USER MOD reduce.3.24.130724 H: found=0, std=0, add=1153, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1153 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 65 LYS NZ :NH3+ 149:sc= 1.83 (180deg=0.371) USER MOD Set 1.2: A 100 GLN : amide:sc= 1.04 K(o=2.9,f=-11!) USER MOD Set 2.1: A 33 ASN : amide:sc= 0.044 K(o=0.047,f=-1.2) USER MOD Set 2.2: A 59 ASN : amide:sc= 0.00269 X(o=0.047,f=-0.26) USER MOD Set 3.1: A 9 THR OG1 : rot 42:sc= 0.311 USER MOD Set 3.2: A 83 GLN : amide:sc= -1.36 K(o=-1,f=-6!) USER MOD Set 4.1: A 2 LYS NZ :NH3+ -150:sc= 0.922 (180deg=0.622) USER MOD Set 4.2: A 76 TYR OH : rot -127:sc= 0.493 USER MOD Single : A 1 MET CE :methyl 162:sc= -0.0768 (180deg=-0.449) USER MOD Single : A 1 MET N :NH3+ -118:sc= 0.105 (180deg=-0.0103) USER MOD Single : A 8 ASN : amide:sc= -0.547 K(o=-0.55,f=0) USER MOD Single : A 10 ASN : amide:sc= 0.1 X(o=0.1,f=0) USER MOD Single : A 11 ASN : amide:sc= -0.173 K(o=-0.17,f=-3.5!) USER MOD Single : A 16 LYS NZ :NH3+ -171:sc=-0.00594 (180deg=-0.094) USER MOD Single : A 17 LYS NZ :NH3+ -147:sc= 1.19 (180deg=-0.0595) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 162:sc= 0.0369 (180deg=0.00381) USER MOD Single : A 24 ASN : amide:sc= -0.363 X(o=-0.36,f=-0.31) USER MOD Single : A 25 GLN : amide:sc= -0.0981 X(o=-0.098,f=-0.24) USER MOD Single : A 27 TYR OH : rot 30:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -0.918 X(o=-0.92,f=-0.46) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 174:sc= 0.661 (180deg=0.443) USER MOD Single : A 40 LYS NZ :NH3+ 157:sc= 0.869 (180deg=0.516) USER MOD Single : A 42 MET CE :methyl 158:sc= -0.601 (180deg=-1.37) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ -134:sc= 0.222 (180deg=-0.32) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 ASN : amide:sc= -0.0555 K(o=-0.056,f=-1.9!) USER MOD Single : A 53 LYS NZ :NH3+ -142:sc= 1.1 (180deg=-1.67!) USER MOD Single : A 58 SER OG : rot 120:sc= -0.312 USER MOD Single : A 61 LYS NZ :NH3+ -123:sc= -0.954 (180deg=-3.81!) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 MET CE :methyl -145:sc= -0.0101 (180deg=-1.93!) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ -144:sc= -0.865 (180deg=-3.75!) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 GLN : amide:sc= -1.08 X(o=-1.1,f=-1.5) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 LYS NZ :NH3+ 166:sc= 0.564 (180deg=0.1) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ -121:sc= 0.0495 (180deg=-1.57!) USER MOD Single : A 108 THR OG1 : rot 64:sc= -0.105 USER MOD Single : A 115 LYS NZ :NH3+ 141:sc= 0.601 (180deg=0.0449) USER MOD Single : A 121 MET CE :methyl -137:sc= 0 (180deg=-0.89) USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 SER OG : rot 58:sc= -0.503 USER MOD Single : A 129 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 130 HIS : no HD1:sc= 0 X(o=0,f=-0.0086) USER MOD Single : A 131 HIS : no HE2:sc= 0.208 K(o=0.21,f=-0.85) USER MOD Single : A 132 HIS : no HD1:sc= 0 X(o=0,f=-0.0066) USER MOD Single : A 133 HIS : no HE2:sc= 0.298 K(o=0.3,f=-1.2) USER MOD Single : A 134 HIS : no HD1:sc= 0 X(o=0,f=-0.097) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -14.012 10.041 4.939 1.00 4.15 N ATOM 2 CA MET A 1 -13.059 9.550 3.909 1.00 32.11 C ATOM 3 C MET A 1 -13.048 8.012 3.872 1.00 63.41 C ATOM 4 O MET A 1 -13.872 7.357 4.516 1.00 74.40 O ATOM 5 CB MET A 1 -11.629 10.101 4.202 1.00 70.41 C ATOM 6 CG MET A 1 -10.988 9.584 5.502 1.00 30.32 C ATOM 7 SD MET A 1 -9.364 10.308 5.822 1.00 72.50 S ATOM 8 CE MET A 1 -9.777 12.036 6.064 1.00 62.31 C ATOM 0 H1 MET A 1 -14.760 10.600 4.481 1.00 4.15 H new ATOM 0 H2 MET A 1 -14.438 9.231 5.433 1.00 4.15 H new ATOM 0 H3 MET A 1 -13.506 10.637 5.625 1.00 4.15 H new ATOM 0 HA MET A 1 -13.381 9.911 2.932 1.00 32.11 H new ATOM 0 HB2 MET A 1 -10.978 9.844 3.366 1.00 70.41 H new ATOM 0 HB3 MET A 1 -11.677 11.189 4.246 1.00 70.41 H new ATOM 0 HG2 MET A 1 -11.650 9.804 6.340 1.00 30.32 H new ATOM 0 HG3 MET A 1 -10.892 8.500 5.448 1.00 30.32 H new ATOM 0 HE1 MET A 1 -8.955 12.539 6.573 1.00 62.31 H new ATOM 0 HE2 MET A 1 -9.948 12.508 5.097 1.00 62.31 H new ATOM 0 HE3 MET A 1 -10.680 12.113 6.669 1.00 62.31 H new ATOM 20 N LYS A 2 -12.133 7.456 3.063 1.00 65.14 N ATOM 21 CA LYS A 2 -11.737 6.044 3.136 1.00 64.14 C ATOM 22 C LYS A 2 -10.204 6.001 3.055 1.00 32.52 C ATOM 23 O LYS A 2 -9.607 6.712 2.241 1.00 71.12 O ATOM 24 CB LYS A 2 -12.415 5.189 2.019 1.00 53.23 C ATOM 25 CG LYS A 2 -12.026 5.529 0.562 1.00 23.31 C ATOM 26 CD LYS A 2 -12.658 4.571 -0.475 1.00 71.20 C ATOM 27 CE LYS A 2 -14.202 4.625 -0.517 1.00 12.10 C ATOM 28 NZ LYS A 2 -14.725 5.896 -1.086 1.00 13.11 N ATOM 0 H LYS A 2 -11.645 7.978 2.336 1.00 65.14 H new ATOM 0 HA LYS A 2 -12.074 5.601 4.073 1.00 64.14 H new ATOM 0 HB2 LYS A 2 -12.178 4.141 2.200 1.00 53.23 H new ATOM 0 HB3 LYS A 2 -13.496 5.293 2.117 1.00 53.23 H new ATOM 0 HG2 LYS A 2 -12.334 6.550 0.339 1.00 23.31 H new ATOM 0 HG3 LYS A 2 -10.941 5.495 0.465 1.00 23.31 H new ATOM 0 HD2 LYS A 2 -12.269 4.813 -1.464 1.00 71.20 H new ATOM 0 HD3 LYS A 2 -12.346 3.551 -0.251 1.00 71.20 H new ATOM 0 HE2 LYS A 2 -14.573 3.789 -1.109 1.00 12.10 H new ATOM 0 HE3 LYS A 2 -14.592 4.498 0.493 1.00 12.10 H new ATOM 0 HZ1 LYS A 2 -15.647 6.115 -0.657 1.00 13.11 H new ATOM 0 HZ2 LYS A 2 -14.057 6.667 -0.884 1.00 13.11 H new ATOM 0 HZ3 LYS A 2 -14.837 5.796 -2.115 1.00 13.11 H new ATOM 42 N GLU A 3 -9.561 5.238 3.944 1.00 3.14 N ATOM 43 CA GLU A 3 -8.093 5.180 4.009 1.00 72.00 C ATOM 44 C GLU A 3 -7.556 4.165 2.988 1.00 61.23 C ATOM 45 O GLU A 3 -8.076 3.055 2.855 1.00 14.40 O ATOM 46 CB GLU A 3 -7.596 4.837 5.442 1.00 33.35 C ATOM 47 CG GLU A 3 -7.896 5.895 6.537 1.00 64.13 C ATOM 48 CD GLU A 3 -9.329 5.853 7.102 1.00 10.23 C ATOM 49 OE1 GLU A 3 -10.255 6.417 6.484 1.00 42.02 O ATOM 50 OE2 GLU A 3 -9.532 5.252 8.175 1.00 44.52 O ATOM 0 H GLU A 3 -10.033 4.650 4.631 1.00 3.14 H new ATOM 0 HA GLU A 3 -7.707 6.168 3.759 1.00 72.00 H new ATOM 0 HB2 GLU A 3 -8.046 3.892 5.745 1.00 33.35 H new ATOM 0 HB3 GLU A 3 -6.518 4.679 5.403 1.00 33.35 H new ATOM 0 HG2 GLU A 3 -7.193 5.757 7.358 1.00 64.13 H new ATOM 0 HG3 GLU A 3 -7.712 6.887 6.124 1.00 64.13 H new ATOM 57 N LEU A 4 -6.511 4.570 2.271 1.00 51.00 N ATOM 58 CA LEU A 4 -5.860 3.751 1.240 1.00 40.43 C ATOM 59 C LEU A 4 -4.476 3.358 1.754 1.00 5.13 C ATOM 60 O LEU A 4 -3.612 4.217 1.929 1.00 55.30 O ATOM 61 CB LEU A 4 -5.757 4.534 -0.115 1.00 32.33 C ATOM 62 CG LEU A 4 -6.984 4.446 -1.085 1.00 22.43 C ATOM 63 CD1 LEU A 4 -7.214 2.996 -1.544 1.00 12.14 C ATOM 64 CD2 LEU A 4 -8.265 5.059 -0.479 1.00 64.44 C ATOM 0 H LEU A 4 -6.083 5.488 2.388 1.00 51.00 H new ATOM 0 HA LEU A 4 -6.451 2.856 1.045 1.00 40.43 H new ATOM 0 HB2 LEU A 4 -5.582 5.585 0.114 1.00 32.33 H new ATOM 0 HB3 LEU A 4 -4.878 4.173 -0.648 1.00 32.33 H new ATOM 0 HG LEU A 4 -6.743 5.048 -1.962 1.00 22.43 H new ATOM 0 HD11 LEU A 4 -8.071 2.959 -2.217 1.00 12.14 H new ATOM 0 HD12 LEU A 4 -6.328 2.634 -2.065 1.00 12.14 H new ATOM 0 HD13 LEU A 4 -7.407 2.366 -0.676 1.00 12.14 H new ATOM 0 HD21 LEU A 4 -9.084 4.971 -1.193 1.00 64.44 H new ATOM 0 HD22 LEU A 4 -8.524 4.528 0.437 1.00 64.44 H new ATOM 0 HD23 LEU A 4 -8.093 6.111 -0.252 1.00 64.44 H new ATOM 76 N ILE A 5 -4.284 2.058 2.013 1.00 25.41 N ATOM 77 CA ILE A 5 -2.990 1.506 2.439 1.00 61.42 C ATOM 78 C ILE A 5 -2.375 0.726 1.266 1.00 45.41 C ATOM 79 O ILE A 5 -2.995 -0.186 0.720 1.00 4.43 O ATOM 80 CB ILE A 5 -3.120 0.588 3.714 1.00 73.50 C ATOM 81 CG1 ILE A 5 -1.756 -0.109 4.048 1.00 62.22 C ATOM 82 CG2 ILE A 5 -4.271 -0.426 3.574 1.00 73.23 C ATOM 83 CD1 ILE A 5 -1.770 -1.061 5.232 1.00 42.14 C ATOM 0 H ILE A 5 -5.022 1.358 1.933 1.00 25.41 H new ATOM 0 HA ILE A 5 -2.339 2.333 2.722 1.00 61.42 H new ATOM 0 HB ILE A 5 -3.373 1.229 4.559 1.00 73.50 H new ATOM 0 HG12 ILE A 5 -1.426 -0.660 3.167 1.00 62.22 H new ATOM 0 HG13 ILE A 5 -1.012 0.664 4.237 1.00 62.22 H new ATOM 0 HG21 ILE A 5 -4.327 -1.039 4.473 1.00 73.23 H new ATOM 0 HG22 ILE A 5 -5.212 0.108 3.440 1.00 73.23 H new ATOM 0 HG23 ILE A 5 -4.090 -1.065 2.710 1.00 73.23 H new ATOM 0 HD11 ILE A 5 -0.775 -1.484 5.370 1.00 42.14 H new ATOM 0 HD12 ILE A 5 -2.062 -0.519 6.131 1.00 42.14 H new ATOM 0 HD13 ILE A 5 -2.483 -1.864 5.045 1.00 42.14 H new ATOM 95 N LEU A 6 -1.168 1.129 0.868 1.00 54.45 N ATOM 96 CA LEU A 6 -0.443 0.521 -0.252 1.00 53.13 C ATOM 97 C LEU A 6 0.745 -0.259 0.310 1.00 70.30 C ATOM 98 O LEU A 6 1.564 0.304 1.031 1.00 51.35 O ATOM 99 CB LEU A 6 0.050 1.592 -1.259 1.00 72.11 C ATOM 100 CG LEU A 6 -1.039 2.464 -1.976 1.00 35.52 C ATOM 101 CD1 LEU A 6 -1.665 3.515 -1.034 1.00 25.12 C ATOM 102 CD2 LEU A 6 -0.455 3.126 -3.232 1.00 13.13 C ATOM 0 H LEU A 6 -0.661 1.892 1.316 1.00 54.45 H new ATOM 0 HA LEU A 6 -1.116 -0.145 -0.792 1.00 53.13 H new ATOM 0 HB2 LEU A 6 0.726 2.265 -0.731 1.00 72.11 H new ATOM 0 HB3 LEU A 6 0.637 1.088 -2.027 1.00 72.11 H new ATOM 0 HG LEU A 6 -1.845 1.794 -2.276 1.00 35.52 H new ATOM 0 HD11 LEU A 6 -2.412 4.092 -1.578 1.00 25.12 H new ATOM 0 HD12 LEU A 6 -2.138 3.012 -0.191 1.00 25.12 H new ATOM 0 HD13 LEU A 6 -0.887 4.184 -0.667 1.00 25.12 H new ATOM 0 HD21 LEU A 6 -1.224 3.727 -3.717 1.00 13.13 H new ATOM 0 HD22 LEU A 6 0.382 3.765 -2.951 1.00 13.13 H new ATOM 0 HD23 LEU A 6 -0.108 2.356 -3.921 1.00 13.13 H new ATOM 114 N ILE A 7 0.814 -1.560 0.003 1.00 50.34 N ATOM 115 CA ILE A 7 1.926 -2.418 0.426 1.00 53.23 C ATOM 116 C ILE A 7 2.852 -2.664 -0.778 1.00 11.13 C ATOM 117 O ILE A 7 2.405 -3.133 -1.818 1.00 22.43 O ATOM 118 CB ILE A 7 1.458 -3.813 1.017 1.00 73.32 C ATOM 119 CG1 ILE A 7 0.647 -3.674 2.355 1.00 54.44 C ATOM 120 CG2 ILE A 7 2.670 -4.741 1.248 1.00 33.50 C ATOM 121 CD1 ILE A 7 -0.724 -3.054 2.224 1.00 22.31 C ATOM 0 H ILE A 7 0.103 -2.046 -0.544 1.00 50.34 H new ATOM 0 HA ILE A 7 2.445 -1.895 1.229 1.00 53.23 H new ATOM 0 HB ILE A 7 0.791 -4.248 0.273 1.00 73.32 H new ATOM 0 HG12 ILE A 7 0.538 -4.664 2.798 1.00 54.44 H new ATOM 0 HG13 ILE A 7 1.232 -3.075 3.053 1.00 54.44 H new ATOM 0 HG21 ILE A 7 2.327 -5.693 1.654 1.00 33.50 H new ATOM 0 HG22 ILE A 7 3.182 -4.913 0.301 1.00 33.50 H new ATOM 0 HG23 ILE A 7 3.358 -4.273 1.952 1.00 33.50 H new ATOM 0 HD11 ILE A 7 -1.197 -3.005 3.205 1.00 22.31 H new ATOM 0 HD12 ILE A 7 -0.631 -2.048 1.816 1.00 22.31 H new ATOM 0 HD13 ILE A 7 -1.336 -3.661 1.556 1.00 22.31 H new ATOM 133 N ASN A 8 4.142 -2.332 -0.623 1.00 22.42 N ATOM 134 CA ASN A 8 5.197 -2.767 -1.542 1.00 63.25 C ATOM 135 C ASN A 8 5.826 -3.999 -0.911 1.00 60.01 C ATOM 136 O ASN A 8 6.310 -3.936 0.224 1.00 1.53 O ATOM 137 CB ASN A 8 6.273 -1.668 -1.734 1.00 61.32 C ATOM 138 CG ASN A 8 7.339 -1.997 -2.798 1.00 3.12 C ATOM 139 OD1 ASN A 8 8.512 -1.627 -2.656 1.00 31.00 O ATOM 140 ND2 ASN A 8 6.940 -2.636 -3.898 1.00 30.05 N ATOM 0 H ASN A 8 4.481 -1.753 0.145 1.00 22.42 H new ATOM 0 HA ASN A 8 4.781 -2.977 -2.527 1.00 63.25 H new ATOM 0 HB2 ASN A 8 5.778 -0.737 -2.009 1.00 61.32 H new ATOM 0 HB3 ASN A 8 6.771 -1.494 -0.780 1.00 61.32 H new ATOM 0 HD21 ASN A 8 7.607 -2.830 -4.645 1.00 30.05 H new ATOM 0 HD22 ASN A 8 5.968 -2.931 -3.992 1.00 30.05 H new ATOM 147 N THR A 9 5.762 -5.127 -1.609 1.00 14.02 N ATOM 148 CA THR A 9 6.311 -6.391 -1.117 1.00 2.51 C ATOM 149 C THR A 9 6.908 -7.174 -2.286 1.00 73.23 C ATOM 150 O THR A 9 6.218 -7.507 -3.255 1.00 3.53 O ATOM 151 CB THR A 9 5.248 -7.235 -0.321 1.00 14.22 C ATOM 152 OG1 THR A 9 5.743 -8.558 -0.039 1.00 23.32 O ATOM 153 CG2 THR A 9 3.895 -7.318 -1.040 1.00 21.44 C ATOM 0 H THR A 9 5.330 -5.194 -2.530 1.00 14.02 H new ATOM 0 HA THR A 9 7.104 -6.169 -0.402 1.00 2.51 H new ATOM 0 HB THR A 9 5.082 -6.709 0.619 1.00 14.22 H new ATOM 0 HG1 THR A 9 6.682 -8.504 0.238 1.00 23.32 H new ATOM 0 HG21 THR A 9 3.202 -7.912 -0.444 1.00 21.44 H new ATOM 0 HG22 THR A 9 3.491 -6.314 -1.172 1.00 21.44 H new ATOM 0 HG23 THR A 9 4.029 -7.787 -2.015 1.00 21.44 H new ATOM 161 N ASN A 10 8.227 -7.408 -2.208 1.00 53.41 N ATOM 162 CA ASN A 10 8.992 -8.125 -3.244 1.00 44.51 C ATOM 163 C ASN A 10 9.392 -9.529 -2.770 1.00 53.51 C ATOM 164 O ASN A 10 10.150 -10.241 -3.449 1.00 63.15 O ATOM 165 CB ASN A 10 10.219 -7.288 -3.660 1.00 31.51 C ATOM 166 CG ASN A 10 9.816 -5.944 -4.277 1.00 11.24 C ATOM 167 OD1 ASN A 10 9.701 -4.936 -3.578 1.00 5.41 O ATOM 168 ND2 ASN A 10 9.592 -5.920 -5.587 1.00 20.53 N ATOM 0 H ASN A 10 8.798 -7.104 -1.420 1.00 53.41 H new ATOM 0 HA ASN A 10 8.358 -8.260 -4.120 1.00 44.51 H new ATOM 0 HB2 ASN A 10 10.850 -7.112 -2.789 1.00 31.51 H new ATOM 0 HB3 ASN A 10 10.816 -7.852 -4.377 1.00 31.51 H new ATOM 0 HD21 ASN A 10 9.316 -5.049 -6.041 1.00 20.53 H new ATOM 0 HD22 ASN A 10 9.696 -6.772 -6.138 1.00 20.53 H new ATOM 175 N ASN A 11 8.884 -9.912 -1.592 1.00 52.24 N ATOM 176 CA ASN A 11 8.900 -11.298 -1.108 1.00 44.23 C ATOM 177 C ASN A 11 7.577 -11.949 -1.554 1.00 32.55 C ATOM 178 O ASN A 11 6.516 -11.609 -1.025 1.00 53.23 O ATOM 179 CB ASN A 11 9.072 -11.326 0.437 1.00 1.40 C ATOM 180 CG ASN A 11 9.174 -12.740 1.058 1.00 55.04 C ATOM 181 OD1 ASN A 11 8.676 -13.735 0.520 1.00 3.45 O ATOM 182 ND2 ASN A 11 9.795 -12.833 2.225 1.00 22.41 N ATOM 0 H ASN A 11 8.445 -9.261 -0.941 1.00 52.24 H new ATOM 0 HA ASN A 11 9.740 -11.855 -1.522 1.00 44.23 H new ATOM 0 HB2 ASN A 11 9.970 -10.765 0.698 1.00 1.40 H new ATOM 0 HB3 ASN A 11 8.228 -10.806 0.891 1.00 1.40 H new ATOM 0 HD21 ASN A 11 9.868 -13.736 2.693 1.00 22.41 H new ATOM 0 HD22 ASN A 11 10.200 -12.001 2.655 1.00 22.41 H new ATOM 189 N ASP A 12 7.670 -12.869 -2.537 1.00 32.11 N ATOM 190 CA ASP A 12 6.510 -13.534 -3.180 1.00 23.25 C ATOM 191 C ASP A 12 5.627 -14.253 -2.148 1.00 12.44 C ATOM 192 O ASP A 12 4.398 -14.110 -2.150 1.00 44.21 O ATOM 193 CB ASP A 12 6.994 -14.572 -4.234 1.00 21.15 C ATOM 194 CG ASP A 12 7.899 -13.976 -5.326 1.00 30.33 C ATOM 195 OD1 ASP A 12 9.110 -13.799 -5.079 1.00 12.22 O ATOM 196 OD2 ASP A 12 7.404 -13.672 -6.434 1.00 23.45 O ATOM 0 H ASP A 12 8.566 -13.178 -2.914 1.00 32.11 H new ATOM 0 HA ASP A 12 5.922 -12.755 -3.665 1.00 23.25 H new ATOM 0 HB2 ASP A 12 7.534 -15.369 -3.723 1.00 21.15 H new ATOM 0 HB3 ASP A 12 6.124 -15.028 -4.706 1.00 21.15 H new ATOM 201 N GLU A 13 6.286 -15.016 -1.269 1.00 2.22 N ATOM 202 CA GLU A 13 5.623 -15.804 -0.229 1.00 34.44 C ATOM 203 C GLU A 13 4.899 -14.877 0.769 1.00 52.40 C ATOM 204 O GLU A 13 3.780 -15.172 1.196 1.00 24.35 O ATOM 205 CB GLU A 13 6.649 -16.727 0.482 1.00 52.13 C ATOM 206 CG GLU A 13 7.415 -17.673 -0.481 1.00 3.52 C ATOM 207 CD GLU A 13 8.284 -18.723 0.235 1.00 31.44 C ATOM 208 OE1 GLU A 13 9.360 -18.368 0.749 1.00 73.23 O ATOM 209 OE2 GLU A 13 7.887 -19.908 0.296 1.00 25.34 O ATOM 0 H GLU A 13 7.302 -15.103 -1.261 1.00 2.22 H new ATOM 0 HA GLU A 13 4.869 -16.441 -0.690 1.00 34.44 H new ATOM 0 HB2 GLU A 13 7.369 -16.109 1.018 1.00 52.13 H new ATOM 0 HB3 GLU A 13 6.128 -17.327 1.227 1.00 52.13 H new ATOM 0 HG2 GLU A 13 6.695 -18.186 -1.119 1.00 3.52 H new ATOM 0 HG3 GLU A 13 8.050 -17.074 -1.134 1.00 3.52 H new ATOM 216 N LEU A 14 5.522 -13.719 1.078 1.00 21.24 N ATOM 217 CA LEU A 14 4.949 -12.717 1.996 1.00 51.05 C ATOM 218 C LEU A 14 3.670 -12.070 1.412 1.00 73.32 C ATOM 219 O LEU A 14 2.723 -11.849 2.165 1.00 14.12 O ATOM 220 CB LEU A 14 6.001 -11.641 2.351 1.00 22.43 C ATOM 221 CG LEU A 14 5.525 -10.418 3.207 1.00 43.40 C ATOM 222 CD1 LEU A 14 4.864 -10.840 4.533 1.00 10.22 C ATOM 223 CD2 LEU A 14 6.685 -9.454 3.468 1.00 51.24 C ATOM 0 H LEU A 14 6.432 -13.456 0.699 1.00 21.24 H new ATOM 0 HA LEU A 14 4.661 -13.234 2.911 1.00 51.05 H new ATOM 0 HB2 LEU A 14 6.815 -12.130 2.887 1.00 22.43 H new ATOM 0 HB3 LEU A 14 6.418 -11.258 1.420 1.00 22.43 H new ATOM 0 HG LEU A 14 4.762 -9.905 2.622 1.00 43.40 H new ATOM 0 HD11 LEU A 14 4.554 -9.952 5.084 1.00 10.22 H new ATOM 0 HD12 LEU A 14 3.992 -11.460 4.324 1.00 10.22 H new ATOM 0 HD13 LEU A 14 5.577 -11.407 5.131 1.00 10.22 H new ATOM 0 HD21 LEU A 14 6.332 -8.612 4.064 1.00 51.24 H new ATOM 0 HD22 LEU A 14 7.476 -9.974 4.008 1.00 51.24 H new ATOM 0 HD23 LEU A 14 7.074 -9.088 2.518 1.00 51.24 H new ATOM 235 N ILE A 15 3.638 -11.807 0.071 1.00 12.11 N ATOM 236 CA ILE A 15 2.452 -11.196 -0.602 1.00 14.25 C ATOM 237 C ILE A 15 1.182 -12.026 -0.290 1.00 75.33 C ATOM 238 O ILE A 15 0.135 -11.482 0.073 1.00 5.33 O ATOM 239 CB ILE A 15 2.606 -11.099 -2.181 1.00 1.05 C ATOM 240 CG1 ILE A 15 3.998 -10.521 -2.601 1.00 44.35 C ATOM 241 CG2 ILE A 15 1.457 -10.254 -2.794 1.00 24.13 C ATOM 242 CD1 ILE A 15 4.225 -10.369 -4.104 1.00 14.44 C ATOM 0 H ILE A 15 4.414 -12.007 -0.560 1.00 12.11 H new ATOM 0 HA ILE A 15 2.371 -10.182 -0.210 1.00 14.25 H new ATOM 0 HB ILE A 15 2.543 -12.114 -2.574 1.00 1.05 H new ATOM 0 HG12 ILE A 15 4.122 -9.545 -2.133 1.00 44.35 H new ATOM 0 HG13 ILE A 15 4.777 -11.169 -2.198 1.00 44.35 H new ATOM 0 HG21 ILE A 15 1.582 -10.200 -3.876 1.00 24.13 H new ATOM 0 HG22 ILE A 15 0.499 -10.720 -2.562 1.00 24.13 H new ATOM 0 HG23 ILE A 15 1.482 -9.248 -2.376 1.00 24.13 H new ATOM 0 HD11 ILE A 15 5.220 -9.961 -4.282 1.00 14.44 H new ATOM 0 HD12 ILE A 15 4.141 -11.344 -4.585 1.00 14.44 H new ATOM 0 HD13 ILE A 15 3.476 -9.694 -4.519 1.00 14.44 H new ATOM 254 N LYS A 16 1.351 -13.353 -0.383 1.00 31.21 N ATOM 255 CA LYS A 16 0.290 -14.346 -0.150 1.00 62.40 C ATOM 256 C LYS A 16 -0.216 -14.287 1.307 1.00 61.43 C ATOM 257 O LYS A 16 -1.417 -14.357 1.561 1.00 33.50 O ATOM 258 CB LYS A 16 0.842 -15.767 -0.463 1.00 70.01 C ATOM 259 CG LYS A 16 1.514 -15.915 -1.850 1.00 52.42 C ATOM 260 CD LYS A 16 0.553 -15.682 -3.034 1.00 10.35 C ATOM 261 CE LYS A 16 -0.559 -16.740 -3.120 1.00 21.44 C ATOM 262 NZ LYS A 16 -0.021 -18.120 -3.306 1.00 71.03 N ATOM 0 H LYS A 16 2.247 -13.775 -0.627 1.00 31.21 H new ATOM 0 HA LYS A 16 -0.550 -14.121 -0.807 1.00 62.40 H new ATOM 0 HB2 LYS A 16 1.566 -16.037 0.306 1.00 70.01 H new ATOM 0 HB3 LYS A 16 0.022 -16.482 -0.394 1.00 70.01 H new ATOM 0 HG2 LYS A 16 2.341 -15.208 -1.920 1.00 52.42 H new ATOM 0 HG3 LYS A 16 1.941 -16.914 -1.932 1.00 52.42 H new ATOM 0 HD2 LYS A 16 0.101 -14.694 -2.940 1.00 10.35 H new ATOM 0 HD3 LYS A 16 1.122 -15.685 -3.963 1.00 10.35 H new ATOM 0 HE2 LYS A 16 -1.159 -16.707 -2.211 1.00 21.44 H new ATOM 0 HE3 LYS A 16 -1.224 -16.498 -3.949 1.00 21.44 H new ATOM 0 HZ1 LYS A 16 -0.804 -18.773 -3.510 1.00 71.03 H new ATOM 0 HZ2 LYS A 16 0.651 -18.127 -4.100 1.00 71.03 H new ATOM 0 HZ3 LYS A 16 0.465 -18.423 -2.438 1.00 71.03 H new ATOM 276 N LYS A 17 0.737 -14.132 2.245 1.00 1.13 N ATOM 277 CA LYS A 17 0.460 -14.100 3.692 1.00 20.11 C ATOM 278 C LYS A 17 -0.261 -12.805 4.096 1.00 62.22 C ATOM 279 O LYS A 17 -1.153 -12.836 4.945 1.00 42.05 O ATOM 280 CB LYS A 17 1.785 -14.254 4.473 1.00 22.02 C ATOM 281 CG LYS A 17 2.555 -15.551 4.144 1.00 41.02 C ATOM 282 CD LYS A 17 3.910 -15.649 4.881 1.00 42.43 C ATOM 283 CE LYS A 17 3.755 -15.765 6.405 1.00 64.52 C ATOM 284 NZ LYS A 17 5.069 -15.855 7.093 1.00 33.25 N ATOM 0 H LYS A 17 1.726 -14.025 2.018 1.00 1.13 H new ATOM 0 HA LYS A 17 -0.202 -14.930 3.938 1.00 20.11 H new ATOM 0 HB2 LYS A 17 2.425 -13.398 4.257 1.00 22.02 H new ATOM 0 HB3 LYS A 17 1.571 -14.231 5.542 1.00 22.02 H new ATOM 0 HG2 LYS A 17 1.939 -16.410 4.410 1.00 41.02 H new ATOM 0 HG3 LYS A 17 2.727 -15.603 3.069 1.00 41.02 H new ATOM 0 HD2 LYS A 17 4.458 -16.515 4.510 1.00 42.43 H new ATOM 0 HD3 LYS A 17 4.509 -14.769 4.648 1.00 42.43 H new ATOM 0 HE2 LYS A 17 3.208 -14.900 6.781 1.00 64.52 H new ATOM 0 HE3 LYS A 17 3.160 -16.647 6.643 1.00 64.52 H new ATOM 0 HZ1 LYS A 17 4.978 -16.455 7.938 1.00 33.25 H new ATOM 0 HZ2 LYS A 17 5.771 -16.270 6.448 1.00 33.25 H new ATOM 0 HZ3 LYS A 17 5.379 -14.903 7.376 1.00 33.25 H new ATOM 298 N ILE A 18 0.141 -11.676 3.465 1.00 61.55 N ATOM 299 CA ILE A 18 -0.481 -10.355 3.682 1.00 11.32 C ATOM 300 C ILE A 18 -1.963 -10.435 3.335 1.00 61.33 C ATOM 301 O ILE A 18 -2.802 -10.088 4.158 1.00 2.11 O ATOM 302 CB ILE A 18 0.228 -9.227 2.834 1.00 44.12 C ATOM 303 CG1 ILE A 18 1.711 -9.068 3.287 1.00 3.31 C ATOM 304 CG2 ILE A 18 -0.521 -7.868 2.917 1.00 4.44 C ATOM 305 CD1 ILE A 18 2.558 -8.152 2.428 1.00 31.04 C ATOM 0 H ILE A 18 0.907 -11.659 2.791 1.00 61.55 H new ATOM 0 HA ILE A 18 -0.364 -10.087 4.732 1.00 11.32 H new ATOM 0 HB ILE A 18 0.204 -9.538 1.790 1.00 44.12 H new ATOM 0 HG12 ILE A 18 1.722 -8.692 4.310 1.00 3.31 H new ATOM 0 HG13 ILE A 18 2.175 -10.054 3.305 1.00 3.31 H new ATOM 0 HG21 ILE A 18 0.005 -7.125 2.318 1.00 4.44 H new ATOM 0 HG22 ILE A 18 -1.536 -7.988 2.537 1.00 4.44 H new ATOM 0 HG23 ILE A 18 -0.559 -7.536 3.955 1.00 4.44 H new ATOM 0 HD11 ILE A 18 3.571 -8.111 2.829 1.00 31.04 H new ATOM 0 HD12 ILE A 18 2.587 -8.534 1.408 1.00 31.04 H new ATOM 0 HD13 ILE A 18 2.127 -7.151 2.429 1.00 31.04 H new ATOM 317 N LYS A 19 -2.248 -10.985 2.133 1.00 13.12 N ATOM 318 CA LYS A 19 -3.619 -11.190 1.637 1.00 72.24 C ATOM 319 C LYS A 19 -4.504 -11.903 2.689 1.00 3.00 C ATOM 320 O LYS A 19 -5.626 -11.473 2.950 1.00 23.32 O ATOM 321 CB LYS A 19 -3.596 -11.998 0.306 1.00 63.11 C ATOM 322 CG LYS A 19 -2.917 -11.268 -0.874 1.00 62.30 C ATOM 323 CD LYS A 19 -2.995 -12.065 -2.201 1.00 63.11 C ATOM 324 CE LYS A 19 -2.333 -11.331 -3.381 1.00 1.33 C ATOM 325 NZ LYS A 19 -2.479 -12.077 -4.667 1.00 32.40 N ATOM 0 H LYS A 19 -1.529 -11.298 1.481 1.00 13.12 H new ATOM 0 HA LYS A 19 -4.056 -10.209 1.449 1.00 72.24 H new ATOM 0 HB2 LYS A 19 -3.080 -12.943 0.478 1.00 63.11 H new ATOM 0 HB3 LYS A 19 -4.621 -12.241 0.025 1.00 63.11 H new ATOM 0 HG2 LYS A 19 -3.388 -10.295 -1.012 1.00 62.30 H new ATOM 0 HG3 LYS A 19 -1.871 -11.084 -0.628 1.00 62.30 H new ATOM 0 HD2 LYS A 19 -2.513 -13.033 -2.066 1.00 63.11 H new ATOM 0 HD3 LYS A 19 -4.040 -12.260 -2.441 1.00 63.11 H new ATOM 0 HE2 LYS A 19 -2.777 -10.341 -3.485 1.00 1.33 H new ATOM 0 HE3 LYS A 19 -1.274 -11.184 -3.167 1.00 1.33 H new ATOM 0 HZ1 LYS A 19 -2.018 -11.544 -5.432 1.00 32.40 H new ATOM 0 HZ2 LYS A 19 -2.032 -13.012 -4.579 1.00 32.40 H new ATOM 0 HZ3 LYS A 19 -3.489 -12.195 -4.887 1.00 32.40 H new ATOM 339 N LYS A 20 -3.939 -12.947 3.328 1.00 53.34 N ATOM 340 CA LYS A 20 -4.644 -13.778 4.326 1.00 32.12 C ATOM 341 C LYS A 20 -4.904 -13.024 5.638 1.00 11.31 C ATOM 342 O LYS A 20 -5.956 -13.205 6.261 1.00 33.14 O ATOM 343 CB LYS A 20 -3.839 -15.075 4.578 1.00 21.43 C ATOM 344 CG LYS A 20 -3.731 -15.970 3.328 1.00 14.43 C ATOM 345 CD LYS A 20 -5.116 -16.430 2.804 1.00 42.45 C ATOM 346 CE LYS A 20 -5.059 -17.040 1.402 1.00 75.02 C ATOM 347 NZ LYS A 20 -6.418 -17.382 0.901 1.00 13.41 N ATOM 0 H LYS A 20 -2.975 -13.239 3.166 1.00 53.34 H new ATOM 0 HA LYS A 20 -5.624 -14.033 3.921 1.00 32.12 H new ATOM 0 HB2 LYS A 20 -2.837 -14.814 4.918 1.00 21.43 H new ATOM 0 HB3 LYS A 20 -4.312 -15.639 5.382 1.00 21.43 H new ATOM 0 HG2 LYS A 20 -3.211 -15.426 2.540 1.00 14.43 H new ATOM 0 HG3 LYS A 20 -3.126 -16.846 3.564 1.00 14.43 H new ATOM 0 HD2 LYS A 20 -5.533 -17.162 3.495 1.00 42.45 H new ATOM 0 HD3 LYS A 20 -5.795 -15.577 2.795 1.00 42.45 H new ATOM 0 HE2 LYS A 20 -4.584 -16.338 0.717 1.00 75.02 H new ATOM 0 HE3 LYS A 20 -4.440 -17.937 1.419 1.00 75.02 H new ATOM 0 HZ1 LYS A 20 -6.388 -17.500 -0.132 1.00 13.41 H new ATOM 0 HZ2 LYS A 20 -6.738 -18.268 1.342 1.00 13.41 H new ATOM 0 HZ3 LYS A 20 -7.080 -16.617 1.142 1.00 13.41 H new ATOM 361 N GLU A 21 -3.942 -12.176 6.047 1.00 4.43 N ATOM 362 CA GLU A 21 -4.100 -11.301 7.229 1.00 41.13 C ATOM 363 C GLU A 21 -5.244 -10.301 7.002 1.00 4.33 C ATOM 364 O GLU A 21 -6.034 -10.031 7.898 1.00 44.31 O ATOM 365 CB GLU A 21 -2.785 -10.539 7.538 1.00 15.34 C ATOM 366 CG GLU A 21 -1.583 -11.439 7.878 1.00 32.31 C ATOM 367 CD GLU A 21 -1.785 -12.307 9.136 1.00 4.40 C ATOM 368 OE1 GLU A 21 -1.528 -11.823 10.257 1.00 33.05 O ATOM 369 OE2 GLU A 21 -2.203 -13.482 9.012 1.00 41.44 O ATOM 0 H GLU A 21 -3.043 -12.077 5.576 1.00 4.43 H new ATOM 0 HA GLU A 21 -4.341 -11.931 8.085 1.00 41.13 H new ATOM 0 HB2 GLU A 21 -2.528 -9.923 6.677 1.00 15.34 H new ATOM 0 HB3 GLU A 21 -2.962 -9.861 8.373 1.00 15.34 H new ATOM 0 HG2 GLU A 21 -1.379 -12.091 7.029 1.00 32.31 H new ATOM 0 HG3 GLU A 21 -0.702 -10.813 8.019 1.00 32.31 H new ATOM 376 N VAL A 22 -5.321 -9.795 5.767 1.00 25.54 N ATOM 377 CA VAL A 22 -6.327 -8.807 5.333 1.00 54.43 C ATOM 378 C VAL A 22 -7.717 -9.463 5.170 1.00 42.32 C ATOM 379 O VAL A 22 -8.750 -8.803 5.359 1.00 72.22 O ATOM 380 CB VAL A 22 -5.860 -8.142 3.992 1.00 31.45 C ATOM 381 CG1 VAL A 22 -6.835 -7.064 3.495 1.00 52.32 C ATOM 382 CG2 VAL A 22 -4.451 -7.549 4.146 1.00 31.44 C ATOM 0 H VAL A 22 -4.676 -10.063 5.023 1.00 25.54 H new ATOM 0 HA VAL A 22 -6.419 -8.037 6.099 1.00 54.43 H new ATOM 0 HB VAL A 22 -5.842 -8.931 3.240 1.00 31.45 H new ATOM 0 HG11 VAL A 22 -6.462 -6.637 2.564 1.00 52.32 H new ATOM 0 HG12 VAL A 22 -7.814 -7.511 3.323 1.00 52.32 H new ATOM 0 HG13 VAL A 22 -6.921 -6.278 4.245 1.00 52.32 H new ATOM 0 HG21 VAL A 22 -4.144 -7.092 3.205 1.00 31.44 H new ATOM 0 HG22 VAL A 22 -4.458 -6.793 4.931 1.00 31.44 H new ATOM 0 HG23 VAL A 22 -3.750 -8.341 4.411 1.00 31.44 H new ATOM 392 N GLU A 23 -7.725 -10.768 4.829 1.00 30.35 N ATOM 393 CA GLU A 23 -8.958 -11.590 4.761 1.00 24.01 C ATOM 394 C GLU A 23 -9.510 -11.863 6.180 1.00 45.44 C ATOM 395 O GLU A 23 -10.717 -12.085 6.348 1.00 72.43 O ATOM 396 CB GLU A 23 -8.684 -12.919 3.994 1.00 42.32 C ATOM 397 CG GLU A 23 -8.504 -12.754 2.462 1.00 0.43 C ATOM 398 CD GLU A 23 -7.940 -14.003 1.751 1.00 24.44 C ATOM 399 OE1 GLU A 23 -8.657 -15.022 1.642 1.00 4.44 O ATOM 400 OE2 GLU A 23 -6.777 -13.973 1.297 1.00 54.42 O ATOM 0 H GLU A 23 -6.878 -11.285 4.592 1.00 30.35 H new ATOM 0 HA GLU A 23 -9.718 -11.035 4.211 1.00 24.01 H new ATOM 0 HB2 GLU A 23 -7.787 -13.382 4.404 1.00 42.32 H new ATOM 0 HB3 GLU A 23 -9.510 -13.606 4.178 1.00 42.32 H new ATOM 0 HG2 GLU A 23 -9.468 -12.503 2.020 1.00 0.43 H new ATOM 0 HG3 GLU A 23 -7.838 -11.912 2.275 1.00 0.43 H new ATOM 407 N ASN A 24 -8.613 -11.841 7.192 1.00 3.52 N ATOM 408 CA ASN A 24 -9.002 -11.919 8.622 1.00 23.24 C ATOM 409 C ASN A 24 -9.670 -10.599 9.060 1.00 61.02 C ATOM 410 O ASN A 24 -10.601 -10.594 9.874 1.00 30.41 O ATOM 411 CB ASN A 24 -7.766 -12.205 9.527 1.00 71.43 C ATOM 412 CG ASN A 24 -7.068 -13.534 9.226 1.00 30.41 C ATOM 413 OD1 ASN A 24 -7.698 -14.518 8.834 1.00 53.13 O ATOM 414 ND2 ASN A 24 -5.756 -13.570 9.410 1.00 24.14 N ATOM 0 H ASN A 24 -7.606 -11.769 7.044 1.00 3.52 H new ATOM 0 HA ASN A 24 -9.708 -12.741 8.734 1.00 23.24 H new ATOM 0 HB2 ASN A 24 -7.047 -11.394 9.410 1.00 71.43 H new ATOM 0 HB3 ASN A 24 -8.083 -12.201 10.570 1.00 71.43 H new ATOM 0 HD21 ASN A 24 -5.239 -14.430 9.226 1.00 24.14 H new ATOM 0 HD22 ASN A 24 -5.264 -12.738 9.735 1.00 24.14 H new ATOM 421 N GLN A 25 -9.172 -9.479 8.499 1.00 11.32 N ATOM 422 CA GLN A 25 -9.657 -8.121 8.817 1.00 2.04 C ATOM 423 C GLN A 25 -10.921 -7.777 8.005 1.00 13.10 C ATOM 424 O GLN A 25 -11.716 -6.918 8.406 1.00 2.03 O ATOM 425 CB GLN A 25 -8.538 -7.086 8.525 1.00 12.03 C ATOM 426 CG GLN A 25 -7.182 -7.404 9.190 1.00 22.35 C ATOM 427 CD GLN A 25 -7.223 -7.492 10.719 1.00 12.20 C ATOM 428 OE1 GLN A 25 -8.001 -6.804 11.384 1.00 11.31 O ATOM 429 NE2 GLN A 25 -6.381 -8.346 11.290 1.00 32.11 N ATOM 0 H GLN A 25 -8.420 -9.491 7.810 1.00 11.32 H new ATOM 0 HA GLN A 25 -9.918 -8.087 9.875 1.00 2.04 H new ATOM 0 HB2 GLN A 25 -8.393 -7.021 7.447 1.00 12.03 H new ATOM 0 HB3 GLN A 25 -8.872 -6.104 8.861 1.00 12.03 H new ATOM 0 HG2 GLN A 25 -6.812 -8.350 8.795 1.00 22.35 H new ATOM 0 HG3 GLN A 25 -6.463 -6.636 8.903 1.00 22.35 H new ATOM 0 HE21 GLN A 25 -5.749 -8.902 10.713 1.00 32.11 H new ATOM 0 HE22 GLN A 25 -6.366 -8.446 12.305 1.00 32.11 H new ATOM 438 N GLY A 26 -11.078 -8.451 6.851 1.00 4.33 N ATOM 439 CA GLY A 26 -12.223 -8.257 5.962 1.00 43.34 C ATOM 440 C GLY A 26 -12.087 -7.061 5.024 1.00 33.34 C ATOM 441 O GLY A 26 -13.095 -6.543 4.529 1.00 21.33 O ATOM 0 H GLY A 26 -10.410 -9.145 6.514 1.00 4.33 H new ATOM 0 HA2 GLY A 26 -12.364 -9.159 5.366 1.00 43.34 H new ATOM 0 HA3 GLY A 26 -13.121 -8.131 6.566 1.00 43.34 H new ATOM 445 N TYR A 27 -10.842 -6.619 4.771 1.00 14.23 N ATOM 446 CA TYR A 27 -10.552 -5.523 3.809 1.00 70.52 C ATOM 447 C TYR A 27 -10.310 -6.119 2.405 1.00 22.10 C ATOM 448 O TYR A 27 -10.018 -7.315 2.268 1.00 41.22 O ATOM 449 CB TYR A 27 -9.319 -4.684 4.259 1.00 33.21 C ATOM 450 CG TYR A 27 -9.494 -3.813 5.520 1.00 53.34 C ATOM 451 CD1 TYR A 27 -10.088 -4.312 6.683 1.00 25.11 C ATOM 452 CD2 TYR A 27 -9.040 -2.492 5.543 1.00 74.33 C ATOM 453 CE1 TYR A 27 -10.225 -3.530 7.815 1.00 12.42 C ATOM 454 CE2 TYR A 27 -9.168 -1.710 6.672 1.00 12.02 C ATOM 455 CZ TYR A 27 -9.764 -2.232 7.807 1.00 45.40 C ATOM 456 OH TYR A 27 -9.893 -1.449 8.942 1.00 61.15 O ATOM 0 H TYR A 27 -10.010 -7.003 5.220 1.00 14.23 H new ATOM 0 HA TYR A 27 -11.413 -4.855 3.778 1.00 70.52 H new ATOM 0 HB2 TYR A 27 -8.487 -5.367 4.431 1.00 33.21 H new ATOM 0 HB3 TYR A 27 -9.031 -4.033 3.433 1.00 33.21 H new ATOM 0 HD1 TYR A 27 -10.448 -5.330 6.698 1.00 25.11 H new ATOM 0 HD2 TYR A 27 -8.580 -2.075 4.659 1.00 74.33 H new ATOM 0 HE1 TYR A 27 -10.691 -3.935 8.701 1.00 12.42 H new ATOM 0 HE2 TYR A 27 -8.804 -0.693 6.670 1.00 12.02 H new ATOM 0 HH TYR A 27 -9.863 -2.020 9.738 1.00 61.15 H new ATOM 466 N GLN A 28 -10.419 -5.270 1.373 1.00 3.53 N ATOM 467 CA GLN A 28 -10.317 -5.687 -0.041 1.00 52.42 C ATOM 468 C GLN A 28 -8.865 -5.588 -0.537 1.00 61.21 C ATOM 469 O GLN A 28 -8.296 -4.503 -0.497 1.00 12.43 O ATOM 470 CB GLN A 28 -11.227 -4.777 -0.896 1.00 71.11 C ATOM 471 CG GLN A 28 -12.712 -4.843 -0.517 1.00 11.11 C ATOM 472 CD GLN A 28 -13.540 -3.771 -1.204 1.00 41.14 C ATOM 473 OE1 GLN A 28 -14.076 -3.971 -2.298 1.00 2.11 O ATOM 474 NE2 GLN A 28 -13.629 -2.614 -0.577 1.00 2.34 N ATOM 0 H GLN A 28 -10.581 -4.270 1.492 1.00 3.53 H new ATOM 0 HA GLN A 28 -10.635 -6.726 -0.131 1.00 52.42 H new ATOM 0 HB2 GLN A 28 -10.884 -3.747 -0.801 1.00 71.11 H new ATOM 0 HB3 GLN A 28 -11.118 -5.054 -1.945 1.00 71.11 H new ATOM 0 HG2 GLN A 28 -13.106 -5.825 -0.779 1.00 11.11 H new ATOM 0 HG3 GLN A 28 -12.812 -4.737 0.563 1.00 11.11 H new ATOM 0 HE21 GLN A 28 -13.172 -2.487 0.326 1.00 2.34 H new ATOM 0 HE22 GLN A 28 -14.155 -1.846 -0.995 1.00 2.34 H new ATOM 483 N VAL A 29 -8.277 -6.714 -1.003 1.00 24.21 N ATOM 484 CA VAL A 29 -6.914 -6.727 -1.592 1.00 14.02 C ATOM 485 C VAL A 29 -6.988 -6.539 -3.119 1.00 62.12 C ATOM 486 O VAL A 29 -7.671 -7.301 -3.812 1.00 31.21 O ATOM 487 CB VAL A 29 -6.130 -8.063 -1.292 1.00 61.32 C ATOM 488 CG1 VAL A 29 -4.731 -8.061 -1.965 1.00 21.24 C ATOM 489 CG2 VAL A 29 -6.003 -8.311 0.224 1.00 24.32 C ATOM 0 H VAL A 29 -8.726 -7.630 -0.983 1.00 24.21 H new ATOM 0 HA VAL A 29 -6.374 -5.903 -1.126 1.00 14.02 H new ATOM 0 HB VAL A 29 -6.709 -8.881 -1.720 1.00 61.32 H new ATOM 0 HG11 VAL A 29 -4.217 -8.995 -1.739 1.00 21.24 H new ATOM 0 HG12 VAL A 29 -4.847 -7.963 -3.044 1.00 21.24 H new ATOM 0 HG13 VAL A 29 -4.146 -7.224 -1.585 1.00 21.24 H new ATOM 0 HG21 VAL A 29 -5.458 -9.239 0.396 1.00 24.32 H new ATOM 0 HG22 VAL A 29 -5.464 -7.483 0.684 1.00 24.32 H new ATOM 0 HG23 VAL A 29 -6.997 -8.387 0.665 1.00 24.32 H new ATOM 499 N ARG A 30 -6.308 -5.501 -3.631 1.00 61.52 N ATOM 500 CA ARG A 30 -6.052 -5.342 -5.079 1.00 2.32 C ATOM 501 C ARG A 30 -4.538 -5.373 -5.301 1.00 61.44 C ATOM 502 O ARG A 30 -3.847 -4.409 -4.974 1.00 22.12 O ATOM 503 CB ARG A 30 -6.650 -4.004 -5.628 1.00 32.32 C ATOM 504 CG ARG A 30 -8.145 -4.044 -6.012 1.00 51.14 C ATOM 505 CD ARG A 30 -9.096 -4.283 -4.829 1.00 51.23 C ATOM 506 NE ARG A 30 -10.497 -4.399 -5.273 1.00 74.24 N ATOM 507 CZ ARG A 30 -11.372 -5.337 -4.859 1.00 41.42 C ATOM 508 NH1 ARG A 30 -11.018 -6.276 -3.977 1.00 44.42 N ATOM 509 NH2 ARG A 30 -12.600 -5.328 -5.348 1.00 20.23 N ATOM 0 H ARG A 30 -5.920 -4.750 -3.060 1.00 61.52 H new ATOM 0 HA ARG A 30 -6.537 -6.155 -5.619 1.00 2.32 H new ATOM 0 HB2 ARG A 30 -6.508 -3.229 -4.875 1.00 32.32 H new ATOM 0 HB3 ARG A 30 -6.077 -3.705 -6.505 1.00 32.32 H new ATOM 0 HG2 ARG A 30 -8.410 -3.102 -6.491 1.00 51.14 H new ATOM 0 HG3 ARG A 30 -8.297 -4.831 -6.750 1.00 51.14 H new ATOM 0 HD2 ARG A 30 -8.804 -5.193 -4.305 1.00 51.23 H new ATOM 0 HD3 ARG A 30 -9.006 -3.462 -4.118 1.00 51.23 H new ATOM 0 HE ARG A 30 -10.832 -3.713 -5.949 1.00 74.24 H new ATOM 0 HH11 ARG A 30 -10.069 -6.293 -3.603 1.00 44.42 H new ATOM 0 HH12 ARG A 30 -11.697 -6.976 -3.678 1.00 44.42 H new ATOM 0 HH21 ARG A 30 -12.873 -4.618 -6.028 1.00 20.23 H new ATOM 0 HH22 ARG A 30 -13.275 -6.031 -5.045 1.00 20.23 H new ATOM 523 N ASP A 31 -4.027 -6.489 -5.860 1.00 64.51 N ATOM 524 CA ASP A 31 -2.606 -6.613 -6.219 1.00 21.51 C ATOM 525 C ASP A 31 -2.412 -6.040 -7.635 1.00 15.33 C ATOM 526 O ASP A 31 -3.017 -6.506 -8.613 1.00 4.13 O ATOM 527 CB ASP A 31 -2.111 -8.091 -6.106 1.00 73.12 C ATOM 528 CG ASP A 31 -2.832 -9.088 -7.035 1.00 34.44 C ATOM 529 OD1 ASP A 31 -3.971 -9.489 -6.712 1.00 33.11 O ATOM 530 OD2 ASP A 31 -2.273 -9.466 -8.092 1.00 70.31 O ATOM 0 H ASP A 31 -4.582 -7.318 -6.072 1.00 64.51 H new ATOM 0 HA ASP A 31 -1.997 -6.044 -5.517 1.00 21.51 H new ATOM 0 HB2 ASP A 31 -1.044 -8.119 -6.325 1.00 73.12 H new ATOM 0 HB3 ASP A 31 -2.234 -8.423 -5.075 1.00 73.12 H new ATOM 535 N VAL A 32 -1.608 -4.976 -7.714 1.00 54.02 N ATOM 536 CA VAL A 32 -1.371 -4.233 -8.948 1.00 42.55 C ATOM 537 C VAL A 32 -0.011 -4.631 -9.539 1.00 24.53 C ATOM 538 O VAL A 32 1.042 -4.474 -8.898 1.00 24.21 O ATOM 539 CB VAL A 32 -1.434 -2.687 -8.684 1.00 11.11 C ATOM 540 CG1 VAL A 32 -1.052 -1.871 -9.944 1.00 74.34 C ATOM 541 CG2 VAL A 32 -2.836 -2.275 -8.159 1.00 2.40 C ATOM 0 H VAL A 32 -1.099 -4.605 -6.912 1.00 54.02 H new ATOM 0 HA VAL A 32 -2.152 -4.481 -9.667 1.00 42.55 H new ATOM 0 HB VAL A 32 -0.697 -2.456 -7.915 1.00 11.11 H new ATOM 0 HG11 VAL A 32 -1.108 -0.806 -9.719 1.00 74.34 H new ATOM 0 HG12 VAL A 32 -0.036 -2.124 -10.248 1.00 74.34 H new ATOM 0 HG13 VAL A 32 -1.742 -2.108 -10.754 1.00 74.34 H new ATOM 0 HG21 VAL A 32 -2.857 -1.200 -7.983 1.00 2.40 H new ATOM 0 HG22 VAL A 32 -3.593 -2.536 -8.899 1.00 2.40 H new ATOM 0 HG23 VAL A 32 -3.044 -2.800 -7.226 1.00 2.40 H new ATOM 551 N ASN A 33 -0.066 -5.140 -10.771 1.00 13.44 N ATOM 552 CA ASN A 33 1.107 -5.570 -11.548 1.00 60.20 C ATOM 553 C ASN A 33 1.255 -4.670 -12.787 1.00 4.34 C ATOM 554 O ASN A 33 2.345 -4.551 -13.356 1.00 71.51 O ATOM 555 CB ASN A 33 0.925 -7.053 -11.976 1.00 63.24 C ATOM 556 CG ASN A 33 0.644 -8.000 -10.796 1.00 11.15 C ATOM 557 OD1 ASN A 33 1.548 -8.620 -10.242 1.00 34.03 O ATOM 558 ND2 ASN A 33 -0.616 -8.103 -10.391 1.00 14.45 N ATOM 0 H ASN A 33 -0.945 -5.269 -11.271 1.00 13.44 H new ATOM 0 HA ASN A 33 2.008 -5.485 -10.940 1.00 60.20 H new ATOM 0 HB2 ASN A 33 0.103 -7.119 -12.689 1.00 63.24 H new ATOM 0 HB3 ASN A 33 1.824 -7.387 -12.494 1.00 63.24 H new ATOM 0 HD21 ASN A 33 -0.851 -8.707 -9.603 1.00 14.45 H new ATOM 0 HD22 ASN A 33 -1.349 -7.578 -10.867 1.00 14.45 H new ATOM 565 N ASP A 34 0.135 -4.026 -13.184 1.00 34.05 N ATOM 566 CA ASP A 34 0.044 -3.192 -14.402 1.00 54.04 C ATOM 567 C ASP A 34 -0.337 -1.748 -14.032 1.00 72.22 C ATOM 568 O ASP A 34 -1.135 -1.518 -13.118 1.00 31.43 O ATOM 569 CB ASP A 34 -1.010 -3.769 -15.378 1.00 41.42 C ATOM 570 CG ASP A 34 -0.720 -5.210 -15.823 1.00 74.43 C ATOM 571 OD1 ASP A 34 0.041 -5.403 -16.792 1.00 15.14 O ATOM 572 OD2 ASP A 34 -1.255 -6.157 -15.208 1.00 31.42 O ATOM 0 H ASP A 34 -0.740 -4.072 -12.662 1.00 34.05 H new ATOM 0 HA ASP A 34 1.019 -3.194 -14.890 1.00 54.04 H new ATOM 0 HB2 ASP A 34 -1.990 -3.736 -14.901 1.00 41.42 H new ATOM 0 HB3 ASP A 34 -1.063 -3.130 -16.260 1.00 41.42 H new ATOM 577 N SER A 35 0.201 -0.787 -14.798 1.00 4.03 N ATOM 578 CA SER A 35 0.025 0.654 -14.558 1.00 14.44 C ATOM 579 C SER A 35 -1.413 1.137 -14.854 1.00 72.22 C ATOM 580 O SER A 35 -1.827 2.195 -14.372 1.00 31.42 O ATOM 581 CB SER A 35 1.060 1.434 -15.399 1.00 33.23 C ATOM 582 OG SER A 35 0.960 1.133 -16.787 1.00 32.31 O ATOM 0 H SER A 35 0.779 -0.992 -15.613 1.00 4.03 H new ATOM 0 HA SER A 35 0.191 0.845 -13.498 1.00 14.44 H new ATOM 0 HB2 SER A 35 0.915 2.504 -15.249 1.00 33.23 H new ATOM 0 HB3 SER A 35 2.064 1.196 -15.049 1.00 33.23 H new ATOM 0 HG SER A 35 1.630 1.648 -17.283 1.00 32.31 H new ATOM 588 N ASP A 36 -2.166 0.376 -15.664 1.00 14.14 N ATOM 589 CA ASP A 36 -3.566 0.719 -15.993 1.00 41.13 C ATOM 590 C ASP A 36 -4.549 0.078 -15.000 1.00 14.34 C ATOM 591 O ASP A 36 -5.622 0.632 -14.758 1.00 44.31 O ATOM 592 CB ASP A 36 -3.921 0.358 -17.456 1.00 34.12 C ATOM 593 CG ASP A 36 -3.137 1.196 -18.483 1.00 72.50 C ATOM 594 OD1 ASP A 36 -3.329 2.430 -18.520 1.00 4.35 O ATOM 595 OD2 ASP A 36 -2.324 0.635 -19.250 1.00 22.34 O ATOM 0 H ASP A 36 -1.832 -0.481 -16.105 1.00 14.14 H new ATOM 0 HA ASP A 36 -3.662 1.801 -15.899 1.00 41.13 H new ATOM 0 HB2 ASP A 36 -3.717 -0.699 -17.625 1.00 34.12 H new ATOM 0 HB3 ASP A 36 -4.990 0.505 -17.613 1.00 34.12 H new ATOM 600 N GLU A 37 -4.172 -1.077 -14.406 1.00 65.11 N ATOM 601 CA GLU A 37 -5.017 -1.768 -13.401 1.00 72.02 C ATOM 602 C GLU A 37 -5.213 -0.902 -12.152 1.00 53.10 C ATOM 603 O GLU A 37 -6.280 -0.943 -11.533 1.00 30.32 O ATOM 604 CB GLU A 37 -4.430 -3.153 -13.010 1.00 4.52 C ATOM 605 CG GLU A 37 -4.490 -4.213 -14.127 1.00 71.52 C ATOM 606 CD GLU A 37 -5.918 -4.507 -14.644 1.00 24.34 C ATOM 607 OE1 GLU A 37 -6.668 -5.256 -13.980 1.00 0.24 O ATOM 608 OE2 GLU A 37 -6.292 -3.993 -15.723 1.00 54.05 O ATOM 0 H GLU A 37 -3.290 -1.551 -14.604 1.00 65.11 H new ATOM 0 HA GLU A 37 -5.990 -1.934 -13.863 1.00 72.02 H new ATOM 0 HB2 GLU A 37 -3.391 -3.021 -12.708 1.00 4.52 H new ATOM 0 HB3 GLU A 37 -4.969 -3.529 -12.141 1.00 4.52 H new ATOM 0 HG2 GLU A 37 -3.874 -3.880 -14.962 1.00 71.52 H new ATOM 0 HG3 GLU A 37 -4.051 -5.140 -13.757 1.00 71.52 H new ATOM 615 N LEU A 38 -4.173 -0.108 -11.792 1.00 12.04 N ATOM 616 CA LEU A 38 -4.258 0.795 -10.638 1.00 2.44 C ATOM 617 C LEU A 38 -5.314 1.890 -10.889 1.00 41.33 C ATOM 618 O LEU A 38 -6.211 2.058 -10.074 1.00 14.35 O ATOM 619 CB LEU A 38 -2.855 1.374 -10.241 1.00 24.14 C ATOM 620 CG LEU A 38 -2.139 2.412 -11.192 1.00 1.32 C ATOM 621 CD1 LEU A 38 -2.505 3.880 -10.861 1.00 45.45 C ATOM 622 CD2 LEU A 38 -0.607 2.239 -11.170 1.00 43.10 C ATOM 0 H LEU A 38 -3.280 -0.081 -12.284 1.00 12.04 H new ATOM 0 HA LEU A 38 -4.590 0.219 -9.774 1.00 2.44 H new ATOM 0 HB2 LEU A 38 -2.962 1.847 -9.265 1.00 24.14 H new ATOM 0 HB3 LEU A 38 -2.178 0.529 -10.113 1.00 24.14 H new ATOM 0 HG LEU A 38 -2.506 2.196 -12.195 1.00 1.32 H new ATOM 0 HD11 LEU A 38 -1.984 4.548 -11.546 1.00 45.45 H new ATOM 0 HD12 LEU A 38 -3.581 4.019 -10.966 1.00 45.45 H new ATOM 0 HD13 LEU A 38 -2.208 4.107 -9.837 1.00 45.45 H new ATOM 0 HD21 LEU A 38 -0.149 2.970 -11.836 1.00 43.10 H new ATOM 0 HD22 LEU A 38 -0.238 2.391 -10.156 1.00 43.10 H new ATOM 0 HD23 LEU A 38 -0.350 1.233 -11.503 1.00 43.10 H new ATOM 634 N LYS A 39 -5.257 2.558 -12.072 1.00 1.52 N ATOM 635 CA LYS A 39 -6.102 3.746 -12.352 1.00 42.44 C ATOM 636 C LYS A 39 -7.587 3.363 -12.505 1.00 11.22 C ATOM 637 O LYS A 39 -8.467 4.175 -12.213 1.00 64.31 O ATOM 638 CB LYS A 39 -5.600 4.539 -13.591 1.00 43.23 C ATOM 639 CG LYS A 39 -5.684 3.791 -14.943 1.00 2.13 C ATOM 640 CD LYS A 39 -5.328 4.676 -16.166 1.00 42.12 C ATOM 641 CE LYS A 39 -3.894 5.238 -16.127 1.00 24.41 C ATOM 642 NZ LYS A 39 -2.875 4.158 -16.131 1.00 12.22 N ATOM 0 H LYS A 39 -4.639 2.295 -12.840 1.00 1.52 H new ATOM 0 HA LYS A 39 -6.015 4.404 -11.487 1.00 42.44 H new ATOM 0 HB2 LYS A 39 -6.178 5.460 -13.669 1.00 43.23 H new ATOM 0 HB3 LYS A 39 -4.563 4.827 -13.420 1.00 43.23 H new ATOM 0 HG2 LYS A 39 -5.011 2.934 -14.917 1.00 2.13 H new ATOM 0 HG3 LYS A 39 -6.693 3.400 -15.070 1.00 2.13 H new ATOM 0 HD2 LYS A 39 -5.455 4.090 -17.076 1.00 42.12 H new ATOM 0 HD3 LYS A 39 -6.033 5.506 -16.220 1.00 42.12 H new ATOM 0 HE2 LYS A 39 -3.736 5.889 -16.987 1.00 24.41 H new ATOM 0 HE3 LYS A 39 -3.769 5.852 -15.235 1.00 24.41 H new ATOM 0 HZ1 LYS A 39 -1.926 4.576 -16.207 1.00 12.22 H new ATOM 0 HZ2 LYS A 39 -2.944 3.613 -15.248 1.00 12.22 H new ATOM 0 HZ3 LYS A 39 -3.041 3.527 -16.941 1.00 12.22 H new ATOM 656 N LYS A 40 -7.842 2.120 -12.952 1.00 31.21 N ATOM 657 CA LYS A 40 -9.194 1.540 -13.016 1.00 71.42 C ATOM 658 C LYS A 40 -9.781 1.393 -11.597 1.00 20.24 C ATOM 659 O LYS A 40 -10.952 1.715 -11.365 1.00 64.34 O ATOM 660 CB LYS A 40 -9.136 0.172 -13.743 1.00 12.31 C ATOM 661 CG LYS A 40 -8.747 0.267 -15.242 1.00 70.44 C ATOM 662 CD LYS A 40 -8.370 -1.102 -15.871 1.00 41.33 C ATOM 663 CE LYS A 40 -9.509 -2.134 -15.840 1.00 5.33 C ATOM 664 NZ LYS A 40 -9.084 -3.446 -16.408 1.00 72.22 N ATOM 0 H LYS A 40 -7.112 1.488 -13.280 1.00 31.21 H new ATOM 0 HA LYS A 40 -9.849 2.205 -13.579 1.00 71.42 H new ATOM 0 HB2 LYS A 40 -8.417 -0.469 -13.232 1.00 12.31 H new ATOM 0 HB3 LYS A 40 -10.109 -0.312 -13.661 1.00 12.31 H new ATOM 0 HG2 LYS A 40 -9.579 0.697 -15.799 1.00 70.44 H new ATOM 0 HG3 LYS A 40 -7.905 0.951 -15.348 1.00 70.44 H new ATOM 0 HD2 LYS A 40 -8.063 -0.944 -16.905 1.00 41.33 H new ATOM 0 HD3 LYS A 40 -7.509 -1.509 -15.342 1.00 41.33 H new ATOM 0 HE2 LYS A 40 -9.844 -2.274 -14.812 1.00 5.33 H new ATOM 0 HE3 LYS A 40 -10.360 -1.753 -16.404 1.00 5.33 H new ATOM 0 HZ1 LYS A 40 -9.695 -4.200 -16.035 1.00 72.22 H new ATOM 0 HZ2 LYS A 40 -9.163 -3.417 -17.445 1.00 72.22 H new ATOM 0 HZ3 LYS A 40 -8.097 -3.637 -16.141 1.00 72.22 H new ATOM 678 N GLU A 41 -8.938 0.933 -10.651 1.00 34.00 N ATOM 679 CA GLU A 41 -9.337 0.763 -9.242 1.00 32.01 C ATOM 680 C GLU A 41 -9.400 2.100 -8.487 1.00 54.13 C ATOM 681 O GLU A 41 -10.142 2.214 -7.514 1.00 25.32 O ATOM 682 CB GLU A 41 -8.408 -0.247 -8.527 1.00 21.43 C ATOM 683 CG GLU A 41 -8.550 -1.689 -9.052 1.00 4.45 C ATOM 684 CD GLU A 41 -9.999 -2.234 -8.971 1.00 24.32 C ATOM 685 OE1 GLU A 41 -10.502 -2.470 -7.847 1.00 12.41 O ATOM 686 OE2 GLU A 41 -10.650 -2.424 -10.026 1.00 62.21 O ATOM 0 H GLU A 41 -7.971 0.671 -10.841 1.00 34.00 H new ATOM 0 HA GLU A 41 -10.349 0.358 -9.239 1.00 32.01 H new ATOM 0 HB2 GLU A 41 -7.374 0.075 -8.647 1.00 21.43 H new ATOM 0 HB3 GLU A 41 -8.624 -0.234 -7.459 1.00 21.43 H new ATOM 0 HG2 GLU A 41 -8.214 -1.725 -10.088 1.00 4.45 H new ATOM 0 HG3 GLU A 41 -7.891 -2.343 -8.480 1.00 4.45 H new ATOM 693 N MET A 42 -8.634 3.109 -8.946 1.00 63.30 N ATOM 694 CA MET A 42 -8.710 4.481 -8.388 1.00 5.24 C ATOM 695 C MET A 42 -10.087 5.111 -8.703 1.00 52.45 C ATOM 696 O MET A 42 -10.602 5.924 -7.925 1.00 60.22 O ATOM 697 CB MET A 42 -7.567 5.388 -8.921 1.00 1.22 C ATOM 698 CG MET A 42 -6.147 4.822 -8.735 1.00 34.42 C ATOM 699 SD MET A 42 -5.806 4.228 -7.070 1.00 31.32 S ATOM 700 CE MET A 42 -5.801 5.751 -6.143 1.00 25.33 C ATOM 0 H MET A 42 -7.955 3.004 -9.700 1.00 63.30 H new ATOM 0 HA MET A 42 -8.589 4.404 -7.307 1.00 5.24 H new ATOM 0 HB2 MET A 42 -7.733 5.570 -9.983 1.00 1.22 H new ATOM 0 HB3 MET A 42 -7.626 6.354 -8.419 1.00 1.22 H new ATOM 0 HG2 MET A 42 -5.999 4.003 -9.439 1.00 34.42 H new ATOM 0 HG3 MET A 42 -5.423 5.596 -8.989 1.00 34.42 H new ATOM 0 HE1 MET A 42 -5.994 5.538 -5.092 1.00 25.33 H new ATOM 0 HE2 MET A 42 -4.829 6.234 -6.243 1.00 25.33 H new ATOM 0 HE3 MET A 42 -6.577 6.413 -6.527 1.00 25.33 H new ATOM 710 N LYS A 43 -10.665 4.717 -9.857 1.00 12.00 N ATOM 711 CA LYS A 43 -12.031 5.101 -10.251 1.00 41.33 C ATOM 712 C LYS A 43 -13.068 4.429 -9.326 1.00 74.24 C ATOM 713 O LYS A 43 -14.034 5.063 -8.903 1.00 4.35 O ATOM 714 CB LYS A 43 -12.310 4.700 -11.718 1.00 63.24 C ATOM 715 CG LYS A 43 -11.421 5.395 -12.776 1.00 43.11 C ATOM 716 CD LYS A 43 -11.820 4.999 -14.221 1.00 4.24 C ATOM 717 CE LYS A 43 -13.252 5.440 -14.581 1.00 3.31 C ATOM 718 NZ LYS A 43 -13.669 4.971 -15.925 1.00 1.14 N ATOM 0 H LYS A 43 -10.195 4.123 -10.540 1.00 12.00 H new ATOM 0 HA LYS A 43 -12.116 6.184 -10.158 1.00 41.33 H new ATOM 0 HB2 LYS A 43 -12.183 3.622 -11.813 1.00 63.24 H new ATOM 0 HB3 LYS A 43 -13.354 4.919 -11.945 1.00 63.24 H new ATOM 0 HG2 LYS A 43 -11.499 6.476 -12.662 1.00 43.11 H new ATOM 0 HG3 LYS A 43 -10.378 5.131 -12.603 1.00 43.11 H new ATOM 0 HD2 LYS A 43 -11.118 5.447 -14.924 1.00 4.24 H new ATOM 0 HD3 LYS A 43 -11.737 3.918 -14.334 1.00 4.24 H new ATOM 0 HE2 LYS A 43 -13.946 5.055 -13.834 1.00 3.31 H new ATOM 0 HE3 LYS A 43 -13.314 6.528 -14.544 1.00 3.31 H new ATOM 0 HZ1 LYS A 43 -14.638 5.293 -16.120 1.00 1.14 H new ATOM 0 HZ2 LYS A 43 -13.024 5.359 -16.643 1.00 1.14 H new ATOM 0 HZ3 LYS A 43 -13.637 3.932 -15.956 1.00 1.14 H new ATOM 732 N LYS A 44 -12.827 3.136 -9.019 1.00 44.00 N ATOM 733 CA LYS A 44 -13.694 2.319 -8.139 1.00 43.33 C ATOM 734 C LYS A 44 -13.817 2.944 -6.733 1.00 61.25 C ATOM 735 O LYS A 44 -14.871 2.859 -6.099 1.00 63.32 O ATOM 736 CB LYS A 44 -13.112 0.883 -8.031 1.00 50.21 C ATOM 737 CG LYS A 44 -12.996 0.129 -9.386 1.00 75.43 C ATOM 738 CD LYS A 44 -14.269 -0.640 -9.795 1.00 23.30 C ATOM 739 CE LYS A 44 -14.519 -1.866 -8.903 1.00 30.05 C ATOM 740 NZ LYS A 44 -13.357 -2.808 -8.905 1.00 71.44 N ATOM 0 H LYS A 44 -12.020 2.625 -9.377 1.00 44.00 H new ATOM 0 HA LYS A 44 -14.692 2.283 -8.577 1.00 43.33 H new ATOM 0 HB2 LYS A 44 -12.123 0.939 -7.575 1.00 50.21 H new ATOM 0 HB3 LYS A 44 -13.741 0.300 -7.358 1.00 50.21 H new ATOM 0 HG2 LYS A 44 -12.752 0.848 -10.169 1.00 75.43 H new ATOM 0 HG3 LYS A 44 -12.164 -0.573 -9.328 1.00 75.43 H new ATOM 0 HD2 LYS A 44 -15.128 0.028 -9.740 1.00 23.30 H new ATOM 0 HD3 LYS A 44 -14.180 -0.960 -10.833 1.00 23.30 H new ATOM 0 HE2 LYS A 44 -14.717 -1.537 -7.883 1.00 30.05 H new ATOM 0 HE3 LYS A 44 -15.411 -2.390 -9.248 1.00 30.05 H new ATOM 0 HZ1 LYS A 44 -13.700 -3.782 -9.028 1.00 71.44 H new ATOM 0 HZ2 LYS A 44 -12.715 -2.566 -9.686 1.00 71.44 H new ATOM 0 HZ3 LYS A 44 -12.847 -2.732 -8.002 1.00 71.44 H new ATOM 754 N LEU A 45 -12.708 3.555 -6.266 1.00 73.35 N ATOM 755 CA LEU A 45 -12.648 4.259 -4.972 1.00 2.22 C ATOM 756 C LEU A 45 -13.643 5.430 -4.939 1.00 4.43 C ATOM 757 O LEU A 45 -14.404 5.577 -3.982 1.00 21.23 O ATOM 758 CB LEU A 45 -11.220 4.799 -4.714 1.00 30.41 C ATOM 759 CG LEU A 45 -10.062 3.769 -4.761 1.00 73.33 C ATOM 760 CD1 LEU A 45 -8.711 4.452 -4.514 1.00 45.20 C ATOM 761 CD2 LEU A 45 -10.293 2.600 -3.788 1.00 2.51 C ATOM 0 H LEU A 45 -11.827 3.573 -6.779 1.00 73.35 H new ATOM 0 HA LEU A 45 -12.913 3.544 -4.193 1.00 2.22 H new ATOM 0 HB2 LEU A 45 -11.013 5.576 -5.450 1.00 30.41 H new ATOM 0 HB3 LEU A 45 -11.210 5.277 -3.734 1.00 30.41 H new ATOM 0 HG LEU A 45 -10.042 3.343 -5.764 1.00 73.33 H new ATOM 0 HD11 LEU A 45 -7.915 3.708 -4.552 1.00 45.20 H new ATOM 0 HD12 LEU A 45 -8.539 5.207 -5.281 1.00 45.20 H new ATOM 0 HD13 LEU A 45 -8.717 4.927 -3.533 1.00 45.20 H new ATOM 0 HD21 LEU A 45 -9.458 1.902 -3.853 1.00 2.51 H new ATOM 0 HD22 LEU A 45 -10.367 2.983 -2.770 1.00 2.51 H new ATOM 0 HD23 LEU A 45 -11.217 2.085 -4.050 1.00 2.51 H new ATOM 773 N ALA A 46 -13.603 6.255 -6.006 1.00 63.35 N ATOM 774 CA ALA A 46 -14.420 7.473 -6.119 1.00 1.50 C ATOM 775 C ALA A 46 -15.912 7.137 -6.297 1.00 13.22 C ATOM 776 O ALA A 46 -16.750 7.571 -5.493 1.00 63.30 O ATOM 777 CB ALA A 46 -13.918 8.343 -7.280 1.00 22.45 C ATOM 0 H ALA A 46 -13.001 6.092 -6.813 1.00 63.35 H new ATOM 0 HA ALA A 46 -14.319 8.034 -5.190 1.00 1.50 H new ATOM 0 HB1 ALA A 46 -14.531 9.241 -7.353 1.00 22.45 H new ATOM 0 HB2 ALA A 46 -12.880 8.625 -7.101 1.00 22.45 H new ATOM 0 HB3 ALA A 46 -13.986 7.781 -8.211 1.00 22.45 H new ATOM 783 N GLU A 47 -16.208 6.336 -7.343 1.00 42.33 N ATOM 784 CA GLU A 47 -17.582 6.004 -7.775 1.00 43.53 C ATOM 785 C GLU A 47 -18.366 5.283 -6.666 1.00 33.44 C ATOM 786 O GLU A 47 -19.495 5.675 -6.327 1.00 51.02 O ATOM 787 CB GLU A 47 -17.538 5.145 -9.069 1.00 71.05 C ATOM 788 CG GLU A 47 -16.948 5.872 -10.302 1.00 4.34 C ATOM 789 CD GLU A 47 -16.907 4.999 -11.569 1.00 21.03 C ATOM 790 OE1 GLU A 47 -17.937 4.367 -11.898 1.00 44.33 O ATOM 791 OE2 GLU A 47 -15.850 4.929 -12.233 1.00 2.35 O ATOM 0 H GLU A 47 -15.490 5.896 -7.918 1.00 42.33 H new ATOM 0 HA GLU A 47 -18.106 6.936 -7.986 1.00 43.53 H new ATOM 0 HB2 GLU A 47 -16.949 4.249 -8.875 1.00 71.05 H new ATOM 0 HB3 GLU A 47 -18.550 4.816 -9.306 1.00 71.05 H new ATOM 0 HG2 GLU A 47 -17.540 6.765 -10.505 1.00 4.34 H new ATOM 0 HG3 GLU A 47 -15.937 6.206 -10.068 1.00 4.34 H new ATOM 798 N GLU A 48 -17.761 4.231 -6.109 1.00 54.34 N ATOM 799 CA GLU A 48 -18.309 3.534 -4.945 1.00 24.13 C ATOM 800 C GLU A 48 -17.886 4.311 -3.684 1.00 60.34 C ATOM 801 O GLU A 48 -16.736 4.224 -3.249 1.00 44.24 O ATOM 802 CB GLU A 48 -17.798 2.075 -4.905 1.00 20.32 C ATOM 803 CG GLU A 48 -18.110 1.233 -6.158 1.00 11.44 C ATOM 804 CD GLU A 48 -19.615 0.992 -6.380 1.00 72.24 C ATOM 805 OE1 GLU A 48 -20.258 0.368 -5.506 1.00 34.15 O ATOM 806 OE2 GLU A 48 -20.157 1.391 -7.431 1.00 44.33 O ATOM 0 H GLU A 48 -16.883 3.841 -6.450 1.00 54.34 H new ATOM 0 HA GLU A 48 -19.397 3.493 -4.999 1.00 24.13 H new ATOM 0 HB2 GLU A 48 -16.718 2.090 -4.757 1.00 20.32 H new ATOM 0 HB3 GLU A 48 -18.232 1.579 -4.037 1.00 20.32 H new ATOM 0 HG2 GLU A 48 -17.698 1.734 -7.034 1.00 11.44 H new ATOM 0 HG3 GLU A 48 -17.605 0.271 -6.074 1.00 11.44 H new ATOM 813 N LYS A 49 -18.803 5.121 -3.141 1.00 63.14 N ATOM 814 CA LYS A 49 -18.506 5.993 -1.990 1.00 2.41 C ATOM 815 C LYS A 49 -18.536 5.183 -0.680 1.00 43.02 C ATOM 816 O LYS A 49 -17.541 5.147 0.060 1.00 74.32 O ATOM 817 CB LYS A 49 -19.503 7.182 -1.927 1.00 71.43 C ATOM 818 CG LYS A 49 -19.638 7.982 -3.247 1.00 44.52 C ATOM 819 CD LYS A 49 -20.445 9.296 -3.098 1.00 24.11 C ATOM 820 CE LYS A 49 -21.849 9.102 -2.490 1.00 54.04 C ATOM 821 NZ LYS A 49 -22.717 8.222 -3.322 1.00 14.45 N ATOM 0 H LYS A 49 -19.762 5.193 -3.480 1.00 63.14 H new ATOM 0 HA LYS A 49 -17.504 6.402 -2.118 1.00 2.41 H new ATOM 0 HB2 LYS A 49 -20.485 6.801 -1.647 1.00 71.43 H new ATOM 0 HB3 LYS A 49 -19.187 7.862 -1.136 1.00 71.43 H new ATOM 0 HG2 LYS A 49 -18.642 8.218 -3.622 1.00 44.52 H new ATOM 0 HG3 LYS A 49 -20.120 7.353 -3.995 1.00 44.52 H new ATOM 0 HD2 LYS A 49 -19.881 9.988 -2.472 1.00 24.11 H new ATOM 0 HD3 LYS A 49 -20.546 9.762 -4.078 1.00 24.11 H new ATOM 0 HE2 LYS A 49 -21.753 8.673 -1.493 1.00 54.04 H new ATOM 0 HE3 LYS A 49 -22.328 10.074 -2.374 1.00 54.04 H new ATOM 0 HZ1 LYS A 49 -23.648 8.125 -2.869 1.00 14.45 H new ATOM 0 HZ2 LYS A 49 -22.833 8.642 -4.266 1.00 14.45 H new ATOM 0 HZ3 LYS A 49 -22.276 7.284 -3.412 1.00 14.45 H new ATOM 835 N ASN A 50 -19.677 4.522 -0.409 1.00 2.41 N ATOM 836 CA ASN A 50 -19.885 3.755 0.840 1.00 40.42 C ATOM 837 C ASN A 50 -19.495 2.278 0.642 1.00 53.02 C ATOM 838 O ASN A 50 -20.309 1.468 0.179 1.00 24.24 O ATOM 839 CB ASN A 50 -21.366 3.876 1.322 1.00 50.21 C ATOM 840 CG ASN A 50 -21.617 3.392 2.767 1.00 65.21 C ATOM 841 OD1 ASN A 50 -20.901 2.543 3.306 1.00 65.33 O ATOM 842 ND2 ASN A 50 -22.658 3.922 3.396 1.00 5.45 N ATOM 0 H ASN A 50 -20.477 4.502 -1.042 1.00 2.41 H new ATOM 0 HA ASN A 50 -19.241 4.177 1.611 1.00 40.42 H new ATOM 0 HB2 ASN A 50 -21.675 4.918 1.244 1.00 50.21 H new ATOM 0 HB3 ASN A 50 -22.001 3.304 0.646 1.00 50.21 H new ATOM 0 HD21 ASN A 50 -22.882 3.630 4.347 1.00 5.45 H new ATOM 0 HD22 ASN A 50 -23.234 4.622 2.928 1.00 5.45 H new ATOM 849 N PHE A 51 -18.229 1.960 0.929 1.00 31.22 N ATOM 850 CA PHE A 51 -17.759 0.575 1.121 1.00 54.13 C ATOM 851 C PHE A 51 -16.442 0.584 1.903 1.00 22.12 C ATOM 852 O PHE A 51 -15.778 1.634 2.002 1.00 44.11 O ATOM 853 CB PHE A 51 -17.666 -0.249 -0.210 1.00 31.40 C ATOM 854 CG PHE A 51 -16.605 0.134 -1.259 1.00 3.31 C ATOM 855 CD1 PHE A 51 -16.166 1.440 -1.447 1.00 53.21 C ATOM 856 CD2 PHE A 51 -16.085 -0.853 -2.103 1.00 15.00 C ATOM 857 CE1 PHE A 51 -15.242 1.742 -2.434 1.00 45.13 C ATOM 858 CE2 PHE A 51 -15.160 -0.546 -3.084 1.00 51.42 C ATOM 859 CZ PHE A 51 -14.742 0.752 -3.250 1.00 5.43 C ATOM 0 H PHE A 51 -17.493 2.658 1.036 1.00 31.22 H new ATOM 0 HA PHE A 51 -18.512 0.049 1.708 1.00 54.13 H new ATOM 0 HB2 PHE A 51 -17.498 -1.291 0.061 1.00 31.40 H new ATOM 0 HB3 PHE A 51 -18.641 -0.199 -0.696 1.00 31.40 H new ATOM 0 HD1 PHE A 51 -16.550 2.228 -0.816 1.00 53.21 H new ATOM 0 HD2 PHE A 51 -16.413 -1.875 -1.986 1.00 15.00 H new ATOM 0 HE1 PHE A 51 -14.911 2.762 -2.564 1.00 45.13 H new ATOM 0 HE2 PHE A 51 -14.767 -1.326 -3.719 1.00 51.42 H new ATOM 0 HZ PHE A 51 -14.023 0.995 -4.018 1.00 5.43 H new ATOM 869 N GLU A 52 -16.098 -0.579 2.493 1.00 1.30 N ATOM 870 CA GLU A 52 -14.932 -0.728 3.380 1.00 20.44 C ATOM 871 C GLU A 52 -13.631 -0.295 2.670 1.00 55.32 C ATOM 872 O GLU A 52 -13.405 -0.650 1.505 1.00 60.40 O ATOM 873 CB GLU A 52 -14.796 -2.183 3.944 1.00 12.31 C ATOM 874 CG GLU A 52 -14.607 -3.326 2.905 1.00 74.34 C ATOM 875 CD GLU A 52 -15.886 -3.687 2.126 1.00 63.54 C ATOM 876 OE1 GLU A 52 -16.698 -4.484 2.645 1.00 41.14 O ATOM 877 OE2 GLU A 52 -16.105 -3.158 1.017 1.00 63.30 O ATOM 0 H GLU A 52 -16.625 -1.443 2.365 1.00 1.30 H new ATOM 0 HA GLU A 52 -15.098 -0.066 4.230 1.00 20.44 H new ATOM 0 HB2 GLU A 52 -13.948 -2.203 4.629 1.00 12.31 H new ATOM 0 HB3 GLU A 52 -15.687 -2.403 4.533 1.00 12.31 H new ATOM 0 HG2 GLU A 52 -13.833 -3.033 2.196 1.00 74.34 H new ATOM 0 HG3 GLU A 52 -14.246 -4.215 3.421 1.00 74.34 H new ATOM 884 N LYS A 53 -12.818 0.502 3.388 1.00 64.50 N ATOM 885 CA LYS A 53 -11.570 1.091 2.870 1.00 4.24 C ATOM 886 C LYS A 53 -10.611 0.003 2.342 1.00 23.45 C ATOM 887 O LYS A 53 -10.414 -1.042 2.976 1.00 42.32 O ATOM 888 CB LYS A 53 -10.927 1.984 3.960 1.00 53.13 C ATOM 889 CG LYS A 53 -10.641 1.278 5.302 1.00 61.13 C ATOM 890 CD LYS A 53 -10.315 2.278 6.433 1.00 44.21 C ATOM 891 CE LYS A 53 -10.213 1.609 7.808 1.00 40.53 C ATOM 892 NZ LYS A 53 -10.080 2.600 8.905 1.00 5.52 N ATOM 0 H LYS A 53 -13.012 0.758 4.356 1.00 64.50 H new ATOM 0 HA LYS A 53 -11.798 1.725 2.013 1.00 4.24 H new ATOM 0 HB2 LYS A 53 -9.991 2.386 3.572 1.00 53.13 H new ATOM 0 HB3 LYS A 53 -11.585 2.833 4.147 1.00 53.13 H new ATOM 0 HG2 LYS A 53 -11.507 0.680 5.587 1.00 61.13 H new ATOM 0 HG3 LYS A 53 -9.805 0.589 5.177 1.00 61.13 H new ATOM 0 HD2 LYS A 53 -9.374 2.780 6.208 1.00 44.21 H new ATOM 0 HD3 LYS A 53 -11.087 3.047 6.465 1.00 44.21 H new ATOM 0 HE2 LYS A 53 -11.099 0.997 7.979 1.00 40.53 H new ATOM 0 HE3 LYS A 53 -9.354 0.938 7.821 1.00 40.53 H new ATOM 0 HZ1 LYS A 53 -9.421 2.237 9.623 1.00 5.52 H new ATOM 0 HZ2 LYS A 53 -9.716 3.495 8.522 1.00 5.52 H new ATOM 0 HZ3 LYS A 53 -11.010 2.763 9.340 1.00 5.52 H new ATOM 906 N ILE A 54 -10.039 0.271 1.163 1.00 64.11 N ATOM 907 CA ILE A 54 -9.442 -0.754 0.296 1.00 62.43 C ATOM 908 C ILE A 54 -7.926 -0.826 0.531 1.00 64.21 C ATOM 909 O ILE A 54 -7.232 0.200 0.549 1.00 2.51 O ATOM 910 CB ILE A 54 -9.740 -0.489 -1.240 1.00 0.35 C ATOM 911 CG1 ILE A 54 -11.282 -0.439 -1.545 1.00 21.12 C ATOM 912 CG2 ILE A 54 -9.059 -1.553 -2.138 1.00 25.51 C ATOM 913 CD1 ILE A 54 -12.008 0.797 -1.044 1.00 34.12 C ATOM 0 H ILE A 54 -9.976 1.214 0.779 1.00 64.11 H new ATOM 0 HA ILE A 54 -9.900 -1.708 0.558 1.00 62.43 H new ATOM 0 HB ILE A 54 -9.319 0.489 -1.472 1.00 0.35 H new ATOM 0 HG12 ILE A 54 -11.424 -0.510 -2.623 1.00 21.12 H new ATOM 0 HG13 ILE A 54 -11.751 -1.318 -1.103 1.00 21.12 H new ATOM 0 HG21 ILE A 54 -9.283 -1.343 -3.184 1.00 25.51 H new ATOM 0 HG22 ILE A 54 -7.980 -1.522 -1.984 1.00 25.51 H new ATOM 0 HG23 ILE A 54 -9.435 -2.543 -1.878 1.00 25.51 H new ATOM 0 HD11 ILE A 54 -13.064 0.730 -1.307 1.00 34.12 H new ATOM 0 HD12 ILE A 54 -11.907 0.864 0.039 1.00 34.12 H new ATOM 0 HD13 ILE A 54 -11.575 1.685 -1.505 1.00 34.12 H new ATOM 925 N LEU A 55 -7.436 -2.052 0.731 1.00 32.44 N ATOM 926 CA LEU A 55 -6.016 -2.343 0.860 1.00 4.53 C ATOM 927 C LEU A 55 -5.438 -2.666 -0.532 1.00 65.31 C ATOM 928 O LEU A 55 -5.807 -3.662 -1.161 1.00 51.24 O ATOM 929 CB LEU A 55 -5.811 -3.510 1.861 1.00 60.03 C ATOM 930 CG LEU A 55 -4.314 -3.893 2.174 1.00 15.20 C ATOM 931 CD1 LEU A 55 -4.077 -4.073 3.687 1.00 31.14 C ATOM 932 CD2 LEU A 55 -3.866 -5.152 1.390 1.00 15.34 C ATOM 0 H LEU A 55 -8.028 -2.879 0.808 1.00 32.44 H new ATOM 0 HA LEU A 55 -5.483 -1.477 1.254 1.00 4.53 H new ATOM 0 HB2 LEU A 55 -6.303 -3.250 2.798 1.00 60.03 H new ATOM 0 HB3 LEU A 55 -6.317 -4.392 1.469 1.00 60.03 H new ATOM 0 HG LEU A 55 -3.698 -3.059 1.838 1.00 15.20 H new ATOM 0 HD11 LEU A 55 -3.034 -4.336 3.863 1.00 31.14 H new ATOM 0 HD12 LEU A 55 -4.309 -3.142 4.205 1.00 31.14 H new ATOM 0 HD13 LEU A 55 -4.721 -4.868 4.064 1.00 31.14 H new ATOM 0 HD21 LEU A 55 -2.829 -5.382 1.634 1.00 15.34 H new ATOM 0 HD22 LEU A 55 -4.499 -5.996 1.664 1.00 15.34 H new ATOM 0 HD23 LEU A 55 -3.954 -4.965 0.320 1.00 15.34 H new ATOM 944 N ILE A 56 -4.562 -1.794 -1.021 1.00 52.21 N ATOM 945 CA ILE A 56 -3.871 -1.988 -2.297 1.00 54.51 C ATOM 946 C ILE A 56 -2.481 -2.601 -2.015 1.00 73.54 C ATOM 947 O ILE A 56 -1.812 -2.226 -1.058 1.00 43.41 O ATOM 948 CB ILE A 56 -3.697 -0.618 -3.065 1.00 33.11 C ATOM 949 CG1 ILE A 56 -5.055 0.154 -3.213 1.00 20.24 C ATOM 950 CG2 ILE A 56 -3.046 -0.828 -4.457 1.00 11.43 C ATOM 951 CD1 ILE A 56 -6.092 -0.506 -4.109 1.00 20.32 C ATOM 0 H ILE A 56 -4.309 -0.929 -0.544 1.00 52.21 H new ATOM 0 HA ILE A 56 -4.465 -2.653 -2.924 1.00 54.51 H new ATOM 0 HB ILE A 56 -3.030 -0.006 -2.458 1.00 33.11 H new ATOM 0 HG12 ILE A 56 -5.488 0.284 -2.221 1.00 20.24 H new ATOM 0 HG13 ILE A 56 -4.845 1.150 -3.603 1.00 20.24 H new ATOM 0 HG21 ILE A 56 -2.941 0.134 -4.958 1.00 11.43 H new ATOM 0 HG22 ILE A 56 -2.063 -1.282 -4.334 1.00 11.43 H new ATOM 0 HG23 ILE A 56 -3.676 -1.483 -5.058 1.00 11.43 H new ATOM 0 HD11 ILE A 56 -6.990 0.110 -4.141 1.00 20.32 H new ATOM 0 HD12 ILE A 56 -5.688 -0.611 -5.116 1.00 20.32 H new ATOM 0 HD13 ILE A 56 -6.341 -1.491 -3.713 1.00 20.32 H new ATOM 963 N ILE A 57 -2.100 -3.600 -2.811 1.00 33.11 N ATOM 964 CA ILE A 57 -0.720 -4.111 -2.882 1.00 24.44 C ATOM 965 C ILE A 57 -0.182 -3.779 -4.286 1.00 34.41 C ATOM 966 O ILE A 57 -0.957 -3.682 -5.239 1.00 54.33 O ATOM 967 CB ILE A 57 -0.652 -5.671 -2.614 1.00 52.25 C ATOM 968 CG1 ILE A 57 -1.208 -6.019 -1.192 1.00 1.05 C ATOM 969 CG2 ILE A 57 0.787 -6.227 -2.792 1.00 13.24 C ATOM 970 CD1 ILE A 57 -1.169 -7.502 -0.824 1.00 21.13 C ATOM 0 H ILE A 57 -2.744 -4.087 -3.434 1.00 33.11 H new ATOM 0 HA ILE A 57 -0.113 -3.641 -2.108 1.00 24.44 H new ATOM 0 HB ILE A 57 -1.283 -6.154 -3.360 1.00 52.25 H new ATOM 0 HG12 ILE A 57 -0.637 -5.462 -0.450 1.00 1.05 H new ATOM 0 HG13 ILE A 57 -2.239 -5.672 -1.127 1.00 1.05 H new ATOM 0 HG21 ILE A 57 0.789 -7.300 -2.599 1.00 13.24 H new ATOM 0 HG22 ILE A 57 1.125 -6.041 -3.811 1.00 13.24 H new ATOM 0 HG23 ILE A 57 1.458 -5.731 -2.091 1.00 13.24 H new ATOM 0 HD11 ILE A 57 -1.575 -7.639 0.178 1.00 21.13 H new ATOM 0 HD12 ILE A 57 -1.766 -8.070 -1.538 1.00 21.13 H new ATOM 0 HD13 ILE A 57 -0.138 -7.856 -0.849 1.00 21.13 H new ATOM 982 N SER A 58 1.133 -3.561 -4.402 1.00 42.13 N ATOM 983 CA SER A 58 1.810 -3.412 -5.694 1.00 52.31 C ATOM 984 C SER A 58 3.264 -3.872 -5.562 1.00 51.13 C ATOM 985 O SER A 58 3.857 -3.825 -4.479 1.00 11.20 O ATOM 986 CB SER A 58 1.748 -1.961 -6.211 1.00 34.13 C ATOM 987 OG SER A 58 2.343 -1.840 -7.494 1.00 55.13 O ATOM 0 H SER A 58 1.759 -3.483 -3.600 1.00 42.13 H new ATOM 0 HA SER A 58 1.293 -4.035 -6.424 1.00 52.31 H new ATOM 0 HB2 SER A 58 0.709 -1.635 -6.258 1.00 34.13 H new ATOM 0 HB3 SER A 58 2.258 -1.301 -5.509 1.00 34.13 H new ATOM 0 HG SER A 58 1.676 -1.514 -8.134 1.00 55.13 H new ATOM 993 N ASN A 59 3.832 -4.295 -6.688 1.00 10.22 N ATOM 994 CA ASN A 59 5.174 -4.899 -6.748 1.00 3.53 C ATOM 995 C ASN A 59 6.249 -3.834 -6.987 1.00 42.05 C ATOM 996 O ASN A 59 7.426 -4.049 -6.670 1.00 31.23 O ATOM 997 CB ASN A 59 5.196 -5.951 -7.884 1.00 44.12 C ATOM 998 CG ASN A 59 4.157 -7.061 -7.687 1.00 33.02 C ATOM 999 OD1 ASN A 59 3.852 -7.462 -6.558 1.00 0.13 O ATOM 1000 ND2 ASN A 59 3.602 -7.565 -8.775 1.00 55.22 N ATOM 0 H ASN A 59 3.375 -4.231 -7.598 1.00 10.22 H new ATOM 0 HA ASN A 59 5.393 -5.378 -5.794 1.00 3.53 H new ATOM 0 HB2 ASN A 59 5.013 -5.454 -8.837 1.00 44.12 H new ATOM 0 HB3 ASN A 59 6.189 -6.396 -7.942 1.00 44.12 H new ATOM 0 HD21 ASN A 59 2.903 -8.304 -8.696 1.00 55.22 H new ATOM 0 HD22 ASN A 59 3.872 -7.215 -9.694 1.00 55.22 H new ATOM 1007 N ASP A 60 5.834 -2.667 -7.505 1.00 41.24 N ATOM 1008 CA ASP A 60 6.765 -1.666 -8.052 1.00 55.12 C ATOM 1009 C ASP A 60 6.425 -0.250 -7.554 1.00 14.51 C ATOM 1010 O ASP A 60 5.250 0.099 -7.388 1.00 65.41 O ATOM 1011 CB ASP A 60 6.732 -1.747 -9.598 1.00 35.14 C ATOM 1012 CG ASP A 60 7.798 -0.880 -10.282 1.00 13.44 C ATOM 1013 OD1 ASP A 60 8.966 -1.316 -10.378 1.00 24.12 O ATOM 1014 OD2 ASP A 60 7.480 0.241 -10.715 1.00 61.14 O ATOM 0 H ASP A 60 4.853 -2.392 -7.557 1.00 41.24 H new ATOM 0 HA ASP A 60 7.774 -1.883 -7.702 1.00 55.12 H new ATOM 0 HB2 ASP A 60 6.870 -2.785 -9.902 1.00 35.14 H new ATOM 0 HB3 ASP A 60 5.747 -1.440 -9.949 1.00 35.14 H new ATOM 1019 N LYS A 61 7.484 0.557 -7.359 1.00 3.11 N ATOM 1020 CA LYS A 61 7.413 1.902 -6.753 1.00 41.43 C ATOM 1021 C LYS A 61 6.732 2.923 -7.676 1.00 13.31 C ATOM 1022 O LYS A 61 6.037 3.825 -7.198 1.00 23.40 O ATOM 1023 CB LYS A 61 8.842 2.382 -6.402 1.00 41.10 C ATOM 1024 CG LYS A 61 9.591 1.465 -5.412 1.00 11.44 C ATOM 1025 CD LYS A 61 11.089 1.815 -5.316 1.00 42.31 C ATOM 1026 CE LYS A 61 11.863 0.854 -4.414 1.00 3.20 C ATOM 1027 NZ LYS A 61 13.326 1.063 -4.534 1.00 22.04 N ATOM 0 H LYS A 61 8.432 0.288 -7.623 1.00 3.11 H new ATOM 0 HA LYS A 61 6.806 1.828 -5.851 1.00 41.43 H new ATOM 0 HB2 LYS A 61 9.424 2.458 -7.321 1.00 41.10 H new ATOM 0 HB3 LYS A 61 8.783 3.384 -5.978 1.00 41.10 H new ATOM 0 HG2 LYS A 61 9.136 1.549 -4.425 1.00 11.44 H new ATOM 0 HG3 LYS A 61 9.481 0.427 -5.726 1.00 11.44 H new ATOM 0 HD2 LYS A 61 11.526 1.801 -6.315 1.00 42.31 H new ATOM 0 HD3 LYS A 61 11.197 2.831 -4.935 1.00 42.31 H new ATOM 0 HE2 LYS A 61 11.557 0.998 -3.378 1.00 3.20 H new ATOM 0 HE3 LYS A 61 11.617 -0.174 -4.679 1.00 3.20 H new ATOM 0 HZ1 LYS A 61 13.782 0.172 -4.818 1.00 22.04 H new ATOM 0 HZ2 LYS A 61 13.515 1.792 -5.251 1.00 22.04 H new ATOM 0 HZ3 LYS A 61 13.709 1.371 -3.618 1.00 22.04 H new ATOM 1041 N GLN A 62 6.948 2.778 -8.997 1.00 42.40 N ATOM 1042 CA GLN A 62 6.374 3.686 -10.006 1.00 11.21 C ATOM 1043 C GLN A 62 4.835 3.595 -10.008 1.00 0.25 C ATOM 1044 O GLN A 62 4.150 4.605 -10.193 1.00 4.33 O ATOM 1045 CB GLN A 62 6.921 3.354 -11.416 1.00 14.41 C ATOM 1046 CG GLN A 62 8.451 3.453 -11.576 1.00 22.44 C ATOM 1047 CD GLN A 62 8.992 4.878 -11.469 1.00 53.15 C ATOM 1048 OE1 GLN A 62 9.361 5.346 -10.394 1.00 32.42 O ATOM 1049 NE2 GLN A 62 9.031 5.579 -12.592 1.00 24.33 N ATOM 0 H GLN A 62 7.522 2.033 -9.392 1.00 42.40 H new ATOM 0 HA GLN A 62 6.666 4.703 -9.746 1.00 11.21 H new ATOM 0 HB2 GLN A 62 6.611 2.342 -11.678 1.00 14.41 H new ATOM 0 HB3 GLN A 62 6.454 4.027 -12.135 1.00 14.41 H new ATOM 0 HG2 GLN A 62 8.927 2.836 -10.814 1.00 22.44 H new ATOM 0 HG3 GLN A 62 8.733 3.039 -12.544 1.00 22.44 H new ATOM 0 HE21 GLN A 62 8.717 5.159 -13.467 1.00 24.33 H new ATOM 0 HE22 GLN A 62 9.375 6.539 -12.582 1.00 24.33 H new ATOM 1058 N LEU A 63 4.313 2.372 -9.777 1.00 41.34 N ATOM 1059 CA LEU A 63 2.864 2.116 -9.724 1.00 4.11 C ATOM 1060 C LEU A 63 2.264 2.803 -8.480 1.00 64.44 C ATOM 1061 O LEU A 63 1.298 3.580 -8.582 1.00 12.42 O ATOM 1062 CB LEU A 63 2.572 0.586 -9.698 1.00 62.42 C ATOM 1063 CG LEU A 63 3.224 -0.269 -10.831 1.00 3.11 C ATOM 1064 CD1 LEU A 63 2.793 -1.749 -10.742 1.00 55.15 C ATOM 1065 CD2 LEU A 63 2.925 0.317 -12.222 1.00 13.25 C ATOM 0 H LEU A 63 4.883 1.540 -9.623 1.00 41.34 H new ATOM 0 HA LEU A 63 2.400 2.529 -10.620 1.00 4.11 H new ATOM 0 HB2 LEU A 63 2.906 0.192 -8.738 1.00 62.42 H new ATOM 0 HB3 LEU A 63 1.492 0.444 -9.743 1.00 62.42 H new ATOM 0 HG LEU A 63 4.303 -0.232 -10.684 1.00 3.11 H new ATOM 0 HD11 LEU A 63 3.265 -2.314 -11.545 1.00 55.15 H new ATOM 0 HD12 LEU A 63 3.100 -2.160 -9.780 1.00 55.15 H new ATOM 0 HD13 LEU A 63 1.709 -1.819 -10.838 1.00 55.15 H new ATOM 0 HD21 LEU A 63 3.394 -0.303 -12.986 1.00 13.25 H new ATOM 0 HD22 LEU A 63 1.847 0.339 -12.383 1.00 13.25 H new ATOM 0 HD23 LEU A 63 3.322 1.330 -12.283 1.00 13.25 H new ATOM 1077 N LEU A 64 2.896 2.517 -7.311 1.00 42.23 N ATOM 1078 CA LEU A 64 2.541 3.107 -6.003 1.00 0.44 C ATOM 1079 C LEU A 64 2.451 4.636 -6.088 1.00 71.35 C ATOM 1080 O LEU A 64 1.482 5.235 -5.629 1.00 43.44 O ATOM 1081 CB LEU A 64 3.616 2.747 -4.943 1.00 23.41 C ATOM 1082 CG LEU A 64 3.797 1.242 -4.608 1.00 51.22 C ATOM 1083 CD1 LEU A 64 5.070 1.019 -3.776 1.00 32.21 C ATOM 1084 CD2 LEU A 64 2.559 0.686 -3.881 1.00 63.12 C ATOM 0 H LEU A 64 3.675 1.861 -7.255 1.00 42.23 H new ATOM 0 HA LEU A 64 1.571 2.701 -5.717 1.00 0.44 H new ATOM 0 HB2 LEU A 64 4.575 3.135 -5.287 1.00 23.41 H new ATOM 0 HB3 LEU A 64 3.372 3.273 -4.020 1.00 23.41 H new ATOM 0 HG LEU A 64 3.906 0.697 -5.546 1.00 51.22 H new ATOM 0 HD11 LEU A 64 5.177 -0.042 -3.552 1.00 32.21 H new ATOM 0 HD12 LEU A 64 5.938 1.361 -4.340 1.00 32.21 H new ATOM 0 HD13 LEU A 64 4.999 1.581 -2.844 1.00 32.21 H new ATOM 0 HD21 LEU A 64 2.712 -0.370 -3.658 1.00 63.12 H new ATOM 0 HD22 LEU A 64 2.406 1.235 -2.952 1.00 63.12 H new ATOM 0 HD23 LEU A 64 1.682 0.799 -4.518 1.00 63.12 H new ATOM 1096 N LYS A 65 3.480 5.225 -6.726 1.00 15.25 N ATOM 1097 CA LYS A 65 3.696 6.668 -6.769 1.00 64.22 C ATOM 1098 C LYS A 65 2.519 7.381 -7.448 1.00 55.42 C ATOM 1099 O LYS A 65 1.990 8.348 -6.906 1.00 13.44 O ATOM 1100 CB LYS A 65 5.024 6.981 -7.508 1.00 54.14 C ATOM 1101 CG LYS A 65 5.510 8.436 -7.353 1.00 70.15 C ATOM 1102 CD LYS A 65 5.818 8.789 -5.883 1.00 21.01 C ATOM 1103 CE LYS A 65 6.248 10.245 -5.703 1.00 11.41 C ATOM 1104 NZ LYS A 65 5.188 11.209 -6.124 1.00 73.45 N ATOM 0 H LYS A 65 4.191 4.696 -7.231 1.00 15.25 H new ATOM 0 HA LYS A 65 3.764 7.039 -5.746 1.00 64.22 H new ATOM 0 HB2 LYS A 65 5.799 6.310 -7.137 1.00 54.14 H new ATOM 0 HB3 LYS A 65 4.896 6.764 -8.569 1.00 54.14 H new ATOM 0 HG2 LYS A 65 6.405 8.586 -7.957 1.00 70.15 H new ATOM 0 HG3 LYS A 65 4.749 9.115 -7.737 1.00 70.15 H new ATOM 0 HD2 LYS A 65 4.934 8.598 -5.275 1.00 21.01 H new ATOM 0 HD3 LYS A 65 6.607 8.133 -5.514 1.00 21.01 H new ATOM 0 HE2 LYS A 65 6.499 10.420 -4.657 1.00 11.41 H new ATOM 0 HE3 LYS A 65 7.153 10.428 -6.283 1.00 11.41 H new ATOM 0 HZ1 LYS A 65 5.256 12.073 -5.548 1.00 73.45 H new ATOM 0 HZ2 LYS A 65 5.317 11.451 -7.127 1.00 73.45 H new ATOM 0 HZ3 LYS A 65 4.252 10.776 -5.990 1.00 73.45 H new ATOM 1118 N GLU A 66 2.112 6.863 -8.628 1.00 51.14 N ATOM 1119 CA GLU A 66 0.969 7.396 -9.394 1.00 3.42 C ATOM 1120 C GLU A 66 -0.326 7.316 -8.578 1.00 72.34 C ATOM 1121 O GLU A 66 -1.126 8.263 -8.586 1.00 35.14 O ATOM 1122 CB GLU A 66 0.802 6.637 -10.729 1.00 63.35 C ATOM 1123 CG GLU A 66 2.031 6.727 -11.650 1.00 74.31 C ATOM 1124 CD GLU A 66 1.844 5.973 -12.970 1.00 14.13 C ATOM 1125 OE1 GLU A 66 1.889 4.727 -12.960 1.00 4.13 O ATOM 1126 OE2 GLU A 66 1.656 6.620 -14.022 1.00 22.25 O ATOM 0 H GLU A 66 2.567 6.066 -9.073 1.00 51.14 H new ATOM 0 HA GLU A 66 1.176 8.444 -9.611 1.00 3.42 H new ATOM 0 HB2 GLU A 66 0.594 5.588 -10.517 1.00 63.35 H new ATOM 0 HB3 GLU A 66 -0.066 7.034 -11.256 1.00 63.35 H new ATOM 0 HG2 GLU A 66 2.243 7.775 -11.863 1.00 74.31 H new ATOM 0 HG3 GLU A 66 2.900 6.326 -11.128 1.00 74.31 H new ATOM 1133 N MET A 67 -0.512 6.181 -7.860 1.00 31.53 N ATOM 1134 CA MET A 67 -1.673 6.002 -6.971 1.00 4.23 C ATOM 1135 C MET A 67 -1.723 7.125 -5.920 1.00 33.22 C ATOM 1136 O MET A 67 -2.768 7.719 -5.749 1.00 14.22 O ATOM 1137 CB MET A 67 -1.659 4.637 -6.240 1.00 5.32 C ATOM 1138 CG MET A 67 -1.601 3.398 -7.125 1.00 3.54 C ATOM 1139 SD MET A 67 -1.540 1.889 -6.134 1.00 13.55 S ATOM 1140 CE MET A 67 -0.603 0.776 -7.168 1.00 60.02 C ATOM 0 H MET A 67 0.125 5.385 -7.883 1.00 31.53 H new ATOM 0 HA MET A 67 -2.557 6.037 -7.608 1.00 4.23 H new ATOM 0 HB2 MET A 67 -0.801 4.618 -5.568 1.00 5.32 H new ATOM 0 HB3 MET A 67 -2.552 4.572 -5.619 1.00 5.32 H new ATOM 0 HG2 MET A 67 -2.474 3.373 -7.777 1.00 3.54 H new ATOM 0 HG3 MET A 67 -0.723 3.449 -7.769 1.00 3.54 H new ATOM 0 HE1 MET A 67 -0.982 -0.239 -7.047 1.00 60.02 H new ATOM 0 HE2 MET A 67 -0.701 1.078 -8.211 1.00 60.02 H new ATOM 0 HE3 MET A 67 0.447 0.808 -6.878 1.00 60.02 H new ATOM 1150 N LEU A 68 -0.570 7.423 -5.263 1.00 64.41 N ATOM 1151 CA LEU A 68 -0.478 8.434 -4.172 1.00 54.50 C ATOM 1152 C LEU A 68 -0.990 9.811 -4.632 1.00 2.12 C ATOM 1153 O LEU A 68 -1.714 10.496 -3.896 1.00 4.23 O ATOM 1154 CB LEU A 68 0.985 8.579 -3.651 1.00 52.54 C ATOM 1155 CG LEU A 68 1.719 7.270 -3.223 1.00 71.23 C ATOM 1156 CD1 LEU A 68 3.102 7.574 -2.628 1.00 20.51 C ATOM 1157 CD2 LEU A 68 0.874 6.414 -2.259 1.00 22.50 C ATOM 0 H LEU A 68 0.320 6.971 -5.473 1.00 64.41 H new ATOM 0 HA LEU A 68 -1.111 8.074 -3.361 1.00 54.50 H new ATOM 0 HB2 LEU A 68 1.576 9.059 -4.431 1.00 52.54 H new ATOM 0 HB3 LEU A 68 0.975 9.256 -2.797 1.00 52.54 H new ATOM 0 HG LEU A 68 1.864 6.680 -4.128 1.00 71.23 H new ATOM 0 HD11 LEU A 68 3.587 6.641 -2.340 1.00 20.51 H new ATOM 0 HD12 LEU A 68 3.713 8.087 -3.371 1.00 20.51 H new ATOM 0 HD13 LEU A 68 2.989 8.210 -1.750 1.00 20.51 H new ATOM 0 HD21 LEU A 68 1.428 5.514 -1.990 1.00 22.50 H new ATOM 0 HD22 LEU A 68 0.656 6.988 -1.359 1.00 22.50 H new ATOM 0 HD23 LEU A 68 -0.060 6.133 -2.745 1.00 22.50 H new ATOM 1169 N GLU A 69 -0.617 10.180 -5.871 1.00 3.54 N ATOM 1170 CA GLU A 69 -1.032 11.445 -6.501 1.00 70.04 C ATOM 1171 C GLU A 69 -2.564 11.453 -6.705 1.00 3.00 C ATOM 1172 O GLU A 69 -3.240 12.455 -6.441 1.00 33.44 O ATOM 1173 CB GLU A 69 -0.311 11.648 -7.872 1.00 25.21 C ATOM 1174 CG GLU A 69 1.189 11.262 -7.917 1.00 0.34 C ATOM 1175 CD GLU A 69 2.055 11.890 -6.807 1.00 34.24 C ATOM 1176 OE1 GLU A 69 2.482 13.054 -6.957 1.00 50.41 O ATOM 1177 OE2 GLU A 69 2.338 11.213 -5.789 1.00 31.34 O ATOM 0 H GLU A 69 -0.017 9.607 -6.465 1.00 3.54 H new ATOM 0 HA GLU A 69 -0.751 12.266 -5.841 1.00 70.04 H new ATOM 0 HB2 GLU A 69 -0.838 11.064 -8.627 1.00 25.21 H new ATOM 0 HB3 GLU A 69 -0.404 12.696 -8.157 1.00 25.21 H new ATOM 0 HG2 GLU A 69 1.272 10.177 -7.852 1.00 0.34 H new ATOM 0 HG3 GLU A 69 1.596 11.556 -8.885 1.00 0.34 H new ATOM 1184 N LEU A 70 -3.089 10.301 -7.166 1.00 11.52 N ATOM 1185 CA LEU A 70 -4.523 10.111 -7.426 1.00 42.44 C ATOM 1186 C LEU A 70 -5.355 10.102 -6.113 1.00 75.31 C ATOM 1187 O LEU A 70 -6.396 10.734 -6.067 1.00 23.02 O ATOM 1188 CB LEU A 70 -4.748 8.829 -8.276 1.00 73.54 C ATOM 1189 CG LEU A 70 -4.116 8.856 -9.708 1.00 52.34 C ATOM 1190 CD1 LEU A 70 -4.308 7.516 -10.444 1.00 64.21 C ATOM 1191 CD2 LEU A 70 -4.670 10.035 -10.538 1.00 11.00 C ATOM 0 H LEU A 70 -2.525 9.475 -7.368 1.00 11.52 H new ATOM 0 HA LEU A 70 -4.882 10.963 -8.003 1.00 42.44 H new ATOM 0 HB2 LEU A 70 -4.340 7.977 -7.733 1.00 73.54 H new ATOM 0 HB3 LEU A 70 -5.821 8.661 -8.373 1.00 73.54 H new ATOM 0 HG LEU A 70 -3.043 9.006 -9.587 1.00 52.34 H new ATOM 0 HD11 LEU A 70 -3.855 7.576 -11.434 1.00 64.21 H new ATOM 0 HD12 LEU A 70 -3.832 6.717 -9.875 1.00 64.21 H new ATOM 0 HD13 LEU A 70 -5.373 7.305 -10.544 1.00 64.21 H new ATOM 0 HD21 LEU A 70 -4.214 10.029 -11.528 1.00 11.00 H new ATOM 0 HD22 LEU A 70 -5.751 9.935 -10.636 1.00 11.00 H new ATOM 0 HD23 LEU A 70 -4.437 10.974 -10.037 1.00 11.00 H new ATOM 1203 N ILE A 71 -4.855 9.448 -5.034 1.00 71.14 N ATOM 1204 CA ILE A 71 -5.549 9.393 -3.712 1.00 34.42 C ATOM 1205 C ILE A 71 -5.663 10.821 -3.132 1.00 43.20 C ATOM 1206 O ILE A 71 -6.682 11.193 -2.530 1.00 42.13 O ATOM 1207 CB ILE A 71 -4.775 8.487 -2.669 1.00 31.20 C ATOM 1208 CG1 ILE A 71 -4.473 7.075 -3.239 1.00 73.21 C ATOM 1209 CG2 ILE A 71 -5.548 8.353 -1.333 1.00 42.15 C ATOM 1210 CD1 ILE A 71 -3.429 6.288 -2.468 1.00 75.43 C ATOM 0 H ILE A 71 -3.967 8.946 -5.050 1.00 71.14 H new ATOM 0 HA ILE A 71 -6.534 8.958 -3.879 1.00 34.42 H new ATOM 0 HB ILE A 71 -3.829 8.993 -2.474 1.00 31.20 H new ATOM 0 HG12 ILE A 71 -5.399 6.501 -3.259 1.00 73.21 H new ATOM 0 HG13 ILE A 71 -4.140 7.179 -4.272 1.00 73.21 H new ATOM 0 HG21 ILE A 71 -4.982 7.724 -0.647 1.00 42.15 H new ATOM 0 HG22 ILE A 71 -5.685 9.340 -0.891 1.00 42.15 H new ATOM 0 HG23 ILE A 71 -6.522 7.901 -1.520 1.00 42.15 H new ATOM 0 HD11 ILE A 71 -3.285 5.316 -2.939 1.00 75.43 H new ATOM 0 HD12 ILE A 71 -2.486 6.835 -2.469 1.00 75.43 H new ATOM 0 HD13 ILE A 71 -3.765 6.147 -1.441 1.00 75.43 H new ATOM 1222 N SER A 72 -4.594 11.607 -3.362 1.00 32.12 N ATOM 1223 CA SER A 72 -4.495 13.008 -2.943 1.00 14.45 C ATOM 1224 C SER A 72 -5.616 13.856 -3.589 1.00 63.04 C ATOM 1225 O SER A 72 -6.316 14.601 -2.890 1.00 53.35 O ATOM 1226 CB SER A 72 -3.096 13.557 -3.310 1.00 32.22 C ATOM 1227 OG SER A 72 -2.922 14.905 -2.898 1.00 55.02 O ATOM 0 H SER A 72 -3.764 11.275 -3.853 1.00 32.12 H new ATOM 0 HA SER A 72 -4.624 13.069 -1.862 1.00 14.45 H new ATOM 0 HB2 SER A 72 -2.331 12.935 -2.845 1.00 32.22 H new ATOM 0 HB3 SER A 72 -2.952 13.487 -4.388 1.00 32.22 H new ATOM 0 HG SER A 72 -2.025 15.210 -3.148 1.00 55.02 H new ATOM 1233 N LYS A 73 -5.807 13.710 -4.924 1.00 62.03 N ATOM 1234 CA LYS A 73 -6.845 14.465 -5.664 1.00 74.53 C ATOM 1235 C LYS A 73 -8.249 13.838 -5.504 1.00 53.03 C ATOM 1236 O LYS A 73 -9.252 14.470 -5.845 1.00 2.34 O ATOM 1237 CB LYS A 73 -6.454 14.676 -7.164 1.00 4.10 C ATOM 1238 CG LYS A 73 -6.187 13.415 -8.031 1.00 14.25 C ATOM 1239 CD LYS A 73 -7.443 12.608 -8.488 1.00 23.43 C ATOM 1240 CE LYS A 73 -8.394 13.365 -9.442 1.00 53.33 C ATOM 1241 NZ LYS A 73 -9.138 14.473 -8.777 1.00 63.11 N ATOM 0 H LYS A 73 -5.257 13.079 -5.507 1.00 62.03 H new ATOM 0 HA LYS A 73 -6.899 15.456 -5.212 1.00 74.53 H new ATOM 0 HB2 LYS A 73 -7.252 15.246 -7.640 1.00 4.10 H new ATOM 0 HB3 LYS A 73 -5.558 15.296 -7.192 1.00 4.10 H new ATOM 0 HG2 LYS A 73 -5.636 13.722 -8.920 1.00 14.25 H new ATOM 0 HG3 LYS A 73 -5.537 12.745 -7.469 1.00 14.25 H new ATOM 0 HD2 LYS A 73 -7.110 11.695 -8.981 1.00 23.43 H new ATOM 0 HD3 LYS A 73 -8.004 12.307 -7.604 1.00 23.43 H new ATOM 0 HE2 LYS A 73 -7.816 13.772 -10.272 1.00 53.33 H new ATOM 0 HE3 LYS A 73 -9.109 12.660 -9.866 1.00 53.33 H new ATOM 0 HZ1 LYS A 73 -10.097 14.534 -9.174 1.00 63.11 H new ATOM 0 HZ2 LYS A 73 -9.198 14.287 -7.755 1.00 63.11 H new ATOM 0 HZ3 LYS A 73 -8.639 15.371 -8.937 1.00 63.11 H new ATOM 1255 N LEU A 74 -8.309 12.578 -5.027 1.00 63.32 N ATOM 1256 CA LEU A 74 -9.579 11.923 -4.646 1.00 51.41 C ATOM 1257 C LEU A 74 -10.020 12.428 -3.258 1.00 32.20 C ATOM 1258 O LEU A 74 -11.201 12.344 -2.903 1.00 52.43 O ATOM 1259 CB LEU A 74 -9.446 10.370 -4.643 1.00 74.34 C ATOM 1260 CG LEU A 74 -9.287 9.666 -6.030 1.00 41.42 C ATOM 1261 CD1 LEU A 74 -9.033 8.150 -5.870 1.00 44.02 C ATOM 1262 CD2 LEU A 74 -10.507 9.930 -6.929 1.00 34.35 C ATOM 0 H LEU A 74 -7.486 11.989 -4.895 1.00 63.32 H new ATOM 0 HA LEU A 74 -10.335 12.183 -5.387 1.00 51.41 H new ATOM 0 HB2 LEU A 74 -8.585 10.105 -4.029 1.00 74.34 H new ATOM 0 HB3 LEU A 74 -10.327 9.956 -4.153 1.00 74.34 H new ATOM 0 HG LEU A 74 -8.412 10.096 -6.517 1.00 41.42 H new ATOM 0 HD11 LEU A 74 -8.927 7.693 -6.854 1.00 44.02 H new ATOM 0 HD12 LEU A 74 -8.119 7.993 -5.297 1.00 44.02 H new ATOM 0 HD13 LEU A 74 -9.873 7.694 -5.346 1.00 44.02 H new ATOM 0 HD21 LEU A 74 -10.369 9.428 -7.887 1.00 34.35 H new ATOM 0 HD22 LEU A 74 -11.405 9.547 -6.445 1.00 34.35 H new ATOM 0 HD23 LEU A 74 -10.613 11.002 -7.093 1.00 34.35 H new ATOM 1274 N GLY A 75 -9.047 12.927 -2.470 1.00 61.33 N ATOM 1275 CA GLY A 75 -9.312 13.531 -1.164 1.00 40.34 C ATOM 1276 C GLY A 75 -9.300 12.525 -0.024 1.00 43.32 C ATOM 1277 O GLY A 75 -9.678 12.859 1.103 1.00 33.11 O ATOM 0 H GLY A 75 -8.060 12.919 -2.727 1.00 61.33 H new ATOM 0 HA2 GLY A 75 -8.565 14.300 -0.969 1.00 40.34 H new ATOM 0 HA3 GLY A 75 -10.282 14.028 -1.191 1.00 40.34 H new ATOM 1281 N TYR A 76 -8.870 11.289 -0.322 1.00 12.41 N ATOM 1282 CA TYR A 76 -8.765 10.206 0.675 1.00 21.32 C ATOM 1283 C TYR A 76 -7.419 10.285 1.412 1.00 10.34 C ATOM 1284 O TYR A 76 -6.534 11.065 1.025 1.00 24.22 O ATOM 1285 CB TYR A 76 -8.905 8.835 -0.015 1.00 0.41 C ATOM 1286 CG TYR A 76 -10.203 8.630 -0.797 1.00 61.44 C ATOM 1287 CD1 TYR A 76 -11.431 9.079 -0.302 1.00 12.54 C ATOM 1288 CD2 TYR A 76 -10.198 7.973 -2.026 1.00 34.35 C ATOM 1289 CE1 TYR A 76 -12.597 8.879 -1.005 1.00 34.34 C ATOM 1290 CE2 TYR A 76 -11.363 7.777 -2.730 1.00 54.01 C ATOM 1291 CZ TYR A 76 -12.557 8.232 -2.218 1.00 13.01 C ATOM 1292 OH TYR A 76 -13.721 8.014 -2.909 1.00 53.11 O ATOM 0 H TYR A 76 -8.585 11.010 -1.261 1.00 12.41 H new ATOM 0 HA TYR A 76 -9.570 10.324 1.401 1.00 21.32 H new ATOM 0 HB2 TYR A 76 -8.064 8.701 -0.696 1.00 0.41 H new ATOM 0 HB3 TYR A 76 -8.829 8.055 0.743 1.00 0.41 H new ATOM 0 HD1 TYR A 76 -11.465 9.591 0.648 1.00 12.54 H new ATOM 0 HD2 TYR A 76 -9.265 7.612 -2.432 1.00 34.35 H new ATOM 0 HE1 TYR A 76 -13.538 9.228 -0.606 1.00 34.34 H new ATOM 0 HE2 TYR A 76 -11.341 7.267 -3.682 1.00 54.01 H new ATOM 0 HH TYR A 76 -13.796 7.062 -3.131 1.00 53.11 H new ATOM 1302 N LYS A 77 -7.266 9.462 2.462 1.00 23.20 N ATOM 1303 CA LYS A 77 -6.015 9.388 3.224 1.00 73.54 C ATOM 1304 C LYS A 77 -5.018 8.452 2.517 1.00 43.23 C ATOM 1305 O LYS A 77 -5.380 7.337 2.117 1.00 41.25 O ATOM 1306 CB LYS A 77 -6.263 8.905 4.676 1.00 73.13 C ATOM 1307 CG LYS A 77 -4.972 8.844 5.538 1.00 64.44 C ATOM 1308 CD LYS A 77 -5.196 8.388 6.992 1.00 40.03 C ATOM 1309 CE LYS A 77 -6.152 9.297 7.784 1.00 1.02 C ATOM 1310 NZ LYS A 77 -6.246 8.879 9.208 1.00 13.24 N ATOM 0 H LYS A 77 -7.998 8.838 2.801 1.00 23.20 H new ATOM 0 HA LYS A 77 -5.593 10.392 3.273 1.00 73.54 H new ATOM 0 HB2 LYS A 77 -6.979 9.573 5.155 1.00 73.13 H new ATOM 0 HB3 LYS A 77 -6.719 7.915 4.648 1.00 73.13 H new ATOM 0 HG2 LYS A 77 -4.264 8.165 5.062 1.00 64.44 H new ATOM 0 HG3 LYS A 77 -4.509 9.831 5.547 1.00 64.44 H new ATOM 0 HD2 LYS A 77 -5.593 7.373 6.988 1.00 40.03 H new ATOM 0 HD3 LYS A 77 -4.235 8.352 7.505 1.00 40.03 H new ATOM 0 HE2 LYS A 77 -5.804 10.329 7.729 1.00 1.02 H new ATOM 0 HE3 LYS A 77 -7.142 9.269 7.329 1.00 1.02 H new ATOM 0 HZ1 LYS A 77 -6.898 9.512 9.713 1.00 13.24 H new ATOM 0 HZ2 LYS A 77 -6.601 7.903 9.261 1.00 13.24 H new ATOM 0 HZ3 LYS A 77 -5.305 8.929 9.647 1.00 13.24 H new ATOM 1324 N VAL A 78 -3.774 8.932 2.361 1.00 11.24 N ATOM 1325 CA VAL A 78 -2.648 8.125 1.884 1.00 33.24 C ATOM 1326 C VAL A 78 -1.947 7.475 3.087 1.00 61.15 C ATOM 1327 O VAL A 78 -1.630 8.147 4.074 1.00 65.12 O ATOM 1328 CB VAL A 78 -1.606 8.994 1.084 1.00 70.22 C ATOM 1329 CG1 VAL A 78 -0.368 8.166 0.665 1.00 71.34 C ATOM 1330 CG2 VAL A 78 -2.264 9.649 -0.151 1.00 50.10 C ATOM 0 H VAL A 78 -3.523 9.899 2.565 1.00 11.24 H new ATOM 0 HA VAL A 78 -3.040 7.363 1.210 1.00 33.24 H new ATOM 0 HB VAL A 78 -1.264 9.783 1.753 1.00 70.22 H new ATOM 0 HG11 VAL A 78 0.326 8.802 0.116 1.00 71.34 H new ATOM 0 HG12 VAL A 78 0.125 7.774 1.554 1.00 71.34 H new ATOM 0 HG13 VAL A 78 -0.682 7.338 0.029 1.00 71.34 H new ATOM 0 HG21 VAL A 78 -1.523 10.243 -0.686 1.00 50.10 H new ATOM 0 HG22 VAL A 78 -2.652 8.873 -0.811 1.00 50.10 H new ATOM 0 HG23 VAL A 78 -3.082 10.293 0.171 1.00 50.10 H new ATOM 1340 N PHE A 79 -1.752 6.161 2.997 1.00 13.02 N ATOM 1341 CA PHE A 79 -0.910 5.391 3.911 1.00 40.32 C ATOM 1342 C PHE A 79 -0.089 4.439 3.027 1.00 44.02 C ATOM 1343 O PHE A 79 -0.652 3.730 2.196 1.00 11.11 O ATOM 1344 CB PHE A 79 -1.773 4.608 4.947 1.00 72.34 C ATOM 1345 CG PHE A 79 -0.971 3.938 6.075 1.00 3.31 C ATOM 1346 CD1 PHE A 79 -0.348 2.699 5.887 1.00 72.23 C ATOM 1347 CD2 PHE A 79 -0.848 4.547 7.323 1.00 44.31 C ATOM 1348 CE1 PHE A 79 0.369 2.100 6.905 1.00 45.00 C ATOM 1349 CE2 PHE A 79 -0.130 3.945 8.339 1.00 5.22 C ATOM 1350 CZ PHE A 79 0.478 2.722 8.129 1.00 34.31 C ATOM 0 H PHE A 79 -2.184 5.589 2.271 1.00 13.02 H new ATOM 0 HA PHE A 79 -0.260 6.041 4.497 1.00 40.32 H new ATOM 0 HB2 PHE A 79 -2.495 5.294 5.391 1.00 72.34 H new ATOM 0 HB3 PHE A 79 -2.343 3.842 4.420 1.00 72.34 H new ATOM 0 HD1 PHE A 79 -0.429 2.203 4.931 1.00 72.23 H new ATOM 0 HD2 PHE A 79 -1.320 5.502 7.498 1.00 44.31 H new ATOM 0 HE1 PHE A 79 0.844 1.144 6.741 1.00 45.00 H new ATOM 0 HE2 PHE A 79 -0.044 4.432 9.299 1.00 5.22 H new ATOM 0 HZ PHE A 79 1.039 2.254 8.925 1.00 34.31 H new ATOM 1360 N LEU A 80 1.231 4.453 3.184 1.00 75.22 N ATOM 1361 CA LEU A 80 2.143 3.579 2.426 1.00 60.35 C ATOM 1362 C LEU A 80 2.911 2.702 3.429 1.00 54.41 C ATOM 1363 O LEU A 80 3.140 3.097 4.574 1.00 25.24 O ATOM 1364 CB LEU A 80 3.094 4.431 1.525 1.00 41.12 C ATOM 1365 CG LEU A 80 4.113 3.655 0.604 1.00 71.01 C ATOM 1366 CD1 LEU A 80 3.408 2.722 -0.395 1.00 11.54 C ATOM 1367 CD2 LEU A 80 5.050 4.631 -0.140 1.00 63.21 C ATOM 0 H LEU A 80 1.708 5.070 3.841 1.00 75.22 H new ATOM 0 HA LEU A 80 1.584 2.930 1.752 1.00 60.35 H new ATOM 0 HB2 LEU A 80 2.476 5.062 0.886 1.00 41.12 H new ATOM 0 HB3 LEU A 80 3.665 5.096 2.173 1.00 41.12 H new ATOM 0 HG LEU A 80 4.714 3.030 1.265 1.00 71.01 H new ATOM 0 HD11 LEU A 80 4.154 2.212 -1.005 1.00 11.54 H new ATOM 0 HD12 LEU A 80 2.818 1.985 0.150 1.00 11.54 H new ATOM 0 HD13 LEU A 80 2.752 3.308 -1.039 1.00 11.54 H new ATOM 0 HD21 LEU A 80 5.740 4.066 -0.766 1.00 63.21 H new ATOM 0 HD22 LEU A 80 4.457 5.299 -0.765 1.00 63.21 H new ATOM 0 HD23 LEU A 80 5.615 5.217 0.585 1.00 63.21 H new ATOM 1379 N LEU A 81 3.235 1.492 2.998 1.00 10.25 N ATOM 1380 CA LEU A 81 3.993 0.505 3.772 1.00 42.50 C ATOM 1381 C LEU A 81 4.840 -0.259 2.769 1.00 34.01 C ATOM 1382 O LEU A 81 4.296 -0.863 1.855 1.00 43.43 O ATOM 1383 CB LEU A 81 3.044 -0.453 4.549 1.00 71.42 C ATOM 1384 CG LEU A 81 3.719 -1.691 5.247 1.00 0.31 C ATOM 1385 CD1 LEU A 81 4.791 -1.261 6.269 1.00 13.24 C ATOM 1386 CD2 LEU A 81 2.661 -2.615 5.888 1.00 74.11 C ATOM 0 H LEU A 81 2.972 1.154 2.072 1.00 10.25 H new ATOM 0 HA LEU A 81 4.614 0.991 4.524 1.00 42.50 H new ATOM 0 HB2 LEU A 81 2.522 0.126 5.311 1.00 71.42 H new ATOM 0 HB3 LEU A 81 2.288 -0.822 3.856 1.00 71.42 H new ATOM 0 HG LEU A 81 4.231 -2.262 4.472 1.00 0.31 H new ATOM 0 HD11 LEU A 81 5.232 -2.146 6.728 1.00 13.24 H new ATOM 0 HD12 LEU A 81 5.568 -0.689 5.762 1.00 13.24 H new ATOM 0 HD13 LEU A 81 4.331 -0.643 7.040 1.00 13.24 H new ATOM 0 HD21 LEU A 81 3.157 -3.462 6.363 1.00 74.11 H new ATOM 0 HD22 LEU A 81 2.097 -2.058 6.637 1.00 74.11 H new ATOM 0 HD23 LEU A 81 1.981 -2.978 5.118 1.00 74.11 H new ATOM 1398 N LEU A 82 6.166 -0.212 2.913 1.00 4.41 N ATOM 1399 CA LEU A 82 7.084 -0.813 1.932 1.00 42.14 C ATOM 1400 C LEU A 82 8.073 -1.774 2.611 1.00 13.52 C ATOM 1401 O LEU A 82 8.532 -1.529 3.735 1.00 73.34 O ATOM 1402 CB LEU A 82 7.773 0.307 1.068 1.00 60.43 C ATOM 1403 CG LEU A 82 8.175 1.654 1.781 1.00 54.03 C ATOM 1404 CD1 LEU A 82 9.346 1.491 2.752 1.00 11.13 C ATOM 1405 CD2 LEU A 82 8.482 2.763 0.755 1.00 62.24 C ATOM 0 H LEU A 82 6.633 0.237 3.701 1.00 4.41 H new ATOM 0 HA LEU A 82 6.514 -1.429 1.236 1.00 42.14 H new ATOM 0 HB2 LEU A 82 8.675 -0.119 0.628 1.00 60.43 H new ATOM 0 HB3 LEU A 82 7.102 0.553 0.245 1.00 60.43 H new ATOM 0 HG LEU A 82 7.308 1.950 2.372 1.00 54.03 H new ATOM 0 HD11 LEU A 82 9.575 2.453 3.211 1.00 11.13 H new ATOM 0 HD12 LEU A 82 9.078 0.774 3.528 1.00 11.13 H new ATOM 0 HD13 LEU A 82 10.220 1.130 2.210 1.00 11.13 H new ATOM 0 HD21 LEU A 82 8.756 3.678 1.280 1.00 62.24 H new ATOM 0 HD22 LEU A 82 9.308 2.450 0.117 1.00 62.24 H new ATOM 0 HD23 LEU A 82 7.599 2.946 0.142 1.00 62.24 H new ATOM 1417 N GLN A 83 8.354 -2.886 1.910 1.00 44.33 N ATOM 1418 CA GLN A 83 9.310 -3.915 2.342 1.00 12.40 C ATOM 1419 C GLN A 83 10.042 -4.448 1.105 1.00 5.20 C ATOM 1420 O GLN A 83 9.477 -4.506 0.004 1.00 72.15 O ATOM 1421 CB GLN A 83 8.630 -5.083 3.142 1.00 11.13 C ATOM 1422 CG GLN A 83 7.927 -6.203 2.321 1.00 71.53 C ATOM 1423 CD GLN A 83 8.862 -7.318 1.784 1.00 53.15 C ATOM 1424 OE1 GLN A 83 8.625 -7.877 0.709 1.00 11.01 O ATOM 1425 NE2 GLN A 83 9.886 -7.693 2.541 1.00 44.34 N ATOM 0 H GLN A 83 7.915 -3.096 1.014 1.00 44.33 H new ATOM 0 HA GLN A 83 10.018 -3.458 3.033 1.00 12.40 H new ATOM 0 HB2 GLN A 83 9.391 -5.551 3.766 1.00 11.13 H new ATOM 0 HB3 GLN A 83 7.892 -4.645 3.814 1.00 11.13 H new ATOM 0 HG2 GLN A 83 7.162 -6.663 2.946 1.00 71.53 H new ATOM 0 HG3 GLN A 83 7.414 -5.744 1.476 1.00 71.53 H new ATOM 0 HE21 GLN A 83 10.066 -7.219 3.426 1.00 44.34 H new ATOM 0 HE22 GLN A 83 10.493 -8.455 2.237 1.00 44.34 H new ATOM 1434 N ASP A 84 11.296 -4.831 1.322 1.00 21.42 N ATOM 1435 CA ASP A 84 12.148 -5.469 0.315 1.00 71.13 C ATOM 1436 C ASP A 84 13.343 -6.100 1.033 1.00 41.32 C ATOM 1437 O ASP A 84 13.683 -5.709 2.160 1.00 4.32 O ATOM 1438 CB ASP A 84 12.618 -4.449 -0.772 1.00 71.11 C ATOM 1439 CG ASP A 84 13.494 -5.060 -1.883 1.00 1.30 C ATOM 1440 OD1 ASP A 84 13.094 -6.080 -2.472 1.00 0.42 O ATOM 1441 OD2 ASP A 84 14.596 -4.538 -2.160 1.00 21.12 O ATOM 0 H ASP A 84 11.762 -4.705 2.221 1.00 21.42 H new ATOM 0 HA ASP A 84 11.579 -6.237 -0.209 1.00 71.13 H new ATOM 0 HB2 ASP A 84 11.740 -3.993 -1.229 1.00 71.11 H new ATOM 0 HB3 ASP A 84 13.176 -3.649 -0.285 1.00 71.11 H new ATOM 1446 N GLN A 85 13.971 -7.077 0.377 1.00 72.25 N ATOM 1447 CA GLN A 85 15.145 -7.790 0.907 1.00 32.40 C ATOM 1448 C GLN A 85 16.389 -6.864 0.912 1.00 3.33 C ATOM 1449 O GLN A 85 17.398 -7.167 1.568 1.00 62.20 O ATOM 1450 CB GLN A 85 15.408 -9.089 0.088 1.00 71.44 C ATOM 1451 CG GLN A 85 14.279 -10.157 0.146 1.00 50.10 C ATOM 1452 CD GLN A 85 12.941 -9.729 -0.499 1.00 62.43 C ATOM 1453 OE1 GLN A 85 12.034 -9.213 0.164 1.00 31.41 O ATOM 1454 NE2 GLN A 85 12.817 -9.919 -1.800 1.00 25.30 N ATOM 0 H GLN A 85 13.680 -7.402 -0.545 1.00 72.25 H new ATOM 0 HA GLN A 85 14.942 -8.079 1.938 1.00 32.40 H new ATOM 0 HB2 GLN A 85 15.571 -8.814 -0.954 1.00 71.44 H new ATOM 0 HB3 GLN A 85 16.332 -9.543 0.446 1.00 71.44 H new ATOM 0 HG2 GLN A 85 14.630 -11.062 -0.349 1.00 50.10 H new ATOM 0 HG3 GLN A 85 14.096 -10.414 1.189 1.00 50.10 H new ATOM 0 HE21 GLN A 85 13.578 -10.347 -2.328 1.00 25.30 H new ATOM 0 HE22 GLN A 85 11.960 -9.638 -2.277 1.00 25.30 H new ATOM 1463 N ASP A 86 16.309 -5.744 0.160 1.00 70.51 N ATOM 1464 CA ASP A 86 17.289 -4.641 0.197 1.00 64.13 C ATOM 1465 C ASP A 86 16.571 -3.364 0.678 1.00 34.21 C ATOM 1466 O ASP A 86 15.910 -2.674 -0.110 1.00 10.42 O ATOM 1467 CB ASP A 86 17.929 -4.422 -1.207 1.00 73.14 C ATOM 1468 CG ASP A 86 18.743 -5.630 -1.694 1.00 42.10 C ATOM 1469 OD1 ASP A 86 19.938 -5.732 -1.352 1.00 43.43 O ATOM 1470 OD2 ASP A 86 18.191 -6.500 -2.394 1.00 60.31 O ATOM 0 H ASP A 86 15.548 -5.581 -0.500 1.00 70.51 H new ATOM 0 HA ASP A 86 18.096 -4.889 0.886 1.00 64.13 H new ATOM 0 HB2 ASP A 86 17.141 -4.208 -1.929 1.00 73.14 H new ATOM 0 HB3 ASP A 86 18.576 -3.546 -1.172 1.00 73.14 H new ATOM 1475 N GLU A 87 16.686 -3.066 1.981 1.00 1.30 N ATOM 1476 CA GLU A 87 15.993 -1.927 2.617 1.00 73.01 C ATOM 1477 C GLU A 87 16.585 -0.567 2.178 1.00 14.21 C ATOM 1478 O GLU A 87 15.936 0.480 2.321 1.00 72.34 O ATOM 1479 CB GLU A 87 16.012 -2.078 4.162 1.00 15.24 C ATOM 1480 CG GLU A 87 15.201 -0.997 4.914 1.00 72.34 C ATOM 1481 CD GLU A 87 15.255 -1.095 6.442 1.00 23.12 C ATOM 1482 OE1 GLU A 87 16.354 -0.941 7.013 1.00 32.40 O ATOM 1483 OE2 GLU A 87 14.194 -1.284 7.079 1.00 23.54 O ATOM 0 H GLU A 87 17.262 -3.606 2.627 1.00 1.30 H new ATOM 0 HA GLU A 87 14.956 -1.940 2.280 1.00 73.01 H new ATOM 0 HB2 GLU A 87 15.619 -3.060 4.425 1.00 15.24 H new ATOM 0 HB3 GLU A 87 17.046 -2.046 4.506 1.00 15.24 H new ATOM 0 HG2 GLU A 87 15.567 -0.015 4.615 1.00 72.34 H new ATOM 0 HG3 GLU A 87 14.160 -1.059 4.597 1.00 72.34 H new ATOM 1490 N ASN A 88 17.801 -0.586 1.596 1.00 21.22 N ATOM 1491 CA ASN A 88 18.467 0.633 1.096 1.00 73.34 C ATOM 1492 C ASN A 88 17.698 1.221 -0.105 1.00 60.34 C ATOM 1493 O ASN A 88 17.766 2.423 -0.372 1.00 35.44 O ATOM 1494 CB ASN A 88 19.943 0.340 0.716 1.00 52.15 C ATOM 1495 CG ASN A 88 20.808 -0.056 1.920 1.00 53.20 C ATOM 1496 OD1 ASN A 88 20.966 -1.237 2.222 1.00 53.15 O ATOM 1497 ND2 ASN A 88 21.355 0.927 2.626 1.00 31.45 N ATOM 0 H ASN A 88 18.345 -1.438 1.460 1.00 21.22 H new ATOM 0 HA ASN A 88 18.465 1.373 1.896 1.00 73.34 H new ATOM 0 HB2 ASN A 88 19.969 -0.462 -0.022 1.00 52.15 H new ATOM 0 HB3 ASN A 88 20.372 1.223 0.243 1.00 52.15 H new ATOM 0 HD21 ASN A 88 21.925 0.711 3.444 1.00 31.45 H new ATOM 0 HD22 ASN A 88 21.205 1.897 2.350 1.00 31.45 H new ATOM 1504 N GLU A 89 16.962 0.353 -0.815 1.00 33.14 N ATOM 1505 CA GLU A 89 16.083 0.749 -1.927 1.00 71.23 C ATOM 1506 C GLU A 89 14.810 1.448 -1.403 1.00 55.35 C ATOM 1507 O GLU A 89 14.255 2.337 -2.056 1.00 64.40 O ATOM 1508 CB GLU A 89 15.704 -0.507 -2.749 1.00 64.24 C ATOM 1509 CG GLU A 89 16.905 -1.309 -3.287 1.00 63.53 C ATOM 1510 CD GLU A 89 17.792 -0.514 -4.259 1.00 32.40 C ATOM 1511 OE1 GLU A 89 17.441 -0.413 -5.454 1.00 12.00 O ATOM 1512 OE2 GLU A 89 18.828 0.040 -3.828 1.00 4.22 O ATOM 0 H GLU A 89 16.960 -0.651 -0.633 1.00 33.14 H new ATOM 0 HA GLU A 89 16.615 1.457 -2.563 1.00 71.23 H new ATOM 0 HB2 GLU A 89 15.096 -1.163 -2.126 1.00 64.24 H new ATOM 0 HB3 GLU A 89 15.083 -0.200 -3.590 1.00 64.24 H new ATOM 0 HG2 GLU A 89 17.512 -1.645 -2.447 1.00 63.53 H new ATOM 0 HG3 GLU A 89 16.537 -2.202 -3.792 1.00 63.53 H new ATOM 1519 N LEU A 90 14.372 1.015 -0.217 1.00 64.33 N ATOM 1520 CA LEU A 90 13.126 1.470 0.417 1.00 50.15 C ATOM 1521 C LEU A 90 13.265 2.886 0.988 1.00 0.54 C ATOM 1522 O LEU A 90 12.398 3.728 0.763 1.00 4.34 O ATOM 1523 CB LEU A 90 12.743 0.493 1.545 1.00 34.25 C ATOM 1524 CG LEU A 90 12.485 -0.972 1.117 1.00 50.23 C ATOM 1525 CD1 LEU A 90 12.243 -1.847 2.353 1.00 53.44 C ATOM 1526 CD2 LEU A 90 11.313 -1.059 0.110 1.00 72.21 C ATOM 0 H LEU A 90 14.880 0.328 0.340 1.00 64.33 H new ATOM 0 HA LEU A 90 12.346 1.493 -0.344 1.00 50.15 H new ATOM 0 HB2 LEU A 90 13.540 0.498 2.289 1.00 34.25 H new ATOM 0 HB3 LEU A 90 11.846 0.870 2.036 1.00 34.25 H new ATOM 0 HG LEU A 90 13.370 -1.350 0.606 1.00 50.23 H new ATOM 0 HD11 LEU A 90 12.063 -2.876 2.041 1.00 53.44 H new ATOM 0 HD12 LEU A 90 13.119 -1.813 3.000 1.00 53.44 H new ATOM 0 HD13 LEU A 90 11.375 -1.475 2.898 1.00 53.44 H new ATOM 0 HD21 LEU A 90 11.154 -2.099 -0.174 1.00 72.21 H new ATOM 0 HD22 LEU A 90 10.407 -0.666 0.571 1.00 72.21 H new ATOM 0 HD23 LEU A 90 11.552 -0.473 -0.778 1.00 72.21 H new ATOM 1538 N GLU A 91 14.365 3.122 1.730 1.00 52.44 N ATOM 1539 CA GLU A 91 14.601 4.390 2.448 1.00 24.45 C ATOM 1540 C GLU A 91 14.740 5.586 1.485 1.00 45.51 C ATOM 1541 O GLU A 91 14.311 6.696 1.812 1.00 2.45 O ATOM 1542 CB GLU A 91 15.851 4.268 3.354 1.00 10.24 C ATOM 1543 CG GLU A 91 17.163 3.983 2.595 1.00 42.21 C ATOM 1544 CD GLU A 91 18.399 3.916 3.501 1.00 53.34 C ATOM 1545 OE1 GLU A 91 18.959 4.976 3.838 1.00 53.35 O ATOM 1546 OE2 GLU A 91 18.825 2.802 3.871 1.00 11.20 O ATOM 0 H GLU A 91 15.114 2.440 1.848 1.00 52.44 H new ATOM 0 HA GLU A 91 13.727 4.582 3.071 1.00 24.45 H new ATOM 0 HB2 GLU A 91 15.966 5.193 3.920 1.00 10.24 H new ATOM 0 HB3 GLU A 91 15.684 3.470 4.078 1.00 10.24 H new ATOM 0 HG2 GLU A 91 17.065 3.039 2.060 1.00 42.21 H new ATOM 0 HG3 GLU A 91 17.315 4.760 1.846 1.00 42.21 H new ATOM 1553 N GLU A 92 15.329 5.343 0.298 1.00 42.31 N ATOM 1554 CA GLU A 92 15.500 6.375 -0.731 1.00 71.02 C ATOM 1555 C GLU A 92 14.146 6.779 -1.334 1.00 11.33 C ATOM 1556 O GLU A 92 13.862 7.975 -1.491 1.00 3.13 O ATOM 1557 CB GLU A 92 16.466 5.873 -1.830 1.00 44.22 C ATOM 1558 CG GLU A 92 17.900 5.585 -1.334 1.00 63.44 C ATOM 1559 CD GLU A 92 18.577 6.797 -0.663 1.00 3.41 C ATOM 1560 OE1 GLU A 92 18.820 7.808 -1.355 1.00 24.32 O ATOM 1561 OE2 GLU A 92 18.877 6.746 0.549 1.00 33.50 O ATOM 0 H GLU A 92 15.696 4.430 0.031 1.00 42.31 H new ATOM 0 HA GLU A 92 15.932 7.261 -0.266 1.00 71.02 H new ATOM 0 HB2 GLU A 92 16.057 4.963 -2.269 1.00 44.22 H new ATOM 0 HB3 GLU A 92 16.512 6.618 -2.625 1.00 44.22 H new ATOM 0 HG2 GLU A 92 17.871 4.757 -0.625 1.00 63.44 H new ATOM 0 HG3 GLU A 92 18.509 5.261 -2.178 1.00 63.44 H new ATOM 1568 N PHE A 93 13.311 5.774 -1.665 1.00 22.11 N ATOM 1569 CA PHE A 93 11.937 6.012 -2.141 1.00 3.33 C ATOM 1570 C PHE A 93 11.133 6.744 -1.050 1.00 24.42 C ATOM 1571 O PHE A 93 10.429 7.708 -1.334 1.00 52.02 O ATOM 1572 CB PHE A 93 11.244 4.672 -2.528 1.00 65.25 C ATOM 1573 CG PHE A 93 9.821 4.813 -3.100 1.00 1.45 C ATOM 1574 CD1 PHE A 93 9.563 5.668 -4.175 1.00 4.12 C ATOM 1575 CD2 PHE A 93 8.748 4.092 -2.568 1.00 34.01 C ATOM 1576 CE1 PHE A 93 8.284 5.795 -4.691 1.00 71.13 C ATOM 1577 CE2 PHE A 93 7.471 4.221 -3.088 1.00 54.51 C ATOM 1578 CZ PHE A 93 7.240 5.071 -4.150 1.00 42.52 C ATOM 0 H PHE A 93 13.567 4.788 -1.611 1.00 22.11 H new ATOM 0 HA PHE A 93 11.976 6.636 -3.034 1.00 3.33 H new ATOM 0 HB2 PHE A 93 11.865 4.159 -3.263 1.00 65.25 H new ATOM 0 HB3 PHE A 93 11.202 4.034 -1.645 1.00 65.25 H new ATOM 0 HD1 PHE A 93 10.372 6.237 -4.609 1.00 4.12 H new ATOM 0 HD2 PHE A 93 8.918 3.423 -1.737 1.00 34.01 H new ATOM 0 HE1 PHE A 93 8.102 6.463 -5.520 1.00 71.13 H new ATOM 0 HE2 PHE A 93 6.655 3.656 -2.662 1.00 54.51 H new ATOM 0 HZ PHE A 93 6.245 5.170 -4.557 1.00 42.52 H new ATOM 1588 N LYS A 94 11.330 6.304 0.207 1.00 53.34 N ATOM 1589 CA LYS A 94 10.552 6.761 1.363 1.00 73.55 C ATOM 1590 C LYS A 94 10.800 8.247 1.677 1.00 60.52 C ATOM 1591 O LYS A 94 9.851 8.971 1.953 1.00 12.03 O ATOM 1592 CB LYS A 94 10.868 5.886 2.603 1.00 45.04 C ATOM 1593 CG LYS A 94 9.992 6.202 3.832 1.00 4.15 C ATOM 1594 CD LYS A 94 10.225 5.258 5.022 1.00 3.22 C ATOM 1595 CE LYS A 94 11.570 5.493 5.730 1.00 14.34 C ATOM 1596 NZ LYS A 94 11.622 6.806 6.425 1.00 44.21 N ATOM 0 H LYS A 94 12.042 5.614 0.446 1.00 53.34 H new ATOM 0 HA LYS A 94 9.497 6.656 1.109 1.00 73.55 H new ATOM 0 HB2 LYS A 94 10.739 4.837 2.337 1.00 45.04 H new ATOM 0 HB3 LYS A 94 11.916 6.020 2.872 1.00 45.04 H new ATOM 0 HG2 LYS A 94 10.186 7.226 4.150 1.00 4.15 H new ATOM 0 HG3 LYS A 94 8.943 6.152 3.541 1.00 4.15 H new ATOM 0 HD2 LYS A 94 9.416 5.385 5.742 1.00 3.22 H new ATOM 0 HD3 LYS A 94 10.181 4.226 4.673 1.00 3.22 H new ATOM 0 HE2 LYS A 94 11.741 4.695 6.453 1.00 14.34 H new ATOM 0 HE3 LYS A 94 12.377 5.440 4.999 1.00 14.34 H new ATOM 0 HZ1 LYS A 94 12.434 6.823 7.074 1.00 44.21 H new ATOM 0 HZ2 LYS A 94 11.724 7.567 5.723 1.00 44.21 H new ATOM 0 HZ3 LYS A 94 10.744 6.948 6.964 1.00 44.21 H new ATOM 1610 N ARG A 95 12.077 8.694 1.621 1.00 31.44 N ATOM 1611 CA ARG A 95 12.445 10.095 1.951 1.00 51.30 C ATOM 1612 C ARG A 95 11.808 11.100 0.964 1.00 24.34 C ATOM 1613 O ARG A 95 11.586 12.265 1.315 1.00 62.52 O ATOM 1614 CB ARG A 95 13.984 10.277 2.044 1.00 34.41 C ATOM 1615 CG ARG A 95 14.771 10.063 0.734 1.00 53.02 C ATOM 1616 CD ARG A 95 16.283 10.292 0.902 1.00 70.55 C ATOM 1617 NE ARG A 95 17.007 10.115 -0.378 1.00 72.32 N ATOM 1618 CZ ARG A 95 17.805 11.028 -0.961 1.00 14.51 C ATOM 1619 NH1 ARG A 95 18.020 12.222 -0.413 1.00 1.14 N ATOM 1620 NH2 ARG A 95 18.420 10.707 -2.093 1.00 51.50 N ATOM 0 H ARG A 95 12.868 8.109 1.352 1.00 31.44 H new ATOM 0 HA ARG A 95 12.036 10.312 2.938 1.00 51.30 H new ATOM 0 HB2 ARG A 95 14.190 11.284 2.408 1.00 34.41 H new ATOM 0 HB3 ARG A 95 14.367 9.583 2.792 1.00 34.41 H new ATOM 0 HG2 ARG A 95 14.600 9.048 0.374 1.00 53.02 H new ATOM 0 HG3 ARG A 95 14.388 10.741 -0.029 1.00 53.02 H new ATOM 0 HD2 ARG A 95 16.459 11.298 1.284 1.00 70.55 H new ATOM 0 HD3 ARG A 95 16.677 9.596 1.643 1.00 70.55 H new ATOM 0 HE ARG A 95 16.890 9.223 -0.859 1.00 72.32 H new ATOM 0 HH11 ARG A 95 17.575 12.465 0.472 1.00 1.14 H new ATOM 0 HH12 ARG A 95 18.630 12.894 -0.878 1.00 1.14 H new ATOM 0 HH21 ARG A 95 18.283 9.783 -2.504 1.00 51.50 H new ATOM 0 HH22 ARG A 95 19.030 11.384 -2.552 1.00 51.50 H new ATOM 1634 N LYS A 96 11.518 10.631 -0.264 1.00 32.14 N ATOM 1635 CA LYS A 96 10.715 11.381 -1.245 1.00 41.23 C ATOM 1636 C LYS A 96 9.248 11.484 -0.774 1.00 61.55 C ATOM 1637 O LYS A 96 8.668 12.566 -0.756 1.00 45.32 O ATOM 1638 CB LYS A 96 10.778 10.683 -2.637 1.00 75.25 C ATOM 1639 CG LYS A 96 12.147 10.755 -3.353 1.00 31.03 C ATOM 1640 CD LYS A 96 12.518 12.194 -3.779 1.00 42.51 C ATOM 1641 CE LYS A 96 13.809 12.262 -4.620 1.00 2.21 C ATOM 1642 NZ LYS A 96 15.008 11.824 -3.852 1.00 10.44 N ATOM 0 H LYS A 96 11.834 9.722 -0.603 1.00 32.14 H new ATOM 0 HA LYS A 96 11.127 12.386 -1.333 1.00 41.23 H new ATOM 0 HB2 LYS A 96 10.507 9.635 -2.512 1.00 75.25 H new ATOM 0 HB3 LYS A 96 10.024 11.132 -3.284 1.00 75.25 H new ATOM 0 HG2 LYS A 96 12.920 10.365 -2.691 1.00 31.03 H new ATOM 0 HG3 LYS A 96 12.127 10.113 -4.233 1.00 31.03 H new ATOM 0 HD2 LYS A 96 11.695 12.620 -4.353 1.00 42.51 H new ATOM 0 HD3 LYS A 96 12.639 12.811 -2.888 1.00 42.51 H new ATOM 0 HE2 LYS A 96 13.697 11.634 -5.504 1.00 2.21 H new ATOM 0 HE3 LYS A 96 13.958 13.283 -4.971 1.00 2.21 H new ATOM 0 HZ1 LYS A 96 15.851 11.887 -4.458 1.00 10.44 H new ATOM 0 HZ2 LYS A 96 15.132 12.438 -3.022 1.00 10.44 H new ATOM 0 HZ3 LYS A 96 14.880 10.841 -3.539 1.00 10.44 H new ATOM 1656 N ILE A 97 8.685 10.333 -0.369 1.00 64.11 N ATOM 1657 CA ILE A 97 7.268 10.198 0.029 1.00 41.31 C ATOM 1658 C ILE A 97 6.952 11.078 1.274 1.00 11.51 C ATOM 1659 O ILE A 97 5.946 11.794 1.303 1.00 74.34 O ATOM 1660 CB ILE A 97 6.929 8.674 0.296 1.00 62.54 C ATOM 1661 CG1 ILE A 97 7.314 7.788 -0.934 1.00 51.15 C ATOM 1662 CG2 ILE A 97 5.453 8.446 0.667 1.00 3.00 C ATOM 1663 CD1 ILE A 97 6.717 8.222 -2.263 1.00 20.41 C ATOM 0 H ILE A 97 9.205 9.458 -0.307 1.00 64.11 H new ATOM 0 HA ILE A 97 6.637 10.554 -0.785 1.00 41.31 H new ATOM 0 HB ILE A 97 7.530 8.376 1.155 1.00 62.54 H new ATOM 0 HG12 ILE A 97 8.400 7.779 -1.028 1.00 51.15 H new ATOM 0 HG13 ILE A 97 7.003 6.763 -0.733 1.00 51.15 H new ATOM 0 HG21 ILE A 97 5.281 7.383 0.838 1.00 3.00 H new ATOM 0 HG22 ILE A 97 5.215 9.003 1.573 1.00 3.00 H new ATOM 0 HG23 ILE A 97 4.816 8.790 -0.148 1.00 3.00 H new ATOM 0 HD11 ILE A 97 7.046 7.542 -3.049 1.00 20.41 H new ATOM 0 HD12 ILE A 97 5.629 8.202 -2.197 1.00 20.41 H new ATOM 0 HD13 ILE A 97 7.047 9.234 -2.497 1.00 20.41 H new ATOM 1675 N GLU A 98 7.861 11.041 2.264 1.00 23.53 N ATOM 1676 CA GLU A 98 7.804 11.866 3.491 1.00 65.20 C ATOM 1677 C GLU A 98 7.887 13.371 3.166 1.00 42.34 C ATOM 1678 O GLU A 98 7.192 14.182 3.792 1.00 32.44 O ATOM 1679 CB GLU A 98 8.965 11.470 4.441 1.00 31.54 C ATOM 1680 CG GLU A 98 8.934 10.002 4.900 1.00 32.45 C ATOM 1681 CD GLU A 98 10.183 9.582 5.684 1.00 31.22 C ATOM 1682 OE1 GLU A 98 11.225 9.332 5.049 1.00 32.12 O ATOM 1683 OE2 GLU A 98 10.133 9.493 6.926 1.00 45.22 O ATOM 0 H GLU A 98 8.674 10.425 2.236 1.00 23.53 H new ATOM 0 HA GLU A 98 6.847 11.680 3.978 1.00 65.20 H new ATOM 0 HB2 GLU A 98 9.913 11.661 3.937 1.00 31.54 H new ATOM 0 HB3 GLU A 98 8.936 12.114 5.320 1.00 31.54 H new ATOM 0 HG2 GLU A 98 8.053 9.842 5.522 1.00 32.45 H new ATOM 0 HG3 GLU A 98 8.829 9.358 4.027 1.00 32.45 H new ATOM 1690 N SER A 99 8.735 13.725 2.174 1.00 10.15 N ATOM 1691 CA SER A 99 8.954 15.126 1.765 1.00 74.13 C ATOM 1692 C SER A 99 7.683 15.718 1.126 1.00 32.41 C ATOM 1693 O SER A 99 7.398 16.917 1.256 1.00 50.02 O ATOM 1694 CB SER A 99 10.141 15.212 0.780 1.00 23.11 C ATOM 1695 OG SER A 99 10.455 16.557 0.451 1.00 53.21 O ATOM 0 H SER A 99 9.282 13.051 1.639 1.00 10.15 H new ATOM 0 HA SER A 99 9.189 15.711 2.654 1.00 74.13 H new ATOM 0 HB2 SER A 99 11.015 14.732 1.221 1.00 23.11 H new ATOM 0 HB3 SER A 99 9.900 14.662 -0.130 1.00 23.11 H new ATOM 0 HG SER A 99 11.211 16.573 -0.172 1.00 53.21 H new ATOM 1701 N GLN A 100 6.916 14.844 0.448 1.00 62.53 N ATOM 1702 CA GLN A 100 5.666 15.211 -0.241 1.00 5.20 C ATOM 1703 C GLN A 100 4.447 15.107 0.703 1.00 52.04 C ATOM 1704 O GLN A 100 3.298 15.252 0.258 1.00 22.31 O ATOM 1705 CB GLN A 100 5.507 14.295 -1.476 1.00 11.14 C ATOM 1706 CG GLN A 100 6.708 14.362 -2.442 1.00 63.41 C ATOM 1707 CD GLN A 100 6.656 13.347 -3.576 1.00 20.34 C ATOM 1708 OE1 GLN A 100 5.580 12.980 -4.051 1.00 2.32 O ATOM 1709 NE2 GLN A 100 7.822 12.876 -4.011 1.00 4.34 N ATOM 0 H GLN A 100 7.149 13.855 0.363 1.00 62.53 H new ATOM 0 HA GLN A 100 5.716 16.252 -0.561 1.00 5.20 H new ATOM 0 HB2 GLN A 100 5.375 13.266 -1.142 1.00 11.14 H new ATOM 0 HB3 GLN A 100 4.601 14.575 -2.013 1.00 11.14 H new ATOM 0 HG2 GLN A 100 6.761 15.364 -2.868 1.00 63.41 H new ATOM 0 HG3 GLN A 100 7.626 14.208 -1.874 1.00 63.41 H new ATOM 0 HE21 GLN A 100 8.693 13.204 -3.593 1.00 4.34 H new ATOM 0 HE22 GLN A 100 7.845 12.187 -4.763 1.00 4.34 H new ATOM 1718 N GLY A 101 4.712 14.856 2.001 1.00 64.04 N ATOM 1719 CA GLY A 101 3.678 14.844 3.034 1.00 23.33 C ATOM 1720 C GLY A 101 2.754 13.640 2.964 1.00 13.54 C ATOM 1721 O GLY A 101 1.599 13.717 3.388 1.00 32.14 O ATOM 0 H GLY A 101 5.648 14.657 2.353 1.00 64.04 H new ATOM 0 HA2 GLY A 101 4.156 14.867 4.013 1.00 23.33 H new ATOM 0 HA3 GLY A 101 3.082 15.753 2.949 1.00 23.33 H new ATOM 1725 N TYR A 102 3.255 12.539 2.391 1.00 1.12 N ATOM 1726 CA TYR A 102 2.529 11.260 2.336 1.00 3.00 C ATOM 1727 C TYR A 102 2.998 10.356 3.495 1.00 60.22 C ATOM 1728 O TYR A 102 4.210 10.156 3.674 1.00 31.03 O ATOM 1729 CB TYR A 102 2.755 10.540 0.983 1.00 75.23 C ATOM 1730 CG TYR A 102 2.213 11.240 -0.278 1.00 61.53 C ATOM 1731 CD1 TYR A 102 0.870 11.594 -0.386 1.00 11.42 C ATOM 1732 CD2 TYR A 102 3.045 11.498 -1.376 1.00 71.43 C ATOM 1733 CE1 TYR A 102 0.369 12.175 -1.537 1.00 0.34 C ATOM 1734 CE2 TYR A 102 2.550 12.090 -2.526 1.00 13.41 C ATOM 1735 CZ TYR A 102 1.212 12.426 -2.602 1.00 42.34 C ATOM 1736 OH TYR A 102 0.706 12.994 -3.757 1.00 24.21 O ATOM 0 H TYR A 102 4.175 12.508 1.952 1.00 1.12 H new ATOM 0 HA TYR A 102 1.463 11.465 2.432 1.00 3.00 H new ATOM 0 HB2 TYR A 102 3.827 10.390 0.853 1.00 75.23 H new ATOM 0 HB3 TYR A 102 2.300 9.552 1.044 1.00 75.23 H new ATOM 0 HD1 TYR A 102 0.206 11.411 0.446 1.00 11.42 H new ATOM 0 HD2 TYR A 102 4.090 11.231 -1.324 1.00 71.43 H new ATOM 0 HE1 TYR A 102 -0.678 12.432 -1.603 1.00 0.34 H new ATOM 0 HE2 TYR A 102 3.207 12.288 -3.360 1.00 13.41 H new ATOM 0 HH TYR A 102 1.428 13.106 -4.410 1.00 24.21 H new ATOM 1746 N GLU A 103 2.038 9.821 4.277 1.00 0.25 N ATOM 1747 CA GLU A 103 2.319 8.884 5.382 1.00 10.15 C ATOM 1748 C GLU A 103 2.870 7.556 4.833 1.00 74.54 C ATOM 1749 O GLU A 103 2.245 6.933 3.978 1.00 71.32 O ATOM 1750 CB GLU A 103 1.030 8.644 6.207 1.00 41.22 C ATOM 1751 CG GLU A 103 1.144 7.585 7.331 1.00 54.34 C ATOM 1752 CD GLU A 103 2.169 7.939 8.427 1.00 51.23 C ATOM 1753 OE1 GLU A 103 1.844 8.765 9.309 1.00 21.22 O ATOM 1754 OE2 GLU A 103 3.302 7.406 8.410 1.00 42.20 O ATOM 0 H GLU A 103 1.046 10.027 4.159 1.00 0.25 H new ATOM 0 HA GLU A 103 3.076 9.320 6.034 1.00 10.15 H new ATOM 0 HB2 GLU A 103 0.724 9.590 6.653 1.00 41.22 H new ATOM 0 HB3 GLU A 103 0.235 8.341 5.526 1.00 41.22 H new ATOM 0 HG2 GLU A 103 0.165 7.454 7.793 1.00 54.34 H new ATOM 0 HG3 GLU A 103 1.418 6.628 6.887 1.00 54.34 H new ATOM 1761 N VAL A 104 4.065 7.178 5.306 1.00 51.13 N ATOM 1762 CA VAL A 104 4.756 5.946 4.891 1.00 25.32 C ATOM 1763 C VAL A 104 5.460 5.273 6.088 1.00 34.12 C ATOM 1764 O VAL A 104 6.023 5.950 6.951 1.00 13.44 O ATOM 1765 CB VAL A 104 5.773 6.240 3.735 1.00 54.34 C ATOM 1766 CG1 VAL A 104 6.708 7.409 4.091 1.00 50.32 C ATOM 1767 CG2 VAL A 104 6.563 4.972 3.316 1.00 2.13 C ATOM 0 H VAL A 104 4.585 7.722 5.994 1.00 51.13 H new ATOM 0 HA VAL A 104 4.006 5.252 4.513 1.00 25.32 H new ATOM 0 HB VAL A 104 5.191 6.545 2.865 1.00 54.34 H new ATOM 0 HG11 VAL A 104 7.400 7.585 3.267 1.00 50.32 H new ATOM 0 HG12 VAL A 104 6.116 8.307 4.267 1.00 50.32 H new ATOM 0 HG13 VAL A 104 7.271 7.163 4.991 1.00 50.32 H new ATOM 0 HG21 VAL A 104 7.255 5.224 2.513 1.00 2.13 H new ATOM 0 HG22 VAL A 104 7.122 4.593 4.171 1.00 2.13 H new ATOM 0 HG23 VAL A 104 5.867 4.208 2.969 1.00 2.13 H new ATOM 1777 N ARG A 105 5.425 3.925 6.117 1.00 4.12 N ATOM 1778 CA ARG A 105 6.145 3.104 7.108 1.00 12.50 C ATOM 1779 C ARG A 105 7.099 2.142 6.367 1.00 74.25 C ATOM 1780 O ARG A 105 6.765 1.633 5.296 1.00 41.15 O ATOM 1781 CB ARG A 105 5.146 2.307 7.996 1.00 73.32 C ATOM 1782 CG ARG A 105 4.160 3.162 8.830 1.00 4.41 C ATOM 1783 CD ARG A 105 4.851 4.248 9.678 1.00 5.10 C ATOM 1784 NE ARG A 105 5.879 3.698 10.587 1.00 25.32 N ATOM 1785 CZ ARG A 105 6.693 4.426 11.383 1.00 64.42 C ATOM 1786 NH1 ARG A 105 6.630 5.754 11.403 1.00 53.14 N ATOM 1787 NH2 ARG A 105 7.547 3.810 12.183 1.00 0.23 N ATOM 0 H ARG A 105 4.891 3.372 5.446 1.00 4.12 H new ATOM 0 HA ARG A 105 6.723 3.756 7.763 1.00 12.50 H new ATOM 0 HB2 ARG A 105 4.568 1.642 7.354 1.00 73.32 H new ATOM 0 HB3 ARG A 105 5.717 1.676 8.677 1.00 73.32 H new ATOM 0 HG2 ARG A 105 3.446 3.637 8.158 1.00 4.41 H new ATOM 0 HG3 ARG A 105 3.590 2.506 9.488 1.00 4.41 H new ATOM 0 HD2 ARG A 105 5.313 4.980 9.016 1.00 5.10 H new ATOM 0 HD3 ARG A 105 4.100 4.777 10.264 1.00 5.10 H new ATOM 0 HE ARG A 105 5.983 2.684 10.616 1.00 25.32 H new ATOM 0 HH11 ARG A 105 5.958 6.242 10.810 1.00 53.14 H new ATOM 0 HH12 ARG A 105 7.253 6.285 12.011 1.00 53.14 H new ATOM 0 HH21 ARG A 105 7.589 2.791 12.197 1.00 0.23 H new ATOM 0 HH22 ARG A 105 8.164 4.354 12.786 1.00 0.23 H new ATOM 1801 N LYS A 106 8.289 1.905 6.950 1.00 21.22 N ATOM 1802 CA LYS A 106 9.340 1.047 6.348 1.00 64.14 C ATOM 1803 C LYS A 106 9.587 -0.195 7.202 1.00 54.53 C ATOM 1804 O LYS A 106 9.646 -0.101 8.430 1.00 63.24 O ATOM 1805 CB LYS A 106 10.658 1.850 6.200 1.00 14.33 C ATOM 1806 CG LYS A 106 11.849 1.084 5.564 1.00 15.34 C ATOM 1807 CD LYS A 106 13.096 1.975 5.365 1.00 31.42 C ATOM 1808 CE LYS A 106 13.619 2.592 6.682 1.00 24.50 C ATOM 1809 NZ LYS A 106 13.929 1.563 7.712 1.00 61.34 N ATOM 0 H LYS A 106 8.554 2.301 7.852 1.00 21.22 H new ATOM 0 HA LYS A 106 8.996 0.727 5.364 1.00 64.14 H new ATOM 0 HB2 LYS A 106 10.456 2.735 5.597 1.00 14.33 H new ATOM 0 HB3 LYS A 106 10.961 2.200 7.187 1.00 14.33 H new ATOM 0 HG2 LYS A 106 12.111 0.237 6.198 1.00 15.34 H new ATOM 0 HG3 LYS A 106 11.541 0.678 4.601 1.00 15.34 H new ATOM 0 HD2 LYS A 106 13.889 1.383 4.909 1.00 31.42 H new ATOM 0 HD3 LYS A 106 12.855 2.776 4.667 1.00 31.42 H new ATOM 0 HE2 LYS A 106 14.516 3.175 6.475 1.00 24.50 H new ATOM 0 HE3 LYS A 106 12.874 3.283 7.076 1.00 24.50 H new ATOM 0 HZ1 LYS A 106 13.355 1.738 8.561 1.00 61.34 H new ATOM 0 HZ2 LYS A 106 13.711 0.618 7.336 1.00 61.34 H new ATOM 0 HZ3 LYS A 106 14.938 1.613 7.960 1.00 61.34 H new ATOM 1823 N VAL A 107 9.745 -1.349 6.537 1.00 11.31 N ATOM 1824 CA VAL A 107 10.129 -2.628 7.172 1.00 14.24 C ATOM 1825 C VAL A 107 11.020 -3.422 6.199 1.00 65.25 C ATOM 1826 O VAL A 107 11.322 -2.965 5.098 1.00 4.11 O ATOM 1827 CB VAL A 107 8.879 -3.501 7.605 1.00 51.31 C ATOM 1828 CG1 VAL A 107 8.114 -2.866 8.775 1.00 74.24 C ATOM 1829 CG2 VAL A 107 7.936 -3.767 6.419 1.00 4.44 C ATOM 0 H VAL A 107 9.609 -1.426 5.529 1.00 11.31 H new ATOM 0 HA VAL A 107 10.674 -2.394 8.087 1.00 14.24 H new ATOM 0 HB VAL A 107 9.270 -4.460 7.947 1.00 51.31 H new ATOM 0 HG11 VAL A 107 7.265 -3.497 9.040 1.00 74.24 H new ATOM 0 HG12 VAL A 107 8.777 -2.771 9.635 1.00 74.24 H new ATOM 0 HG13 VAL A 107 7.755 -1.879 8.482 1.00 74.24 H new ATOM 0 HG21 VAL A 107 7.091 -4.368 6.754 1.00 4.44 H new ATOM 0 HG22 VAL A 107 7.573 -2.819 6.023 1.00 4.44 H new ATOM 0 HG23 VAL A 107 8.476 -4.303 5.638 1.00 4.44 H new ATOM 1839 N THR A 108 11.431 -4.611 6.631 1.00 22.32 N ATOM 1840 CA THR A 108 12.260 -5.540 5.839 1.00 73.24 C ATOM 1841 C THR A 108 11.754 -6.961 6.079 1.00 73.34 C ATOM 1842 O THR A 108 11.603 -7.757 5.144 1.00 32.44 O ATOM 1843 CB THR A 108 13.776 -5.450 6.236 1.00 63.12 C ATOM 1844 OG1 THR A 108 14.229 -4.091 6.168 1.00 73.11 O ATOM 1845 CG2 THR A 108 14.680 -6.319 5.337 1.00 73.34 C ATOM 0 H THR A 108 11.198 -4.970 7.557 1.00 22.32 H new ATOM 0 HA THR A 108 12.179 -5.269 4.786 1.00 73.24 H new ATOM 0 HB THR A 108 13.850 -5.828 7.256 1.00 63.12 H new ATOM 0 HG1 THR A 108 13.748 -3.552 6.830 1.00 73.11 H new ATOM 0 HG21 THR A 108 15.717 -6.218 5.657 1.00 73.34 H new ATOM 0 HG22 THR A 108 14.376 -7.363 5.416 1.00 73.34 H new ATOM 0 HG23 THR A 108 14.586 -5.991 4.302 1.00 73.34 H new ATOM 1853 N ASP A 109 11.466 -7.240 7.356 1.00 52.33 N ATOM 1854 CA ASP A 109 11.046 -8.561 7.827 1.00 62.44 C ATOM 1855 C ASP A 109 9.606 -8.873 7.389 1.00 62.03 C ATOM 1856 O ASP A 109 8.759 -7.972 7.294 1.00 43.15 O ATOM 1857 CB ASP A 109 11.140 -8.641 9.374 1.00 50.24 C ATOM 1858 CG ASP A 109 12.569 -8.493 9.932 1.00 30.35 C ATOM 1859 OD1 ASP A 109 13.157 -7.393 9.812 1.00 1.45 O ATOM 1860 OD2 ASP A 109 13.109 -9.463 10.504 1.00 30.44 O ATOM 0 H ASP A 109 11.520 -6.544 8.099 1.00 52.33 H new ATOM 0 HA ASP A 109 11.716 -9.297 7.383 1.00 62.44 H new ATOM 0 HB2 ASP A 109 10.512 -7.861 9.805 1.00 50.24 H new ATOM 0 HB3 ASP A 109 10.732 -9.597 9.702 1.00 50.24 H new ATOM 1865 N ASP A 110 9.372 -10.166 7.138 1.00 34.11 N ATOM 1866 CA ASP A 110 8.039 -10.747 6.893 1.00 53.43 C ATOM 1867 C ASP A 110 7.093 -10.412 8.062 1.00 65.20 C ATOM 1868 O ASP A 110 5.990 -9.898 7.860 1.00 61.53 O ATOM 1869 CB ASP A 110 8.204 -12.290 6.735 1.00 74.01 C ATOM 1870 CG ASP A 110 6.901 -13.091 6.543 1.00 30.24 C ATOM 1871 OD1 ASP A 110 6.165 -13.301 7.531 1.00 23.35 O ATOM 1872 OD2 ASP A 110 6.622 -13.548 5.413 1.00 14.20 O ATOM 0 H ASP A 110 10.120 -10.858 7.098 1.00 34.11 H new ATOM 0 HA ASP A 110 7.603 -10.331 5.985 1.00 53.43 H new ATOM 0 HB2 ASP A 110 8.854 -12.481 5.881 1.00 74.01 H new ATOM 0 HB3 ASP A 110 8.716 -12.673 7.617 1.00 74.01 H new ATOM 1877 N GLU A 111 7.582 -10.681 9.285 1.00 13.15 N ATOM 1878 CA GLU A 111 6.811 -10.523 10.526 1.00 21.12 C ATOM 1879 C GLU A 111 6.453 -9.048 10.800 1.00 51.20 C ATOM 1880 O GLU A 111 5.341 -8.756 11.243 1.00 3.22 O ATOM 1881 CB GLU A 111 7.604 -11.144 11.706 1.00 52.22 C ATOM 1882 CG GLU A 111 8.982 -10.496 11.984 1.00 32.43 C ATOM 1883 CD GLU A 111 9.870 -11.320 12.932 1.00 11.11 C ATOM 1884 OE1 GLU A 111 10.466 -12.319 12.472 1.00 54.20 O ATOM 1885 OE2 GLU A 111 9.975 -10.985 14.130 1.00 72.40 O ATOM 0 H GLU A 111 8.533 -11.017 9.439 1.00 13.15 H new ATOM 0 HA GLU A 111 5.864 -11.051 10.416 1.00 21.12 H new ATOM 0 HB2 GLU A 111 6.997 -11.072 12.609 1.00 52.22 H new ATOM 0 HB3 GLU A 111 7.753 -12.205 11.505 1.00 52.22 H new ATOM 0 HG2 GLU A 111 9.506 -10.357 11.038 1.00 32.43 H new ATOM 0 HG3 GLU A 111 8.829 -9.506 12.413 1.00 32.43 H new ATOM 1892 N GLU A 112 7.390 -8.126 10.499 1.00 54.11 N ATOM 1893 CA GLU A 112 7.192 -6.684 10.725 1.00 5.00 C ATOM 1894 C GLU A 112 6.262 -6.073 9.658 1.00 41.04 C ATOM 1895 O GLU A 112 5.621 -5.045 9.907 1.00 54.13 O ATOM 1896 CB GLU A 112 8.550 -5.946 10.755 1.00 72.15 C ATOM 1897 CG GLU A 112 9.511 -6.387 11.879 1.00 35.51 C ATOM 1898 CD GLU A 112 8.938 -6.214 13.299 1.00 43.31 C ATOM 1899 OE1 GLU A 112 8.770 -5.057 13.752 1.00 73.03 O ATOM 1900 OE2 GLU A 112 8.654 -7.231 13.971 1.00 63.54 O ATOM 0 H GLU A 112 8.297 -8.360 10.096 1.00 54.11 H new ATOM 0 HA GLU A 112 6.711 -6.560 11.695 1.00 5.00 H new ATOM 0 HB2 GLU A 112 9.046 -6.092 9.796 1.00 72.15 H new ATOM 0 HB3 GLU A 112 8.363 -4.877 10.857 1.00 72.15 H new ATOM 0 HG2 GLU A 112 9.772 -7.435 11.729 1.00 35.51 H new ATOM 0 HG3 GLU A 112 10.435 -5.814 11.799 1.00 35.51 H new ATOM 1907 N ALA A 113 6.202 -6.710 8.472 1.00 22.44 N ATOM 1908 CA ALA A 113 5.294 -6.300 7.391 1.00 11.24 C ATOM 1909 C ALA A 113 3.844 -6.663 7.744 1.00 63.24 C ATOM 1910 O ALA A 113 2.967 -5.797 7.707 1.00 2.25 O ATOM 1911 CB ALA A 113 5.721 -6.939 6.068 1.00 50.12 C ATOM 0 H ALA A 113 6.779 -7.518 8.241 1.00 22.44 H new ATOM 0 HA ALA A 113 5.349 -5.218 7.274 1.00 11.24 H new ATOM 0 HB1 ALA A 113 5.040 -6.627 5.276 1.00 50.12 H new ATOM 0 HB2 ALA A 113 6.734 -6.622 5.821 1.00 50.12 H new ATOM 0 HB3 ALA A 113 5.694 -8.025 6.163 1.00 50.12 H new ATOM 1917 N LEU A 114 3.625 -7.941 8.140 1.00 73.23 N ATOM 1918 CA LEU A 114 2.304 -8.455 8.567 1.00 54.32 C ATOM 1919 C LEU A 114 1.805 -7.679 9.800 1.00 11.52 C ATOM 1920 O LEU A 114 0.605 -7.438 9.955 1.00 50.33 O ATOM 1921 CB LEU A 114 2.389 -9.971 8.909 1.00 1.44 C ATOM 1922 CG LEU A 114 2.791 -10.926 7.747 1.00 64.11 C ATOM 1923 CD1 LEU A 114 2.864 -12.392 8.222 1.00 44.24 C ATOM 1924 CD2 LEU A 114 1.833 -10.778 6.556 1.00 72.33 C ATOM 0 H LEU A 114 4.363 -8.645 8.172 1.00 73.23 H new ATOM 0 HA LEU A 114 1.603 -8.317 7.744 1.00 54.32 H new ATOM 0 HB2 LEU A 114 3.108 -10.098 9.718 1.00 1.44 H new ATOM 0 HB3 LEU A 114 1.419 -10.289 9.291 1.00 1.44 H new ATOM 0 HG LEU A 114 3.788 -10.639 7.414 1.00 64.11 H new ATOM 0 HD11 LEU A 114 3.147 -13.032 7.386 1.00 44.24 H new ATOM 0 HD12 LEU A 114 3.607 -12.481 9.015 1.00 44.24 H new ATOM 0 HD13 LEU A 114 1.890 -12.701 8.601 1.00 44.24 H new ATOM 0 HD21 LEU A 114 2.137 -11.456 5.758 1.00 72.33 H new ATOM 0 HD22 LEU A 114 0.819 -11.021 6.873 1.00 72.33 H new ATOM 0 HD23 LEU A 114 1.863 -9.752 6.190 1.00 72.33 H new ATOM 1936 N LYS A 115 2.774 -7.302 10.654 1.00 21.14 N ATOM 1937 CA LYS A 115 2.551 -6.493 11.854 1.00 73.24 C ATOM 1938 C LYS A 115 1.839 -5.178 11.508 1.00 24.14 C ATOM 1939 O LYS A 115 0.736 -4.954 11.983 1.00 1.24 O ATOM 1940 CB LYS A 115 3.914 -6.242 12.550 1.00 73.00 C ATOM 1941 CG LYS A 115 3.935 -5.198 13.690 1.00 52.14 C ATOM 1942 CD LYS A 115 5.368 -5.003 14.245 1.00 63.52 C ATOM 1943 CE LYS A 115 5.509 -3.802 15.187 1.00 31.35 C ATOM 1944 NZ LYS A 115 6.917 -3.619 15.642 1.00 44.32 N ATOM 0 H LYS A 115 3.752 -7.559 10.521 1.00 21.14 H new ATOM 0 HA LYS A 115 1.897 -7.030 12.541 1.00 73.24 H new ATOM 0 HB2 LYS A 115 4.269 -7.191 12.952 1.00 73.00 H new ATOM 0 HB3 LYS A 115 4.630 -5.929 11.790 1.00 73.00 H new ATOM 0 HG2 LYS A 115 3.552 -4.246 13.322 1.00 52.14 H new ATOM 0 HG3 LYS A 115 3.272 -5.519 14.493 1.00 52.14 H new ATOM 0 HD2 LYS A 115 5.668 -5.906 14.776 1.00 63.52 H new ATOM 0 HD3 LYS A 115 6.057 -4.881 13.410 1.00 63.52 H new ATOM 0 HE2 LYS A 115 5.171 -2.899 14.678 1.00 31.35 H new ATOM 0 HE3 LYS A 115 4.862 -3.941 16.053 1.00 31.35 H new ATOM 0 HZ1 LYS A 115 7.142 -2.604 15.675 1.00 44.32 H new ATOM 0 HZ2 LYS A 115 7.032 -4.030 16.590 1.00 44.32 H new ATOM 0 HZ3 LYS A 115 7.561 -4.095 14.978 1.00 44.32 H new ATOM 1958 N ILE A 116 2.454 -4.349 10.632 1.00 44.44 N ATOM 1959 CA ILE A 116 1.935 -3.001 10.305 1.00 11.21 C ATOM 1960 C ILE A 116 0.658 -3.069 9.420 1.00 5.12 C ATOM 1961 O ILE A 116 -0.162 -2.148 9.442 1.00 32.22 O ATOM 1962 CB ILE A 116 3.052 -2.079 9.666 1.00 51.15 C ATOM 1963 CG1 ILE A 116 4.291 -1.983 10.622 1.00 12.54 C ATOM 1964 CG2 ILE A 116 2.515 -0.660 9.338 1.00 72.43 C ATOM 1965 CD1 ILE A 116 5.386 -1.018 10.172 1.00 41.42 C ATOM 0 H ILE A 116 3.313 -4.592 10.138 1.00 44.44 H new ATOM 0 HA ILE A 116 1.641 -2.536 11.246 1.00 11.21 H new ATOM 0 HB ILE A 116 3.358 -2.539 8.727 1.00 51.15 H new ATOM 0 HG12 ILE A 116 3.945 -1.679 11.610 1.00 12.54 H new ATOM 0 HG13 ILE A 116 4.726 -2.977 10.728 1.00 12.54 H new ATOM 0 HG21 ILE A 116 3.314 -0.061 8.901 1.00 72.43 H new ATOM 0 HG22 ILE A 116 1.691 -0.738 8.629 1.00 72.43 H new ATOM 0 HG23 ILE A 116 2.163 -0.184 10.253 1.00 72.43 H new ATOM 0 HD11 ILE A 116 6.198 -1.024 10.900 1.00 41.42 H new ATOM 0 HD12 ILE A 116 5.768 -1.329 9.200 1.00 41.42 H new ATOM 0 HD13 ILE A 116 4.975 -0.011 10.095 1.00 41.42 H new ATOM 1977 N VAL A 117 0.488 -4.170 8.653 1.00 41.31 N ATOM 1978 CA VAL A 117 -0.788 -4.465 7.955 1.00 3.43 C ATOM 1979 C VAL A 117 -1.949 -4.555 8.986 1.00 33.23 C ATOM 1980 O VAL A 117 -2.989 -3.908 8.823 1.00 34.13 O ATOM 1981 CB VAL A 117 -0.688 -5.793 7.100 1.00 61.30 C ATOM 1982 CG1 VAL A 117 -2.061 -6.224 6.531 1.00 1.44 C ATOM 1983 CG2 VAL A 117 0.338 -5.635 5.949 1.00 62.54 C ATOM 0 H VAL A 117 1.216 -4.868 8.501 1.00 41.31 H new ATOM 0 HA VAL A 117 -0.994 -3.649 7.262 1.00 3.43 H new ATOM 0 HB VAL A 117 -0.346 -6.578 7.775 1.00 61.30 H new ATOM 0 HG11 VAL A 117 -1.943 -7.140 5.952 1.00 1.44 H new ATOM 0 HG12 VAL A 117 -2.756 -6.401 7.352 1.00 1.44 H new ATOM 0 HG13 VAL A 117 -2.452 -5.435 5.888 1.00 1.44 H new ATOM 0 HG21 VAL A 117 0.388 -6.561 5.377 1.00 62.54 H new ATOM 0 HG22 VAL A 117 0.028 -4.820 5.295 1.00 62.54 H new ATOM 0 HG23 VAL A 117 1.320 -5.412 6.365 1.00 62.54 H new ATOM 1993 N ARG A 118 -1.726 -5.329 10.069 1.00 63.02 N ATOM 1994 CA ARG A 118 -2.705 -5.501 11.167 1.00 32.25 C ATOM 1995 C ARG A 118 -2.847 -4.204 12.001 1.00 71.14 C ATOM 1996 O ARG A 118 -3.949 -3.850 12.435 1.00 62.33 O ATOM 1997 CB ARG A 118 -2.280 -6.674 12.088 1.00 71.05 C ATOM 1998 CG ARG A 118 -2.216 -8.060 11.402 1.00 61.42 C ATOM 1999 CD ARG A 118 -1.749 -9.164 12.371 1.00 4.32 C ATOM 2000 NE ARG A 118 -2.673 -9.328 13.513 1.00 11.32 N ATOM 2001 CZ ARG A 118 -2.338 -9.747 14.749 1.00 34.02 C ATOM 2002 NH1 ARG A 118 -1.078 -10.064 15.054 1.00 22.22 N ATOM 2003 NH2 ARG A 118 -3.280 -9.826 15.680 1.00 64.14 N ATOM 0 H ARG A 118 -0.862 -5.853 10.208 1.00 63.02 H new ATOM 0 HA ARG A 118 -3.672 -5.727 10.718 1.00 32.25 H new ATOM 0 HB2 ARG A 118 -1.300 -6.449 12.508 1.00 71.05 H new ATOM 0 HB3 ARG A 118 -2.979 -6.731 12.923 1.00 71.05 H new ATOM 0 HG2 ARG A 118 -3.200 -8.315 11.009 1.00 61.42 H new ATOM 0 HG3 ARG A 118 -1.536 -8.012 10.552 1.00 61.42 H new ATOM 0 HD2 ARG A 118 -1.668 -10.108 11.832 1.00 4.32 H new ATOM 0 HD3 ARG A 118 -0.753 -8.922 12.743 1.00 4.32 H new ATOM 0 HE ARG A 118 -3.655 -9.103 13.350 1.00 11.32 H new ATOM 0 HH11 ARG A 118 -0.348 -9.991 14.345 1.00 22.22 H new ATOM 0 HH12 ARG A 118 -0.845 -10.379 15.996 1.00 22.22 H new ATOM 0 HH21 ARG A 118 -4.242 -9.571 15.455 1.00 64.14 H new ATOM 0 HH22 ARG A 118 -3.042 -10.141 16.620 1.00 64.14 H new ATOM 2017 N GLU A 119 -1.704 -3.531 12.241 1.00 23.11 N ATOM 2018 CA GLU A 119 -1.645 -2.263 12.981 1.00 73.32 C ATOM 2019 C GLU A 119 -2.436 -1.159 12.282 1.00 1.31 C ATOM 2020 O GLU A 119 -3.090 -0.379 12.955 1.00 62.04 O ATOM 2021 CB GLU A 119 -0.179 -1.806 13.208 1.00 52.25 C ATOM 2022 CG GLU A 119 0.627 -2.673 14.195 1.00 22.52 C ATOM 2023 CD GLU A 119 -0.008 -2.762 15.596 1.00 1.32 C ATOM 2024 OE1 GLU A 119 0.086 -1.777 16.363 1.00 54.32 O ATOM 2025 OE2 GLU A 119 -0.582 -3.818 15.947 1.00 75.32 O ATOM 0 H GLU A 119 -0.792 -3.858 11.923 1.00 23.11 H new ATOM 0 HA GLU A 119 -2.105 -2.447 13.952 1.00 73.32 H new ATOM 0 HB2 GLU A 119 0.337 -1.800 12.248 1.00 52.25 H new ATOM 0 HB3 GLU A 119 -0.187 -0.779 13.572 1.00 52.25 H new ATOM 0 HG2 GLU A 119 0.727 -3.678 13.786 1.00 22.52 H new ATOM 0 HG3 GLU A 119 1.634 -2.265 14.286 1.00 22.52 H new ATOM 2032 N PHE A 120 -2.388 -1.113 10.930 1.00 11.24 N ATOM 2033 CA PHE A 120 -3.134 -0.110 10.135 1.00 61.33 C ATOM 2034 C PHE A 120 -4.613 -0.120 10.514 1.00 52.21 C ATOM 2035 O PHE A 120 -5.229 0.930 10.642 1.00 54.33 O ATOM 2036 CB PHE A 120 -2.983 -0.370 8.611 1.00 35.04 C ATOM 2037 CG PHE A 120 -3.953 0.446 7.734 1.00 2.45 C ATOM 2038 CD1 PHE A 120 -3.709 1.792 7.455 1.00 11.23 C ATOM 2039 CD2 PHE A 120 -5.127 -0.132 7.231 1.00 72.21 C ATOM 2040 CE1 PHE A 120 -4.601 2.528 6.696 1.00 74.44 C ATOM 2041 CE2 PHE A 120 -6.016 0.608 6.483 1.00 4.24 C ATOM 2042 CZ PHE A 120 -5.753 1.934 6.214 1.00 63.21 C ATOM 0 H PHE A 120 -1.839 -1.761 10.366 1.00 11.24 H new ATOM 0 HA PHE A 120 -2.711 0.869 10.361 1.00 61.33 H new ATOM 0 HB2 PHE A 120 -1.960 -0.140 8.314 1.00 35.04 H new ATOM 0 HB3 PHE A 120 -3.140 -1.431 8.417 1.00 35.04 H new ATOM 0 HD1 PHE A 120 -2.815 2.263 7.836 1.00 11.23 H new ATOM 0 HD2 PHE A 120 -5.337 -1.172 7.433 1.00 72.21 H new ATOM 0 HE1 PHE A 120 -4.398 3.566 6.480 1.00 74.44 H new ATOM 0 HE2 PHE A 120 -6.919 0.149 6.107 1.00 4.24 H new ATOM 0 HZ PHE A 120 -6.450 2.511 5.624 1.00 63.21 H new ATOM 2052 N MET A 121 -5.148 -1.327 10.697 1.00 1.12 N ATOM 2053 CA MET A 121 -6.573 -1.543 10.950 1.00 23.10 C ATOM 2054 C MET A 121 -7.025 -0.820 12.238 1.00 23.32 C ATOM 2055 O MET A 121 -8.118 -0.251 12.286 1.00 13.31 O ATOM 2056 CB MET A 121 -6.867 -3.062 11.027 1.00 53.41 C ATOM 2057 CG MET A 121 -6.271 -3.875 9.862 1.00 33.15 C ATOM 2058 SD MET A 121 -6.714 -3.224 8.238 1.00 52.30 S ATOM 2059 CE MET A 121 -5.845 -4.331 7.124 1.00 11.34 C ATOM 0 H MET A 121 -4.602 -2.188 10.674 1.00 1.12 H new ATOM 0 HA MET A 121 -7.144 -1.119 10.124 1.00 23.10 H new ATOM 0 HB2 MET A 121 -6.474 -3.451 11.966 1.00 53.41 H new ATOM 0 HB3 MET A 121 -7.946 -3.212 11.047 1.00 53.41 H new ATOM 0 HG2 MET A 121 -5.185 -3.890 9.956 1.00 33.15 H new ATOM 0 HG3 MET A 121 -6.611 -4.908 9.937 1.00 33.15 H new ATOM 0 HE1 MET A 121 -5.380 -3.753 6.326 1.00 11.34 H new ATOM 0 HE2 MET A 121 -5.076 -4.872 7.675 1.00 11.34 H new ATOM 0 HE3 MET A 121 -6.551 -5.041 6.693 1.00 11.34 H new ATOM 2069 N GLN A 122 -6.139 -0.808 13.264 1.00 22.53 N ATOM 2070 CA GLN A 122 -6.416 -0.161 14.564 1.00 72.23 C ATOM 2071 C GLN A 122 -5.924 1.308 14.599 1.00 21.34 C ATOM 2072 O GLN A 122 -6.490 2.132 15.324 1.00 10.21 O ATOM 2073 CB GLN A 122 -5.813 -0.992 15.733 1.00 50.24 C ATOM 2074 CG GLN A 122 -4.274 -1.093 15.762 1.00 5.14 C ATOM 2075 CD GLN A 122 -3.742 -1.930 16.927 1.00 3.25 C ATOM 2076 OE1 GLN A 122 -3.503 -1.416 18.020 1.00 62.33 O ATOM 2077 NE2 GLN A 122 -3.562 -3.226 16.714 1.00 23.33 N ATOM 0 H GLN A 122 -5.219 -1.245 13.211 1.00 22.53 H new ATOM 0 HA GLN A 122 -7.498 -0.132 14.692 1.00 72.23 H new ATOM 0 HB2 GLN A 122 -6.147 -0.555 16.674 1.00 50.24 H new ATOM 0 HB3 GLN A 122 -6.223 -2.001 15.686 1.00 50.24 H new ATOM 0 HG2 GLN A 122 -3.928 -1.528 14.824 1.00 5.14 H new ATOM 0 HG3 GLN A 122 -3.852 -0.090 15.823 1.00 5.14 H new ATOM 0 HE21 GLN A 122 -3.768 -3.626 15.799 1.00 23.33 H new ATOM 0 HE22 GLN A 122 -3.218 -3.823 17.466 1.00 23.33 H new ATOM 2086 N LYS A 123 -4.893 1.633 13.789 1.00 43.13 N ATOM 2087 CA LYS A 123 -4.288 2.989 13.742 1.00 73.21 C ATOM 2088 C LYS A 123 -5.087 3.919 12.816 1.00 63.55 C ATOM 2089 O LYS A 123 -4.972 5.143 12.908 1.00 64.34 O ATOM 2090 CB LYS A 123 -2.809 2.917 13.275 1.00 32.11 C ATOM 2091 CG LYS A 123 -1.854 2.161 14.228 1.00 33.04 C ATOM 2092 CD LYS A 123 -1.730 2.797 15.633 1.00 64.32 C ATOM 2093 CE LYS A 123 -1.121 4.210 15.606 1.00 61.14 C ATOM 2094 NZ LYS A 123 -0.951 4.760 16.975 1.00 54.32 N ATOM 0 H LYS A 123 -4.456 0.968 13.151 1.00 43.13 H new ATOM 0 HA LYS A 123 -4.317 3.399 14.752 1.00 73.21 H new ATOM 0 HB2 LYS A 123 -2.776 2.436 12.297 1.00 32.11 H new ATOM 0 HB3 LYS A 123 -2.436 3.933 13.143 1.00 32.11 H new ATOM 0 HG2 LYS A 123 -2.203 1.134 14.335 1.00 33.04 H new ATOM 0 HG3 LYS A 123 -0.865 2.116 13.773 1.00 33.04 H new ATOM 0 HD2 LYS A 123 -2.717 2.842 16.093 1.00 64.32 H new ATOM 0 HD3 LYS A 123 -1.114 2.155 16.263 1.00 64.32 H new ATOM 0 HE2 LYS A 123 -0.154 4.180 15.103 1.00 61.14 H new ATOM 0 HE3 LYS A 123 -1.763 4.872 15.025 1.00 61.14 H new ATOM 0 HZ1 LYS A 123 -0.538 5.713 16.918 1.00 54.32 H new ATOM 0 HZ2 LYS A 123 -1.877 4.811 17.446 1.00 54.32 H new ATOM 0 HZ3 LYS A 123 -0.319 4.141 17.522 1.00 54.32 H new ATOM 2108 N ALA A 124 -5.894 3.323 11.922 1.00 11.25 N ATOM 2109 CA ALA A 124 -6.830 4.054 11.047 1.00 3.32 C ATOM 2110 C ALA A 124 -8.187 4.233 11.742 1.00 3.22 C ATOM 2111 O ALA A 124 -9.190 4.556 11.095 1.00 50.34 O ATOM 2112 CB ALA A 124 -6.978 3.329 9.698 1.00 10.23 C ATOM 0 H ALA A 124 -5.916 2.313 11.784 1.00 11.25 H new ATOM 0 HA ALA A 124 -6.426 5.047 10.849 1.00 3.32 H new ATOM 0 HB1 ALA A 124 -7.672 3.880 9.063 1.00 10.23 H new ATOM 0 HB2 ALA A 124 -6.006 3.270 9.208 1.00 10.23 H new ATOM 0 HB3 ALA A 124 -7.361 2.323 9.866 1.00 10.23 H new ATOM 2118 N GLY A 125 -8.197 4.012 13.071 1.00 54.32 N ATOM 2119 CA GLY A 125 -9.372 4.183 13.889 1.00 30.21 C ATOM 2120 C GLY A 125 -10.351 3.045 13.728 1.00 74.22 C ATOM 2121 O GLY A 125 -11.365 3.191 13.030 1.00 31.44 O ATOM 0 H GLY A 125 -7.375 3.708 13.593 1.00 54.32 H new ATOM 0 HA2 GLY A 125 -9.076 4.260 14.935 1.00 30.21 H new ATOM 0 HA3 GLY A 125 -9.862 5.121 13.627 1.00 30.21 H new ATOM 2125 N SER A 126 -10.041 1.890 14.339 1.00 43.12 N ATOM 2126 CA SER A 126 -10.994 0.782 14.458 1.00 44.21 C ATOM 2127 C SER A 126 -12.031 1.141 15.539 1.00 21.12 C ATOM 2128 O SER A 126 -12.025 0.611 16.665 1.00 54.10 O ATOM 2129 CB SER A 126 -10.250 -0.531 14.781 1.00 62.34 C ATOM 2130 OG SER A 126 -9.422 -0.378 15.925 1.00 23.40 O ATOM 0 H SER A 126 -9.131 1.702 14.760 1.00 43.12 H new ATOM 0 HA SER A 126 -11.516 0.625 13.514 1.00 44.21 H new ATOM 0 HB2 SER A 126 -10.972 -1.329 14.954 1.00 62.34 H new ATOM 0 HB3 SER A 126 -9.644 -0.830 13.926 1.00 62.34 H new ATOM 0 HG SER A 126 -9.969 -0.102 16.690 1.00 23.40 H new ATOM 2136 N LEU A 127 -12.889 2.101 15.181 1.00 51.12 N ATOM 2137 CA LEU A 127 -13.833 2.729 16.097 1.00 52.12 C ATOM 2138 C LEU A 127 -14.965 1.759 16.412 1.00 55.23 C ATOM 2139 O LEU A 127 -15.732 1.384 15.510 1.00 53.54 O ATOM 2140 CB LEU A 127 -14.385 4.039 15.471 1.00 42.52 C ATOM 2141 CG LEU A 127 -13.315 5.104 15.071 1.00 71.12 C ATOM 2142 CD1 LEU A 127 -13.953 6.347 14.419 1.00 45.55 C ATOM 2143 CD2 LEU A 127 -12.445 5.490 16.280 1.00 22.21 C ATOM 0 H LEU A 127 -12.944 2.466 14.230 1.00 51.12 H new ATOM 0 HA LEU A 127 -13.325 2.982 17.027 1.00 52.12 H new ATOM 0 HB2 LEU A 127 -14.962 3.780 14.583 1.00 42.52 H new ATOM 0 HB3 LEU A 127 -15.077 4.495 16.179 1.00 42.52 H new ATOM 0 HG LEU A 127 -12.668 4.649 14.321 1.00 71.12 H new ATOM 0 HD11 LEU A 127 -13.173 7.061 14.157 1.00 45.55 H new ATOM 0 HD12 LEU A 127 -14.490 6.050 13.518 1.00 45.55 H new ATOM 0 HD13 LEU A 127 -14.648 6.810 15.120 1.00 45.55 H new ATOM 0 HD21 LEU A 127 -11.708 6.233 15.975 1.00 22.21 H new ATOM 0 HD22 LEU A 127 -13.077 5.906 17.065 1.00 22.21 H new ATOM 0 HD23 LEU A 127 -11.933 4.605 16.658 1.00 22.21 H new ATOM 2155 N GLU A 128 -15.036 1.322 17.674 1.00 3.21 N ATOM 2156 CA GLU A 128 -16.122 0.473 18.156 1.00 2.34 C ATOM 2157 C GLU A 128 -17.379 1.326 18.385 1.00 53.53 C ATOM 2158 O GLU A 128 -17.693 1.728 19.516 1.00 53.44 O ATOM 2159 CB GLU A 128 -15.700 -0.298 19.437 1.00 42.24 C ATOM 2160 CG GLU A 128 -14.461 -1.197 19.244 1.00 43.22 C ATOM 2161 CD GLU A 128 -14.057 -1.957 20.516 1.00 5.24 C ATOM 2162 OE1 GLU A 128 -14.624 -3.035 20.779 1.00 33.14 O ATOM 2163 OE2 GLU A 128 -13.189 -1.470 21.268 1.00 50.41 O ATOM 0 H GLU A 128 -14.342 1.548 18.386 1.00 3.21 H new ATOM 0 HA GLU A 128 -16.353 -0.278 17.401 1.00 2.34 H new ATOM 0 HB2 GLU A 128 -15.496 0.420 20.231 1.00 42.24 H new ATOM 0 HB3 GLU A 128 -16.535 -0.914 19.771 1.00 42.24 H new ATOM 0 HG2 GLU A 128 -14.662 -1.915 18.449 1.00 43.22 H new ATOM 0 HG3 GLU A 128 -13.623 -0.583 18.915 1.00 43.22 H new ATOM 2170 N HIS A 129 -18.026 1.683 17.267 1.00 72.32 N ATOM 2171 CA HIS A 129 -19.366 2.284 17.257 1.00 0.34 C ATOM 2172 C HIS A 129 -20.369 1.150 17.530 1.00 31.15 C ATOM 2173 O HIS A 129 -21.447 1.352 18.097 1.00 51.31 O ATOM 2174 CB HIS A 129 -19.618 2.973 15.885 1.00 2.23 C ATOM 2175 CG HIS A 129 -20.735 3.984 15.894 1.00 44.34 C ATOM 2176 ND1 HIS A 129 -20.511 5.343 15.811 1.00 14.40 N ATOM 2177 CD2 HIS A 129 -22.083 3.838 15.929 1.00 64.41 C ATOM 2178 CE1 HIS A 129 -21.660 5.980 15.816 1.00 35.53 C ATOM 2179 NE2 HIS A 129 -22.631 5.091 15.879 1.00 5.23 N ATOM 0 H HIS A 129 -17.629 1.561 16.335 1.00 72.32 H new ATOM 0 HA HIS A 129 -19.474 3.054 18.021 1.00 0.34 H new ATOM 0 HB2 HIS A 129 -18.700 3.466 15.565 1.00 2.23 H new ATOM 0 HB3 HIS A 129 -19.843 2.207 15.143 1.00 2.23 H new ATOM 0 HD2 HIS A 129 -22.624 2.905 15.986 1.00 64.41 H new ATOM 0 HE1 HIS A 129 -21.787 7.052 15.775 1.00 35.53 H new ATOM 0 HE2 HIS A 129 -23.629 5.303 15.889 1.00 5.23 H new ATOM 2188 N HIS A 130 -19.961 -0.051 17.090 1.00 20.42 N ATOM 2189 CA HIS A 130 -20.560 -1.324 17.464 1.00 34.34 C ATOM 2190 C HIS A 130 -19.503 -2.088 18.291 1.00 13.43 C ATOM 2191 O HIS A 130 -18.524 -2.594 17.723 1.00 60.42 O ATOM 2192 CB HIS A 130 -20.943 -2.139 16.195 1.00 73.31 C ATOM 2193 CG HIS A 130 -21.717 -1.368 15.150 1.00 21.50 C ATOM 2194 ND1 HIS A 130 -21.343 -1.325 13.825 1.00 74.44 N ATOM 2195 CD2 HIS A 130 -22.868 -0.660 15.227 1.00 55.44 C ATOM 2196 CE1 HIS A 130 -22.224 -0.628 13.144 1.00 1.43 C ATOM 2197 NE2 HIS A 130 -23.162 -0.214 13.965 1.00 30.01 N ATOM 0 H HIS A 130 -19.179 -0.157 16.444 1.00 20.42 H new ATOM 0 HA HIS A 130 -21.472 -1.169 18.040 1.00 34.34 H new ATOM 0 HB2 HIS A 130 -20.030 -2.523 15.739 1.00 73.31 H new ATOM 0 HB3 HIS A 130 -21.535 -3.002 16.501 1.00 73.31 H new ATOM 0 HD2 HIS A 130 -23.448 -0.480 16.120 1.00 55.44 H new ATOM 0 HE1 HIS A 130 -22.184 -0.428 12.083 1.00 1.43 H new ATOM 0 HE2 HIS A 130 -23.974 0.346 13.706 1.00 30.01 H new ATOM 2206 N HIS A 131 -19.647 -2.096 19.630 1.00 34.51 N ATOM 2207 CA HIS A 131 -18.748 -2.858 20.529 1.00 3.33 C ATOM 2208 C HIS A 131 -19.066 -4.361 20.384 1.00 1.11 C ATOM 2209 O HIS A 131 -19.907 -4.920 21.097 1.00 11.20 O ATOM 2210 CB HIS A 131 -18.910 -2.347 21.983 1.00 72.20 C ATOM 2211 CG HIS A 131 -17.986 -2.959 23.001 1.00 33.22 C ATOM 2212 ND1 HIS A 131 -16.615 -2.840 22.938 1.00 52.04 N ATOM 2213 CD2 HIS A 131 -18.246 -3.654 24.137 1.00 45.45 C ATOM 2214 CE1 HIS A 131 -16.076 -3.433 23.982 1.00 63.13 C ATOM 2215 NE2 HIS A 131 -17.042 -3.932 24.725 1.00 4.52 N ATOM 0 H HIS A 131 -20.380 -1.582 20.118 1.00 34.51 H new ATOM 0 HA HIS A 131 -17.703 -2.710 20.258 1.00 3.33 H new ATOM 0 HB2 HIS A 131 -18.760 -1.267 21.987 1.00 72.20 H new ATOM 0 HB3 HIS A 131 -19.938 -2.527 22.299 1.00 72.20 H new ATOM 0 HD1 HIS A 131 -16.098 -2.366 22.197 1.00 52.04 H new ATOM 0 HD2 HIS A 131 -19.221 -3.935 24.508 1.00 45.45 H new ATOM 0 HE1 HIS A 131 -15.019 -3.499 24.194 1.00 63.13 H new ATOM 2224 N HIS A 132 -18.417 -4.973 19.388 1.00 74.42 N ATOM 2225 CA HIS A 132 -18.743 -6.312 18.880 1.00 52.54 C ATOM 2226 C HIS A 132 -17.699 -7.350 19.319 1.00 63.44 C ATOM 2227 O HIS A 132 -16.527 -7.271 18.917 1.00 65.04 O ATOM 2228 CB HIS A 132 -18.827 -6.241 17.333 1.00 55.45 C ATOM 2229 CG HIS A 132 -19.165 -7.540 16.651 1.00 20.24 C ATOM 2230 ND1 HIS A 132 -18.329 -8.154 15.747 1.00 61.30 N ATOM 2231 CD2 HIS A 132 -20.267 -8.327 16.727 1.00 35.02 C ATOM 2232 CE1 HIS A 132 -18.897 -9.253 15.306 1.00 22.05 C ATOM 2233 NE2 HIS A 132 -20.071 -9.381 15.883 1.00 74.12 N ATOM 0 H HIS A 132 -17.632 -4.542 18.900 1.00 74.42 H new ATOM 0 HA HIS A 132 -19.700 -6.630 19.293 1.00 52.54 H new ATOM 0 HB2 HIS A 132 -19.577 -5.499 17.059 1.00 55.45 H new ATOM 0 HB3 HIS A 132 -17.871 -5.885 16.949 1.00 55.45 H new ATOM 0 HD2 HIS A 132 -21.138 -8.152 17.341 1.00 35.02 H new ATOM 0 HE1 HIS A 132 -18.470 -9.938 14.588 1.00 22.05 H new ATOM 0 HE2 HIS A 132 -20.729 -10.144 15.725 1.00 74.12 H new ATOM 2242 N HIS A 133 -18.133 -8.317 20.151 1.00 3.34 N ATOM 2243 CA HIS A 133 -17.320 -9.502 20.498 1.00 14.11 C ATOM 2244 C HIS A 133 -17.295 -10.481 19.299 1.00 51.45 C ATOM 2245 O HIS A 133 -18.077 -10.320 18.351 1.00 73.51 O ATOM 2246 CB HIS A 133 -17.873 -10.202 21.777 1.00 63.34 C ATOM 2247 CG HIS A 133 -19.227 -10.870 21.616 1.00 63.10 C ATOM 2248 ND1 HIS A 133 -19.373 -12.162 21.156 1.00 33.42 N ATOM 2249 CD2 HIS A 133 -20.485 -10.428 21.854 1.00 51.41 C ATOM 2250 CE1 HIS A 133 -20.649 -12.474 21.119 1.00 45.42 C ATOM 2251 NE2 HIS A 133 -21.341 -11.442 21.538 1.00 32.42 N ATOM 0 H HIS A 133 -19.049 -8.301 20.599 1.00 3.34 H new ATOM 0 HA HIS A 133 -16.301 -9.181 20.715 1.00 14.11 H new ATOM 0 HB2 HIS A 133 -17.152 -10.953 22.101 1.00 63.34 H new ATOM 0 HB3 HIS A 133 -17.943 -9.462 22.575 1.00 63.34 H new ATOM 0 HD1 HIS A 133 -18.608 -12.780 20.886 1.00 33.42 H new ATOM 0 HD2 HIS A 133 -20.760 -9.452 22.226 1.00 51.41 H new ATOM 0 HE1 HIS A 133 -21.058 -13.420 20.798 1.00 45.42 H new ATOM 2260 N HIS A 134 -16.412 -11.498 19.345 1.00 44.44 N ATOM 2261 CA HIS A 134 -16.297 -12.489 18.251 1.00 10.32 C ATOM 2262 C HIS A 134 -17.566 -13.387 18.186 1.00 23.01 C ATOM 2263 O HIS A 134 -18.172 -13.504 17.102 1.00 34.32 O ATOM 2264 CB HIS A 134 -14.996 -13.336 18.370 1.00 73.12 C ATOM 2265 CG HIS A 134 -14.911 -14.244 19.573 1.00 74.14 C ATOM 2266 ND1 HIS A 134 -14.496 -13.811 20.814 1.00 14.44 N ATOM 2267 CD2 HIS A 134 -15.163 -15.572 19.711 1.00 41.33 C ATOM 2268 CE1 HIS A 134 -14.508 -14.825 21.652 1.00 1.31 C ATOM 2269 NE2 HIS A 134 -14.903 -15.899 21.009 1.00 33.02 N ATOM 2270 OXT HIS A 134 -17.987 -13.917 19.239 1.00 37.41 O ATOM 0 H HIS A 134 -15.771 -11.656 20.122 1.00 44.44 H new ATOM 0 HA HIS A 134 -16.227 -11.940 17.312 1.00 10.32 H new ATOM 0 HB2 HIS A 134 -14.898 -13.945 17.471 1.00 73.12 H new ATOM 0 HB3 HIS A 134 -14.143 -12.657 18.390 1.00 73.12 H new ATOM 0 HD2 HIS A 134 -15.505 -16.243 18.937 1.00 41.33 H new ATOM 0 HE1 HIS A 134 -14.237 -14.781 22.697 1.00 1.31 H new ATOM 0 HE2 HIS A 134 -15.000 -16.830 21.415 1.00 33.02 H new TER 2279 HIS A 134