.00 0.00 C ATOM 417 CD LYS A 26 13.925 11.585 -6.571 1.00 0.00 C ATOM 418 CE LYS A 26 13.219 12.773 -7.229 1.00 0.00 C ATOM 419 NZ LYS A 26 13.135 13.900 -6.258 1.00 0.00 N ATOM 0 H LYS A 26 13.696 11.085 -1.976 1.00 0.00 H new ATOM 0 HA LYS A 26 12.170 9.153 -3.685 1.00 0.00 H new ATOM 0 HB2 LYS A 26 14.890 10.422 -4.295 1.00 0.00 H new ATOM 0 HB3 LYS A 26 14.093 9.201 -5.268 1.00 0.00 H new ATOM 0 HG2 LYS A 26 12.156 10.764 -5.635 1.00 0.00 H new ATOM 0 HG3 LYS A 26 12.966 11.986 -4.674 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.939 11.864 -6.285 1.00 0.00 H new ATOM 0 HD3 LYS A 26 14.009 10.761 -7.280 1.00 0.00 H new ATOM 0 HE2 LYS A 26 13.764 13.086 -8.120 1.00 0.00 H new ATOM 0 HE3 LYS A 26 12.220 12.482 -7.553 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 13.013 14.795 -6.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 12.324 13.752 -5.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 14.010 13.941 -5.697 1.00 0.00 H new ATOM 433 N LEU A 27 13.760 7.273 -2.940 1.00 0.00 N ATOM 434 CA LEU A 27 14.529 6.186 -2.249 1.00 0.00 C ATOM 435 C LEU A 27 15.276 5.377 -3.308 1.00 0.00 C ATOM 436 O LEU A 27 14.766 5.140 -4.383 1.00 0.00 O ATOM 437 CB LEU A 27 13.550 5.277 -1.499 1.00 0.00 C ATOM 438 CG LEU A 27 14.321 4.247 -0.660 1.00 0.00 C ATOM 439 CD1 LEU A 27 15.112 4.949 0.464 1.00 0.00 C ATOM 440 CD2 LEU A 27 13.319 3.259 -0.050 1.00 0.00 C ATOM 0 H LEU A 27 13.112 6.948 -3.657 1.00 0.00 H new ATOM 0 HA LEU A 27 15.238 6.612 -1.539 1.00 0.00 H new ATOM 0 HB2 LEU A 27 12.908 5.876 -0.853 1.00 0.00 H new ATOM 0 HB3 LEU A 27 12.900 4.766 -2.209 1.00 0.00 H new ATOM 0 HG LEU A 27 15.028 3.717 -1.298 1.00 0.00 H new ATOM 0 HD11 LEU A 27 15.652 4.204 1.049 1.00 0.00 H new ATOM 0 HD12 LEU A 27 15.821 5.651 0.026 1.00 0.00 H new ATOM 0 HD13 LEU A 27 14.422 5.488 1.113 1.00 0.00 H new ATOM 0 HD21 LEU A 27 13.854 2.522 0.549 1.00 0.00 H new ATOM 0 HD22 LEU A 27 12.615 3.799 0.583 1.00 0.00 H new ATOM 0 HD23 LEU A 27 12.775 2.753 -0.848 1.00 0.00 H new ATOM 452 N LYS A 28 16.487 4.959 -3.032 1.00 0.00 N ATOM 453 CA LYS A 28 17.249 4.175 -4.052 1.00 0.00 C ATOM 454 C LYS A 28 16.960 2.683 -3.872 1.00 0.00 C ATOM 455 O LYS A 28 16.716 2.218 -2.776 1.00 0.00 O ATOM 456 CB LYS A 28 18.748 4.433 -3.885 1.00 0.00 C ATOM 457 CG LYS A 28 19.051 5.901 -4.192 1.00 0.00 C ATOM 458 CD LYS A 28 20.530 6.183 -3.920 1.00 0.00 C ATOM 459 CE LYS A 28 20.861 7.619 -4.331 1.00 0.00 C ATOM 460 NZ LYS A 28 22.192 8.000 -3.777 1.00 0.00 N ATOM 0 H LYS A 28 16.977 5.125 -2.153 1.00 0.00 H new ATOM 0 HA LYS A 28 16.940 4.485 -5.050 1.00 0.00 H new ATOM 0 HB2 LYS A 28 19.058 4.192 -2.868 1.00 0.00 H new ATOM 0 HB3 LYS A 28 19.316 3.786 -4.554 1.00 0.00 H new ATOM 0 HG2 LYS A 28 18.813 6.123 -5.232 1.00 0.00 H new ATOM 0 HG3 LYS A 28 18.427 6.549 -3.577 1.00 0.00 H new ATOM 0 HD2 LYS A 28 20.750 6.036 -2.863 1.00 0.00 H new ATOM 0 HD3 LYS A 28 21.153 5.482 -4.476 1.00 0.00 H new ATOM 0 HE2 LYS A 28 20.869 7.705 -5.418 1.00 0.00 H new ATOM 0 HE3 LYS A 28 20.094 8.300 -3.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 22.418 8.976 -4.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 22.168 7.933 -2.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 22.920 7.357 -4.149 1.00 0.00 H new ATOM 474 N LYS A 29 16.986 1.926 -4.934 1.00 0.00 N ATOM 475 CA LYS A 29 16.714 0.463 -4.820 1.00 0.00 C ATOM 476 C LYS A 29 17.691 -0.186 -3.830 1.00 0.00 C ATOM 477 O LYS A 29 17.324 -1.039 -3.047 1.00 0.00 O ATOM 478 CB LYS A 29 16.889 -0.188 -6.199 1.00 0.00 C ATOM 479 CG LYS A 29 18.371 -0.183 -6.596 1.00 0.00 C ATOM 480 CD LYS A 29 18.507 -0.518 -8.085 1.00 0.00 C ATOM 481 CE LYS A 29 19.947 -0.942 -8.389 1.00 0.00 C ATOM 482 NZ LYS A 29 20.894 -0.007 -7.719 1.00 0.00 N ATOM 0 H LYS A 29 17.184 2.257 -5.878 1.00 0.00 H new ATOM 0 HA LYS A 29 15.696 0.317 -4.460 1.00 0.00 H new ATOM 0 HB2 LYS A 29 16.513 -1.211 -6.178 1.00 0.00 H new ATOM 0 HB3 LYS A 29 16.303 0.352 -6.943 1.00 0.00 H new ATOM 0 HG2 LYS A 29 18.809 0.794 -6.392 1.00 0.00 H new ATOM 0 HG3 LYS A 29 18.920 -0.910 -5.998 1.00 0.00 H new ATOM 0 HD2 LYS A 29 17.818 -1.319 -8.352 1.00 0.00 H new ATOM 0 HD3 LYS A 29 18.238 0.349 -8.689 1.00 0.00 H new ATOM 0 HE2 LYS A 29 20.118 -1.961 -8.041 1.00 0.00 H new ATOM 0 HE3 LYS A 29 20.118 -0.940 -9.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 21.816 -0.045 -8.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 20.518 0.961 -7.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 21.009 -0.284 -6.723 1.00 0.00 H new ATOM 496 N SER A 30 18.935 0.198 -3.882 1.00 0.00 N ATOM 497 CA SER A 30 19.952 -0.406 -2.972 1.00 0.00 C ATOM 498 C SER A 30 19.560 -0.214 -1.503 1.00 0.00 C ATOM 499 O SER A 30 19.723 -1.102 -0.680 1.00 0.00 O ATOM 500 CB SER A 30 21.301 0.271 -3.218 1.00 0.00 C ATOM 501 OG SER A 30 21.525 0.374 -4.618 1.00 0.00 O ATOM 0 H SER A 30 19.295 0.909 -4.519 1.00 0.00 H new ATOM 0 HA SER A 30 20.013 -1.475 -3.178 1.00 0.00 H new ATOM 0 HB2 SER A 30 21.313 1.261 -2.762 1.00 0.00 H new ATOM 0 HB3 SER A 30 22.100 -0.304 -2.751 1.00 0.00 H new ATOM 0 HG SER A 30 22.388 0.809 -4.780 1.00 0.00 H new ATOM 507 N GLU A 31 19.044 0.936 -1.159 1.00 0.00 N ATOM 508 CA GLU A 31 18.662 1.165 0.265 1.00 0.00 C ATOM 509 C GLU A 31 17.321 0.490 0.536 1.00 0.00 C ATOM 510 O GLU A 31 17.073 -0.020 1.611 1.00 0.00 O ATOM 511 CB GLU A 31 18.566 2.664 0.551 1.00 0.00 C ATOM 512 CG GLU A 31 19.974 3.258 0.646 1.00 0.00 C ATOM 513 CD GLU A 31 19.877 4.763 0.898 1.00 0.00 C ATOM 514 OE1 GLU A 31 19.406 5.463 0.016 1.00 0.00 O ATOM 515 OE2 GLU A 31 20.274 5.191 1.969 1.00 0.00 O ATOM 0 H GLU A 31 18.872 1.717 -1.792 1.00 0.00 H new ATOM 0 HA GLU A 31 19.423 0.739 0.919 1.00 0.00 H new ATOM 0 HB2 GLU A 31 18.003 3.160 -0.240 1.00 0.00 H new ATOM 0 HB3 GLU A 31 18.025 2.833 1.482 1.00 0.00 H new ATOM 0 HG2 GLU A 31 20.529 2.779 1.453 1.00 0.00 H new ATOM 0 HG3 GLU A 31 20.523 3.068 -0.276 1.00 0.00 H new ATOM 522 N LEU A 32 16.458 0.467 -0.444 1.00 0.00 N ATOM 523 CA LEU A 32 15.141 -0.193 -0.256 1.00 0.00 C ATOM 524 C LEU A 32 15.384 -1.674 0.030 1.00 0.00 C ATOM 525 O LEU A 32 14.767 -2.254 0.899 1.00 0.00 O ATOM 526 CB LEU A 32 14.294 -0.025 -1.524 1.00 0.00 C ATOM 527 CG LEU A 32 13.043 -0.915 -1.468 1.00 0.00 C ATOM 528 CD1 LEU A 32 12.259 -0.641 -0.180 1.00 0.00 C ATOM 529 CD2 LEU A 32 12.155 -0.603 -2.676 1.00 0.00 C ATOM 0 H LEU A 32 16.611 0.878 -1.365 1.00 0.00 H new ATOM 0 HA LEU A 32 14.604 0.259 0.578 1.00 0.00 H new ATOM 0 HB2 LEU A 32 13.999 1.018 -1.633 1.00 0.00 H new ATOM 0 HB3 LEU A 32 14.889 -0.281 -2.401 1.00 0.00 H new ATOM 0 HG LEU A 32 13.345 -1.962 -1.485 1.00 0.00 H new ATOM 0 HD11 LEU A 32 11.374 -1.277 -0.150 1.00 0.00 H new ATOM 0 HD12 LEU A 32 12.890 -0.856 0.683 1.00 0.00 H new ATOM 0 HD13 LEU A 32 11.955 0.405 -0.155 1.00 0.00 H new ATOM 0 HD21 LEU A 32 11.264 -1.230 -2.644 1.00 0.00 H new ATOM 0 HD22 LEU A 32 11.861 0.446 -2.650 1.00 0.00 H new ATOM 0 HD23 LEU A 32 12.707 -0.802 -3.595 1.00 0.00 H new ATOM 541 N LYS A 33 16.263 -2.309 -0.698 1.00 0.00 N ATOM 542 CA LYS A 33 16.495 -3.755 -0.449 1.00 0.00 C ATOM 543 C LYS A 33 16.788 -3.957 1.033 1.00 0.00 C ATOM 544 O LYS A 33 16.117 -4.706 1.713 1.00 0.00 O ATOM 545 CB LYS A 33 17.681 -4.239 -1.285 1.00 0.00 C ATOM 546 CG LYS A 33 17.851 -5.747 -1.104 1.00 0.00 C ATOM 547 CD LYS A 33 19.009 -6.238 -1.976 1.00 0.00 C ATOM 548 CE LYS A 33 19.067 -7.765 -1.934 1.00 0.00 C ATOM 549 NZ LYS A 33 20.172 -8.245 -2.812 1.00 0.00 N ATOM 0 H LYS A 33 16.822 -1.894 -1.443 1.00 0.00 H new ATOM 0 HA LYS A 33 15.611 -4.327 -0.730 1.00 0.00 H new ATOM 0 HB2 LYS A 33 17.518 -4.004 -2.337 1.00 0.00 H new ATOM 0 HB3 LYS A 33 18.590 -3.721 -0.980 1.00 0.00 H new ATOM 0 HG2 LYS A 33 18.046 -5.979 -0.057 1.00 0.00 H new ATOM 0 HG3 LYS A 33 16.931 -6.263 -1.378 1.00 0.00 H new ATOM 0 HD2 LYS A 33 18.875 -5.897 -3.003 1.00 0.00 H new ATOM 0 HD3 LYS A 33 19.950 -5.818 -1.620 1.00 0.00 H new ATOM 0 HE2 LYS A 33 19.227 -8.105 -0.911 1.00 0.00 H new ATOM 0 HE3 LYS A 33 18.117 -8.185 -2.265 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 20.212 -9.284 -2.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 20.000 -7.932 -3.789 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 21.076 -7.855 -2.477 1.00 0.00 H new ATOM 563 N GLU A 34 17.794 -3.294 1.539 1.00 0.00 N ATOM 564 CA GLU A 34 18.127 -3.459 2.987 1.00 0.00 C ATOM 565 C GLU A 34 16.842 -3.317 3.813 1.00 0.00 C ATOM 566 O GLU A 34 16.658 -3.990 4.808 1.00 0.00 O ATOM 567 CB GLU A 34 19.137 -2.392 3.415 1.00 0.00 C ATOM 568 CG GLU A 34 20.437 -2.575 2.628 1.00 0.00 C ATOM 569 CD GLU A 34 21.428 -1.477 3.015 1.00 0.00 C ATOM 570 OE1 GLU A 34 21.030 -0.571 3.729 1.00 0.00 O ATOM 571 OE2 GLU A 34 22.568 -1.559 2.590 1.00 0.00 O ATOM 0 H GLU A 34 18.394 -2.652 1.021 1.00 0.00 H new ATOM 0 HA GLU A 34 18.565 -4.444 3.152 1.00 0.00 H new ATOM 0 HB2 GLU A 34 18.729 -1.397 3.237 1.00 0.00 H new ATOM 0 HB3 GLU A 34 19.333 -2.470 4.484 1.00 0.00 H new ATOM 0 HG2 GLU A 34 20.865 -3.556 2.836 1.00 0.00 H new ATOM 0 HG3 GLU A 34 20.235 -2.536 1.558 1.00 0.00 H new ATOM 578 N LEU A 35 15.943 -2.463 3.402 1.00 0.00 N ATOM 579 CA LEU A 35 14.666 -2.302 4.159 1.00 0.00 C ATOM 580 C LEU A 35 13.855 -3.606 4.044 1.00 0.00 C ATOM 581 O LEU A 35 13.408 -4.148 5.033 1.00 0.00 O ATOM 582 CB LEU A 35 13.873 -1.102 3.579 1.00 0.00 C ATOM 583 CG LEU A 35 13.848 0.074 4.574 1.00 0.00 C ATOM 584 CD1 LEU A 35 13.478 1.363 3.836 1.00 0.00 C ATOM 585 CD2 LEU A 35 12.808 -0.194 5.667 1.00 0.00 C ATOM 0 H LEU A 35 16.037 -1.871 2.577 1.00 0.00 H new ATOM 0 HA LEU A 35 14.867 -2.103 5.212 1.00 0.00 H new ATOM 0 HB2 LEU A 35 14.327 -0.781 2.641 1.00 0.00 H new ATOM 0 HB3 LEU A 35 12.853 -1.412 3.350 1.00 0.00 H new ATOM 0 HG LEU A 35 14.834 0.179 5.026 1.00 0.00 H new ATOM 0 HD11 LEU A 35 13.461 2.194 4.541 1.00 0.00 H new ATOM 0 HD12 LEU A 35 14.216 1.562 3.059 1.00 0.00 H new ATOM 0 HD13 LEU A 35 12.493 1.252 3.382 1.00 0.00 H new ATOM 0 HD21 LEU A 35 12.794 0.640 6.368 1.00 0.00 H new ATOM 0 HD22 LEU A 35 11.823 -0.303 5.213 1.00 0.00 H new ATOM 0 HD23 LEU A 35 13.066 -1.110 6.198 1.00 0.00 H new ATOM 597 N ILE A 36 13.677 -4.128 2.859 1.00 0.00 N ATOM 598 CA ILE A 36 12.914 -5.403 2.707 1.00 0.00 C ATOM 599 C ILE A 36 13.498 -6.469 3.641 1.00 0.00 C ATOM 600 O ILE A 36 12.781 -7.267 4.211 1.00 0.00 O ATOM 601 CB ILE A 36 13.031 -5.865 1.247 1.00 0.00 C ATOM 602 CG1 ILE A 36 12.494 -4.745 0.345 1.00 0.00 C ATOM 603 CG2 ILE A 36 12.203 -7.141 1.030 1.00 0.00 C ATOM 604 CD1 ILE A 36 12.473 -5.202 -1.115 1.00 0.00 C ATOM 0 H ILE A 36 14.027 -3.727 1.989 1.00 0.00 H new ATOM 0 HA ILE A 36 11.867 -5.249 2.966 1.00 0.00 H new ATOM 0 HB ILE A 36 14.072 -6.081 1.008 1.00 0.00 H new ATOM 0 HG12 ILE A 36 11.489 -4.466 0.660 1.00 0.00 H new ATOM 0 HG13 ILE A 36 13.118 -3.857 0.446 1.00 0.00 H new ATOM 0 HG21 ILE A 36 12.292 -7.461 -0.008 1.00 0.00 H new ATOM 0 HG22 ILE A 36 12.572 -7.930 1.686 1.00 0.00 H new ATOM 0 HG23 ILE A 36 11.157 -6.939 1.259 1.00 0.00 H new ATOM 0 HD11 ILE A 36 12.090 -4.397 -1.743 1.00 0.00 H new ATOM 0 HD12 ILE A 36 13.484 -5.458 -1.431 1.00 0.00 H new ATOM 0 HD13 ILE A 36 11.830 -6.076 -1.213 1.00 0.00 H new ATOM 616 N ASN A 37 14.793 -6.506 3.781 1.00 0.00 N ATOM 617 CA ASN A 37 15.426 -7.538 4.654 1.00 0.00 C ATOM 618 C ASN A 37 15.007 -7.341 6.115 1.00 0.00 C ATOM 619 O ASN A 37 14.988 -8.274 6.893 1.00 0.00 O ATOM 620 CB ASN A 37 16.947 -7.414 4.549 1.00 0.00 C ATOM 621 CG ASN A 37 17.608 -8.593 5.266 1.00 0.00 C ATOM 622 OD1 ASN A 37 17.449 -9.729 4.866 1.00 0.00 O ATOM 623 ND2 ASN A 37 18.347 -8.369 6.317 1.00 0.00 N ATOM 0 H ASN A 37 15.444 -5.865 3.328 1.00 0.00 H new ATOM 0 HA ASN A 37 15.101 -8.525 4.326 1.00 0.00 H new ATOM 0 HB2 ASN A 37 17.249 -7.396 3.502 1.00 0.00 H new ATOM 0 HB3 ASN A 37 17.277 -6.474 4.992 1.00 0.00 H new ATOM 0 HD21 ASN A 37 18.792 -9.148 6.803 1.00 0.00 H new ATOM 0 HD22 ASN A 37 18.480 -7.415 6.653 1.00 0.00 H new ATOM 630 N ASN A 38 14.697 -6.127 6.496 1.00 0.00 N ATOM 631 CA ASN A 38 14.305 -5.839 7.915 1.00 0.00 C ATOM 632 C ASN A 38 12.883 -5.278 7.975 1.00 0.00 C ATOM 633 O ASN A 38 12.405 -4.916 9.032 1.00 0.00 O ATOM 634 CB ASN A 38 15.265 -4.791 8.482 1.00 0.00 C ATOM 635 CG ASN A 38 16.647 -5.418 8.682 1.00 0.00 C ATOM 636 OD1 ASN A 38 17.179 -6.043 7.786 1.00 0.00 O ATOM 637 ND2 ASN A 38 17.254 -5.276 9.828 1.00 0.00 N ATOM 0 H ASN A 38 14.698 -5.314 5.880 1.00 0.00 H new ATOM 0 HA ASN A 38 14.349 -6.763 8.491 1.00 0.00 H new ATOM 0 HB2 ASN A 38 15.335 -3.941 7.803 1.00 0.00 H new ATOM 0 HB3 ASN A 38 14.886 -4.411 9.431 1.00 0.00 H new ATOM 0 HD21 ASN A 38 18.175 -5.690 9.972 1.00 0.00 H new ATOM 0 HD22 ASN A 38 16.807 -4.751 10.580 1.00 0.00 H new ATOM 644 N GLU A 39 12.206 -5.183 6.858 1.00 0.00 N ATOM 645 CA GLU A 39 10.817 -4.619 6.863 1.00 0.00 C ATOM 646 C GLU A 39 9.780 -5.735 6.703 1.00 0.00 C ATOM 647 O GLU A 39 8.686 -5.647 7.225 1.00 0.00 O ATOM 648 CB GLU A 39 10.681 -3.639 5.696 1.00 0.00 C ATOM 649 CG GLU A 39 9.377 -2.856 5.831 1.00 0.00 C ATOM 650 CD GLU A 39 9.142 -2.033 4.563 1.00 0.00 C ATOM 651 OE1 GLU A 39 8.531 -2.556 3.646 1.00 0.00 O ATOM 652 OE2 GLU A 39 9.579 -0.894 4.530 1.00 0.00 O ATOM 0 H GLU A 39 12.553 -5.471 5.943 1.00 0.00 H new ATOM 0 HA GLU A 39 10.642 -4.113 7.812 1.00 0.00 H new ATOM 0 HB2 GLU A 39 11.528 -2.954 5.683 1.00 0.00 H new ATOM 0 HB3 GLU A 39 10.695 -4.181 4.750 1.00 0.00 H new ATOM 0 HG2 GLU A 39 8.544 -3.541 5.992 1.00 0.00 H new ATOM 0 HG3 GLU A 39 9.423 -2.200 6.700 1.00 0.00 H new ATOM 659 N LEU A 40 10.116 -6.784 5.991 1.00 0.00 N ATOM 660 CA LEU A 40 9.154 -7.920 5.792 1.00 0.00 C ATOM 661 C LEU A 40 9.810 -9.233 6.228 1.00 0.00 C ATOM 662 O LEU A 40 9.639 -10.261 5.603 1.00 0.00 O ATOM 663 CB LEU A 40 8.779 -8.014 4.310 1.00 0.00 C ATOM 664 CG LEU A 40 8.278 -6.653 3.808 1.00 0.00 C ATOM 665 CD1 LEU A 40 8.070 -6.716 2.293 1.00 0.00 C ATOM 666 CD2 LEU A 40 6.947 -6.299 4.490 1.00 0.00 C ATOM 0 H LEU A 40 11.021 -6.905 5.535 1.00 0.00 H new ATOM 0 HA LEU A 40 8.259 -7.744 6.389 1.00 0.00 H new ATOM 0 HB2 LEU A 40 9.644 -8.330 3.727 1.00 0.00 H new ATOM 0 HB3 LEU A 40 8.006 -8.770 4.169 1.00 0.00 H new ATOM 0 HG LEU A 40 9.018 -5.889 4.048 1.00 0.00 H new ATOM 0 HD11 LEU A 40 7.714 -5.750 1.934 1.00 0.00 H new ATOM 0 HD12 LEU A 40 9.014 -6.959 1.806 1.00 0.00 H new ATOM 0 HD13 LEU A 40 7.333 -7.484 2.059 1.00 0.00 H new ATOM 0 HD21 LEU A 40 6.599 -5.332 4.128 1.00 0.00 H new ATOM 0 HD22 LEU A 40 6.205 -7.062 4.257 1.00 0.00 H new ATOM 0 HD23 LEU A 40 7.092 -6.252 5.569 1.00 0.00 H new ATOM 678 N SER A 41 10.565 -9.204 7.291 1.00 0.00 N ATOM 679 CA SER A 41 11.239 -10.447 7.764 1.00 0.00 C ATOM 680 C SER A 41 10.200 -11.440 8.292 1.00 0.00 C ATOM 681 O SER A 41 10.397 -12.637 8.238 1.00 0.00 O ATOM 682 CB SER A 41 12.217 -10.096 8.887 1.00 0.00 C ATOM 683 OG SER A 41 11.535 -9.351 9.887 1.00 0.00 O ATOM 0 H SER A 41 10.745 -8.372 7.854 1.00 0.00 H new ATOM 0 HA SER A 41 11.776 -10.900 6.931 1.00 0.00 H new ATOM 0 HB2 SER A 41 12.636 -11.005 9.317 1.00 0.00 H new ATOM 0 HB3 SER A 41 13.051 -9.517 8.491 1.00 0.00 H new ATOM 0 HG SER A 41 12.158 -9.126 10.609 1.00 0.00 H new ATOM 689 N HIS A 42 9.099 -10.964 8.804 1.00 0.00 N ATOM 690 CA HIS A 42 8.066 -11.900 9.331 1.00 0.00 C ATOM 691 C HIS A 42 7.317 -12.558 8.170 1.00 0.00 C ATOM 692 O HIS A 42 7.195 -13.765 8.105 1.00 0.00 O ATOM 693 CB HIS A 42 7.077 -11.125 10.205 1.00 0.00 C ATOM 694 CG HIS A 42 7.731 -10.786 11.517 1.00 0.00 C ATOM 695 ND1 HIS A 42 7.020 -10.726 12.705 1.00 0.00 N ATOM 696 CD2 HIS A 42 9.032 -10.496 11.842 1.00 0.00 C ATOM 697 CE1 HIS A 42 7.890 -10.412 13.681 1.00 0.00 C ATOM 698 NE2 HIS A 42 9.131 -10.261 13.209 1.00 0.00 N ATOM 0 H HIS A 42 8.870 -9.973 8.880 1.00 0.00 H new ATOM 0 HA HIS A 42 8.552 -12.674 9.925 1.00 0.00 H new ATOM 0 HB2 HIS A 42 6.762 -10.214 9.697 1.00 0.00 H new ATOM 0 HB3 HIS A 42 6.181 -11.721 10.376 1.00 0.00 H new ATOM 0 HD2 HIS A 42 9.854 -10.456 11.143 1.00 0.00 H new ATOM 0 HE1 HIS A 42 7.619 -10.296 14.720 1.00 0.00 H new ATOM 0 HE2 HIS A 42 9.970 -10.024 13.738 1.00 0.00 H new ATOM 706 N PHE A 43 6.811 -11.780 7.253 1.00 0.00 N ATOM 707 CA PHE A 43 6.070 -12.373 6.106 1.00 0.00 C ATOM 708 C PHE A 43 7.024 -13.246 5.287 1.00 0.00 C ATOM 709 O PHE A 43 6.608 -14.103 4.532 1.00 0.00 O ATOM 710 CB PHE A 43 5.498 -11.254 5.232 1.00 0.00 C ATOM 711 CG PHE A 43 4.406 -10.537 5.993 1.00 0.00 C ATOM 712 CD1 PHE A 43 3.142 -11.125 6.124 1.00 0.00 C ATOM 713 CD2 PHE A 43 4.659 -9.286 6.571 1.00 0.00 C ATOM 714 CE1 PHE A 43 2.132 -10.463 6.832 1.00 0.00 C ATOM 715 CE2 PHE A 43 3.648 -8.625 7.279 1.00 0.00 C ATOM 716 CZ PHE A 43 2.385 -9.214 7.410 1.00 0.00 C ATOM 0 H PHE A 43 6.879 -10.762 7.249 1.00 0.00 H new ATOM 0 HA PHE A 43 5.249 -12.987 6.475 1.00 0.00 H new ATOM 0 HB2 PHE A 43 6.286 -10.553 4.956 1.00 0.00 H new ATOM 0 HB3 PHE A 43 5.100 -11.667 4.305 1.00 0.00 H new ATOM 0 HD1 PHE A 43 2.946 -12.089 5.679 1.00 0.00 H new ATOM 0 HD2 PHE A 43 5.634 -8.832 6.470 1.00 0.00 H new ATOM 0 HE1 PHE A 43 1.157 -10.917 6.932 1.00 0.00 H new ATOM 0 HE2 PHE A 43 3.843 -7.660 7.724 1.00 0.00 H new ATOM 0 HZ PHE A 43 1.606 -8.704 7.957 1.00 0.00 H new ATOM 726 N LEU A 44 8.302 -13.029 5.429 1.00 0.00 N ATOM 727 CA LEU A 44 9.293 -13.836 4.661 1.00 0.00 C ATOM 728 C LEU A 44 8.969 -15.325 4.805 1.00 0.00 C ATOM 729 O LEU A 44 8.887 -16.052 3.834 1.00 0.00 O ATOM 730 CB LEU A 44 10.695 -13.563 5.220 1.00 0.00 C ATOM 731 CG LEU A 44 11.771 -14.210 4.323 1.00 0.00 C ATOM 732 CD1 LEU A 44 12.105 -13.285 3.147 1.00 0.00 C ATOM 733 CD2 LEU A 44 13.042 -14.453 5.144 1.00 0.00 C ATOM 0 H LEU A 44 8.705 -12.324 6.047 1.00 0.00 H new ATOM 0 HA LEU A 44 9.252 -13.561 3.607 1.00 0.00 H new ATOM 0 HB2 LEU A 44 10.864 -12.488 5.283 1.00 0.00 H new ATOM 0 HB3 LEU A 44 10.772 -13.958 6.233 1.00 0.00 H new ATOM 0 HG LEU A 44 11.388 -15.156 3.940 1.00 0.00 H new ATOM 0 HD11 LEU A 44 12.865 -13.752 2.521 1.00 0.00 H new ATOM 0 HD12 LEU A 44 11.206 -13.109 2.556 1.00 0.00 H new ATOM 0 HD13 LEU A 44 12.481 -12.335 3.527 1.00 0.00 H new ATOM 0 HD21 LEU A 44 13.802 -14.910 4.511 1.00 0.00 H new ATOM 0 HD22 LEU A 44 13.413 -13.503 5.529 1.00 0.00 H new ATOM 0 HD23 LEU A 44 12.815 -15.119 5.977 1.00 0.00 H new ATOM 745 N GLU A 45 8.794 -15.784 6.010 1.00 0.00 N ATOM 746 CA GLU A 45 8.486 -17.225 6.223 1.00 0.00 C ATOM 747 C GLU A 45 7.241 -17.613 5.423 1.00 0.00 C ATOM 748 O GLU A 45 7.080 -18.747 5.017 1.00 0.00 O ATOM 749 CB GLU A 45 8.229 -17.471 7.713 1.00 0.00 C ATOM 750 CG GLU A 45 8.286 -18.974 8.006 1.00 0.00 C ATOM 751 CD GLU A 45 9.745 -19.437 8.041 1.00 0.00 C ATOM 752 OE1 GLU A 45 10.360 -19.313 9.087 1.00 0.00 O ATOM 753 OE2 GLU A 45 10.221 -19.910 7.023 1.00 0.00 O ATOM 0 H GLU A 45 8.851 -15.223 6.860 1.00 0.00 H new ATOM 0 HA GLU A 45 9.330 -17.828 5.889 1.00 0.00 H new ATOM 0 HB2 GLU A 45 8.973 -16.946 8.312 1.00 0.00 H new ATOM 0 HB3 GLU A 45 7.254 -17.073 7.994 1.00 0.00 H new ATOM 0 HG2 GLU A 45 7.804 -19.187 8.960 1.00 0.00 H new ATOM 0 HG3 GLU A 45 7.738 -19.525 7.242 1.00 0.00 H new ATOM 760 N GLU A 46 6.347 -16.684 5.213 1.00 0.00 N ATOM 761 CA GLU A 46 5.092 -16.998 4.461 1.00 0.00 C ATOM 762 C GLU A 46 5.266 -16.715 2.963 1.00 0.00 C ATOM 763 O GLU A 46 4.555 -15.909 2.396 1.00 0.00 O ATOM 764 CB GLU A 46 3.953 -16.134 5.006 1.00 0.00 C ATOM 765 CG GLU A 46 3.656 -16.535 6.453 1.00 0.00 C ATOM 766 CD GLU A 46 2.788 -15.462 7.113 1.00 0.00 C ATOM 767 OE1 GLU A 46 2.251 -14.635 6.394 1.00 0.00 O ATOM 768 OE2 GLU A 46 2.674 -15.486 8.328 1.00 0.00 O ATOM 0 H GLU A 46 6.430 -15.718 5.530 1.00 0.00 H new ATOM 0 HA GLU A 46 4.863 -18.056 4.591 1.00 0.00 H new ATOM 0 HB2 GLU A 46 4.227 -15.080 4.958 1.00 0.00 H new ATOM 0 HB3 GLU A 46 3.061 -16.260 4.392 1.00 0.00 H new ATOM 0 HG2 GLU A 46 3.144 -17.497 6.477 1.00 0.00 H new ATOM 0 HG3 GLU A 46 4.587 -16.655 7.006 1.00 0.00 H new ATOM 775 N ILE A 47 6.188 -17.388 2.314 1.00 0.00 N ATOM 776 CA ILE A 47 6.398 -17.183 0.840 1.00 0.00 C ATOM 777 C ILE A 47 6.280 -18.536 0.132 1.00 0.00 C ATOM 778 O ILE A 47 7.178 -19.353 0.185 1.00 0.00 O ATOM 779 CB ILE A 47 7.791 -16.593 0.589 1.00 0.00 C ATOM 780 CG1 ILE A 47 7.836 -15.155 1.117 1.00 0.00 C ATOM 781 CG2 ILE A 47 8.082 -16.589 -0.917 1.00 0.00 C ATOM 782 CD1 ILE A 47 9.277 -14.636 1.096 1.00 0.00 C ATOM 0 H ILE A 47 6.808 -18.075 2.743 1.00 0.00 H new ATOM 0 HA ILE A 47 5.647 -16.493 0.455 1.00 0.00 H new ATOM 0 HB ILE A 47 8.539 -17.197 1.103 1.00 0.00 H new ATOM 0 HG12 ILE A 47 7.201 -14.514 0.506 1.00 0.00 H new ATOM 0 HG13 ILE A 47 7.442 -15.119 2.133 1.00 0.00 H new ATOM 0 HG21 ILE A 47 9.072 -16.170 -1.095 1.00 0.00 H new ATOM 0 HG22 ILE A 47 8.047 -17.610 -1.297 1.00 0.00 H new ATOM 0 HG23 ILE A 47 7.334 -15.985 -1.430 1.00 0.00 H new ATOM 0 HD11 ILE A 47 9.301 -13.613 1.473 1.00 0.00 H new ATOM 0 HD12 ILE A 47 9.901 -15.270 1.726 1.00 0.00 H new ATOM 0 HD13 ILE A 47 9.656 -14.655 0.074 1.00 0.00 H new ATOM 794 N LYS A 48 5.179 -18.783 -0.533 1.00 0.00 N ATOM 795 CA LYS A 48 5.008 -20.088 -1.243 1.00 0.00 C ATOM 796 C LYS A 48 5.485 -19.946 -2.692 1.00 0.00 C ATOM 797 O LYS A 48 6.214 -20.775 -3.200 1.00 0.00 O ATOM 798 CB LYS A 48 3.531 -20.488 -1.224 1.00 0.00 C ATOM 799 CG LYS A 48 3.393 -21.954 -1.645 1.00 0.00 C ATOM 800 CD LYS A 48 1.919 -22.280 -1.911 1.00 0.00 C ATOM 801 CE LYS A 48 1.125 -22.213 -0.604 1.00 0.00 C ATOM 802 NZ LYS A 48 -0.184 -22.903 -0.783 1.00 0.00 N ATOM 0 H LYS A 48 4.392 -18.139 -0.615 1.00 0.00 H new ATOM 0 HA LYS A 48 5.597 -20.857 -0.742 1.00 0.00 H new ATOM 0 HB2 LYS A 48 3.117 -20.345 -0.226 1.00 0.00 H new ATOM 0 HB3 LYS A 48 2.962 -19.850 -1.899 1.00 0.00 H new ATOM 0 HG2 LYS A 48 3.984 -22.142 -2.541 1.00 0.00 H new ATOM 0 HG3 LYS A 48 3.784 -22.605 -0.863 1.00 0.00 H new ATOM 0 HD2 LYS A 48 1.507 -21.576 -2.633 1.00 0.00 H new ATOM 0 HD3 LYS A 48 1.831 -23.274 -2.349 1.00 0.00 H new ATOM 0 HE2 LYS A 48 1.689 -22.683 0.201 1.00 0.00 H new ATOM 0 HE3 LYS A 48 0.964 -21.174 -0.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -0.724 -22.858 0.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -0.722 -22.435 -1.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -0.020 -23.898 -1.038 1.00 0.00 H new ATOM 816 N GLU A 49 5.081 -18.898 -3.361 1.00 0.00 N ATOM 817 CA GLU A 49 5.514 -18.699 -4.777 1.00 0.00 C ATOM 818 C GLU A 49 6.893 -18.032 -4.798 1.00 0.00 C ATOM 819 O GLU A 49 7.039 -16.899 -5.213 1.00 0.00 O ATOM 820 CB GLU A 49 4.499 -17.809 -5.500 1.00 0.00 C ATOM 821 CG GLU A 49 3.078 -18.242 -5.128 1.00 0.00 C ATOM 822 CD GLU A 49 2.909 -19.739 -5.397 1.00 0.00 C ATOM 823 OE1 GLU A 49 3.445 -20.207 -6.388 1.00 0.00 O ATOM 824 OE2 GLU A 49 2.245 -20.391 -4.608 1.00 0.00 O ATOM 0 H GLU A 49 4.470 -18.171 -2.989 1.00 0.00 H new ATOM 0 HA GLU A 49 5.571 -19.664 -5.281 1.00 0.00 H new ATOM 0 HB2 GLU A 49 4.655 -16.766 -5.226 1.00 0.00 H new ATOM 0 HB3 GLU A 49 4.641 -17.880 -6.578 1.00 0.00 H new ATOM 0 HG2 GLU A 49 2.885 -18.027 -4.077 1.00 0.00 H new ATOM 0 HG3 GLU A 49 2.351 -17.674 -5.708 1.00 0.00 H new ATOM 831 N GLN A 50 7.903 -18.718 -4.339 1.00 0.00 N ATOM 832 CA GLN A 50 9.269 -18.118 -4.315 1.00 0.00 C ATOM 833 C GLN A 50 9.573 -17.434 -5.652 1.00 0.00 C ATOM 834 O GLN A 50 10.408 -16.554 -5.733 1.00 0.00 O ATOM 835 CB GLN A 50 10.300 -19.221 -4.071 1.00 0.00 C ATOM 836 CG GLN A 50 9.962 -19.961 -2.775 1.00 0.00 C ATOM 837 CD GLN A 50 11.058 -20.984 -2.472 1.00 0.00 C ATOM 838 OE1 GLN A 50 12.009 -20.684 -1.778 1.00 0.00 O ATOM 839 NE2 GLN A 50 10.965 -22.188 -2.967 1.00 0.00 N ATOM 0 H GLN A 50 7.842 -19.670 -3.979 1.00 0.00 H new ATOM 0 HA GLN A 50 9.316 -17.377 -3.517 1.00 0.00 H new ATOM 0 HB2 GLN A 50 10.307 -19.918 -4.909 1.00 0.00 H new ATOM 0 HB3 GLN A 50 11.299 -18.791 -4.006 1.00 0.00 H new ATOM 0 HG2 GLN A 50 9.873 -19.252 -1.952 1.00 0.00 H new ATOM 0 HG3 GLN A 50 8.998 -20.462 -2.870 1.00 0.00 H new ATOM 0 HE21 GLN A 50 10.166 -22.440 -3.550 1.00 0.00 H new ATOM 0 HE22 GLN A 50 11.691 -22.877 -2.771 1.00 0.00 H new ATOM 848 N GLU A 51 8.914 -17.841 -6.704 1.00 0.00 N ATOM 849 CA GLU A 51 9.179 -17.222 -8.036 1.00 0.00 C ATOM 850 C GLU A 51 8.564 -15.821 -8.103 1.00 0.00 C ATOM 851 O GLU A 51 9.043 -14.969 -8.825 1.00 0.00 O ATOM 852 CB GLU A 51 8.618 -18.106 -9.152 1.00 0.00 C ATOM 853 CG GLU A 51 9.509 -19.337 -9.325 1.00 0.00 C ATOM 854 CD GLU A 51 9.627 -20.075 -7.990 1.00 0.00 C ATOM 855 OE1 GLU A 51 8.599 -20.326 -7.382 1.00 0.00 O ATOM 856 OE2 GLU A 51 10.742 -20.376 -7.598 1.00 0.00 O ATOM 0 H GLU A 51 8.205 -18.574 -6.699 1.00 0.00 H new ATOM 0 HA GLU A 51 10.257 -17.134 -8.172 1.00 0.00 H new ATOM 0 HB2 GLU A 51 7.600 -18.412 -8.911 1.00 0.00 H new ATOM 0 HB3 GLU A 51 8.570 -17.545 -10.085 1.00 0.00 H new ATOM 0 HG2 GLU A 51 9.089 -19.999 -10.082 1.00 0.00 H new ATOM 0 HG3 GLU A 51 10.497 -19.038 -9.675 1.00 0.00 H new ATOM 863 N VAL A 52 7.549 -15.546 -7.334 1.00 0.00 N ATOM 864 CA VAL A 52 6.979 -14.169 -7.350 1.00 0.00 C ATOM 865 C VAL A 52 7.957 -13.263 -6.609 1.00 0.00 C ATOM 866 O VAL A 52 8.346 -12.222 -7.101 1.00 0.00 O ATOM 867 CB VAL A 52 5.628 -14.151 -6.628 1.00 0.00 C ATOM 868 CG1 VAL A 52 5.152 -12.706 -6.458 1.00 0.00 C ATOM 869 CG2 VAL A 52 4.597 -14.924 -7.449 1.00 0.00 C ATOM 0 H VAL A 52 7.093 -16.205 -6.702 1.00 0.00 H new ATOM 0 HA VAL A 52 6.829 -13.832 -8.376 1.00 0.00 H new ATOM 0 HB VAL A 52 5.741 -14.616 -5.649 1.00 0.00 H new ATOM 0 HG11 VAL A 52 4.191 -12.698 -5.944 1.00 0.00 H new ATOM 0 HG12 VAL A 52 5.882 -12.149 -5.871 1.00 0.00 H new ATOM 0 HG13 VAL A 52 5.044 -12.241 -7.438 1.00 0.00 H new ATOM 0 HG21 VAL A 52 3.637 -14.910 -6.933 1.00 0.00 H new ATOM 0 HG22 VAL A 52 4.490 -14.459 -8.429 1.00 0.00 H new ATOM 0 HG23 VAL A 52 4.928 -15.955 -7.571 1.00 0.00 H new ATOM 879 N VAL A 53 8.374 -13.650 -5.439 1.00 0.00 N ATOM 880 CA VAL A 53 9.339 -12.807 -4.691 1.00 0.00 C ATOM 881 C VAL A 53 10.638 -12.723 -5.492 1.00 0.00 C ATOM 882 O VAL A 53 11.346 -11.737 -5.454 1.00 0.00 O ATOM 883 CB VAL A 53 9.619 -13.441 -3.326 1.00 0.00 C ATOM 884 CG1 VAL A 53 10.727 -12.661 -2.617 1.00 0.00 C ATOM 885 CG2 VAL A 53 8.346 -13.404 -2.475 1.00 0.00 C ATOM 0 H VAL A 53 8.089 -14.510 -4.971 1.00 0.00 H new ATOM 0 HA VAL A 53 8.927 -11.809 -4.544 1.00 0.00 H new ATOM 0 HB VAL A 53 9.935 -14.475 -3.465 1.00 0.00 H new ATOM 0 HG11 VAL A 53 10.926 -13.113 -1.645 1.00 0.00 H new ATOM 0 HG12 VAL A 53 11.634 -12.686 -3.221 1.00 0.00 H new ATOM 0 HG13 VAL A 53 10.412 -11.627 -2.478 1.00 0.00 H new ATOM 0 HG21 VAL A 53 8.545 -13.855 -1.503 1.00 0.00 H new ATOM 0 HG22 VAL A 53 8.030 -12.370 -2.337 1.00 0.00 H new ATOM 0 HG23 VAL A 53 7.555 -13.960 -2.978 1.00 0.00 H new ATOM 895 N ASP A 54 10.959 -13.763 -6.214 1.00 0.00 N ATOM 896 CA ASP A 54 12.212 -13.758 -7.015 1.00 0.00 C ATOM 897 C ASP A 54 12.155 -12.642 -8.060 1.00 0.00 C ATOM 898 O ASP A 54 13.080 -11.868 -8.207 1.00 0.00 O ATOM 899 CB ASP A 54 12.372 -15.105 -7.721 1.00 0.00 C ATOM 900 CG ASP A 54 13.743 -15.167 -8.398 1.00 0.00 C ATOM 901 OD1 ASP A 54 14.079 -14.225 -9.097 1.00 0.00 O ATOM 902 OD2 ASP A 54 14.433 -16.154 -8.205 1.00 0.00 O ATOM 0 H ASP A 54 10.405 -14.617 -6.282 1.00 0.00 H new ATOM 0 HA ASP A 54 13.060 -13.589 -6.352 1.00 0.00 H new ATOM 0 HB2 ASP A 54 12.272 -15.918 -7.002 1.00 0.00 H new ATOM 0 HB3 ASP A 54 11.583 -15.236 -8.461 1.00 0.00 H new ATOM 907 N LYS A 55 11.080 -12.564 -8.804 1.00 0.00 N ATOM 908 CA LYS A 55 10.979 -11.510 -9.853 1.00 0.00 C ATOM 909 C LYS A 55 10.945 -10.129 -9.199 1.00 0.00 C ATOM 910 O LYS A 55 11.379 -9.155 -9.783 1.00 0.00 O ATOM 911 CB LYS A 55 9.723 -11.725 -10.698 1.00 0.00 C ATOM 912 CG LYS A 55 9.809 -13.082 -11.405 1.00 0.00 C ATOM 913 CD LYS A 55 8.436 -13.467 -11.969 1.00 0.00 C ATOM 914 CE LYS A 55 8.080 -12.550 -13.143 1.00 0.00 C ATOM 915 NZ LYS A 55 6.900 -13.105 -13.865 1.00 0.00 N ATOM 0 H LYS A 55 10.273 -13.183 -8.729 1.00 0.00 H new ATOM 0 HA LYS A 55 11.851 -11.573 -10.504 1.00 0.00 H new ATOM 0 HB2 LYS A 55 8.836 -11.688 -10.066 1.00 0.00 H new ATOM 0 HB3 LYS A 55 9.625 -10.926 -11.433 1.00 0.00 H new ATOM 0 HG2 LYS A 55 10.542 -13.036 -12.210 1.00 0.00 H new ATOM 0 HG3 LYS A 55 10.151 -13.845 -10.706 1.00 0.00 H new ATOM 0 HD2 LYS A 55 8.446 -14.506 -12.298 1.00 0.00 H new ATOM 0 HD3 LYS A 55 7.678 -13.387 -11.190 1.00 0.00 H new ATOM 0 HE2 LYS A 55 7.859 -11.546 -12.781 1.00 0.00 H new ATOM 0 HE3 LYS A 55 8.928 -12.464 -13.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 6.657 -12.483 -14.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 7.127 -14.055 -14.223 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 6.091 -13.165 -13.214 1.00 0.00 H new ATOM 929 N VAL A 56 10.482 -10.025 -7.985 1.00 0.00 N ATOM 930 CA VAL A 56 10.490 -8.698 -7.313 1.00 0.00 C ATOM 931 C VAL A 56 11.944 -8.254 -7.162 1.00 0.00 C ATOM 932 O VAL A 56 12.327 -7.181 -7.584 1.00 0.00 O ATOM 933 CB VAL A 56 9.841 -8.818 -5.927 1.00 0.00 C ATOM 934 CG1 VAL A 56 10.116 -7.545 -5.111 1.00 0.00 C ATOM 935 CG2 VAL A 56 8.330 -9.001 -6.098 1.00 0.00 C ATOM 0 H VAL A 56 10.102 -10.794 -7.434 1.00 0.00 H new ATOM 0 HA VAL A 56 9.930 -7.971 -7.901 1.00 0.00 H new ATOM 0 HB VAL A 56 10.260 -9.675 -5.400 1.00 0.00 H new ATOM 0 HG11 VAL A 56 9.653 -7.636 -4.128 1.00 0.00 H new ATOM 0 HG12 VAL A 56 11.192 -7.413 -4.995 1.00 0.00 H new ATOM 0 HG13 VAL A 56 9.699 -6.683 -5.631 1.00 0.00 H new ATOM 0 HG21 VAL A 56 7.861 -9.087 -5.118 1.00 0.00 H new ATOM 0 HG22 VAL A 56 7.916 -8.140 -6.624 1.00 0.00 H new ATOM 0 HG23 VAL A 56 8.136 -9.906 -6.674 1.00 0.00 H new ATOM 945 N MET A 57 12.753 -9.070 -6.549 1.00 0.00 N ATOM 946 CA MET A 57 14.180 -8.700 -6.352 1.00 0.00 C ATOM 947 C MET A 57 14.836 -8.371 -7.697 1.00 0.00 C ATOM 948 O MET A 57 15.784 -7.613 -7.761 1.00 0.00 O ATOM 949 CB MET A 57 14.915 -9.871 -5.691 1.00 0.00 C ATOM 950 CG MET A 57 14.305 -10.149 -4.311 1.00 0.00 C ATOM 951 SD MET A 57 15.481 -11.089 -3.305 1.00 0.00 S ATOM 952 CE MET A 57 14.972 -10.440 -1.692 1.00 0.00 C ATOM 0 H MET A 57 12.486 -9.981 -6.175 1.00 0.00 H new ATOM 0 HA MET A 57 14.237 -7.819 -5.713 1.00 0.00 H new ATOM 0 HB2 MET A 57 14.842 -10.760 -6.318 1.00 0.00 H new ATOM 0 HB3 MET A 57 15.975 -9.638 -5.591 1.00 0.00 H new ATOM 0 HG2 MET A 57 14.057 -9.210 -3.816 1.00 0.00 H new ATOM 0 HG3 MET A 57 13.375 -10.708 -4.419 1.00 0.00 H new ATOM 0 HE1 MET A 57 15.579 -10.894 -0.909 1.00 0.00 H new ATOM 0 HE2 MET A 57 15.108 -9.359 -1.675 1.00 0.00 H new ATOM 0 HE3 MET A 57 13.922 -10.676 -1.520 1.00 0.00 H new ATOM 962 N GLU A 58 14.334 -8.921 -8.781 1.00 0.00 N ATOM 963 CA GLU A 58 14.921 -8.625 -10.126 1.00 0.00 C ATOM 964 C GLU A 58 14.256 -7.381 -10.719 1.00 0.00 C ATOM 965 O GLU A 58 14.911 -6.550 -11.315 1.00 0.00 O ATOM 966 CB GLU A 58 14.738 -9.822 -11.060 1.00 0.00 C ATOM 967 CG GLU A 58 15.534 -9.595 -12.347 1.00 0.00 C ATOM 968 CD GLU A 58 15.228 -10.718 -13.339 1.00 0.00 C ATOM 969 OE1 GLU A 58 15.679 -11.827 -13.106 1.00 0.00 O ATOM 970 OE2 GLU A 58 14.546 -10.451 -14.315 1.00 0.00 O ATOM 0 H GLU A 58 13.541 -9.563 -8.789 1.00 0.00 H new ATOM 0 HA GLU A 58 15.989 -8.436 -10.013 1.00 0.00 H new ATOM 0 HB2 GLU A 58 15.075 -10.735 -10.568 1.00 0.00 H new ATOM 0 HB3 GLU A 58 13.682 -9.956 -11.293 1.00 0.00 H new ATOM 0 HG2 GLU A 58 15.275 -8.630 -12.782 1.00 0.00 H new ATOM 0 HG3 GLU A 58 16.601 -9.570 -12.128 1.00 0.00 H new ATOM 977 N THR A 59 12.969 -7.227 -10.560 1.00 0.00 N ATOM 978 CA THR A 59 12.310 -6.017 -11.122 1.00 0.00 C ATOM 979 C THR A 59 12.787 -4.807 -10.317 1.00 0.00 C ATOM 980 O THR A 59 13.024 -3.749 -10.864 1.00 0.00 O ATOM 981 CB THR A 59 10.782 -6.167 -11.048 1.00 0.00 C ATOM 982 OG1 THR A 59 10.447 -6.971 -9.930 1.00 0.00 O ATOM 983 CG2 THR A 59 10.256 -6.836 -12.324 1.00 0.00 C ATOM 0 H THR A 59 12.354 -7.878 -10.072 1.00 0.00 H new ATOM 0 HA THR A 59 12.574 -5.885 -12.171 1.00 0.00 H new ATOM 0 HB THR A 59 10.330 -5.180 -10.949 1.00 0.00 H new ATOM 0 HG1 THR A 59 10.559 -7.917 -10.162 1.00 0.00 H new ATOM 0 HG21 THR A 59 9.173 -6.938 -12.261 1.00 0.00 H new ATOM 0 HG22 THR A 59 10.514 -6.224 -13.188 1.00 0.00 H new ATOM 0 HG23 THR A 59 10.707 -7.822 -12.430 1.00 0.00 H new ATOM 991 N LEU A 60 12.984 -4.957 -9.037 1.00 0.00 N ATOM 992 CA LEU A 60 13.506 -3.826 -8.225 1.00 0.00 C ATOM 993 C LEU A 60 14.959 -3.580 -8.635 1.00 0.00 C ATOM 994 O LEU A 60 15.315 -2.503 -9.070 1.00 0.00 O ATOM 995 CB LEU A 60 13.441 -4.214 -6.739 1.00 0.00 C ATOM 996 CG LEU A 60 14.243 -3.222 -5.883 1.00 0.00 C ATOM 997 CD1 LEU A 60 13.812 -1.787 -6.207 1.00 0.00 C ATOM 998 CD2 LEU A 60 13.982 -3.514 -4.402 1.00 0.00 C ATOM 0 H LEU A 60 12.805 -5.817 -8.518 1.00 0.00 H new ATOM 0 HA LEU A 60 12.917 -2.923 -8.387 1.00 0.00 H new ATOM 0 HB2 LEU A 60 12.403 -4.231 -6.408 1.00 0.00 H new ATOM 0 HB3 LEU A 60 13.836 -5.221 -6.603 1.00 0.00 H new ATOM 0 HG LEU A 60 15.306 -3.331 -6.099 1.00 0.00 H new ATOM 0 HD11 LEU A 60 14.384 -1.089 -5.597 1.00 0.00 H new ATOM 0 HD12 LEU A 60 13.995 -1.582 -7.262 1.00 0.00 H new ATOM 0 HD13 LEU A 60 12.750 -1.669 -5.993 1.00 0.00 H new ATOM 0 HD21 LEU A 60 14.548 -2.814 -3.788 1.00 0.00 H new ATOM 0 HD22 LEU A 60 12.918 -3.404 -4.191 1.00 0.00 H new ATOM 0 HD23 LEU A 60 14.294 -4.533 -4.172 1.00 0.00 H new ATOM 1010 N ASP A 61 15.801 -4.569 -8.506 1.00 0.00 N ATOM 1011 CA ASP A 61 17.225 -4.379 -8.899 1.00 0.00 C ATOM 1012 C ASP A 61 17.283 -3.779 -10.304 1.00 0.00 C ATOM 1013 O ASP A 61 18.274 -3.200 -10.704 1.00 0.00 O ATOM 1014 CB ASP A 61 17.944 -5.730 -8.895 1.00 0.00 C ATOM 1015 CG ASP A 61 19.405 -5.528 -9.297 1.00 0.00 C ATOM 1016 OD1 ASP A 61 19.829 -4.386 -9.358 1.00 0.00 O ATOM 1017 OD2 ASP A 61 20.076 -6.518 -9.536 1.00 0.00 O ATOM 0 H ASP A 61 15.566 -5.495 -8.148 1.00 0.00 H new ATOM 0 HA ASP A 61 17.712 -3.708 -8.191 1.00 0.00 H new ATOM 0 HB2 ASP A 61 17.887 -6.182 -7.905 1.00 0.00 H new ATOM 0 HB3 ASP A 61 17.456 -6.416 -9.587 1.00 0.00 H new ATOM 1022 N GLU A 62 16.218 -3.911 -11.056 1.00 0.00 N ATOM 1023 CA GLU A 62 16.188 -3.351 -12.443 1.00 0.00 C ATOM 1024 C GLU A 62 15.437 -2.029 -12.426 1.00 0.00 C ATOM 1025 O GLU A 62 14.648 -1.719 -13.296 1.00 0.00 O ATOM 1026 CB GLU A 62 15.473 -4.305 -13.354 1.00 0.00 C ATOM 1027 CG GLU A 62 16.354 -5.525 -13.627 1.00 0.00 C ATOM 1028 CD GLU A 62 17.534 -5.114 -14.511 1.00 0.00 C ATOM 1029 OE1 GLU A 62 17.434 -4.085 -15.159 1.00 0.00 O ATOM 1030 OE2 GLU A 62 18.517 -5.837 -14.526 1.00 0.00 O ATOM 0 H GLU A 62 15.363 -4.386 -10.767 1.00 0.00 H new ATOM 0 HA GLU A 62 17.207 -3.200 -12.798 1.00 0.00 H new ATOM 0 HB2 GLU A 62 14.533 -4.619 -12.900 1.00 0.00 H new ATOM 0 HB3 GLU A 62 15.224 -3.808 -14.292 1.00 0.00 H new ATOM 0 HG2 GLU A 62 16.717 -5.942 -12.688 1.00 0.00 H new ATOM 0 HG3 GLU A 62 15.772 -6.305 -14.118 1.00 0.00 H new ATOM 1037 N ASP A 63 15.698 -1.267 -11.437 1.00 0.00 N ATOM 1038 CA ASP A 63 15.044 0.066 -11.286 1.00 0.00 C ATOM 1039 C ASP A 63 15.023 0.783 -12.635 1.00 0.00 C ATOM 1040 O ASP A 63 14.084 1.474 -12.975 1.00 0.00 O ATOM 1041 CB ASP A 63 15.887 0.905 -10.314 1.00 0.00 C ATOM 1042 CG ASP A 63 17.267 1.168 -10.922 1.00 0.00 C ATOM 1043 OD1 ASP A 63 17.906 0.210 -11.327 1.00 0.00 O ATOM 1044 OD2 ASP A 63 17.662 2.321 -10.970 1.00 0.00 O ATOM 0 H ASP A 63 16.355 -1.502 -10.693 1.00 0.00 H new ATOM 0 HA ASP A 63 14.026 -0.062 -10.918 1.00 0.00 H new ATOM 0 HB2 ASP A 63 15.385 1.850 -10.105 1.00 0.00 H new ATOM 0 HB3 ASP A 63 15.992 0.382 -9.363 1.00 0.00 H new ATOM 1049 N GLY A 64 16.047 0.576 -13.413 1.00 0.00 N ATOM 1050 CA GLY A 64 16.127 1.190 -14.775 1.00 0.00 C ATOM 1051 C GLY A 64 15.874 2.706 -14.737 1.00 0.00 C ATOM 1052 O GLY A 64 16.034 3.374 -15.738 1.00 0.00 O ATOM 0 H GLY A 64 16.848 -0.003 -13.161 1.00 0.00 H new ATOM 0 HA2 GLY A 64 17.111 0.997 -15.203 1.00 0.00 H new ATOM 0 HA3 GLY A 64 15.396 0.716 -15.430 1.00 0.00 H new ATOM 1056 N ASP A 65 15.488 3.264 -13.607 1.00 0.00 N ATOM 1057 CA ASP A 65 15.236 4.753 -13.538 1.00 0.00 C ATOM 1058 C ASP A 65 16.365 5.498 -12.776 1.00 0.00 C ATOM 1059 O ASP A 65 16.635 6.641 -13.091 1.00 0.00 O ATOM 1060 CB ASP A 65 13.908 4.995 -12.820 1.00 0.00 C ATOM 1061 CG ASP A 65 13.641 6.498 -12.735 1.00 0.00 C ATOM 1062 OD1 ASP A 65 13.501 7.115 -13.779 1.00 0.00 O ATOM 1063 OD2 ASP A 65 13.580 7.008 -11.628 1.00 0.00 O ATOM 0 H ASP A 65 15.337 2.760 -12.734 1.00 0.00 H new ATOM 0 HA ASP A 65 15.208 5.139 -14.557 1.00 0.00 H new ATOM 0 HB2 ASP A 65 13.097 4.501 -13.355 1.00 0.00 H new ATOM 0 HB3 ASP A 65 13.939 4.563 -11.820 1.00 0.00 H new ATOM 1068 N GLY A 66 17.026 4.910 -11.788 1.00 0.00 N ATOM 1069 CA GLY A 66 18.111 5.648 -11.054 1.00 0.00 C ATOM 1070 C GLY A 66 17.594 6.057 -9.672 1.00 0.00 C ATOM 1071 O GLY A 66 18.354 6.227 -8.740 1.00 0.00 O ATOM 0 H GLY A 66 16.858 3.957 -11.465 1.00 0.00 H new ATOM 0 HA2 GLY A 66 18.993 5.016 -10.953 1.00 0.00 H new ATOM 0 HA3 GLY A 66 18.413 6.530 -11.618 1.00 0.00 H new ATOM 1075 N GLU A 67 16.301 6.195 -9.527 1.00 0.00 N ATOM 1076 CA GLU A 67 15.728 6.571 -8.197 1.00 0.00 C ATOM 1077 C GLU A 67 14.317 5.992 -8.061 1.00 0.00 C ATOM 1078 O GLU A 67 13.498 6.137 -8.947 1.00 0.00 O ATOM 1079 CB GLU A 67 15.668 8.095 -8.074 1.00 0.00 C ATOM 1080 CG GLU A 67 17.087 8.663 -8.007 1.00 0.00 C ATOM 1081 CD GLU A 67 17.027 10.132 -7.585 1.00 0.00 C ATOM 1082 OE1 GLU A 67 16.459 10.919 -8.324 1.00 0.00 O ATOM 1083 OE2 GLU A 67 17.551 10.446 -6.528 1.00 0.00 O ATOM 0 H GLU A 67 15.616 6.064 -10.271 1.00 0.00 H new ATOM 0 HA GLU A 67 16.362 6.169 -7.407 1.00 0.00 H new ATOM 0 HB2 GLU A 67 15.137 8.518 -8.927 1.00 0.00 H new ATOM 0 HB3 GLU A 67 15.111 8.376 -7.180 1.00 0.00 H new ATOM 0 HG2 GLU A 67 17.685 8.093 -7.296 1.00 0.00 H new ATOM 0 HG3 GLU A 67 17.573 8.572 -8.978 1.00 0.00 H new ATOM 1090 N CYS A 68 14.015 5.350 -6.956 1.00 0.00 N ATOM 1091 CA CYS A 68 12.644 4.776 -6.762 1.00 0.00 C ATOM 1092 C CYS A 68 11.843 5.721 -5.859 1.00 0.00 C ATOM 1093 O CYS A 68 12.255 6.042 -4.762 1.00 0.00 O ATOM 1094 CB CYS A 68 12.759 3.392 -6.109 1.00 0.00 C ATOM 1095 SG CYS A 68 11.161 2.896 -5.413 1.00 0.00 S ATOM 0 H CYS A 68 14.659 5.199 -6.180 1.00 0.00 H new ATOM 0 HA CYS A 68 12.138 4.670 -7.721 1.00 0.00 H new ATOM 0 HB2 CYS A 68 13.086 2.659 -6.847 1.00 0.00 H new ATOM 0 HB3 CYS A 68 13.515 3.413 -5.324 1.00 0.00 H new ATOM 0 HG CYS A 68 10.511 3.952 -5.024 1.00 0.00 H new ATOM 1101 N ASP A 69 10.705 6.175 -6.314 1.00 0.00 N ATOM 1102 CA ASP A 69 9.883 7.107 -5.486 1.00 0.00 C ATOM 1103 C ASP A 69 9.039 6.307 -4.491 1.00 0.00 C ATOM 1104 O ASP A 69 9.178 5.107 -4.369 1.00 0.00 O ATOM 1105 CB ASP A 69 8.964 7.922 -6.399 1.00 0.00 C ATOM 1106 CG ASP A 69 8.264 6.988 -7.388 1.00 0.00 C ATOM 1107 OD1 ASP A 69 8.105 5.823 -7.062 1.00 0.00 O ATOM 1108 OD2 ASP A 69 7.899 7.454 -8.455 1.00 0.00 O ATOM 0 H ASP A 69 10.309 5.941 -7.224 1.00 0.00 H new ATOM 0 HA ASP A 69 10.542 7.780 -4.937 1.00 0.00 H new ATOM 0 HB2 ASP A 69 8.225 8.458 -5.803 1.00 0.00 H new ATOM 0 HB3 ASP A 69 9.543 8.672 -6.938 1.00 0.00 H new ATOM 1113 N PHE A 70 8.154 6.962 -3.785 1.00 0.00 N ATOM 1114 CA PHE A 70 7.293 6.232 -2.811 1.00 0.00 C ATOM 1115 C PHE A 70 6.223 5.455 -3.583 1.00 0.00 C ATOM 1116 O PHE A 70 5.830 4.375 -3.191 1.00 0.00 O ATOM 1117 CB PHE A 70 6.636 7.232 -1.852 1.00 0.00 C ATOM 1118 CG PHE A 70 6.012 6.504 -0.681 1.00 0.00 C ATOM 1119 CD1 PHE A 70 4.824 5.781 -0.853 1.00 0.00 C ATOM 1120 CD2 PHE A 70 6.617 6.561 0.581 1.00 0.00 C ATOM 1121 CE1 PHE A 70 4.246 5.115 0.233 1.00 0.00 C ATOM 1122 CE2 PHE A 70 6.037 5.895 1.667 1.00 0.00 C ATOM 1123 CZ PHE A 70 4.852 5.171 1.492 1.00 0.00 C ATOM 0 H PHE A 70 7.992 7.967 -3.841 1.00 0.00 H new ATOM 0 HA PHE A 70 7.896 5.536 -2.227 1.00 0.00 H new ATOM 0 HB2 PHE A 70 7.379 7.944 -1.492 1.00 0.00 H new ATOM 0 HB3 PHE A 70 5.874 7.806 -2.380 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.354 5.738 -1.825 1.00 0.00 H new ATOM 0 HD2 PHE A 70 7.532 7.119 0.716 1.00 0.00 H new ATOM 0 HE1 PHE A 70 3.331 4.557 0.099 1.00 0.00 H new ATOM 0 HE2 PHE A 70 6.504 5.940 2.640 1.00 0.00 H new ATOM 0 HZ PHE A 70 4.406 4.656 2.329 1.00 0.00 H new ATOM 1133 N GLN A 71 5.755 5.982 -4.680 1.00 0.00 N ATOM 1134 CA GLN A 71 4.722 5.250 -5.467 1.00 0.00 C ATOM 1135 C GLN A 71 5.295 3.893 -5.889 1.00 0.00 C ATOM 1136 O GLN A 71 4.609 2.890 -5.886 1.00 0.00 O ATOM 1137 CB GLN A 71 4.356 6.075 -6.710 1.00 0.00 C ATOM 1138 CG GLN A 71 3.507 5.240 -7.679 1.00 0.00 C ATOM 1139 CD GLN A 71 2.349 4.582 -6.925 1.00 0.00 C ATOM 1140 OE1 GLN A 71 2.244 3.373 -6.887 1.00 0.00 O ATOM 1141 NE2 GLN A 71 1.469 5.333 -6.321 1.00 0.00 N ATOM 0 H GLN A 71 6.041 6.883 -5.064 1.00 0.00 H new ATOM 0 HA GLN A 71 3.826 5.096 -4.865 1.00 0.00 H new ATOM 0 HB2 GLN A 71 3.806 6.968 -6.412 1.00 0.00 H new ATOM 0 HB3 GLN A 71 5.264 6.412 -7.210 1.00 0.00 H new ATOM 0 HG2 GLN A 71 3.119 5.875 -8.476 1.00 0.00 H new ATOM 0 HG3 GLN A 71 4.125 4.477 -8.152 1.00 0.00 H new ATOM 0 HE21 GLN A 71 1.557 6.349 -6.353 1.00 0.00 H new ATOM 0 HE22 GLN A 71 0.693 4.904 -5.817 1.00 0.00 H new ATOM 1150 N GLU A 72 6.549 3.854 -6.243 1.00 0.00 N ATOM 1151 CA GLU A 72 7.174 2.564 -6.656 1.00 0.00 C ATOM 1152 C GLU A 72 7.376 1.671 -5.423 1.00 0.00 C ATOM 1153 O GLU A 72 7.427 0.462 -5.517 1.00 0.00 O ATOM 1154 CB GLU A 72 8.520 2.844 -7.338 1.00 0.00 C ATOM 1155 CG GLU A 72 8.287 3.234 -8.801 1.00 0.00 C ATOM 1156 CD GLU A 72 9.596 3.735 -9.413 1.00 0.00 C ATOM 1157 OE1 GLU A 72 9.929 4.887 -9.189 1.00 0.00 O ATOM 1158 OE2 GLU A 72 10.243 2.959 -10.096 1.00 0.00 O ATOM 0 H GLU A 72 7.171 4.662 -6.265 1.00 0.00 H new ATOM 0 HA GLU A 72 6.521 2.048 -7.360 1.00 0.00 H new ATOM 0 HB2 GLU A 72 9.043 3.646 -6.817 1.00 0.00 H new ATOM 0 HB3 GLU A 72 9.157 1.961 -7.284 1.00 0.00 H new ATOM 0 HG2 GLU A 72 7.916 2.376 -9.362 1.00 0.00 H new ATOM 0 HG3 GLU A 72 7.524 4.010 -8.864 1.00 0.00 H new ATOM 1165 N PHE A 73 7.455 2.267 -4.266 1.00 0.00 N ATOM 1166 CA PHE A 73 7.617 1.479 -3.006 1.00 0.00 C ATOM 1167 C PHE A 73 6.285 0.809 -2.655 1.00 0.00 C ATOM 1168 O PHE A 73 6.260 -0.346 -2.285 1.00 0.00 O ATOM 1169 CB PHE A 73 8.081 2.407 -1.879 1.00 0.00 C ATOM 1170 CG PHE A 73 8.009 1.703 -0.541 1.00 0.00 C ATOM 1171 CD1 PHE A 73 8.818 0.589 -0.294 1.00 0.00 C ATOM 1172 CD2 PHE A 73 7.147 2.176 0.459 1.00 0.00 C ATOM 1173 CE1 PHE A 73 8.765 -0.055 0.949 1.00 0.00 C ATOM 1174 CE2 PHE A 73 7.096 1.534 1.702 1.00 0.00 C ATOM 1175 CZ PHE A 73 7.904 0.418 1.947 1.00 0.00 C ATOM 0 H PHE A 73 7.414 3.278 -4.136 1.00 0.00 H new ATOM 0 HA PHE A 73 8.370 0.703 -3.142 1.00 0.00 H new ATOM 0 HB2 PHE A 73 9.103 2.734 -2.069 1.00 0.00 H new ATOM 0 HB3 PHE A 73 7.459 3.302 -1.859 1.00 0.00 H new ATOM 0 HD1 PHE A 73 9.484 0.225 -1.062 1.00 0.00 H new ATOM 0 HD2 PHE A 73 6.522 3.036 0.270 1.00 0.00 H new ATOM 0 HE1 PHE A 73 9.388 -0.917 1.138 1.00 0.00 H new ATOM 0 HE2 PHE A 73 6.433 1.900 2.472 1.00 0.00 H new ATOM 0 HZ PHE A 73 7.864 -0.078 2.905 1.00 0.00 H new ATOM 1185 N MET A 74 5.181 1.477 -2.782 1.00 0.00 N ATOM 1186 CA MET A 74 3.899 0.787 -2.461 1.00 0.00 C ATOM 1187 C MET A 74 3.694 -0.350 -3.472 1.00 0.00 C ATOM 1188 O MET A 74 3.459 -1.478 -3.086 1.00 0.00 O ATOM 1189 CB MET A 74 2.728 1.774 -2.520 1.00 0.00 C ATOM 1190 CG MET A 74 1.535 1.207 -1.742 1.00 0.00 C ATOM 1191 SD MET A 74 1.823 1.412 0.038 1.00 0.00 S ATOM 1192 CE MET A 74 1.825 -0.338 0.512 1.00 0.00 C ATOM 0 H MET A 74 5.104 2.448 -3.086 1.00 0.00 H new ATOM 0 HA MET A 74 3.941 0.381 -1.450 1.00 0.00 H new ATOM 0 HB2 MET A 74 3.027 2.734 -2.098 1.00 0.00 H new ATOM 0 HB3 MET A 74 2.445 1.956 -3.557 1.00 0.00 H new ATOM 0 HG2 MET A 74 0.619 1.720 -2.035 1.00 0.00 H new ATOM 0 HG3 MET A 74 1.400 0.152 -1.980 1.00 0.00 H new ATOM 0 HE1 MET A 74 1.581 -0.429 1.570 1.00 0.00 H new ATOM 0 HE2 MET A 74 1.084 -0.876 -0.079 1.00 0.00 H new ATOM 0 HE3 MET A 74 2.812 -0.763 0.330 1.00 0.00 H new ATOM 1202 N ALA A 75 3.773 -0.095 -4.746 1.00 0.00 N ATOM 1203 CA ALA A 75 3.573 -1.198 -5.733 1.00 0.00 C ATOM 1204 C ALA A 75 4.512 -2.374 -5.433 1.00 0.00 C ATOM 1205 O ALA A 75 4.084 -3.510 -5.367 1.00 0.00 O ATOM 1206 CB ALA A 75 3.858 -0.674 -7.141 1.00 0.00 C ATOM 0 H ALA A 75 3.966 0.822 -5.148 1.00 0.00 H new ATOM 0 HA ALA A 75 2.543 -1.546 -5.662 1.00 0.00 H new ATOM 0 HB1 ALA A 75 3.713 -1.477 -7.864 1.00 0.00 H new ATOM 0 HB2 ALA A 75 3.178 0.147 -7.368 1.00 0.00 H new ATOM 0 HB3 ALA A 75 4.887 -0.318 -7.195 1.00 0.00 H new ATOM 1212 N PHE A 76 5.781 -2.129 -5.264 1.00 0.00 N ATOM 1213 CA PHE A 76 6.716 -3.264 -4.986 1.00 0.00 C ATOM 1214 C PHE A 76 6.344 -3.920 -3.646 1.00 0.00 C ATOM 1215 O PHE A 76 6.422 -5.122 -3.492 1.00 0.00 O ATOM 1216 CB PHE A 76 8.173 -2.746 -4.944 1.00 0.00 C ATOM 1217 CG PHE A 76 8.809 -2.846 -6.321 1.00 0.00 C ATOM 1218 CD1 PHE A 76 8.937 -4.095 -6.944 1.00 0.00 C ATOM 1219 CD2 PHE A 76 9.268 -1.692 -6.974 1.00 0.00 C ATOM 1220 CE1 PHE A 76 9.521 -4.190 -8.212 1.00 0.00 C ATOM 1221 CE2 PHE A 76 9.853 -1.790 -8.242 1.00 0.00 C ATOM 1222 CZ PHE A 76 9.979 -3.038 -8.861 1.00 0.00 C ATOM 0 H PHE A 76 6.211 -1.205 -5.305 1.00 0.00 H new ATOM 0 HA PHE A 76 6.632 -4.006 -5.780 1.00 0.00 H new ATOM 0 HB2 PHE A 76 8.188 -1.711 -4.603 1.00 0.00 H new ATOM 0 HB3 PHE A 76 8.752 -3.327 -4.226 1.00 0.00 H new ATOM 0 HD1 PHE A 76 8.584 -4.985 -6.445 1.00 0.00 H new ATOM 0 HD2 PHE A 76 9.170 -0.728 -6.498 1.00 0.00 H new ATOM 0 HE1 PHE A 76 9.618 -5.153 -8.690 1.00 0.00 H new ATOM 0 HE2 PHE A 76 10.207 -0.901 -8.743 1.00 0.00 H new ATOM 0 HZ PHE A 76 10.430 -3.112 -9.840 1.00 0.00 H new ATOM 1232 N VAL A 77 5.934 -3.143 -2.688 1.00 0.00 N ATOM 1233 CA VAL A 77 5.549 -3.729 -1.370 1.00 0.00 C ATOM 1234 C VAL A 77 4.313 -4.621 -1.556 1.00 0.00 C ATOM 1235 O VAL A 77 4.146 -5.613 -0.875 1.00 0.00 O ATOM 1236 CB VAL A 77 5.235 -2.592 -0.385 1.00 0.00 C ATOM 1237 CG1 VAL A 77 4.523 -3.147 0.858 1.00 0.00 C ATOM 1238 CG2 VAL A 77 6.542 -1.905 0.042 1.00 0.00 C ATOM 0 H VAL A 77 5.847 -2.129 -2.756 1.00 0.00 H new ATOM 0 HA VAL A 77 6.368 -4.330 -0.974 1.00 0.00 H new ATOM 0 HB VAL A 77 4.583 -1.870 -0.877 1.00 0.00 H new ATOM 0 HG11 VAL A 77 4.306 -2.331 1.548 1.00 0.00 H new ATOM 0 HG12 VAL A 77 3.591 -3.627 0.559 1.00 0.00 H new ATOM 0 HG13 VAL A 77 5.166 -3.877 1.350 1.00 0.00 H new ATOM 0 HG21 VAL A 77 6.318 -1.099 0.741 1.00 0.00 H new ATOM 0 HG22 VAL A 77 7.195 -2.632 0.525 1.00 0.00 H new ATOM 0 HG23 VAL A 77 7.042 -1.496 -0.836 1.00 0.00 H new ATOM 1248 N SER A 78 3.447 -4.273 -2.467 1.00 0.00 N ATOM 1249 CA SER A 78 2.223 -5.097 -2.691 1.00 0.00 C ATOM 1250 C SER A 78 2.601 -6.438 -3.334 1.00 0.00 C ATOM 1251 O SER A 78 2.207 -7.490 -2.873 1.00 0.00 O ATOM 1252 CB SER A 78 1.270 -4.342 -3.620 1.00 0.00 C ATOM 1253 OG SER A 78 1.644 -4.581 -4.971 1.00 0.00 O ATOM 0 H SER A 78 3.533 -3.453 -3.067 1.00 0.00 H new ATOM 0 HA SER A 78 1.738 -5.285 -1.733 1.00 0.00 H new ATOM 0 HB2 SER A 78 0.244 -4.669 -3.451 1.00 0.00 H new ATOM 0 HB3 SER A 78 1.304 -3.274 -3.405 1.00 0.00 H new ATOM 0 HG SER A 78 2.431 -4.041 -5.193 1.00 0.00 H new ATOM 1259 N MET A 79 3.341 -6.407 -4.406 1.00 0.00 N ATOM 1260 CA MET A 79 3.719 -7.677 -5.095 1.00 0.00 C ATOM 1261 C MET A 79 4.303 -8.684 -4.097 1.00 0.00 C ATOM 1262 O MET A 79 4.068 -9.872 -4.197 1.00 0.00 O ATOM 1263 CB MET A 79 4.760 -7.374 -6.178 1.00 0.00 C ATOM 1264 CG MET A 79 4.857 -8.549 -7.158 1.00 0.00 C ATOM 1265 SD MET A 79 3.536 -8.415 -8.390 1.00 0.00 S ATOM 1266 CE MET A 79 4.481 -7.521 -9.648 1.00 0.00 C ATOM 0 H MET A 79 3.702 -5.556 -4.838 1.00 0.00 H new ATOM 0 HA MET A 79 2.825 -8.110 -5.544 1.00 0.00 H new ATOM 0 HB2 MET A 79 4.485 -6.465 -6.714 1.00 0.00 H new ATOM 0 HB3 MET A 79 5.732 -7.192 -5.719 1.00 0.00 H new ATOM 0 HG2 MET A 79 5.830 -8.547 -7.650 1.00 0.00 H new ATOM 0 HG3 MET A 79 4.773 -9.493 -6.620 1.00 0.00 H new ATOM 0 HE1 MET A 79 3.846 -7.330 -10.513 1.00 0.00 H new ATOM 0 HE2 MET A 79 4.828 -6.573 -9.237 1.00 0.00 H new ATOM 0 HE3 MET A 79 5.339 -8.120 -9.953 1.00 0.00 H new ATOM 1276 N VAL A 80 5.062 -8.232 -3.141 1.00 0.00 N ATOM 1277 CA VAL A 80 5.653 -9.187 -2.157 1.00 0.00 C ATOM 1278 C VAL A 80 4.569 -9.679 -1.197 1.00 0.00 C ATOM 1279 O VAL A 80 4.427 -10.863 -0.963 1.00 0.00 O ATOM 1280 CB VAL A 80 6.748 -8.483 -1.351 1.00 0.00 C ATOM 1281 CG1 VAL A 80 7.328 -9.454 -0.321 1.00 0.00 C ATOM 1282 CG2 VAL A 80 7.860 -8.020 -2.291 1.00 0.00 C ATOM 0 H VAL A 80 5.299 -7.251 -2.996 1.00 0.00 H new ATOM 0 HA VAL A 80 6.077 -10.034 -2.696 1.00 0.00 H new ATOM 0 HB VAL A 80 6.321 -7.620 -0.840 1.00 0.00 H new ATOM 0 HG11 VAL A 80 8.108 -8.953 0.253 1.00 0.00 H new ATOM 0 HG12 VAL A 80 6.537 -9.785 0.353 1.00 0.00 H new ATOM 0 HG13 VAL A 80 7.753 -10.317 -0.834 1.00 0.00 H new ATOM 0 HG21 VAL A 80 8.638 -7.519 -1.715 1.00 0.00 H new ATOM 0 HG22 VAL A 80 8.286 -8.883 -2.803 1.00 0.00 H new ATOM 0 HG23 VAL A 80 7.450 -7.327 -3.026 1.00 0.00 H new ATOM 1292 N THR A 81 3.801 -8.785 -0.642 1.00 0.00 N ATOM 1293 CA THR A 81 2.727 -9.209 0.298 1.00 0.00 C ATOM 1294 C THR A 81 1.728 -10.097 -0.447 1.00 0.00 C ATOM 1295 O THR A 81 1.361 -11.161 0.012 1.00 0.00 O ATOM 1296 CB THR A 81 2.006 -7.973 0.838 1.00 0.00 C ATOM 1297 OG1 THR A 81 2.952 -7.107 1.448 1.00 0.00 O ATOM 1298 CG2 THR A 81 0.960 -8.400 1.869 1.00 0.00 C ATOM 0 H THR A 81 3.870 -7.779 -0.798 1.00 0.00 H new ATOM 0 HA THR A 81 3.164 -9.765 1.128 1.00 0.00 H new ATOM 0 HB THR A 81 1.511 -7.452 0.019 1.00 0.00 H new ATOM 0 HG1 THR A 81 3.411 -6.585 0.757 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.447 -7.518 2.253 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.236 -9.065 1.399 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.451 -8.921 2.691 1.00 0.00 H new ATOM 1306 N THR A 82 1.288 -9.666 -1.597 1.00 0.00 N ATOM 1307 CA THR A 82 0.314 -10.476 -2.381 1.00 0.00 C ATOM 1308 C THR A 82 0.914 -11.850 -2.685 1.00 0.00 C ATOM 1309 O THR A 82 0.206 -12.805 -2.936 1.00 0.00 O ATOM 1310 CB THR A 82 -0.006 -9.757 -3.693 1.00 0.00 C ATOM 1311 OG1 THR A 82 1.205 -9.444 -4.367 1.00 0.00 O ATOM 1312 CG2 THR A 82 -0.776 -8.469 -3.398 1.00 0.00 C ATOM 0 H THR A 82 1.563 -8.784 -2.029 1.00 0.00 H new ATOM 0 HA THR A 82 -0.601 -10.602 -1.802 1.00 0.00 H new ATOM 0 HB THR A 82 -0.616 -10.405 -4.323 1.00 0.00 H new ATOM 0 HG1 THR A 82 1.601 -8.640 -3.971 1.00 0.00 H new ATOM 0 HG21 THR A 82 -1.003 -7.958 -4.334 1.00 0.00 H new ATOM 0 HG22 THR A 82 -1.705 -8.711 -2.882 1.00 0.00 H new ATOM 0 HG23 THR A 82 -0.169 -7.819 -2.768 1.00 0.00 H new ATOM 1320 N ALA A 83 2.215 -11.961 -2.663 1.00 0.00 N ATOM 1321 CA ALA A 83 2.856 -13.276 -2.949 1.00 0.00 C ATOM 1322 C ALA A 83 2.526 -14.257 -1.823 1.00 0.00 C ATOM 1323 O ALA A 83 2.375 -15.442 -2.043 1.00 0.00 O ATOM 1324 CB ALA A 83 4.373 -13.095 -3.038 1.00 0.00 C ATOM 0 H ALA A 83 2.861 -11.198 -2.459 1.00 0.00 H new ATOM 0 HA ALA A 83 2.480 -13.666 -3.895 1.00 0.00 H new ATOM 0 HB1 ALA A 83 4.842 -14.056 -3.247 1.00 0.00 H new ATOM 0 HB2 ALA A 83 4.609 -12.394 -3.838 1.00 0.00 H new ATOM 0 HB3 ALA A 83 4.749 -12.706 -2.092 1.00 0.00 H new ATOM 1481 N SER B 1 8.339 -5.109 14.226 1.00 0.00 N ATOM 1482 CA SER B 1 8.337 -3.618 14.276 1.00 0.00 C ATOM 1483 C SER B 1 6.894 -3.117 14.228 1.00 0.00 C ATOM 1484 O SER B 1 5.983 -3.846 13.889 1.00 0.00 O ATOM 1485 CB SER B 1 9.107 -3.064 13.080 1.00 0.00 C ATOM 1486 OG SER B 1 8.224 -2.961 11.967 1.00 0.00 O ATOM 0 H1 SER B 1 9.231 -5.468 14.622 1.00 0.00 H new ATOM 0 H2 SER B 1 7.541 -5.476 14.782 1.00 0.00 H new ATOM 0 H3 SER B 1 8.247 -5.423 13.239 1.00 0.00 H new ATOM 0 HA SER B 1 8.813 -3.283 15.197 1.00 0.00 H new ATOM 0 HB2 SER B 1 9.524 -2.086 13.321 1.00 0.00 H new ATOM 0 HB3 SER B 1 9.945 -3.717 12.837 1.00 0.00 H new ATOM 0 HG SER B 1 8.498 -3.596 11.273 1.00 0.00 H new ATOM 1492 N GLU B 2 6.677 -1.876 14.563 1.00 0.00 N ATOM 1493 CA GLU B 2 5.292 -1.336 14.532 1.00 0.00 C ATOM 1494 C GLU B 2 4.704 -1.541 13.134 1.00 0.00 C ATOM 1495 O GLU B 2 3.517 -1.736 12.970 1.00 0.00 O ATOM 1496 CB GLU B 2 5.320 0.156 14.867 1.00 0.00 C ATOM 1497 CG GLU B 2 6.050 0.362 16.196 1.00 0.00 C ATOM 1498 CD GLU B 2 6.025 1.845 16.569 1.00 0.00 C ATOM 1499 OE1 GLU B 2 6.358 2.655 15.719 1.00 0.00 O ATOM 1500 OE2 GLU B 2 5.673 2.146 17.697 1.00 0.00 O ATOM 0 H GLU B 2 7.397 -1.215 14.856 1.00 0.00 H new ATOM 0 HA GLU B 2 4.676 -1.857 15.265 1.00 0.00 H new ATOM 0 HB2 GLU B 2 5.822 0.709 14.073 1.00 0.00 H new ATOM 0 HB3 GLU B 2 4.304 0.545 14.933 1.00 0.00 H new ATOM 0 HG2 GLU B 2 5.575 -0.229 16.979 1.00 0.00 H new ATOM 0 HG3 GLU B 2 7.080 0.014 16.115 1.00 0.00 H new ATOM 1507 N LEU B 3 5.528 -1.490 12.123 1.00 0.00 N ATOM 1508 CA LEU B 3 5.017 -1.675 10.736 1.00 0.00 C ATOM 1509 C LEU B 3 4.325 -3.037 10.624 1.00 0.00 C ATOM 1510 O LEU B 3 3.193 -3.134 10.195 1.00 0.00 O ATOM 1511 CB LEU B 3 6.193 -1.601 9.745 1.00 0.00 C ATOM 1512 CG LEU B 3 5.700 -1.126 8.372 1.00 0.00 C ATOM 1513 CD1 LEU B 3 6.883 -1.060 7.404 1.00 0.00 C ATOM 1514 CD2 LEU B 3 4.647 -2.103 7.830 1.00 0.00 C ATOM 0 H LEU B 3 6.532 -1.328 12.198 1.00 0.00 H new ATOM 0 HA LEU B 3 4.299 -0.889 10.501 1.00 0.00 H new ATOM 0 HB2 LEU B 3 6.954 -0.918 10.123 1.00 0.00 H new ATOM 0 HB3 LEU B 3 6.662 -2.581 9.652 1.00 0.00 H new ATOM 0 HG LEU B 3 5.252 -0.137 8.471 1.00 0.00 H new ATOM 0 HD11 LEU B 3 6.536 -0.723 6.427 1.00 0.00 H new ATOM 0 HD12 LEU B 3 7.627 -0.361 7.786 1.00 0.00 H new ATOM 0 HD13 LEU B 3 7.330 -2.049 7.308 1.00 0.00 H new ATOM 0 HD21 LEU B 3 4.301 -1.760 6.855 1.00 0.00 H new ATOM 0 HD22 LEU B 3 5.088 -3.095 7.731 1.00 0.00 H new ATOM 0 HD23 LEU B 3 3.804 -2.148 8.519 1.00 0.00 H new ATOM 1526 N GLU B 4 4.994 -4.094 11.001 1.00 0.00 N ATOM 1527 CA GLU B 4 4.361 -5.439 10.900 1.00 0.00 C ATOM 1528 C GLU B 4 2.987 -5.407 11.574 1.00 0.00 C ATOM 1529 O GLU B 4 2.000 -5.859 11.031 1.00 0.00 O ATOM 1530 CB GLU B 4 5.251 -6.481 11.584 1.00 0.00 C ATOM 1531 CG GLU B 4 6.455 -6.794 10.691 1.00 0.00 C ATOM 1532 CD GLU B 4 7.327 -5.545 10.552 1.00 0.00 C ATOM 1533 OE1 GLU B 4 8.100 -5.282 11.459 1.00 0.00 O ATOM 1534 OE2 GLU B 4 7.208 -4.872 9.541 1.00 0.00 O ATOM 0 H GLU B 4 5.944 -4.084 11.372 1.00 0.00 H new ATOM 0 HA GLU B 4 4.242 -5.707 9.850 1.00 0.00 H new ATOM 0 HB2 GLU B 4 5.590 -6.107 12.550 1.00 0.00 H new ATOM 0 HB3 GLU B 4 4.682 -7.390 11.776 1.00 0.00 H new ATOM 0 HG2 GLU B 4 7.036 -7.610 11.120 1.00 0.00 H new ATOM 0 HG3 GLU B 4 6.116 -7.125 9.709 1.00 0.00 H new ATOM 1541 N LYS B 5 2.924 -4.857 12.756 1.00 0.00 N ATOM 1542 CA LYS B 5 1.627 -4.768 13.485 1.00 0.00 C ATOM 1543 C LYS B 5 0.568 -4.153 12.568 1.00 0.00 C ATOM 1544 O LYS B 5 -0.558 -4.604 12.498 1.00 0.00 O ATOM 1545 CB LYS B 5 1.800 -3.853 14.706 1.00 0.00 C ATOM 1546 CG LYS B 5 2.965 -4.342 15.583 1.00 0.00 C ATOM 1547 CD LYS B 5 2.544 -5.579 16.386 1.00 0.00 C ATOM 1548 CE LYS B 5 3.596 -5.871 17.459 1.00 0.00 C ATOM 1549 NZ LYS B 5 3.711 -4.703 18.377 1.00 0.00 N ATOM 0 H LYS B 5 3.723 -4.462 13.252 1.00 0.00 H new ATOM 0 HA LYS B 5 1.318 -5.766 13.797 1.00 0.00 H new ATOM 0 HB2 LYS B 5 1.988 -2.831 14.378 1.00 0.00 H new ATOM 0 HB3 LYS B 5 0.879 -3.837 15.289 1.00 0.00 H new ATOM 0 HG2 LYS B 5 3.825 -4.582 14.957 1.00 0.00 H new ATOM 0 HG3 LYS B 5 3.276 -3.548 16.262 1.00 0.00 H new ATOM 0 HD2 LYS B 5 1.572 -5.411 16.850 1.00 0.00 H new ATOM 0 HD3 LYS B 5 2.437 -6.437 15.723 1.00 0.00 H new ATOM 0 HE2 LYS B 5 3.319 -6.763 18.021 1.00 0.00 H new ATOM 0 HE3 LYS B 5 4.559 -6.076 16.992 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 4.020 -5.028 19.315 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 4.407 -4.030 17.997 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 2.786 -4.234 18.460 1.00 0.00 H new ATOM 1563 N ALA B 6 0.934 -3.106 11.880 1.00 0.00 N ATOM 1564 CA ALA B 6 -0.015 -2.407 10.967 1.00 0.00 C ATOM 1565 C ALA B 6 -0.222 -3.203 9.670 1.00 0.00 C ATOM 1566 O ALA B 6 -1.271 -3.129 9.063 1.00 0.00 O ATOM 1567 CB ALA B 6 0.553 -1.013 10.647 1.00 0.00 C ATOM 0 H ALA B 6 1.868 -2.698 11.913 1.00 0.00 H new ATOM 0 HA ALA B 6 -0.984 -2.316 11.457 1.00 0.00 H new ATOM 0 HB1 ALA B 6 -0.129 -0.487 9.979 1.00 0.00 H new ATOM 0 HB2 ALA B 6 0.667 -0.446 11.571 1.00 0.00 H new ATOM 0 HB3 ALA B 6 1.524 -1.118 10.164 1.00 0.00 H new ATOM 1573 N MET B 7 0.738 -3.968 9.237 1.00 0.00 N ATOM 1574 CA MET B 7 0.523 -4.747 7.984 1.00 0.00 C ATOM 1575 C MET B 7 -0.574 -5.792 8.238 1.00 0.00 C ATOM 1576 O MET B 7 -1.542 -5.897 7.501 1.00 0.00 O ATOM 1577 CB MET B 7 1.833 -5.441 7.581 1.00 0.00 C ATOM 1578 CG MET B 7 1.822 -5.750 6.080 1.00 0.00 C ATOM 1579 SD MET B 7 1.979 -4.205 5.149 1.00 0.00 S ATOM 1580 CE MET B 7 1.426 -4.842 3.549 1.00 0.00 C ATOM 0 H MET B 7 1.647 -4.088 9.685 1.00 0.00 H new ATOM 0 HA MET B 7 0.215 -4.084 7.175 1.00 0.00 H new ATOM 0 HB2 MET B 7 2.682 -4.802 7.823 1.00 0.00 H new ATOM 0 HB3 MET B 7 1.956 -6.363 8.150 1.00 0.00 H new ATOM 0 HG2 MET B 7 2.642 -6.424 5.830 1.00 0.00 H new ATOM 0 HG3 MET B 7 0.897 -6.259 5.809 1.00 0.00 H new ATOM 0 HE1 MET B 7 1.769 -4.179 2.755 1.00 0.00 H new ATOM 0 HE2 MET B 7 1.838 -5.839 3.392 1.00 0.00 H new ATOM 0 HE3 MET B 7 0.337 -4.893 3.534 1.00 0.00 H new ATOM 1590 N VAL B 8 -0.435 -6.553 9.290 1.00 0.00 N ATOM 1591 CA VAL B 8 -1.464 -7.581 9.611 1.00 0.00 C ATOM 1592 C VAL B 8 -2.810 -6.894 9.836 1.00 0.00 C ATOM 1593 O VAL B 8 -3.849 -7.412 9.479 1.00 0.00 O ATOM 1594 CB VAL B 8 -1.058 -8.333 10.881 1.00 0.00 C ATOM 1595 CG1 VAL B 8 -1.965 -9.551 11.067 1.00 0.00 C ATOM 1596 CG2 VAL B 8 0.393 -8.801 10.761 1.00 0.00 C ATOM 0 H VAL B 8 0.348 -6.506 9.941 1.00 0.00 H new ATOM 0 HA VAL B 8 -1.546 -8.286 8.784 1.00 0.00 H new ATOM 0 HB VAL B 8 -1.157 -7.667 11.738 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -1.675 -10.086 11.971 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -3.001 -9.223 11.155 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -1.866 -10.213 10.207 1.00 0.00 H new ATOM 0 HG21 VAL B 8 0.679 -9.336 11.667 1.00 0.00 H new ATOM 0 HG22 VAL B 8 0.492 -9.464 9.902 1.00 0.00 H new ATOM 0 HG23 VAL B 8 1.044 -7.937 10.629 1.00 0.00 H new ATOM 1606 N ALA B 9 -2.800 -5.727 10.421 1.00 0.00 N ATOM 1607 CA ALA B 9 -4.079 -5.004 10.663 1.00 0.00 C ATOM 1608 C ALA B 9 -4.794 -4.790 9.328 1.00 0.00 C ATOM 1609 O ALA B 9 -5.975 -5.031 9.201 1.00 0.00 O ATOM 1610 CB ALA B 9 -3.777 -3.647 11.302 1.00 0.00 C ATOM 0 H ALA B 9 -1.961 -5.244 10.741 1.00 0.00 H new ATOM 0 HA ALA B 9 -4.714 -5.588 11.329 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -4.710 -3.113 11.481 1.00 0.00 H new ATOM 0 HB2 ALA B 9 -3.258 -3.798 12.248 1.00 0.00 H new ATOM 0 HB3 ALA B 9 -3.147 -3.061 10.632 1.00 0.00 H new ATOM 1616 N LEU B 10 -4.091 -4.323 8.335 1.00 0.00 N ATOM 1617 CA LEU B 10 -4.742 -4.079 7.014 1.00 0.00 C ATOM 1618 C LEU B 10 -5.606 -5.280 6.643 1.00 0.00 C ATOM 1619 O LEU B 10 -6.723 -5.138 6.187 1.00 0.00 O ATOM 1620 CB LEU B 10 -3.658 -3.906 5.943 1.00 0.00 C ATOM 1621 CG LEU B 10 -2.912 -2.575 6.141 1.00 0.00 C ATOM 1622 CD1 LEU B 10 -1.681 -2.549 5.227 1.00 0.00 C ATOM 1623 CD2 LEU B 10 -3.831 -1.381 5.800 1.00 0.00 C ATOM 0 H LEU B 10 -3.097 -4.100 8.378 1.00 0.00 H new ATOM 0 HA LEU B 10 -5.359 -3.182 7.075 1.00 0.00 H new ATOM 0 HB2 LEU B 10 -2.953 -4.736 5.993 1.00 0.00 H new ATOM 0 HB3 LEU B 10 -4.110 -3.932 4.952 1.00 0.00 H new ATOM 0 HG LEU B 10 -2.606 -2.492 7.184 1.00 0.00 H new ATOM 0 HD11 LEU B 10 -1.147 -1.608 5.362 1.00 0.00 H new ATOM 0 HD12 LEU B 10 -1.022 -3.380 5.480 1.00 0.00 H new ATOM 0 HD13 LEU B 10 -1.997 -2.641 4.188 1.00 0.00 H new ATOM 0 HD21 LEU B 10 -3.286 -0.449 5.946 1.00 0.00 H new ATOM 0 HD22 LEU B 10 -4.152 -1.454 4.761 1.00 0.00 H new ATOM 0 HD23 LEU B 10 -4.704 -1.396 6.452 1.00 0.00 H new ATOM 1635 N ILE B 11 -5.105 -6.468 6.855 1.00 0.00 N ATOM 1636 CA ILE B 11 -5.922 -7.673 6.530 1.00 0.00 C ATOM 1637 C ILE B 11 -7.138 -7.685 7.462 1.00 0.00 C ATOM 1638 O ILE B 11 -8.243 -8.003 7.066 1.00 0.00 O ATOM 1639 CB ILE B 11 -5.084 -8.943 6.740 1.00 0.00 C ATOM 1640 CG1 ILE B 11 -4.059 -9.074 5.606 1.00 0.00 C ATOM 1641 CG2 ILE B 11 -5.992 -10.178 6.734 1.00 0.00 C ATOM 1642 CD1 ILE B 11 -3.072 -7.903 5.649 1.00 0.00 C ATOM 0 H ILE B 11 -4.177 -6.655 7.234 1.00 0.00 H new ATOM 0 HA ILE B 11 -6.246 -7.644 5.490 1.00 0.00 H new ATOM 0 HB ILE B 11 -4.572 -8.873 7.700 1.00 0.00 H new ATOM 0 HG12 ILE B 11 -3.520 -10.017 5.700 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -4.571 -9.093 4.644 1.00 0.00 H new ATOM 0 HG21 ILE B 11 -5.389 -11.074 6.884 1.00 0.00 H new ATOM 0 HG22 ILE B 11 -6.724 -10.095 7.537 1.00 0.00 H new ATOM 0 HG23 ILE B 11 -6.509 -10.245 5.777 1.00 0.00 H new ATOM 0 HD11 ILE B 11 -2.349 -8.006 4.840 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -3.615 -6.965 5.533 1.00 0.00 H new ATOM 0 HD13 ILE B 11 -2.549 -7.903 6.605 1.00 0.00 H new ATOM 1654 N ASP B 12 -6.930 -7.330 8.701 1.00 0.00 N ATOM 1655 CA ASP B 12 -8.047 -7.299 9.685 1.00 0.00 C ATOM 1656 C ASP B 12 -9.219 -6.500 9.120 1.00 0.00 C ATOM 1657 O ASP B 12 -10.346 -6.953 9.095 1.00 0.00 O ATOM 1658 CB ASP B 12 -7.559 -6.608 10.968 1.00 0.00 C ATOM 1659 CG ASP B 12 -8.513 -6.929 12.123 1.00 0.00 C ATOM 1660 OD1 ASP B 12 -9.579 -6.336 12.168 1.00 0.00 O ATOM 1661 OD2 ASP B 12 -8.161 -7.760 12.943 1.00 0.00 O ATOM 0 H ASP B 12 -6.022 -7.057 9.077 1.00 0.00 H new ATOM 0 HA ASP B 12 -8.369 -8.319 9.895 1.00 0.00 H new ATOM 0 HB2 ASP B 12 -6.551 -6.944 11.212 1.00 0.00 H new ATOM 0 HB3 ASP B 12 -7.508 -5.530 10.815 1.00 0.00 H new ATOM 1666 N VAL B 13 -8.956 -5.291 8.696 1.00 0.00 N ATOM 1667 CA VAL B 13 -10.048 -4.429 8.164 1.00 0.00 C ATOM 1668 C VAL B 13 -10.439 -4.844 6.742 1.00 0.00 C ATOM 1669 O VAL B 13 -11.610 -4.924 6.427 1.00 0.00 O ATOM 1670 CB VAL B 13 -9.599 -2.966 8.193 1.00 0.00 C ATOM 1671 CG1 VAL B 13 -10.646 -2.088 7.503 1.00 0.00 C ATOM 1672 CG2 VAL B 13 -9.438 -2.519 9.649 1.00 0.00 C ATOM 0 H VAL B 13 -8.029 -4.865 8.696 1.00 0.00 H new ATOM 0 HA VAL B 13 -10.929 -4.550 8.794 1.00 0.00 H new ATOM 0 HB VAL B 13 -8.648 -2.867 7.669 1.00 0.00 H new ATOM 0 HG11 VAL B 13 -10.321 -1.048 7.527 1.00 0.00 H new ATOM 0 HG12 VAL B 13 -10.764 -2.408 6.468 1.00 0.00 H new ATOM 0 HG13 VAL B 13 -11.599 -2.182 8.023 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -9.118 -1.477 9.677 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -10.391 -2.620 10.168 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -8.690 -3.141 10.140 1.00 0.00 H new ATOM 1682 N PHE B 14 -9.506 -5.097 5.869 1.00 0.00 N ATOM 1683 CA PHE B 14 -9.920 -5.482 4.490 1.00 0.00 C ATOM 1684 C PHE B 14 -10.806 -6.724 4.569 1.00 0.00 C ATOM 1685 O PHE B 14 -11.742 -6.888 3.808 1.00 0.00 O ATOM 1686 CB PHE B 14 -8.698 -5.778 3.619 1.00 0.00 C ATOM 1687 CG PHE B 14 -9.162 -6.084 2.212 1.00 0.00 C ATOM 1688 CD1 PHE B 14 -9.416 -5.038 1.316 1.00 0.00 C ATOM 1689 CD2 PHE B 14 -9.343 -7.413 1.805 1.00 0.00 C ATOM 1690 CE1 PHE B 14 -9.851 -5.320 0.014 1.00 0.00 C ATOM 1691 CE2 PHE B 14 -9.778 -7.694 0.502 1.00 0.00 C ATOM 1692 CZ PHE B 14 -10.032 -6.648 -0.392 1.00 0.00 C ATOM 0 H PHE B 14 -8.501 -5.056 6.041 1.00 0.00 H new ATOM 0 HA PHE B 14 -10.469 -4.655 4.040 1.00 0.00 H new ATOM 0 HB2 PHE B 14 -8.022 -4.923 3.615 1.00 0.00 H new ATOM 0 HB3 PHE B 14 -8.142 -6.623 4.025 1.00 0.00 H new ATOM 0 HD1 PHE B 14 -9.277 -4.014 1.629 1.00 0.00 H new ATOM 0 HD2 PHE B 14 -9.147 -8.221 2.495 1.00 0.00 H new ATOM 0 HE1 PHE B 14 -10.047 -4.513 -0.676 1.00 0.00 H new ATOM 0 HE2 PHE B 14 -9.917 -8.718 0.188 1.00 0.00 H new ATOM 0 HZ PHE B 14 -10.368 -6.865 -1.395 1.00 0.00 H new ATOM 1702 N HIS B 15 -10.516 -7.604 5.490 1.00 0.00 N ATOM 1703 CA HIS B 15 -11.335 -8.839 5.625 1.00 0.00 C ATOM 1704 C HIS B 15 -12.639 -8.518 6.359 1.00 0.00 C ATOM 1705 O HIS B 15 -13.656 -9.146 6.144 1.00 0.00 O ATOM 1706 CB HIS B 15 -10.553 -9.891 6.416 1.00 0.00 C ATOM 1707 CG HIS B 15 -11.217 -11.232 6.257 1.00 0.00 C ATOM 1708 ND1 HIS B 15 -11.533 -11.756 5.013 1.00 0.00 N ATOM 1709 CD2 HIS B 15 -11.635 -12.165 7.173 1.00 0.00 C ATOM 1710 CE1 HIS B 15 -12.115 -12.952 5.212 1.00 0.00 C ATOM 1711 NE2 HIS B 15 -12.202 -13.250 6.512 1.00 0.00 N ATOM 0 H HIS B 15 -9.746 -7.519 6.154 1.00 0.00 H new ATOM 0 HA HIS B 15 -11.564 -9.226 4.632 1.00 0.00 H new ATOM 0 HB2 HIS B 15 -9.524 -9.938 6.061 1.00 0.00 H new ATOM 0 HB3 HIS B 15 -10.514 -9.615 7.470 1.00 0.00 H new ATOM 0 HD2 HIS B 15 -11.538 -12.071 8.245 1.00 0.00 H new ATOM 0 HE1 HIS B 15 -12.469 -13.593 4.418 1.00 0.00 H new ATOM 0 HE2 HIS B 15 -12.599 -14.092 6.930 1.00 0.00 H new ATOM 1719 N GLN B 16 -12.609 -7.549 7.237 1.00 0.00 N ATOM 1720 CA GLN B 16 -13.840 -7.195 7.999 1.00 0.00 C ATOM 1721 C GLN B 16 -14.984 -6.925 7.024 1.00 0.00 C ATOM 1722 O GLN B 16 -16.096 -7.370 7.224 1.00 0.00 O ATOM 1723 CB GLN B 16 -13.581 -5.949 8.851 1.00 0.00 C ATOM 1724 CG GLN B 16 -14.740 -5.747 9.830 1.00 0.00 C ATOM 1725 CD GLN B 16 -14.647 -6.781 10.954 1.00 0.00 C ATOM 1726 OE1 GLN B 16 -13.641 -6.874 11.628 1.00 0.00 O ATOM 1727 NE2 GLN B 16 -15.662 -7.569 11.187 1.00 0.00 N ATOM 0 H GLN B 16 -11.786 -6.989 7.458 1.00 0.00 H new ATOM 0 HA GLN B 16 -14.111 -8.024 8.653 1.00 0.00 H new ATOM 0 HB2 GLN B 16 -12.644 -6.058 9.398 1.00 0.00 H new ATOM 0 HB3 GLN B 16 -13.476 -5.073 8.210 1.00 0.00 H new ATOM 0 HG2 GLN B 16 -14.708 -4.740 10.245 1.00 0.00 H new ATOM 0 HG3 GLN B 16 -15.692 -5.846 9.308 1.00 0.00 H new ATOM 0 HE21 GLN B 16 -16.508 -7.492 10.622 1.00 0.00 H new ATOM 0 HE22 GLN B 16 -15.609 -8.261 11.934 1.00 0.00 H new ATOM 1736 N TYR B 17 -14.727 -6.205 5.967 1.00 0.00 N ATOM 1737 CA TYR B 17 -15.808 -5.919 4.986 1.00 0.00 C ATOM 1738 C TYR B 17 -16.138 -7.200 4.219 1.00 0.00 C ATOM 1739 O TYR B 17 -17.286 -7.569 4.071 1.00 0.00 O ATOM 1740 CB TYR B 17 -15.337 -4.838 4.003 1.00 0.00 C ATOM 1741 CG TYR B 17 -15.452 -3.474 4.646 1.00 0.00 C ATOM 1742 CD1 TYR B 17 -14.492 -3.055 5.575 1.00 0.00 C ATOM 1743 CD2 TYR B 17 -16.518 -2.629 4.311 1.00 0.00 C ATOM 1744 CE1 TYR B 17 -14.599 -1.791 6.170 1.00 0.00 C ATOM 1745 CE2 TYR B 17 -16.624 -1.367 4.905 1.00 0.00 C ATOM 1746 CZ TYR B 17 -15.665 -0.948 5.835 1.00 0.00 C ATOM 1747 OH TYR B 17 -15.769 0.297 6.421 1.00 0.00 O ATOM 0 H TYR B 17 -13.817 -5.804 5.742 1.00 0.00 H new ATOM 0 HA TYR B 17 -16.696 -5.565 5.510 1.00 0.00 H new ATOM 0 HB2 TYR B 17 -14.304 -5.026 3.710 1.00 0.00 H new ATOM 0 HB3 TYR B 17 -15.938 -4.873 3.094 1.00 0.00 H new ATOM 0 HD1 TYR B 17 -13.669 -3.706 5.833 1.00 0.00 H new ATOM 0 HD2 TYR B 17 -17.258 -2.952 3.594 1.00 0.00 H new ATOM 0 HE1 TYR B 17 -13.859 -1.467 6.887 1.00 0.00 H new ATOM 0 HE2 TYR B 17 -17.446 -0.716 4.646 1.00 0.00 H new ATOM 0 HH TYR B 17 -16.565 0.755 6.078 1.00 0.00 H new ATOM 1757 N SER B 18 -15.137 -7.880 3.724 1.00 0.00 N ATOM 1758 CA SER B 18 -15.386 -9.136 2.955 1.00 0.00 C ATOM 1759 C SER B 18 -15.224 -10.358 3.868 1.00 0.00 C ATOM 1760 O SER B 18 -14.400 -11.215 3.617 1.00 0.00 O ATOM 1761 CB SER B 18 -14.381 -9.231 1.806 1.00 0.00 C ATOM 1762 OG SER B 18 -14.324 -10.574 1.344 1.00 0.00 O ATOM 0 H SER B 18 -14.155 -7.619 3.819 1.00 0.00 H new ATOM 0 HA SER B 18 -16.403 -9.117 2.563 1.00 0.00 H new ATOM 0 HB2 SER B 18 -14.676 -8.567 0.994 1.00 0.00 H new ATOM 0 HB3 SER B 18 -13.396 -8.907 2.141 1.00 0.00 H new ATOM 0 HG SER B 18 -13.845 -11.125 1.998 1.00 0.00 H new ATOM 1768 N GLY B 19 -16.021 -10.463 4.909 1.00 0.00 N ATOM 1769 CA GLY B 19 -15.941 -11.648 5.829 1.00 0.00 C ATOM 1770 C GLY B 19 -17.274 -12.394 5.745 1.00 0.00 C ATOM 1771 O GLY B 19 -17.387 -13.539 6.138 1.00 0.00 O ATOM 0 H GLY B 19 -16.729 -9.773 5.162 1.00 0.00 H new ATOM 0 HA2 GLY B 19 -15.118 -12.302 5.540 1.00 0.00 H new ATOM 0 HA3 GLY B 19 -15.747 -11.325 6.852 1.00 0.00 H new ATOM 1775 N ARG B 20 -18.272 -11.760 5.199 1.00 0.00 N ATOM 1776 CA ARG B 20 -19.598 -12.420 5.033 1.00 0.00 C ATOM 1777 C ARG B 20 -19.442 -13.649 4.140 1.00 0.00 C ATOM 1778 O ARG B 20 -20.149 -14.622 4.308 1.00 0.00 O ATOM 1779 CB ARG B 20 -20.578 -11.442 4.383 1.00 0.00 C ATOM 1780 CG ARG B 20 -20.528 -10.104 5.122 1.00 0.00 C ATOM 1781 CD ARG B 20 -21.715 -9.239 4.694 1.00 0.00 C ATOM 1782 NE ARG B 20 -21.848 -9.278 3.210 1.00 0.00 N ATOM 1783 CZ ARG B 20 -22.892 -8.743 2.635 1.00 0.00 C ATOM 1784 NH1 ARG B 20 -23.458 -7.692 3.161 1.00 0.00 N ATOM 1785 NH2 ARG B 20 -23.367 -9.260 1.535 1.00 0.00 N ATOM 0 H ARG B 20 -18.226 -10.801 4.856 1.00 0.00 H new ATOM 0 HA ARG B 20 -19.979 -12.721 6.009 1.00 0.00 H new ATOM 0 HB2 ARG B 20 -20.323 -11.299 3.333 1.00 0.00 H new ATOM 0 HB3 ARG B 20 -21.589 -11.849 4.414 1.00 0.00 H new ATOM 0 HG2 ARG B 20 -20.555 -10.270 6.199 1.00 0.00 H new ATOM 0 HG3 ARG B 20 -19.592 -9.590 4.902 1.00 0.00 H new ATOM 0 HD2 ARG B 20 -22.630 -9.602 5.162 1.00 0.00 H new ATOM 0 HD3 ARG B 20 -21.571 -8.212 5.030 1.00 0.00 H new ATOM 0 HE ARG B 20 -21.125 -9.722 2.644 1.00 0.00 H new ATOM 0 HH11 ARG B 20 -23.085 -7.289 4.021 1.00 0.00 H new ATOM 0 HH12 ARG B 20 -24.273 -7.274 2.713 1.00 0.00 H new ATOM 0 HH21 ARG B 20 -22.923 -10.082 1.124 1.00 0.00 H new ATOM 0 HH22 ARG B 20 -24.182 -8.843 1.086 1.00 0.00 H new ATOM 1799 N GLU B 21 -18.527 -13.644 3.208 1.00 0.00 N ATOM 1800 CA GLU B 21 -18.361 -14.856 2.349 1.00 0.00 C ATOM 1801 C GLU B 21 -16.904 -15.006 1.915 1.00 0.00 C ATOM 1802 O GLU B 21 -16.350 -16.088 1.949 1.00 0.00 O ATOM 1803 CB GLU B 21 -19.249 -14.727 1.110 1.00 0.00 C ATOM 1804 CG GLU B 21 -20.718 -14.719 1.536 1.00 0.00 C ATOM 1805 CD GLU B 21 -21.608 -14.904 0.305 1.00 0.00 C ATOM 1806 OE1 GLU B 21 -21.601 -15.991 -0.249 1.00 0.00 O ATOM 1807 OE2 GLU B 21 -22.282 -13.955 -0.062 1.00 0.00 O ATOM 0 H GLU B 21 -17.896 -12.868 3.005 1.00 0.00 H new ATOM 0 HA GLU B 21 -18.651 -15.736 2.923 1.00 0.00 H new ATOM 0 HB2 GLU B 21 -19.010 -13.810 0.572 1.00 0.00 H new ATOM 0 HB3 GLU B 21 -19.062 -15.555 0.427 1.00 0.00 H new ATOM 0 HG2 GLU B 21 -20.903 -15.517 2.255 1.00 0.00 H new ATOM 0 HG3 GLU B 21 -20.958 -13.779 2.034 1.00 0.00 H new ATOM 1814 N GLY B 22 -16.271 -13.941 1.503 1.00 0.00 N ATOM 1815 CA GLY B 22 -14.848 -14.048 1.066 1.00 0.00 C ATOM 1816 C GLY B 22 -14.702 -15.222 0.095 1.00 0.00 C ATOM 1817 O GLY B 22 -13.607 -15.640 -0.223 1.00 0.00 O ATOM 0 H GLY B 22 -16.674 -13.006 1.450 1.00 0.00 H new ATOM 0 HA2 GLY B 22 -14.533 -13.122 0.585 1.00 0.00 H new ATOM 0 HA3 GLY B 22 -14.200 -14.194 1.931 1.00 0.00 H new ATOM 1821 N ASP B 23 -15.795 -15.757 -0.382 1.00 0.00 N ATOM 1822 CA ASP B 23 -15.704 -16.902 -1.334 1.00 0.00 C ATOM 1823 C ASP B 23 -14.701 -16.538 -2.428 1.00 0.00 C ATOM 1824 O ASP B 23 -13.729 -17.233 -2.651 1.00 0.00 O ATOM 1825 CB ASP B 23 -17.076 -17.163 -1.959 1.00 0.00 C ATOM 1826 CG ASP B 23 -17.018 -18.438 -2.802 1.00 0.00 C ATOM 1827 OD1 ASP B 23 -16.054 -19.173 -2.662 1.00 0.00 O ATOM 1828 OD2 ASP B 23 -17.937 -18.659 -3.573 1.00 0.00 O ATOM 0 H ASP B 23 -16.742 -15.453 -0.155 1.00 0.00 H new ATOM 0 HA ASP B 23 -15.380 -17.801 -0.810 1.00 0.00 H new ATOM 0 HB2 ASP B 23 -17.830 -17.264 -1.178 1.00 0.00 H new ATOM 0 HB3 ASP B 23 -17.372 -16.317 -2.580 1.00 0.00 H new ATOM 1833 N LYS B 24 -14.913 -15.435 -3.092 1.00 0.00 N ATOM 1834 CA LYS B 24 -13.959 -14.997 -4.149 1.00 0.00 C ATOM 1835 C LYS B 24 -12.906 -14.090 -3.501 1.00 0.00 C ATOM 1836 O LYS B 24 -12.931 -13.839 -2.312 1.00 0.00 O ATOM 1837 CB LYS B 24 -14.718 -14.235 -5.250 1.00 0.00 C ATOM 1838 CG LYS B 24 -15.905 -13.469 -4.650 1.00 0.00 C ATOM 1839 CD LYS B 24 -15.416 -12.515 -3.556 1.00 0.00 C ATOM 1840 CE LYS B 24 -16.531 -11.529 -3.201 1.00 0.00 C ATOM 1841 NZ LYS B 24 -16.954 -10.788 -4.423 1.00 0.00 N ATOM 0 H LYS B 24 -15.710 -14.815 -2.947 1.00 0.00 H new ATOM 0 HA LYS B 24 -13.472 -15.860 -4.603 1.00 0.00 H new ATOM 0 HB2 LYS B 24 -14.044 -13.540 -5.751 1.00 0.00 H new ATOM 0 HB3 LYS B 24 -15.074 -14.935 -6.006 1.00 0.00 H new ATOM 0 HG2 LYS B 24 -16.418 -12.907 -5.431 1.00 0.00 H new ATOM 0 HG3 LYS B 24 -16.628 -14.171 -4.235 1.00 0.00 H new ATOM 0 HD2 LYS B 24 -15.121 -13.080 -2.672 1.00 0.00 H new ATOM 0 HD3 LYS B 24 -14.534 -11.974 -3.898 1.00 0.00 H new ATOM 0 HE2 LYS B 24 -17.380 -12.063 -2.776 1.00 0.00 H new ATOM 0 HE3 LYS B 24 -16.182 -10.829 -2.442 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 -17.397 -9.888 -4.147 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 -16.123 -10.596 -5.018 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 -17.638 -11.361 -4.957 1.00 0.00 H new ATOM 1855 N HIS B 25 -12.001 -13.577 -4.290 1.00 0.00 N ATOM 1856 CA HIS B 25 -10.947 -12.653 -3.767 1.00 0.00 C ATOM 1857 C HIS B 25 -10.922 -11.432 -4.683 1.00 0.00 C ATOM 1858 O HIS B 25 -9.880 -10.988 -5.122 1.00 0.00 O ATOM 1859 CB HIS B 25 -9.586 -13.351 -3.800 1.00 0.00 C ATOM 1860 CG HIS B 25 -9.653 -14.624 -3.000 1.00 0.00 C ATOM 1861 ND1 HIS B 25 -10.482 -15.677 -3.354 1.00 0.00 N ATOM 1862 CD2 HIS B 25 -8.997 -15.028 -1.863 1.00 0.00 C ATOM 1863 CE1 HIS B 25 -10.305 -16.655 -2.446 1.00 0.00 C ATOM 1864 NE2 HIS B 25 -9.410 -16.311 -1.515 1.00 0.00 N ATOM 0 H HIS B 25 -11.945 -13.761 -5.292 1.00 0.00 H new ATOM 0 HA HIS B 25 -11.160 -12.363 -2.738 1.00 0.00 H new ATOM 0 HB2 HIS B 25 -9.303 -13.571 -4.830 1.00 0.00 H new ATOM 0 HB3 HIS B 25 -8.818 -12.693 -3.392 1.00 0.00 H new ATOM 0 HD2 HIS B 25 -8.271 -14.440 -1.321 1.00 0.00 H new ATOM 0 HE1 HIS B 25 -10.823 -17.602 -2.467 1.00 0.00 H new ATOM 0 HE2 HIS B 25 -9.097 -16.869 -0.720 1.00 0.00 H new ATOM 1872 N LYS B 26 -12.080 -10.895 -4.976 1.00 0.00 N ATOM 1873 CA LYS B 26 -12.171 -9.703 -5.869 1.00 0.00 C ATOM 1874 C LYS B 26 -13.111 -8.667 -5.246 1.00 0.00 C ATOM 1875 O LYS B 26 -14.038 -9.013 -4.541 1.00 0.00 O ATOM 1876 CB LYS B 26 -12.733 -10.137 -7.226 1.00 0.00 C ATOM 1877 CG LYS B 26 -11.831 -11.213 -7.838 1.00 0.00 C ATOM 1878 CD LYS B 26 -12.388 -11.633 -9.201 1.00 0.00 C ATOM 1879 CE LYS B 26 -11.572 -12.807 -9.749 1.00 0.00 C ATOM 1880 NZ LYS B 26 -11.654 -13.955 -8.803 1.00 0.00 N ATOM 0 H LYS B 26 -12.976 -11.237 -4.629 1.00 0.00 H new ATOM 0 HA LYS B 26 -11.181 -9.266 -5.997 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -13.745 -10.523 -7.105 1.00 0.00 H new ATOM 0 HB3 LYS B 26 -12.797 -9.279 -7.895 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -10.816 -10.831 -7.950 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -11.775 -12.076 -7.175 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -13.436 -11.918 -9.105 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -12.349 -10.794 -9.896 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -11.951 -13.101 -10.728 1.00 0.00 H new ATOM 0 HE3 LYS B 26 -10.533 -12.509 -9.886 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -11.489 -14.843 -9.319 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -10.933 -13.846 -8.062 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -12.598 -13.979 -8.367 1.00 0.00 H new ATOM 1894 N LEU B 27 -12.887 -7.403 -5.505 1.00 0.00 N ATOM 1895 CA LEU B 27 -13.771 -6.333 -4.938 1.00 0.00 C ATOM 1896 C LEU B 27 -14.324 -5.502 -6.094 1.00 0.00 C ATOM 1897 O LEU B 27 -13.634 -5.240 -7.057 1.00 0.00 O ATOM 1898 CB LEU B 27 -12.946 -5.440 -4.007 1.00 0.00 C ATOM 1899 CG LEU B 27 -13.857 -4.429 -3.295 1.00 0.00 C ATOM 1900 CD1 LEU B 27 -14.831 -5.156 -2.344 1.00 0.00 C ATOM 1901 CD2 LEU B 27 -12.983 -3.454 -2.497 1.00 0.00 C ATOM 0 H LEU B 27 -12.124 -7.062 -6.089 1.00 0.00 H new ATOM 0 HA LEU B 27 -14.592 -6.776 -4.374 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -12.426 -6.053 -3.271 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -12.183 -4.913 -4.579 1.00 0.00 H new ATOM 0 HG LEU B 27 -14.443 -3.886 -4.036 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -15.469 -4.425 -1.848 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -15.449 -5.848 -2.916 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -14.264 -5.710 -1.596 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -13.618 -2.730 -1.986 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -12.399 -4.007 -1.761 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -12.309 -2.930 -3.175 1.00 0.00 H new ATOM 1913 N LYS B 28 -15.567 -5.091 -6.026 1.00 0.00 N ATOM 1914 CA LYS B 28 -16.141 -4.286 -7.148 1.00 0.00 C ATOM 1915 C LYS B 28 -15.896 -2.797 -6.888 1.00 0.00 C ATOM 1916 O LYS B 28 -15.851 -2.357 -5.756 1.00 0.00 O ATOM 1917 CB LYS B 28 -17.644 -4.548 -7.254 1.00 0.00 C ATOM 1918 CG LYS B 28 -17.882 -6.009 -7.641 1.00 0.00 C ATOM 1919 CD LYS B 28 -19.384 -6.299 -7.641 1.00 0.00 C ATOM 1920 CE LYS B 28 -19.630 -7.726 -8.135 1.00 0.00 C ATOM 1921 NZ LYS B 28 -21.036 -8.120 -7.832 1.00 0.00 N ATOM 0 H LYS B 28 -16.203 -5.276 -5.250 1.00 0.00 H new ATOM 0 HA LYS B 28 -15.659 -4.575 -8.082 1.00 0.00 H new ATOM 0 HB2 LYS B 28 -18.130 -4.329 -6.303 1.00 0.00 H new ATOM 0 HB3 LYS B 28 -18.087 -3.887 -7.998 1.00 0.00 H new ATOM 0 HG2 LYS B 28 -17.462 -6.208 -8.627 1.00 0.00 H new ATOM 0 HG3 LYS B 28 -17.373 -6.670 -6.939 1.00 0.00 H new ATOM 0 HD2 LYS B 28 -19.789 -6.176 -6.636 1.00 0.00 H new ATOM 0 HD3 LYS B 28 -19.902 -5.587 -8.283 1.00 0.00 H new ATOM 0 HE2 LYS B 28 -19.447 -7.788 -9.208 1.00 0.00 H new ATOM 0 HE3 LYS B 28 -18.936 -8.414 -7.653 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 -21.205 -9.090 -8.167 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 -21.195 -8.076 -6.805 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 -21.690 -7.469 -8.312 1.00 0.00 H new ATOM 1935 N LYS B 29 -15.738 -2.017 -7.921 1.00 0.00 N ATOM 1936 CA LYS B 29 -15.497 -0.557 -7.729 1.00 0.00 C ATOM 1937 C LYS B 29 -16.636 0.069 -6.913 1.00 0.00 C ATOM 1938 O LYS B 29 -16.418 0.905 -6.059 1.00 0.00 O ATOM 1939 CB LYS B 29 -15.429 0.124 -9.103 1.00 0.00 C ATOM 1940 CG LYS B 29 -16.818 0.127 -9.755 1.00 0.00 C ATOM 1941 CD LYS B 29 -16.691 0.495 -11.237 1.00 0.00 C ATOM 1942 CE LYS B 29 -18.056 0.924 -11.781 1.00 0.00 C ATOM 1943 NZ LYS B 29 -19.103 -0.027 -11.309 1.00 0.00 N ATOM 0 H LYS B 29 -15.765 -2.327 -8.892 1.00 0.00 H new ATOM 0 HA LYS B 29 -14.559 -0.418 -7.192 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -15.067 1.146 -8.994 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -14.719 -0.399 -9.743 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -17.281 -0.854 -9.652 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -17.467 0.840 -9.247 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -15.969 1.303 -11.361 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -16.315 -0.358 -11.802 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -18.291 1.935 -11.447 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -18.034 0.946 -12.871 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -19.958 0.081 -11.891 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -18.749 -1.002 -11.391 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -19.333 0.175 -10.315 1.00 0.00 H new ATOM 1957 N SER B 30 -17.850 -0.315 -7.192 1.00 0.00 N ATOM 1958 CA SER B 30 -19.015 0.268 -6.463 1.00 0.00 C ATOM 1959 C SER B 30 -18.887 0.043 -4.953 1.00 0.00 C ATOM 1960 O SER B 30 -19.197 0.913 -4.153 1.00 0.00 O ATOM 1961 CB SER B 30 -20.296 -0.405 -6.958 1.00 0.00 C ATOM 1962 OG SER B 30 -20.268 -0.477 -8.377 1.00 0.00 O ATOM 0 H SER B 30 -18.089 -1.012 -7.898 1.00 0.00 H new ATOM 0 HA SER B 30 -19.044 1.341 -6.654 1.00 0.00 H new ATOM 0 HB2 SER B 30 -20.383 -1.405 -6.533 1.00 0.00 H new ATOM 0 HB3 SER B 30 -21.168 0.159 -6.628 1.00 0.00 H new ATOM 0 HG SER B 30 -21.086 -0.909 -8.699 1.00 0.00 H new ATOM 1968 N GLU B 31 -18.434 -1.113 -4.548 1.00 0.00 N ATOM 1969 CA GLU B 31 -18.308 -1.373 -3.084 1.00 0.00 C ATOM 1970 C GLU B 31 -17.039 -0.703 -2.566 1.00 0.00 C ATOM 1971 O GLU B 31 -16.987 -0.216 -1.454 1.00 0.00 O ATOM 1972 CB GLU B 31 -18.257 -2.878 -2.818 1.00 0.00 C ATOM 1973 CG GLU B 31 -19.656 -3.475 -2.986 1.00 0.00 C ATOM 1974 CD GLU B 31 -19.598 -4.986 -2.754 1.00 0.00 C ATOM 1975 OE1 GLU B 31 -18.975 -5.665 -3.553 1.00 0.00 O ATOM 1976 OE2 GLU B 31 -20.175 -5.438 -1.779 1.00 0.00 O ATOM 0 H GLU B 31 -18.149 -1.880 -5.158 1.00 0.00 H new ATOM 0 HA GLU B 31 -19.174 -0.962 -2.565 1.00 0.00 H new ATOM 0 HB2 GLU B 31 -17.561 -3.356 -3.507 1.00 0.00 H new ATOM 0 HB3 GLU B 31 -17.888 -3.067 -1.810 1.00 0.00 H new ATOM 0 HG2 GLU B 31 -20.347 -3.014 -2.280 1.00 0.00 H new ATOM 0 HG3 GLU B 31 -20.035 -3.264 -3.986 1.00 0.00 H new ATOM 1983 N LEU B 32 -16.017 -0.657 -3.378 1.00 0.00 N ATOM 1984 CA LEU B 32 -14.757 0.000 -2.946 1.00 0.00 C ATOM 1985 C LEU B 32 -15.055 1.474 -2.676 1.00 0.00 C ATOM 1986 O LEU B 32 -14.604 2.035 -1.699 1.00 0.00 O ATOM 1987 CB LEU B 32 -13.699 -0.139 -4.048 1.00 0.00 C ATOM 1988 CG LEU B 32 -12.482 0.750 -3.752 1.00 0.00 C ATOM 1989 CD1 LEU B 32 -11.936 0.449 -2.353 1.00 0.00 C ATOM 1990 CD2 LEU B 32 -11.393 0.467 -4.792 1.00 0.00 C ATOM 0 H LEU B 32 -16.003 -1.047 -4.321 1.00 0.00 H new ATOM 0 HA LEU B 32 -14.372 -0.470 -2.041 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -13.384 -1.180 -4.127 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -14.131 0.137 -5.010 1.00 0.00 H new ATOM 0 HG LEU B 32 -12.782 1.797 -3.798 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -11.073 1.085 -2.154 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -12.710 0.645 -1.611 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -11.636 -0.597 -2.297 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -10.525 1.094 -4.590 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -11.103 -0.582 -4.739 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -11.775 0.688 -5.789 1.00 0.00 H new ATOM 2002 N LYS B 33 -15.794 2.124 -3.533 1.00 0.00 N ATOM 2003 CA LYS B 33 -16.073 3.564 -3.298 1.00 0.00 C ATOM 2004 C LYS B 33 -16.624 3.733 -1.887 1.00 0.00 C ATOM 2005 O LYS B 33 -16.087 4.467 -1.083 1.00 0.00 O ATOM 2006 CB LYS B 33 -17.096 4.065 -4.320 1.00 0.00 C ATOM 2007 CG LYS B 33 -17.303 5.569 -4.139 1.00 0.00 C ATOM 2008 CD LYS B 33 -18.291 6.077 -5.191 1.00 0.00 C ATOM 2009 CE LYS B 33 -18.363 7.603 -5.127 1.00 0.00 C ATOM 2010 NZ LYS B 33 -19.298 8.101 -6.175 1.00 0.00 N ATOM 0 H LYS B 33 -16.211 1.725 -4.374 1.00 0.00 H new ATOM 0 HA LYS B 33 -15.156 4.143 -3.407 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -16.749 3.854 -5.331 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -18.042 3.539 -4.192 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -17.682 5.777 -3.138 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -16.352 6.092 -4.235 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -17.976 5.758 -6.185 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -19.278 5.648 -5.016 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -18.702 7.921 -4.141 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -17.372 8.031 -5.276 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -19.347 9.139 -6.132 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -18.955 7.809 -7.113 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -20.245 7.703 -6.013 1.00 0.00 H new ATOM 2024 N GLU B 34 -17.701 3.057 -1.581 1.00 0.00 N ATOM 2025 CA GLU B 34 -18.285 3.190 -0.211 1.00 0.00 C ATOM 2026 C GLU B 34 -17.165 3.031 0.826 1.00 0.00 C ATOM 2027 O GLU B 34 -17.163 3.682 1.851 1.00 0.00 O ATOM 2028 CB GLU B 34 -19.350 2.113 0.008 1.00 0.00 C ATOM 2029 CG GLU B 34 -20.490 2.312 -0.991 1.00 0.00 C ATOM 2030 CD GLU B 34 -21.529 1.204 -0.810 1.00 0.00 C ATOM 2031 OE1 GLU B 34 -21.259 0.283 -0.056 1.00 0.00 O ATOM 2032 OE2 GLU B 34 -22.577 1.295 -1.427 1.00 0.00 O ATOM 0 H GLU B 34 -18.197 2.426 -2.211 1.00 0.00 H new ATOM 0 HA GLU B 34 -18.749 4.170 -0.104 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -18.912 1.123 -0.117 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -19.732 2.166 1.027 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -20.953 3.287 -0.840 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -20.102 2.298 -2.009 1.00 0.00 H new ATOM 2039 N LEU B 35 -16.204 2.187 0.562 1.00 0.00 N ATOM 2040 CA LEU B 35 -15.079 2.011 1.528 1.00 0.00 C ATOM 2041 C LEU B 35 -14.267 3.318 1.586 1.00 0.00 C ATOM 2042 O LEU B 35 -14.005 3.839 2.649 1.00 0.00 O ATOM 2043 CB LEU B 35 -14.190 0.825 1.071 1.00 0.00 C ATOM 2044 CG LEU B 35 -14.335 -0.372 2.029 1.00 0.00 C ATOM 2045 CD1 LEU B 35 -13.834 -1.645 1.341 1.00 0.00 C ATOM 2046 CD2 LEU B 35 -13.506 -0.128 3.294 1.00 0.00 C ATOM 0 H LEU B 35 -16.148 1.612 -0.279 1.00 0.00 H new ATOM 0 HA LEU B 35 -15.462 1.788 2.524 1.00 0.00 H new ATOM 0 HB2 LEU B 35 -14.470 0.524 0.061 1.00 0.00 H new ATOM 0 HB3 LEU B 35 -13.147 1.141 1.032 1.00 0.00 H new ATOM 0 HG LEU B 35 -15.385 -0.487 2.297 1.00 0.00 H new ATOM 0 HD11 LEU B 35 -13.938 -2.491 2.021 1.00 0.00 H new ATOM 0 HD12 LEU B 35 -14.422 -1.828 0.442 1.00 0.00 H new ATOM 0 HD13 LEU B 35 -12.785 -1.524 1.070 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -13.612 -0.978 3.968 1.00 0.00 H new ATOM 0 HD22 LEU B 35 -12.457 -0.008 3.024 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -13.858 0.776 3.791 1.00 0.00 H new ATOM 2058 N ILE B 36 -13.885 3.866 0.463 1.00 0.00 N ATOM 2059 CA ILE B 36 -13.114 5.146 0.475 1.00 0.00 C ATOM 2060 C ILE B 36 -13.859 6.190 1.314 1.00 0.00 C ATOM 2061 O ILE B 36 -13.257 6.976 2.019 1.00 0.00 O ATOM 2062 CB ILE B 36 -12.974 5.640 -0.972 1.00 0.00 C ATOM 2063 CG1 ILE B 36 -12.281 4.541 -1.789 1.00 0.00 C ATOM 2064 CG2 ILE B 36 -12.126 6.921 -1.012 1.00 0.00 C ATOM 2065 CD1 ILE B 36 -12.004 5.029 -3.212 1.00 0.00 C ATOM 0 H ILE B 36 -14.073 3.483 -0.463 1.00 0.00 H new ATOM 0 HA ILE B 36 -12.128 4.988 0.911 1.00 0.00 H new ATOM 0 HB ILE B 36 -13.958 5.860 -1.386 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -11.346 4.256 -1.307 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -12.909 3.651 -1.819 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -12.033 7.263 -2.043 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -12.608 7.695 -0.415 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -11.135 6.714 -0.607 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -11.512 4.238 -3.779 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -12.945 5.291 -3.696 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -11.357 5.906 -3.177 1.00 0.00 H new ATOM 2077 N ASN B 37 -15.158 6.222 1.225 1.00 0.00 N ATOM 2078 CA ASN B 37 -15.940 7.234 1.994 1.00 0.00 C ATOM 2079 C ASN B 37 -15.785 7.006 3.502 1.00 0.00 C ATOM 2080 O ASN B 37 -15.908 7.921 4.291 1.00 0.00 O ATOM 2081 CB ASN B 37 -17.419 7.111 1.620 1.00 0.00 C ATOM 2082 CG ASN B 37 -18.201 8.273 2.234 1.00 0.00 C ATOM 2083 OD1 ASN B 37 -17.980 9.417 1.893 1.00 0.00 O ATOM 2084 ND2 ASN B 37 -19.113 8.025 3.133 1.00 0.00 N ATOM 0 H ASN B 37 -15.716 5.590 0.651 1.00 0.00 H new ATOM 0 HA ASN B 37 -15.566 8.228 1.749 1.00 0.00 H new ATOM 0 HB2 ASN B 37 -17.532 7.116 0.536 1.00 0.00 H new ATOM 0 HB3 ASN B 37 -17.817 6.162 1.978 1.00 0.00 H new ATOM 0 HD21 ASN B 37 -19.641 8.792 3.549 1.00 0.00 H new ATOM 0 HD22 ASN B 37 -19.299 7.064 3.419 1.00 0.00 H new ATOM 2091 N ASN B 38 -15.541 5.784 3.905 1.00 0.00 N ATOM 2092 CA ASN B 38 -15.404 5.464 5.364 1.00 0.00 C ATOM 2093 C ASN B 38 -14.012 4.904 5.662 1.00 0.00 C ATOM 2094 O ASN B 38 -13.726 4.519 6.779 1.00 0.00 O ATOM 2095 CB ASN B 38 -16.444 4.403 5.730 1.00 0.00 C ATOM 2096 CG ASN B 38 -17.842 5.024 5.696 1.00 0.00 C ATOM 2097 OD1 ASN B 38 -18.211 5.668 4.734 1.00 0.00 O ATOM 2098 ND2 ASN B 38 -18.641 4.857 6.714 1.00 0.00 N ATOM 0 H ASN B 38 -15.429 4.985 3.281 1.00 0.00 H new ATOM 0 HA ASN B 38 -15.554 6.375 5.944 1.00 0.00 H new ATOM 0 HB2 ASN B 38 -16.388 3.568 5.031 1.00 0.00 H new ATOM 0 HB3 ASN B 38 -16.237 4.003 6.722 1.00 0.00 H new ATOM 0 HD21 ASN B 38 -19.575 5.267 6.702 1.00 0.00 H new ATOM 0 HD22 ASN B 38 -18.332 4.316 7.522 1.00 0.00 H new ATOM 2105 N GLU B 39 -13.149 4.834 4.680 1.00 0.00 N ATOM 2106 CA GLU B 39 -11.779 4.272 4.918 1.00 0.00 C ATOM 2107 C GLU B 39 -10.735 5.392 4.968 1.00 0.00 C ATOM 2108 O GLU B 39 -9.750 5.294 5.673 1.00 0.00 O ATOM 2109 CB GLU B 39 -11.435 3.318 3.773 1.00 0.00 C ATOM 2110 CG GLU B 39 -10.170 2.533 4.119 1.00 0.00 C ATOM 2111 CD GLU B 39 -9.712 1.739 2.895 1.00 0.00 C ATOM 2112 OE1 GLU B 39 -8.951 2.283 2.112 1.00 0.00 O ATOM 2113 OE2 GLU B 39 -10.131 0.601 2.760 1.00 0.00 O ATOM 0 H GLU B 39 -13.331 5.140 3.724 1.00 0.00 H new ATOM 0 HA GLU B 39 -11.771 3.746 5.873 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -12.264 2.632 3.597 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -11.285 3.880 2.851 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -9.382 3.215 4.439 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -10.365 1.857 4.952 1.00 0.00 H new ATOM 2120 N LEU B 40 -10.946 6.456 4.230 1.00 0.00 N ATOM 2121 CA LEU B 40 -9.970 7.597 4.229 1.00 0.00 C ATOM 2122 C LEU B 40 -10.699 8.899 4.570 1.00 0.00 C ATOM 2123 O LEU B 40 -10.425 9.941 4.008 1.00 0.00 O ATOM 2124 CB LEU B 40 -9.340 7.725 2.839 1.00 0.00 C ATOM 2125 CG LEU B 40 -8.751 6.376 2.404 1.00 0.00 C ATOM 2126 CD1 LEU B 40 -8.279 6.473 0.951 1.00 0.00 C ATOM 2127 CD2 LEU B 40 -7.560 6.008 3.302 1.00 0.00 C ATOM 0 H LEU B 40 -11.756 6.585 3.624 1.00 0.00 H new ATOM 0 HA LEU B 40 -9.194 7.408 4.971 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -10.090 8.053 2.119 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -8.559 8.485 2.853 1.00 0.00 H new ATOM 0 HG LEU B 40 -9.518 5.606 2.493 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -7.860 5.516 0.640 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -9.124 6.725 0.310 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -7.516 7.247 0.867 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -7.149 5.049 2.986 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -6.792 6.777 3.221 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -7.893 5.936 4.337 1.00 0.00 H new ATOM 2139 N SER B 41 -11.629 8.847 5.483 1.00 0.00 N ATOM 2140 CA SER B 41 -12.382 10.078 5.856 1.00 0.00 C ATOM 2141 C SER B 41 -11.458 11.060 6.580 1.00 0.00 C ATOM 2142 O SER B 41 -11.648 12.258 6.518 1.00 0.00 O ATOM 2143 CB SER B 41 -13.541 9.701 6.781 1.00 0.00 C ATOM 2144 OG SER B 41 -13.043 8.935 7.870 1.00 0.00 O ATOM 0 H SER B 41 -11.901 8.003 5.988 1.00 0.00 H new ATOM 0 HA SER B 41 -12.766 10.549 4.951 1.00 0.00 H new ATOM 0 HB2 SER B 41 -14.034 10.600 7.150 1.00 0.00 H new ATOM 0 HB3 SER B 41 -14.289 9.129 6.231 1.00 0.00 H new ATOM 0 HG SER B 41 -13.783 8.693 8.465 1.00 0.00 H new ATOM 2150 N HIS B 42 -10.462 10.574 7.269 1.00 0.00 N ATOM 2151 CA HIS B 42 -9.543 11.499 7.990 1.00 0.00 C ATOM 2152 C HIS B 42 -8.604 12.184 6.994 1.00 0.00 C ATOM 2153 O HIS B 42 -8.478 13.392 6.978 1.00 0.00 O ATOM 2154 CB HIS B 42 -8.720 10.706 9.008 1.00 0.00 C ATOM 2155 CG HIS B 42 -9.593 10.338 10.176 1.00 0.00 C ATOM 2156 ND1 HIS B 42 -9.102 10.252 11.469 1.00 0.00 N ATOM 2157 CD2 HIS B 42 -10.930 10.039 10.260 1.00 0.00 C ATOM 2158 CE1 HIS B 42 -10.130 9.915 12.270 1.00 0.00 C ATOM 2159 NE2 HIS B 42 -11.267 9.773 11.583 1.00 0.00 N ATOM 0 H HIS B 42 -10.246 9.582 7.364 1.00 0.00 H new ATOM 0 HA HIS B 42 -10.130 12.259 8.506 1.00 0.00 H new ATOM 0 HB2 HIS B 42 -8.316 9.806 8.544 1.00 0.00 H new ATOM 0 HB3 HIS B 42 -7.871 11.299 9.347 1.00 0.00 H new ATOM 0 HD2 HIS B 42 -11.616 10.014 9.426 1.00 0.00 H new ATOM 0 HE1 HIS B 42 -10.046 9.776 13.338 1.00 0.00 H new ATOM 0 HE2 HIS B 42 -12.185 9.523 11.950 1.00 0.00 H new ATOM 2167 N PHE B 43 -7.940 11.426 6.164 1.00 0.00 N ATOM 2168 CA PHE B 43 -7.011 12.046 5.178 1.00 0.00 C ATOM 2169 C PHE B 43 -7.810 12.936 4.223 1.00 0.00 C ATOM 2170 O PHE B 43 -7.272 13.810 3.572 1.00 0.00 O ATOM 2171 CB PHE B 43 -6.289 10.947 4.395 1.00 0.00 C ATOM 2172 CG PHE B 43 -5.345 10.214 5.321 1.00 0.00 C ATOM 2173 CD1 PHE B 43 -4.126 10.801 5.687 1.00 0.00 C ATOM 2174 CD2 PHE B 43 -5.689 8.951 5.819 1.00 0.00 C ATOM 2175 CE1 PHE B 43 -3.254 10.124 6.547 1.00 0.00 C ATOM 2176 CE2 PHE B 43 -4.816 8.275 6.680 1.00 0.00 C ATOM 2177 CZ PHE B 43 -3.598 8.862 7.044 1.00 0.00 C ATOM 0 H PHE B 43 -8.000 10.408 6.126 1.00 0.00 H new ATOM 0 HA PHE B 43 -6.271 12.653 5.699 1.00 0.00 H new ATOM 0 HB2 PHE B 43 -7.013 10.252 3.970 1.00 0.00 H new ATOM 0 HB3 PHE B 43 -5.736 11.381 3.562 1.00 0.00 H new ATOM 0 HD1 PHE B 43 -3.860 11.776 5.305 1.00 0.00 H new ATOM 0 HD2 PHE B 43 -6.629 8.498 5.539 1.00 0.00 H new ATOM 0 HE1 PHE B 43 -2.314 10.576 6.828 1.00 0.00 H new ATOM 0 HE2 PHE B 43 -5.082 7.301 7.063 1.00 0.00 H new ATOM 0 HZ PHE B 43 -2.924 8.341 7.708 1.00 0.00 H new ATOM 2187 N LEU B 44 -9.092 12.714 4.133 1.00 0.00 N ATOM 2188 CA LEU B 44 -9.936 13.537 3.219 1.00 0.00 C ATOM 2189 C LEU B 44 -9.650 15.023 3.450 1.00 0.00 C ATOM 2190 O LEU B 44 -9.402 15.771 2.525 1.00 0.00 O ATOM 2191 CB LEU B 44 -11.413 13.250 3.516 1.00 0.00 C ATOM 2192 CG LEU B 44 -12.317 13.916 2.457 1.00 0.00 C ATOM 2193 CD1 LEU B 44 -12.434 13.016 1.221 1.00 0.00 C ATOM 2194 CD2 LEU B 44 -13.715 14.139 3.046 1.00 0.00 C ATOM 0 H LEU B 44 -9.594 11.996 4.655 1.00 0.00 H new ATOM 0 HA LEU B 44 -9.708 13.286 2.183 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -11.586 12.174 3.525 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -11.670 13.622 4.508 1.00 0.00 H new ATOM 0 HG LEU B 44 -11.877 14.871 2.168 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -13.074 13.496 0.481 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -11.444 12.853 0.794 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -12.867 12.058 1.508 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -14.354 14.609 2.299 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -14.144 13.180 3.338 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -13.643 14.786 3.920 1.00 0.00 H new ATOM 2206 N GLU B 45 -9.692 15.455 4.677 1.00 0.00 N ATOM 2207 CA GLU B 45 -9.434 16.891 4.972 1.00 0.00 C ATOM 2208 C GLU B 45 -8.070 17.298 4.413 1.00 0.00 C ATOM 2209 O GLU B 45 -7.845 18.441 4.066 1.00 0.00 O ATOM 2210 CB GLU B 45 -9.446 17.105 6.489 1.00 0.00 C ATOM 2211 CG GLU B 45 -9.561 18.600 6.800 1.00 0.00 C ATOM 2212 CD GLU B 45 -11.005 19.061 6.587 1.00 0.00 C ATOM 2213 OE1 GLU B 45 -11.794 18.913 7.505 1.00 0.00 O ATOM 2214 OE2 GLU B 45 -11.296 19.556 5.511 1.00 0.00 O ATOM 0 H GLU B 45 -9.894 14.875 5.491 1.00 0.00 H new ATOM 0 HA GLU B 45 -10.209 17.500 4.507 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -10.282 16.566 6.935 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -8.535 16.701 6.930 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -9.256 18.792 7.829 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -8.889 19.168 6.157 1.00 0.00 H new ATOM 2221 N GLU B 46 -7.148 16.375 4.344 1.00 0.00 N ATOM 2222 CA GLU B 46 -5.781 16.707 3.832 1.00 0.00 C ATOM 2223 C GLU B 46 -5.687 16.457 2.321 1.00 0.00 C ATOM 2224 O GLU B 46 -4.884 15.664 1.871 1.00 0.00 O ATOM 2225 CB GLU B 46 -4.752 15.832 4.551 1.00 0.00 C ATOM 2226 CG GLU B 46 -4.717 16.201 6.036 1.00 0.00 C ATOM 2227 CD GLU B 46 -3.974 15.115 6.816 1.00 0.00 C ATOM 2228 OE1 GLU B 46 -3.315 14.305 6.185 1.00 0.00 O ATOM 2229 OE2 GLU B 46 -4.076 15.113 8.032 1.00 0.00 O ATOM 0 H GLU B 46 -7.281 15.402 4.620 1.00 0.00 H new ATOM 0 HA GLU B 46 -5.583 17.762 4.023 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -5.008 14.779 4.433 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -3.766 15.972 4.107 1.00 0.00 H new ATOM 0 HG2 GLU B 46 -4.222 17.163 6.171 1.00 0.00 H new ATOM 0 HG3 GLU B 46 -5.732 16.308 6.419 1.00 0.00 H new ATOM 2236 N ILE B 47 -6.483 17.143 1.534 1.00 0.00 N ATOM 2237 CA ILE B 47 -6.429 16.971 0.043 1.00 0.00 C ATOM 2238 C ILE B 47 -6.195 18.339 -0.605 1.00 0.00 C ATOM 2239 O ILE B 47 -7.092 19.154 -0.693 1.00 0.00 O ATOM 2240 CB ILE B 47 -7.753 16.385 -0.463 1.00 0.00 C ATOM 2241 CG1 ILE B 47 -7.883 14.936 0.018 1.00 0.00 C ATOM 2242 CG2 ILE B 47 -7.773 16.414 -1.996 1.00 0.00 C ATOM 2243 CD1 ILE B 47 -9.295 14.416 -0.269 1.00 0.00 C ATOM 0 H ILE B 47 -7.173 17.819 1.861 1.00 0.00 H new ATOM 0 HA ILE B 47 -5.618 16.291 -0.218 1.00 0.00 H new ATOM 0 HB ILE B 47 -8.583 16.976 -0.077 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -7.146 14.309 -0.485 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -7.675 14.878 1.086 1.00 0.00 H new ATOM 0 HG21 ILE B 47 -8.714 15.998 -2.356 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -7.676 17.443 -2.342 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -6.943 15.822 -2.382 1.00 0.00 H new ATOM 0 HD11 ILE B 47 -9.380 13.385 0.076 1.00 0.00 H new ATOM 0 HD12 ILE B 47 -10.024 15.035 0.254 1.00 0.00 H new ATOM 0 HD13 ILE B 47 -9.487 14.457 -1.341 1.00 0.00 H new ATOM 2255 N LYS B 48 -4.995 18.602 -1.059 1.00 0.00 N ATOM 2256 CA LYS B 48 -4.708 19.923 -1.699 1.00 0.00 C ATOM 2257 C LYS B 48 -4.921 19.813 -3.212 1.00 0.00 C ATOM 2258 O LYS B 48 -5.553 20.652 -3.823 1.00 0.00 O ATOM 2259 CB LYS B 48 -3.259 20.324 -1.411 1.00 0.00 C ATOM 2260 CG LYS B 48 -3.056 21.799 -1.769 1.00 0.00 C ATOM 2261 CD LYS B 48 -1.560 22.132 -1.764 1.00 0.00 C ATOM 2262 CE LYS B 48 -1.009 22.037 -0.339 1.00 0.00 C ATOM 2263 NZ LYS B 48 0.308 22.732 -0.270 1.00 0.00 N ATOM 0 H LYS B 48 -4.203 17.961 -1.014 1.00 0.00 H new ATOM 0 HA LYS B 48 -5.380 20.679 -1.293 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -3.027 20.159 -0.359 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -2.576 19.701 -1.989 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -3.481 22.006 -2.751 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -3.581 22.432 -1.054 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -1.023 21.444 -2.417 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -1.401 23.136 -2.158 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -1.709 22.489 0.364 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -0.897 20.992 -0.050 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 0.684 22.668 0.698 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 0.973 22.281 -0.930 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 0.187 23.732 -0.529 1.00 0.00 H new ATOM 2277 N GLU B 49 -4.400 18.780 -3.822 1.00 0.00 N ATOM 2278 CA GLU B 49 -4.575 18.611 -5.296 1.00 0.00 C ATOM 2279 C GLU B 49 -5.926 17.944 -5.575 1.00 0.00 C ATOM 2280 O GLU B 49 -5.990 16.820 -6.033 1.00 0.00 O ATOM 2281 CB GLU B 49 -3.444 17.739 -5.848 1.00 0.00 C ATOM 2282 CG GLU B 49 -2.114 18.165 -5.221 1.00 0.00 C ATOM 2283 CD GLU B 49 -1.907 19.668 -5.424 1.00 0.00 C ATOM 2284 OE1 GLU B 49 -2.262 20.157 -6.483 1.00 0.00 O ATOM 2285 OE2 GLU B 49 -1.396 20.303 -4.517 1.00 0.00 O ATOM 0 H GLU B 49 -3.861 18.046 -3.363 1.00 0.00 H new ATOM 0 HA GLU B 49 -4.547 19.586 -5.782 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -3.641 16.689 -5.630 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -3.394 17.835 -6.933 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -2.110 17.928 -4.157 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -1.293 17.610 -5.675 1.00 0.00 H new ATOM 2292 N GLN B 50 -7.004 18.618 -5.287 1.00 0.00 N ATOM 2293 CA GLN B 50 -8.350 18.016 -5.516 1.00 0.00 C ATOM 2294 C GLN B 50 -8.410 17.362 -6.901 1.00 0.00 C ATOM 2295 O GLN B 50 -9.213 16.484 -7.147 1.00 0.00 O ATOM 2296 CB GLN B 50 -9.413 19.113 -5.435 1.00 0.00 C ATOM 2297 CG GLN B 50 -9.313 19.825 -4.084 1.00 0.00 C ATOM 2298 CD GLN B 50 -10.450 20.839 -3.957 1.00 0.00 C ATOM 2299 OE1 GLN B 50 -11.507 20.523 -3.448 1.00 0.00 O ATOM 2300 NE2 GLN B 50 -10.277 22.054 -4.401 1.00 0.00 N ATOM 0 H GLN B 50 -7.012 19.562 -4.902 1.00 0.00 H new ATOM 0 HA GLN B 50 -8.533 17.258 -4.754 1.00 0.00 H new ATOM 0 HB2 GLN B 50 -9.275 19.828 -6.246 1.00 0.00 H new ATOM 0 HB3 GLN B 50 -10.406 18.681 -5.557 1.00 0.00 H new ATOM 0 HG2 GLN B 50 -9.367 19.099 -3.273 1.00 0.00 H new ATOM 0 HG3 GLN B 50 -8.350 20.329 -3.997 1.00 0.00 H new ATOM 0 HE21 GLN B 50 -9.390 22.319 -4.828 1.00 0.00 H new ATOM 0 HE22 GLN B 50 -11.029 22.738 -4.321 1.00 0.00 H new ATOM 2309 N GLU B 51 -7.578 17.793 -7.810 1.00 0.00 N ATOM 2310 CA GLU B 51 -7.601 17.204 -9.182 1.00 0.00 C ATOM 2311 C GLU B 51 -6.977 15.805 -9.170 1.00 0.00 C ATOM 2312 O GLU B 51 -7.316 14.969 -9.984 1.00 0.00 O ATOM 2313 CB GLU B 51 -6.856 18.112 -10.162 1.00 0.00 C ATOM 2314 CG GLU B 51 -7.709 19.346 -10.463 1.00 0.00 C ATOM 2315 CD GLU B 51 -8.063 20.054 -9.154 1.00 0.00 C ATOM 2316 OE1 GLU B 51 -7.161 20.293 -8.369 1.00 0.00 O ATOM 2317 OE2 GLU B 51 -9.232 20.345 -8.959 1.00 0.00 O ATOM 0 H GLU B 51 -6.884 18.526 -7.664 1.00 0.00 H new ATOM 0 HA GLU B 51 -8.638 17.119 -9.508 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -5.898 18.413 -9.739 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -6.641 17.571 -11.084 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -7.166 20.025 -11.121 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -8.618 19.053 -10.988 1.00 0.00 H new ATOM 2324 N VAL B 52 -6.112 15.514 -8.240 1.00 0.00 N ATOM 2325 CA VAL B 52 -5.541 14.138 -8.185 1.00 0.00 C ATOM 2326 C VAL B 52 -6.630 13.215 -7.648 1.00 0.00 C ATOM 2327 O VAL B 52 -6.920 12.185 -8.223 1.00 0.00 O ATOM 2328 CB VAL B 52 -4.338 14.106 -7.236 1.00 0.00 C ATOM 2329 CG1 VAL B 52 -3.893 12.657 -7.016 1.00 0.00 C ATOM 2330 CG2 VAL B 52 -3.183 14.898 -7.845 1.00 0.00 C ATOM 0 H VAL B 52 -5.778 16.159 -7.524 1.00 0.00 H new ATOM 0 HA VAL B 52 -5.210 13.823 -9.175 1.00 0.00 H new ATOM 0 HB VAL B 52 -4.624 14.549 -6.282 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -3.037 12.638 -6.341 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -4.713 12.087 -6.579 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -3.611 12.214 -7.971 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -2.329 14.874 -7.168 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -2.902 14.455 -8.800 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -3.493 15.931 -8.001 1.00 0.00 H new ATOM 2340 N VAL B 53 -7.248 13.576 -6.562 1.00 0.00 N ATOM 2341 CA VAL B 53 -8.327 12.715 -6.014 1.00 0.00 C ATOM 2342 C VAL B 53 -9.464 12.647 -7.034 1.00 0.00 C ATOM 2343 O VAL B 53 -10.162 11.660 -7.142 1.00 0.00 O ATOM 2344 CB VAL B 53 -8.846 13.318 -4.707 1.00 0.00 C ATOM 2345 CG1 VAL B 53 -10.058 12.522 -4.221 1.00 0.00 C ATOM 2346 CG2 VAL B 53 -7.743 13.264 -3.645 1.00 0.00 C ATOM 0 H VAL B 53 -7.054 14.426 -6.032 1.00 0.00 H new ATOM 0 HA VAL B 53 -7.943 11.714 -5.818 1.00 0.00 H new ATOM 0 HB VAL B 53 -9.137 14.354 -4.878 1.00 0.00 H new ATOM 0 HG11 VAL B 53 -10.427 12.953 -3.290 1.00 0.00 H new ATOM 0 HG12 VAL B 53 -10.844 12.560 -4.975 1.00 0.00 H new ATOM 0 HG13 VAL B 53 -9.768 11.485 -4.051 1.00 0.00 H new ATOM 0 HG21 VAL B 53 -8.113 13.694 -2.714 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -7.451 12.227 -3.476 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -6.879 13.832 -3.989 1.00 0.00 H new ATOM 2356 N ASP B 54 -9.656 13.703 -7.778 1.00 0.00 N ATOM 2357 CA ASP B 54 -10.749 13.714 -8.787 1.00 0.00 C ATOM 2358 C ASP B 54 -10.503 12.622 -9.830 1.00 0.00 C ATOM 2359 O ASP B 54 -11.384 11.851 -10.154 1.00 0.00 O ATOM 2360 CB ASP B 54 -10.788 15.077 -9.481 1.00 0.00 C ATOM 2361 CG ASP B 54 -12.019 15.151 -10.388 1.00 0.00 C ATOM 2362 OD1 ASP B 54 -12.222 14.225 -11.156 1.00 0.00 O ATOM 2363 OD2 ASP B 54 -12.737 16.133 -10.299 1.00 0.00 O ATOM 0 H ASP B 54 -9.102 14.558 -7.729 1.00 0.00 H new ATOM 0 HA ASP B 54 -11.700 13.529 -8.288 1.00 0.00 H new ATOM 0 HB2 ASP B 54 -10.821 15.874 -8.739 1.00 0.00 H new ATOM 0 HB3 ASP B 54 -9.881 15.225 -10.067 1.00 0.00 H new ATOM 2368 N LYS B 55 -9.313 12.562 -10.373 1.00 0.00 N ATOM 2369 CA LYS B 55 -9.023 11.531 -11.411 1.00 0.00 C ATOM 2370 C LYS B 55 -9.099 10.136 -10.792 1.00 0.00 C ATOM 2371 O LYS B 55 -9.418 9.175 -11.464 1.00 0.00 O ATOM 2372 CB LYS B 55 -7.639 11.766 -12.016 1.00 0.00 C ATOM 2373 CG LYS B 55 -7.606 13.138 -12.698 1.00 0.00 C ATOM 2374 CD LYS B 55 -6.157 13.537 -13.002 1.00 0.00 C ATOM 2375 CE LYS B 55 -5.594 12.647 -14.114 1.00 0.00 C ATOM 2376 NZ LYS B 55 -4.309 13.219 -14.605 1.00 0.00 N ATOM 0 H LYS B 55 -8.535 13.180 -10.143 1.00 0.00 H new ATOM 0 HA LYS B 55 -9.767 11.607 -12.204 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -6.877 11.716 -11.238 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -7.408 10.983 -12.739 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -8.185 13.109 -13.621 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -8.070 13.885 -12.054 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -6.115 14.583 -13.305 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -5.548 13.440 -12.103 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -5.435 11.636 -13.740 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -6.309 12.575 -14.934 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -3.926 12.615 -15.360 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -4.475 14.176 -14.977 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -3.628 13.266 -13.821 1.00 0.00 H new ATOM 2390 N VAL B 56 -8.857 10.005 -9.517 1.00 0.00 N ATOM 2391 CA VAL B 56 -8.976 8.664 -8.886 1.00 0.00 C ATOM 2392 C VAL B 56 -10.432 8.215 -9.004 1.00 0.00 C ATOM 2393 O VAL B 56 -10.729 7.151 -9.510 1.00 0.00 O ATOM 2394 CB VAL B 56 -8.583 8.754 -7.405 1.00 0.00 C ATOM 2395 CG1 VAL B 56 -8.991 7.463 -6.678 1.00 0.00 C ATOM 2396 CG2 VAL B 56 -7.066 8.942 -7.303 1.00 0.00 C ATOM 0 H VAL B 56 -8.584 10.762 -8.891 1.00 0.00 H new ATOM 0 HA VAL B 56 -8.317 7.951 -9.381 1.00 0.00 H new ATOM 0 HB VAL B 56 -9.093 9.599 -6.942 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -8.710 7.533 -5.627 1.00 0.00 H new ATOM 0 HG12 VAL B 56 -10.070 7.327 -6.756 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -8.484 6.613 -7.134 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -6.777 9.007 -6.254 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -6.562 8.094 -7.766 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -6.778 9.859 -7.816 1.00 0.00 H new ATOM 2406 N MET B 57 -11.341 9.017 -8.526 1.00 0.00 N ATOM 2407 CA MET B 57 -12.778 8.641 -8.591 1.00 0.00 C ATOM 2408 C MET B 57 -13.185 8.341 -10.038 1.00 0.00 C ATOM 2409 O MET B 57 -14.102 7.583 -10.285 1.00 0.00 O ATOM 2410 CB MET B 57 -13.624 9.796 -8.045 1.00 0.00 C ATOM 2411 CG MET B 57 -13.268 10.044 -6.574 1.00 0.00 C ATOM 2412 SD MET B 57 -14.607 10.960 -5.771 1.00 0.00 S ATOM 2413 CE MET B 57 -14.388 10.276 -4.109 1.00 0.00 C ATOM 0 H MET B 57 -11.149 9.920 -8.092 1.00 0.00 H new ATOM 0 HA MET B 57 -12.942 7.746 -7.991 1.00 0.00 H new ATOM 0 HB2 MET B 57 -13.446 10.698 -8.630 1.00 0.00 H new ATOM 0 HB3 MET B 57 -14.684 9.559 -8.138 1.00 0.00 H new ATOM 0 HG2 MET B 57 -13.106 9.095 -6.064 1.00 0.00 H new ATOM 0 HG3 MET B 57 -12.337 10.606 -6.505 1.00 0.00 H new ATOM 0 HE1 MET B 57 -15.126 10.712 -3.436 1.00 0.00 H new ATOM 0 HE2 MET B 57 -14.520 9.194 -4.140 1.00 0.00 H new ATOM 0 HE3 MET B 57 -13.386 10.509 -3.749 1.00 0.00 H new ATOM 2423 N GLU B 58 -12.502 8.916 -11.004 1.00 0.00 N ATOM 2424 CA GLU B 58 -12.842 8.648 -12.437 1.00 0.00 C ATOM 2425 C GLU B 58 -12.076 7.418 -12.931 1.00 0.00 C ATOM 2426 O GLU B 58 -12.612 6.600 -13.651 1.00 0.00 O ATOM 2427 CB GLU B 58 -12.502 9.866 -13.299 1.00 0.00 C ATOM 2428 CG GLU B 58 -13.057 9.667 -14.711 1.00 0.00 C ATOM 2429 CD GLU B 58 -12.587 10.812 -15.609 1.00 0.00 C ATOM 2430 OE1 GLU B 58 -13.077 11.916 -15.435 1.00 0.00 O ATOM 2431 OE2 GLU B 58 -11.742 10.567 -16.455 1.00 0.00 O ATOM 0 H GLU B 58 -11.724 9.559 -10.859 1.00 0.00 H new ATOM 0 HA GLU B 58 -13.912 8.455 -12.517 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -12.924 10.768 -12.855 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -11.422 10.006 -13.338 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -12.720 8.712 -15.115 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -14.146 9.635 -14.684 1.00 0.00 H new ATOM 2438 N THR B 59 -10.836 7.263 -12.551 1.00 0.00 N ATOM 2439 CA THR B 59 -10.083 6.066 -13.013 1.00 0.00 C ATOM 2440 C THR B 59 -10.688 4.838 -12.331 1.00 0.00 C ATOM 2441 O THR B 59 -10.819 3.792 -12.934 1.00 0.00 O ATOM 2442 CB THR B 59 -8.592 6.216 -12.668 1.00 0.00 C ATOM 2443 OG1 THR B 59 -8.464 6.995 -11.491 1.00 0.00 O ATOM 2444 CG2 THR B 59 -7.853 6.914 -13.816 1.00 0.00 C ATOM 0 H THR B 59 -10.319 7.904 -11.949 1.00 0.00 H new ATOM 0 HA THR B 59 -10.158 5.957 -14.095 1.00 0.00 H new ATOM 0 HB THR B 59 -8.159 5.228 -12.513 1.00 0.00 H new ATOM 0 HG1 THR B 59 -8.409 7.944 -11.731 1.00 0.00 H new ATOM 0 HG21 THR B 59 -6.798 7.015 -13.561 1.00 0.00 H new ATOM 0 HG22 THR B 59 -7.952 6.322 -14.726 1.00 0.00 H new ATOM 0 HG23 THR B 59 -8.283 7.902 -13.978 1.00 0.00 H new ATOM 2452 N LEU B 60 -11.108 4.960 -11.103 1.00 0.00 N ATOM 2453 CA LEU B 60 -11.760 3.810 -10.421 1.00 0.00 C ATOM 2454 C LEU B 60 -13.116 3.572 -11.086 1.00 0.00 C ATOM 2455 O LEU B 60 -13.385 2.504 -11.601 1.00 0.00 O ATOM 2456 CB LEU B 60 -11.960 4.165 -8.939 1.00 0.00 C ATOM 2457 CG LEU B 60 -12.895 3.154 -8.260 1.00 0.00 C ATOM 2458 CD1 LEU B 60 -12.407 1.727 -8.533 1.00 0.00 C ATOM 2459 CD2 LEU B 60 -12.901 3.413 -6.750 1.00 0.00 C ATOM 0 H LEU B 60 -11.027 5.808 -10.542 1.00 0.00 H new ATOM 0 HA LEU B 60 -11.147 2.912 -10.496 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -10.997 4.176 -8.429 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -12.377 5.168 -8.853 1.00 0.00 H new ATOM 0 HG LEU B 60 -13.903 3.267 -8.659 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -13.075 1.015 -8.048 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -12.400 1.544 -9.608 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -11.399 1.605 -8.138 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -13.563 2.699 -6.261 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -11.891 3.299 -6.357 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -13.254 4.426 -6.556 1.00 0.00 H new ATOM 2471 N ASP B 61 -13.973 4.557 -11.087 1.00 0.00 N ATOM 2472 CA ASP B 61 -15.305 4.375 -11.729 1.00 0.00 C ATOM 2473 C ASP B 61 -15.111 3.805 -13.135 1.00 0.00 C ATOM 2474 O ASP B 61 -16.013 3.234 -13.716 1.00 0.00 O ATOM 2475 CB ASP B 61 -16.019 5.724 -11.823 1.00 0.00 C ATOM 2476 CG ASP B 61 -17.386 5.529 -12.480 1.00 0.00 C ATOM 2477 OD1 ASP B 61 -17.787 4.388 -12.640 1.00 0.00 O ATOM 2478 OD2 ASP B 61 -18.009 6.524 -12.813 1.00 0.00 O ATOM 0 H ASP B 61 -13.809 5.475 -10.673 1.00 0.00 H new ATOM 0 HA ASP B 61 -15.906 3.689 -11.132 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -16.139 6.155 -10.829 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -15.420 6.425 -12.404 1.00 0.00 H new ATOM 2483 N GLU B 62 -13.931 3.953 -13.683 1.00 0.00 N ATOM 2484 CA GLU B 62 -13.654 3.421 -15.052 1.00 0.00 C ATOM 2485 C GLU B 62 -12.912 2.102 -14.935 1.00 0.00 C ATOM 2486 O GLU B 62 -11.979 1.814 -15.659 1.00 0.00 O ATOM 2487 CB GLU B 62 -12.793 4.399 -15.803 1.00 0.00 C ATOM 2488 CG GLU B 62 -13.619 5.624 -16.203 1.00 0.00 C ATOM 2489 CD GLU B 62 -14.622 5.233 -17.290 1.00 0.00 C ATOM 2490 OE1 GLU B 62 -14.404 4.219 -17.932 1.00 0.00 O ATOM 2491 OE2 GLU B 62 -15.591 5.955 -17.462 1.00 0.00 O ATOM 0 H GLU B 62 -13.143 4.423 -13.238 1.00 0.00 H new ATOM 0 HA GLU B 62 -14.595 3.274 -15.582 1.00 0.00 H new ATOM 0 HB2 GLU B 62 -11.950 4.705 -15.183 1.00 0.00 H new ATOM 0 HB3 GLU B 62 -12.379 3.923 -16.692 1.00 0.00 H new ATOM 0 HG2 GLU B 62 -14.145 6.020 -15.334 1.00 0.00 H new ATOM 0 HG3 GLU B 62 -12.963 6.415 -16.567 1.00 0.00 H new ATOM 2498 N ASP B 63 -13.340 1.318 -14.024 1.00 0.00 N ATOM 2499 CA ASP B 63 -12.717 -0.021 -13.783 1.00 0.00 C ATOM 2500 C ASP B 63 -12.454 -0.703 -15.127 1.00 0.00 C ATOM 2501 O ASP B 63 -11.465 -1.385 -15.312 1.00 0.00 O ATOM 2502 CB ASP B 63 -13.710 -0.877 -12.996 1.00 0.00 C ATOM 2503 CG ASP B 63 -14.962 -1.127 -13.846 1.00 0.00 C ATOM 2504 OD1 ASP B 63 -15.523 -0.161 -14.337 1.00 0.00 O ATOM 2505 OD2 ASP B 63 -15.336 -2.279 -13.989 1.00 0.00 O ATOM 0 H ASP B 63 -14.120 1.537 -13.405 1.00 0.00 H new ATOM 0 HA ASP B 63 -11.782 0.095 -13.234 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -13.249 -1.826 -12.721 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -13.983 -0.375 -12.068 1.00 0.00 H new ATOM 2510 N GLY B 64 -13.324 -0.477 -16.068 1.00 0.00 N ATOM 2511 CA GLY B 64 -13.160 -1.059 -17.431 1.00 0.00 C ATOM 2512 C GLY B 64 -12.911 -2.578 -17.386 1.00 0.00 C ATOM 2513 O GLY B 64 -12.888 -3.224 -18.415 1.00 0.00 O ATOM 0 H GLY B 64 -14.159 0.097 -15.950 1.00 0.00 H new ATOM 0 HA2 GLY B 64 -14.053 -0.856 -18.021 1.00 0.00 H new ATOM 0 HA3 GLY B 64 -12.327 -0.570 -17.936 1.00 0.00 H new ATOM 2517 N ASP B 65 -12.727 -3.161 -16.220 1.00 0.00 N ATOM 2518 CA ASP B 65 -12.484 -4.648 -16.142 1.00 0.00 C ATOM 2519 C ASP B 65 -13.725 -5.414 -15.606 1.00 0.00 C ATOM 2520 O ASP B 65 -13.930 -6.549 -15.988 1.00 0.00 O ATOM 2521 CB ASP B 65 -11.301 -4.907 -15.204 1.00 0.00 C ATOM 2522 CG ASP B 65 -11.046 -6.412 -15.106 1.00 0.00 C ATOM 2523 OD1 ASP B 65 -10.722 -7.005 -16.122 1.00 0.00 O ATOM 2524 OD2 ASP B 65 -11.179 -6.946 -14.017 1.00 0.00 O ATOM 0 H ASP B 65 -12.734 -2.677 -15.322 1.00 0.00 H new ATOM 0 HA ASP B 65 -12.275 -5.008 -17.150 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -10.411 -4.400 -15.576 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -11.511 -4.498 -14.216 1.00 0.00 H new ATOM 2529 N GLY B 66 -14.553 -4.849 -14.739 1.00 0.00 N ATOM 2530 CA GLY B 66 -15.745 -5.602 -14.226 1.00 0.00 C ATOM 2531 C GLY B 66 -15.479 -6.040 -12.781 1.00 0.00 C ATOM 2532 O GLY B 66 -16.392 -6.233 -12.002 1.00 0.00 O ATOM 0 H GLY B 66 -14.449 -3.903 -14.371 1.00 0.00 H new ATOM 0 HA2 GLY B 66 -16.634 -4.973 -14.271 1.00 0.00 H new ATOM 0 HA3 GLY B 66 -15.938 -6.472 -14.853 1.00 0.00 H new ATOM 2536 N GLU B 67 -14.231 -6.182 -12.412 1.00 0.00 N ATOM 2537 CA GLU B 67 -13.901 -6.587 -11.010 1.00 0.00 C ATOM 2538 C GLU B 67 -12.539 -6.010 -10.615 1.00 0.00 C ATOM 2539 O GLU B 67 -11.576 -6.134 -11.346 1.00 0.00 O ATOM 2540 CB GLU B 67 -13.856 -8.113 -10.912 1.00 0.00 C ATOM 2541 CG GLU B 67 -15.261 -8.685 -11.109 1.00 0.00 C ATOM 2542 CD GLU B 67 -15.270 -10.163 -10.714 1.00 0.00 C ATOM 2543 OE1 GLU B 67 -14.576 -10.932 -11.358 1.00 0.00 O ATOM 2544 OE2 GLU B 67 -15.970 -10.500 -9.774 1.00 0.00 O ATOM 0 H GLU B 67 -13.426 -6.035 -13.021 1.00 0.00 H new ATOM 0 HA GLU B 67 -14.667 -6.203 -10.336 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -13.180 -8.516 -11.667 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -13.464 -8.413 -9.940 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -15.979 -8.131 -10.504 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -15.568 -8.574 -12.149 1.00 0.00 H new ATOM 2551 N CYS B 68 -12.439 -5.393 -9.460 1.00 0.00 N ATOM 2552 CA CYS B 68 -11.127 -4.822 -9.015 1.00 0.00 C ATOM 2553 C CYS B 68 -10.493 -5.785 -8.006 1.00 0.00 C ATOM 2554 O CYS B 68 -11.091 -6.130 -7.006 1.00 0.00 O ATOM 2555 CB CYS B 68 -11.362 -3.452 -8.363 1.00 0.00 C ATOM 2556 SG CYS B 68 -9.915 -2.970 -7.385 1.00 0.00 S ATOM 0 H CYS B 68 -13.210 -5.260 -8.806 1.00 0.00 H new ATOM 0 HA CYS B 68 -10.460 -4.695 -9.868 1.00 0.00 H new ATOM 0 HB2 CYS B 68 -11.557 -2.704 -9.131 1.00 0.00 H new ATOM 0 HB3 CYS B 68 -12.245 -3.491 -7.725 1.00 0.00 H new ATOM 0 HG CYS B 68 -9.446 -4.010 -6.762 1.00 0.00 H new ATOM 2562 N ASP B 69 -9.291 -6.228 -8.263 1.00 0.00 N ATOM 2563 CA ASP B 69 -8.623 -7.177 -7.322 1.00 0.00 C ATOM 2564 C ASP B 69 -7.972 -6.399 -6.177 1.00 0.00 C ATOM 2565 O ASP B 69 -8.136 -5.201 -6.056 1.00 0.00 O ATOM 2566 CB ASP B 69 -7.553 -7.970 -8.076 1.00 0.00 C ATOM 2567 CG ASP B 69 -6.695 -7.014 -8.906 1.00 0.00 C ATOM 2568 OD1 ASP B 69 -6.602 -5.857 -8.532 1.00 0.00 O ATOM 2569 OD2 ASP B 69 -6.145 -7.456 -9.901 1.00 0.00 O ATOM 0 H ASP B 69 -8.742 -5.974 -9.084 1.00 0.00 H new ATOM 0 HA ASP B 69 -9.365 -7.862 -6.912 1.00 0.00 H new ATOM 0 HB2 ASP B 69 -6.927 -8.517 -7.371 1.00 0.00 H new ATOM 0 HB3 ASP B 69 -8.023 -8.709 -8.725 1.00 0.00 H new ATOM 2574 N PHE B 70 -7.221 -7.068 -5.341 1.00 0.00 N ATOM 2575 CA PHE B 70 -6.550 -6.358 -4.214 1.00 0.00 C ATOM 2576 C PHE B 70 -5.365 -5.564 -4.768 1.00 0.00 C ATOM 2577 O PHE B 70 -5.052 -4.492 -4.289 1.00 0.00 O ATOM 2578 CB PHE B 70 -6.068 -7.378 -3.176 1.00 0.00 C ATOM 2579 CG PHE B 70 -5.664 -6.676 -1.898 1.00 0.00 C ATOM 2580 CD1 PHE B 70 -4.467 -5.948 -1.842 1.00 0.00 C ATOM 2581 CD2 PHE B 70 -6.482 -6.762 -0.764 1.00 0.00 C ATOM 2582 CE1 PHE B 70 -4.093 -5.306 -0.656 1.00 0.00 C ATOM 2583 CE2 PHE B 70 -6.105 -6.120 0.421 1.00 0.00 C ATOM 2584 CZ PHE B 70 -4.912 -5.391 0.474 1.00 0.00 C ATOM 0 H PHE B 70 -7.044 -8.071 -5.390 1.00 0.00 H new ATOM 0 HA PHE B 70 -7.250 -5.676 -3.731 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -6.860 -8.098 -2.969 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -5.223 -7.940 -3.573 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -3.834 -5.883 -2.714 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -7.404 -7.324 -0.804 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -3.171 -4.745 -0.614 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -6.735 -6.187 1.295 1.00 0.00 H new ATOM 0 HZ PHE B 70 -4.624 -4.894 1.388 1.00 0.00 H new ATOM 2594 N GLN B 71 -4.708 -6.066 -5.777 1.00 0.00 N ATOM 2595 CA GLN B 71 -3.555 -5.316 -6.353 1.00 0.00 C ATOM 2596 C GLN B 71 -4.052 -3.950 -6.840 1.00 0.00 C ATOM 2597 O GLN B 71 -3.382 -2.947 -6.694 1.00 0.00 O ATOM 2598 CB GLN B 71 -2.972 -6.112 -7.530 1.00 0.00 C ATOM 2599 CG GLN B 71 -1.970 -5.255 -8.315 1.00 0.00 C ATOM 2600 CD GLN B 71 -0.966 -4.613 -7.355 1.00 0.00 C ATOM 2601 OE1 GLN B 71 -0.876 -3.405 -7.272 1.00 0.00 O ATOM 2602 NE2 GLN B 71 -0.203 -5.376 -6.621 1.00 0.00 N ATOM 0 H GLN B 71 -4.917 -6.958 -6.226 1.00 0.00 H new ATOM 0 HA GLN B 71 -2.780 -5.175 -5.600 1.00 0.00 H new ATOM 0 HB2 GLN B 71 -2.479 -7.011 -7.160 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -3.776 -6.438 -8.190 1.00 0.00 H new ATOM 0 HG2 GLN B 71 -1.445 -5.871 -9.045 1.00 0.00 H new ATOM 0 HG3 GLN B 71 -2.499 -4.482 -8.872 1.00 0.00 H new ATOM 0 HE21 GLN B 71 -0.279 -6.391 -6.691 1.00 0.00 H new ATOM 0 HE22 GLN B 71 0.469 -4.958 -5.978 1.00 0.00 H new ATOM 2611 N GLU B 72 -5.224 -3.905 -7.409 1.00 0.00 N ATOM 2612 CA GLU B 72 -5.772 -2.606 -7.898 1.00 0.00 C ATOM 2613 C GLU B 72 -6.194 -1.741 -6.701 1.00 0.00 C ATOM 2614 O GLU B 72 -6.233 -0.530 -6.776 1.00 0.00 O ATOM 2615 CB GLU B 72 -6.975 -2.872 -8.812 1.00 0.00 C ATOM 2616 CG GLU B 72 -6.486 -3.230 -10.219 1.00 0.00 C ATOM 2617 CD GLU B 72 -7.665 -3.719 -11.063 1.00 0.00 C ATOM 2618 OE1 GLU B 72 -8.026 -4.876 -10.927 1.00 0.00 O ATOM 2619 OE2 GLU B 72 -8.185 -2.928 -11.833 1.00 0.00 O ATOM 0 H GLU B 72 -5.829 -4.713 -7.558 1.00 0.00 H new ATOM 0 HA GLU B 72 -5.007 -2.074 -8.464 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -7.578 -3.685 -8.408 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -7.615 -1.991 -8.852 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -6.026 -2.360 -10.688 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -5.720 -4.004 -10.163 1.00 0.00 H new ATOM 2626 N PHE B 73 -6.473 -2.363 -5.589 1.00 0.00 N ATOM 2627 CA PHE B 73 -6.858 -1.603 -4.361 1.00 0.00 C ATOM 2628 C PHE B 73 -5.613 -0.939 -3.765 1.00 0.00 C ATOM 2629 O PHE B 73 -5.659 0.207 -3.372 1.00 0.00 O ATOM 2630 CB PHE B 73 -7.510 -2.556 -3.353 1.00 0.00 C ATOM 2631 CG PHE B 73 -7.678 -1.881 -2.008 1.00 0.00 C ATOM 2632 CD1 PHE B 73 -8.523 -0.774 -1.885 1.00 0.00 C ATOM 2633 CD2 PHE B 73 -7.003 -2.375 -0.882 1.00 0.00 C ATOM 2634 CE1 PHE B 73 -8.693 -0.158 -0.638 1.00 0.00 C ATOM 2635 CE2 PHE B 73 -7.175 -1.761 0.363 1.00 0.00 C ATOM 2636 CZ PHE B 73 -8.020 -0.652 0.486 1.00 0.00 C ATOM 0 H PHE B 73 -6.451 -3.376 -5.475 1.00 0.00 H new ATOM 0 HA PHE B 73 -7.579 -0.825 -4.612 1.00 0.00 H new ATOM 0 HB2 PHE B 73 -8.482 -2.879 -3.727 1.00 0.00 H new ATOM 0 HB3 PHE B 73 -6.897 -3.451 -3.242 1.00 0.00 H new ATOM 0 HD1 PHE B 73 -9.045 -0.394 -2.751 1.00 0.00 H new ATOM 0 HD2 PHE B 73 -6.350 -3.230 -0.976 1.00 0.00 H new ATOM 0 HE1 PHE B 73 -9.344 0.699 -0.544 1.00 0.00 H new ATOM 0 HE2 PHE B 73 -6.656 -2.143 1.230 1.00 0.00 H new ATOM 0 HZ PHE B 73 -8.153 -0.178 1.447 1.00 0.00 H new ATOM 2646 N MET B 74 -4.500 -1.604 -3.710 1.00 0.00 N ATOM 2647 CA MET B 74 -3.298 -0.919 -3.153 1.00 0.00 C ATOM 2648 C MET B 74 -2.923 0.240 -4.087 1.00 0.00 C ATOM 2649 O MET B 74 -2.766 1.360 -3.641 1.00 0.00 O ATOM 2650 CB MET B 74 -2.130 -1.904 -3.026 1.00 0.00 C ATOM 2651 CG MET B 74 -1.095 -1.352 -2.038 1.00 0.00 C ATOM 2652 SD MET B 74 -1.692 -1.598 -0.340 1.00 0.00 S ATOM 2653 CE MET B 74 -1.786 0.142 0.163 1.00 0.00 C ATOM 0 H MET B 74 -4.365 -2.568 -4.017 1.00 0.00 H new ATOM 0 HA MET B 74 -3.520 -0.535 -2.157 1.00 0.00 H new ATOM 0 HB2 MET B 74 -2.494 -2.873 -2.683 1.00 0.00 H new ATOM 0 HB3 MET B 74 -1.668 -2.063 -4.000 1.00 0.00 H new ATOM 0 HG2 MET B 74 -0.139 -1.857 -2.176 1.00 0.00 H new ATOM 0 HG3 MET B 74 -0.926 -0.292 -2.226 1.00 0.00 H new ATOM 0 HE1 MET B 74 -1.715 0.211 1.248 1.00 0.00 H new ATOM 0 HE2 MET B 74 -0.965 0.697 -0.291 1.00 0.00 H new ATOM 0 HE3 MET B 74 -2.735 0.565 -0.166 1.00 0.00 H new ATOM 2663 N ALA B 75 -2.775 0.013 -5.360 1.00 0.00 N ATOM 2664 CA ALA B 75 -2.410 1.139 -6.272 1.00 0.00 C ATOM 2665 C ALA B 75 -3.392 2.306 -6.117 1.00 0.00 C ATOM 2666 O ALA B 75 -2.989 3.441 -5.952 1.00 0.00 O ATOM 2667 CB ALA B 75 -2.439 0.645 -7.720 1.00 0.00 C ATOM 0 H ALA B 75 -2.889 -0.895 -5.810 1.00 0.00 H new ATOM 0 HA ALA B 75 -1.410 1.488 -6.012 1.00 0.00 H new ATOM 0 HB1 ALA B 75 -2.173 1.463 -8.389 1.00 0.00 H new ATOM 0 HB2 ALA B 75 -1.724 -0.169 -7.841 1.00 0.00 H new ATOM 0 HB3 ALA B 75 -3.440 0.288 -7.963 1.00 0.00 H new ATOM 2673 N PHE B 76 -4.670 2.056 -6.180 1.00 0.00 N ATOM 2674 CA PHE B 76 -5.645 3.184 -6.048 1.00 0.00 C ATOM 2675 C PHE B 76 -5.519 3.810 -4.649 1.00 0.00 C ATOM 2676 O PHE B 76 -5.628 5.008 -4.485 1.00 0.00 O ATOM 2677 CB PHE B 76 -7.084 2.663 -6.274 1.00 0.00 C ATOM 2678 CG PHE B 76 -7.467 2.793 -7.740 1.00 0.00 C ATOM 2679 CD1 PHE B 76 -7.490 4.056 -8.348 1.00 0.00 C ATOM 2680 CD2 PHE B 76 -7.799 1.654 -8.488 1.00 0.00 C ATOM 2681 CE1 PHE B 76 -7.842 4.178 -9.697 1.00 0.00 C ATOM 2682 CE2 PHE B 76 -8.151 1.779 -9.837 1.00 0.00 C ATOM 2683 CZ PHE B 76 -8.172 3.040 -10.442 1.00 0.00 C ATOM 0 H PHE B 76 -5.082 1.133 -6.315 1.00 0.00 H new ATOM 0 HA PHE B 76 -5.426 3.943 -6.799 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -7.154 1.620 -5.964 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -7.784 3.227 -5.657 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -7.236 4.935 -7.775 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -7.783 0.680 -8.023 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -7.859 5.152 -10.164 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -8.407 0.901 -10.411 1.00 0.00 H new ATOM 0 HZ PHE B 76 -8.443 3.135 -11.483 1.00 0.00 H new ATOM 2693 N VAL B 77 -5.280 3.013 -3.651 1.00 0.00 N ATOM 2694 CA VAL B 77 -5.136 3.570 -2.273 1.00 0.00 C ATOM 2695 C VAL B 77 -3.892 4.467 -2.219 1.00 0.00 C ATOM 2696 O VAL B 77 -3.853 5.444 -1.498 1.00 0.00 O ATOM 2697 CB VAL B 77 -4.996 2.412 -1.273 1.00 0.00 C ATOM 2698 CG1 VAL B 77 -4.517 2.940 0.088 1.00 0.00 C ATOM 2699 CG2 VAL B 77 -6.354 1.714 -1.098 1.00 0.00 C ATOM 0 H VAL B 77 -5.177 2.001 -3.724 1.00 0.00 H new ATOM 0 HA VAL B 77 -6.014 4.161 -2.015 1.00 0.00 H new ATOM 0 HB VAL B 77 -4.264 1.702 -1.658 1.00 0.00 H new ATOM 0 HG11 VAL B 77 -4.422 2.109 0.787 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -3.549 3.427 -0.031 1.00 0.00 H new ATOM 0 HG13 VAL B 77 -5.240 3.659 0.474 1.00 0.00 H new ATOM 0 HG21 VAL B 77 -6.252 0.893 -0.388 1.00 0.00 H new ATOM 0 HG22 VAL B 77 -7.085 2.430 -0.722 1.00 0.00 H new ATOM 0 HG23 VAL B 77 -6.689 1.324 -2.059 1.00 0.00 H new ATOM 2709 N SER B 78 -2.877 4.140 -2.970 1.00 0.00 N ATOM 2710 CA SER B 78 -1.637 4.971 -2.956 1.00 0.00 C ATOM 2711 C SER B 78 -1.903 6.325 -3.627 1.00 0.00 C ATOM 2712 O SER B 78 -1.600 7.367 -3.080 1.00 0.00 O ATOM 2713 CB SER B 78 -0.531 4.237 -3.719 1.00 0.00 C ATOM 2714 OG SER B 78 -0.662 4.506 -5.109 1.00 0.00 O ATOM 0 H SER B 78 -2.851 3.333 -3.594 1.00 0.00 H new ATOM 0 HA SER B 78 -1.329 5.139 -1.924 1.00 0.00 H new ATOM 0 HB2 SER B 78 0.448 4.561 -3.365 1.00 0.00 H new ATOM 0 HB3 SER B 78 -0.597 3.164 -3.536 1.00 0.00 H new ATOM 0 HG SER B 78 -1.374 3.947 -5.485 1.00 0.00 H new ATOM 2720 N MET B 79 -2.441 6.317 -4.813 1.00 0.00 N ATOM 2721 CA MET B 79 -2.698 7.602 -5.530 1.00 0.00 C ATOM 2722 C MET B 79 -3.453 8.585 -4.629 1.00 0.00 C ATOM 2723 O MET B 79 -3.210 9.775 -4.661 1.00 0.00 O ATOM 2724 CB MET B 79 -3.531 7.321 -6.786 1.00 0.00 C ATOM 2725 CG MET B 79 -3.458 8.518 -7.742 1.00 0.00 C ATOM 2726 SD MET B 79 -1.940 8.412 -8.724 1.00 0.00 S ATOM 2727 CE MET B 79 -2.644 7.546 -10.149 1.00 0.00 C ATOM 0 H MET B 79 -2.716 5.476 -5.320 1.00 0.00 H new ATOM 0 HA MET B 79 -1.742 8.047 -5.805 1.00 0.00 H new ATOM 0 HB2 MET B 79 -3.162 6.424 -7.284 1.00 0.00 H new ATOM 0 HB3 MET B 79 -4.568 7.129 -6.509 1.00 0.00 H new ATOM 0 HG2 MET B 79 -4.329 8.527 -8.398 1.00 0.00 H new ATOM 0 HG3 MET B 79 -3.474 9.450 -7.177 1.00 0.00 H new ATOM 0 HE1 MET B 79 -1.865 7.375 -10.892 1.00 0.00 H new ATOM 0 HE2 MET B 79 -3.054 6.589 -9.827 1.00 0.00 H new ATOM 0 HE3 MET B 79 -3.437 8.152 -10.587 1.00 0.00 H new ATOM 2737 N VAL B 80 -4.368 8.111 -3.833 1.00 0.00 N ATOM 2738 CA VAL B 80 -5.127 9.044 -2.949 1.00 0.00 C ATOM 2739 C VAL B 80 -4.232 9.516 -1.801 1.00 0.00 C ATOM 2740 O VAL B 80 -4.139 10.695 -1.521 1.00 0.00 O ATOM 2741 CB VAL B 80 -6.343 8.321 -2.364 1.00 0.00 C ATOM 2742 CG1 VAL B 80 -7.101 9.268 -1.431 1.00 0.00 C ATOM 2743 CG2 VAL B 80 -7.271 7.878 -3.495 1.00 0.00 C ATOM 0 H VAL B 80 -4.624 7.127 -3.754 1.00 0.00 H new ATOM 0 HA VAL B 80 -5.452 9.902 -3.537 1.00 0.00 H new ATOM 0 HB VAL B 80 -6.007 7.447 -1.805 1.00 0.00 H new ATOM 0 HG11 VAL B 80 -7.967 8.753 -1.015 1.00 0.00 H new ATOM 0 HG12 VAL B 80 -6.443 9.585 -0.622 1.00 0.00 H new ATOM 0 HG13 VAL B 80 -7.434 10.142 -1.991 1.00 0.00 H new ATOM 0 HG21 VAL B 80 -8.136 7.364 -3.076 1.00 0.00 H new ATOM 0 HG22 VAL B 80 -7.605 8.752 -4.055 1.00 0.00 H new ATOM 0 HG23 VAL B 80 -6.735 7.202 -4.162 1.00 0.00 H new ATOM 2753 N THR B 81 -3.570 8.610 -1.139 1.00 0.00 N ATOM 2754 CA THR B 81 -2.680 9.015 -0.015 1.00 0.00 C ATOM 2755 C THR B 81 -1.570 9.920 -0.553 1.00 0.00 C ATOM 2756 O THR B 81 -1.296 10.973 -0.013 1.00 0.00 O ATOM 2757 CB THR B 81 -2.060 7.768 0.617 1.00 0.00 C ATOM 2758 OG1 THR B 81 -3.095 6.887 1.031 1.00 0.00 O ATOM 2759 CG2 THR B 81 -1.214 8.173 1.825 1.00 0.00 C ATOM 0 H THR B 81 -3.606 7.608 -1.327 1.00 0.00 H new ATOM 0 HA THR B 81 -3.259 9.553 0.736 1.00 0.00 H new ATOM 0 HB THR B 81 -1.426 7.265 -0.113 1.00 0.00 H new ATOM 0 HG1 THR B 81 -3.411 6.369 0.262 1.00 0.00 H new ATOM 0 HG21 THR B 81 -0.773 7.284 2.275 1.00 0.00 H new ATOM 0 HG22 THR B 81 -0.421 8.849 1.504 1.00 0.00 H new ATOM 0 HG23 THR B 81 -1.844 8.676 2.559 1.00 0.00 H new ATOM 2767 N THR B 82 -0.932 9.514 -1.616 1.00 0.00 N ATOM 2768 CA THR B 82 0.161 10.343 -2.198 1.00 0.00 C ATOM 2769 C THR B 82 -0.383 11.723 -2.574 1.00 0.00 C ATOM 2770 O THR B 82 0.354 12.684 -2.675 1.00 0.00 O ATOM 2771 CB THR B 82 0.711 9.654 -3.449 1.00 0.00 C ATOM 2772 OG1 THR B 82 -0.361 9.355 -4.332 1.00 0.00 O ATOM 2773 CG2 THR B 82 1.424 8.360 -3.050 1.00 0.00 C ATOM 0 H THR B 82 -1.121 8.641 -2.108 1.00 0.00 H new ATOM 0 HA THR B 82 0.958 10.457 -1.463 1.00 0.00 H new ATOM 0 HB THR B 82 1.419 10.316 -3.948 1.00 0.00 H new ATOM 0 HG1 THR B 82 -0.807 8.533 -4.039 1.00 0.00 H new ATOM 0 HG21 THR B 82 1.815 7.870 -3.942 1.00 0.00 H new ATOM 0 HG22 THR B 82 2.246 8.592 -2.373 1.00 0.00 H new ATOM 0 HG23 THR B 82 0.719 7.695 -2.551 1.00 0.00 H new ATOM 2781 N ALA B 83 -1.668 11.832 -2.779 1.00 0.00 N ATOM 2782 CA ALA B 83 -2.254 13.152 -3.145 1.00 0.00 C ATOM 2783 C ALA B 83 -2.134 14.108 -1.957 1.00 0.00 C ATOM 2784 O ALA B 83 -1.952 15.299 -2.122 1.00 0.00 O ATOM 2785 CB ALA B 83 -3.731 12.972 -3.505 1.00 0.00 C ATOM 0 H ALA B 83 -2.336 11.064 -2.709 1.00 0.00 H new ATOM 0 HA ALA B 83 -1.718 13.563 -4.000 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -4.160 13.937 -3.773 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -3.819 12.289 -4.350 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -4.267 12.562 -2.649 1.00 0.00 H new