USER MOD reduce.3.24.130724 H: found=0, std=0, add=808, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 808 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 27 CYS SG : rot -172:sc= -5.58! USER MOD Set 1.2: A 62 TYR OH : rot -38:sc= -0.472 USER MOD Set 2.1: A 14 ASN :FLIP amide:sc= -1.17 F(o=-3.9,f=-1.7) USER MOD Set 2.2: A 78 MET CE :methyl -145:sc= -0.567 (180deg=0) USER MOD Single : A 4 TYR OH : rot 70:sc= -4.4! USER MOD Single : A 6 THR OG1 : rot 79:sc= 0.00207 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 THR OG1 : rot 97:sc= 0.376 USER MOD Single : A 13 ASN : amide:sc= -0.157 K(o=-0.16,f=-1.6!) USER MOD Single : A 16 THR OG1 : rot 180:sc= -0.809 USER MOD Single : A 22 GLN : amide:sc= -1.32 K(o=-1.3,f=-8.6!) USER MOD Single : A 24 LYS NZ :NH3+ -150:sc= 0.345 (180deg=-0.85) USER MOD Single : A 25 SER OG : rot 87:sc= 1.2 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 SER OG : rot 180:sc= -1.8 USER MOD Single : A 40 THR OG1 : rot 11:sc= 0.602 USER MOD Single : A 41 THR OG1 : rot 160:sc= 0.549 USER MOD Single : A 43 SER OG : rot -41:sc= -1.2 USER MOD Single : A 47 SER OG : rot 100:sc= 1.25 USER MOD Single : A 51 SER OG : rot 98:sc= 1.08 USER MOD Single : A 52 HIS : no HD1:sc= -1.27 K(o=-1.3,f=-1.8) USER MOD Single : A 53 ASN : amide:sc= -0.208 X(o=-0.21,f=0) USER MOD Single : A 54 LYS NZ :NH3+ -149:sc= 0.153 (180deg=-0.0375) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 ASN :FLIP amide:sc= 0 F(o=-0.96,f=0) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 65 HIS : no HD1:sc= -4.01! C(o=-4!,f=-4.6!) USER MOD Single : A 70 SER OG : rot -130:sc= -0.55 USER MOD Single : A 77 THR OG1 : rot 96:sc= 1.13 USER MOD Single : A 82 TYR OH : rot 165:sc= -1.1 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0.432 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0287) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 TYR OH : rot 30:sc= -0.0534 USER MOD Single : A 109 LYS NZ :NH3+ -168:sc= -0.0242 (180deg=-0.199) USER MOD ----------------------------------------------------------------- ATOM 20 N ALA A 2 -3.917 15.011 8.840 1.00 35.11 N ATOM 21 CA ALA A 2 -5.292 14.542 8.966 1.00 35.11 C ATOM 22 C ALA A 2 -5.570 13.442 7.960 1.00 35.11 C ATOM 23 O ALA A 2 -6.090 12.384 8.312 1.00 35.11 O ATOM 24 CB ALA A 2 -6.277 15.693 8.798 1.00 35.11 C ATOM 0 HA ALA A 2 -5.424 14.133 9.968 1.00 35.11 H new ATOM 0 HB1 ALA A 2 -7.296 15.317 8.896 1.00 35.11 H new ATOM 0 HB2 ALA A 2 -6.092 16.445 9.565 1.00 35.11 H new ATOM 0 HB3 ALA A 2 -6.149 16.141 7.812 1.00 35.11 H new ATOM 30 N GLU A 3 -5.178 13.671 6.713 1.00 71.76 N ATOM 31 CA GLU A 3 -5.345 12.664 5.676 1.00 71.76 C ATOM 32 C GLU A 3 -4.515 11.454 6.046 1.00 71.76 C ATOM 33 O GLU A 3 -4.940 10.313 5.875 1.00 71.76 O ATOM 34 CB GLU A 3 -4.915 13.224 4.329 1.00 71.76 C ATOM 35 CG GLU A 3 -5.776 14.380 3.883 1.00 71.76 C ATOM 36 CD GLU A 3 -7.173 13.951 3.474 1.00 71.76 C ATOM 37 OE1 GLU A 3 -7.386 12.738 3.257 1.00 71.76 O ATOM 38 OE2 GLU A 3 -8.055 14.828 3.370 1.00 71.76 O ATOM 0 H GLU A 3 -4.745 14.539 6.398 1.00 71.76 H new ATOM 0 HA GLU A 3 -6.393 12.375 5.597 1.00 71.76 H new ATOM 0 HB2 GLU A 3 -3.877 13.550 4.389 1.00 71.76 H new ATOM 0 HB3 GLU A 3 -4.957 12.433 3.580 1.00 71.76 H new ATOM 0 HG2 GLU A 3 -5.847 15.107 4.692 1.00 71.76 H new ATOM 0 HG3 GLU A 3 -5.295 14.882 3.044 1.00 71.76 H new ATOM 45 N TYR A 4 -3.329 11.722 6.583 1.00112.05 N ATOM 46 CA TYR A 4 -2.446 10.661 7.012 1.00112.05 C ATOM 47 C TYR A 4 -3.088 9.870 8.145 1.00112.05 C ATOM 48 O TYR A 4 -3.032 8.640 8.162 1.00112.05 O ATOM 49 CB TYR A 4 -1.084 11.208 7.441 1.00112.05 C ATOM 50 CG TYR A 4 -0.104 10.116 7.761 1.00112.05 C ATOM 51 CD1 TYR A 4 0.249 9.177 6.802 1.00112.05 C ATOM 52 CD2 TYR A 4 0.454 10.012 9.023 1.00112.05 C ATOM 53 CE1 TYR A 4 1.137 8.163 7.092 1.00112.05 C ATOM 54 CE2 TYR A 4 1.339 9.002 9.323 1.00112.05 C ATOM 55 CZ TYR A 4 1.679 8.080 8.354 1.00112.05 C ATOM 56 OH TYR A 4 2.559 7.068 8.649 1.00112.05 O ATOM 0 H TYR A 4 -2.965 12.664 6.728 1.00112.05 H new ATOM 0 HA TYR A 4 -2.281 9.995 6.165 1.00112.05 H new ATOM 0 HB2 TYR A 4 -0.680 11.834 6.645 1.00112.05 H new ATOM 0 HB3 TYR A 4 -1.211 11.846 8.315 1.00112.05 H new ATOM 0 HD1 TYR A 4 -0.179 9.242 5.812 1.00112.05 H new ATOM 0 HD2 TYR A 4 0.191 10.733 9.783 1.00112.05 H new ATOM 0 HE1 TYR A 4 1.405 7.440 6.335 1.00112.05 H new ATOM 0 HE2 TYR A 4 1.766 8.931 10.313 1.00112.05 H new ATOM 0 HH TYR A 4 3.402 7.218 8.173 1.00112.05 H new ATOM 66 N GLY A 5 -3.726 10.581 9.087 1.00 23.54 N ATOM 67 CA GLY A 5 -4.390 9.905 10.189 1.00 23.54 C ATOM 68 C GLY A 5 -5.460 8.964 9.682 1.00 23.54 C ATOM 69 O GLY A 5 -5.562 7.818 10.120 1.00 23.54 O ATOM 0 H GLY A 5 -3.791 11.599 9.102 1.00 23.54 H new ATOM 0 HA2 GLY A 5 -3.657 9.348 10.773 1.00 23.54 H new ATOM 0 HA3 GLY A 5 -4.836 10.642 10.857 1.00 23.54 H new ATOM 73 N THR A 6 -6.238 9.458 8.727 1.00 90.84 N ATOM 74 CA THR A 6 -7.289 8.689 8.102 1.00 90.84 C ATOM 75 C THR A 6 -6.694 7.599 7.227 1.00 90.84 C ATOM 76 O THR A 6 -7.211 6.489 7.176 1.00 90.84 O ATOM 77 CB THR A 6 -8.199 9.618 7.278 1.00 90.84 C ATOM 78 OG1 THR A 6 -8.834 10.569 8.141 1.00 90.84 O ATOM 79 CG2 THR A 6 -9.246 8.840 6.517 1.00 90.84 C ATOM 0 H THR A 6 -6.151 10.409 8.368 1.00 90.84 H new ATOM 0 HA THR A 6 -7.891 8.212 8.875 1.00 90.84 H new ATOM 0 HB THR A 6 -7.574 10.139 6.552 1.00 90.84 H new ATOM 0 HG1 THR A 6 -8.202 11.286 8.359 1.00 90.84 H new ATOM 0 HG21 THR A 6 -9.869 9.529 5.947 1.00 90.84 H new ATOM 0 HG22 THR A 6 -8.758 8.144 5.835 1.00 90.84 H new ATOM 0 HG23 THR A 6 -9.868 8.284 7.219 1.00 90.84 H new ATOM 87 N LEU A 7 -5.590 7.911 6.558 1.00 63.89 N ATOM 88 CA LEU A 7 -4.914 6.932 5.712 1.00 63.89 C ATOM 89 C LEU A 7 -4.631 5.667 6.515 1.00 63.89 C ATOM 90 O LEU A 7 -5.056 4.569 6.155 1.00 63.89 O ATOM 91 CB LEU A 7 -3.603 7.518 5.174 1.00 63.89 C ATOM 92 CG LEU A 7 -2.634 6.494 4.576 1.00 63.89 C ATOM 93 CD1 LEU A 7 -3.290 5.734 3.430 1.00 63.89 C ATOM 94 CD2 LEU A 7 -1.334 7.159 4.145 1.00 63.89 C ATOM 0 H LEU A 7 -5.145 8.829 6.584 1.00 63.89 H new ATOM 0 HA LEU A 7 -5.559 6.683 4.869 1.00 63.89 H new ATOM 0 HB2 LEU A 7 -3.840 8.260 4.412 1.00 63.89 H new ATOM 0 HB3 LEU A 7 -3.098 8.044 5.984 1.00 63.89 H new ATOM 0 HG LEU A 7 -2.383 5.767 5.349 1.00 63.89 H new ATOM 0 HD11 LEU A 7 -2.583 5.012 3.020 1.00 63.89 H new ATOM 0 HD12 LEU A 7 -4.172 5.210 3.799 1.00 63.89 H new ATOM 0 HD13 LEU A 7 -3.585 6.436 2.650 1.00 63.89 H new ATOM 0 HD21 LEU A 7 -0.664 6.409 3.724 1.00 63.89 H new ATOM 0 HD22 LEU A 7 -1.546 7.919 3.393 1.00 63.89 H new ATOM 0 HD23 LEU A 7 -0.860 7.625 5.009 1.00 63.89 H new ATOM 106 N LEU A 8 -3.926 5.853 7.618 1.00 67.93 N ATOM 107 CA LEU A 8 -3.592 4.759 8.507 1.00 67.93 C ATOM 108 C LEU A 8 -4.857 4.106 9.044 1.00 67.93 C ATOM 109 O LEU A 8 -4.941 2.890 9.145 1.00 67.93 O ATOM 110 CB LEU A 8 -2.726 5.274 9.657 1.00 67.93 C ATOM 111 CG LEU A 8 -1.206 5.292 9.403 1.00 67.93 C ATOM 112 CD1 LEU A 8 -0.870 5.662 7.963 1.00 67.93 C ATOM 113 CD2 LEU A 8 -0.516 6.245 10.368 1.00 67.93 C ATOM 0 H LEU A 8 -3.572 6.761 7.919 1.00 67.93 H new ATOM 0 HA LEU A 8 -3.031 4.008 7.950 1.00 67.93 H new ATOM 0 HB2 LEU A 8 -3.046 6.287 9.901 1.00 67.93 H new ATOM 0 HB3 LEU A 8 -2.920 4.659 10.535 1.00 67.93 H new ATOM 0 HG LEU A 8 -0.838 4.281 9.575 1.00 67.93 H new ATOM 0 HD11 LEU A 8 0.212 5.662 7.830 1.00 67.93 H new ATOM 0 HD12 LEU A 8 -1.319 4.935 7.286 1.00 67.93 H new ATOM 0 HD13 LEU A 8 -1.263 6.654 7.741 1.00 67.93 H new ATOM 0 HD21 LEU A 8 0.557 6.245 10.175 1.00 67.93 H new ATOM 0 HD22 LEU A 8 -0.910 7.252 10.229 1.00 67.93 H new ATOM 0 HD23 LEU A 8 -0.700 5.922 11.393 1.00 67.93 H new ATOM 125 N GLN A 9 -5.849 4.929 9.363 1.00 42.21 N ATOM 126 CA GLN A 9 -7.118 4.443 9.870 1.00 42.21 C ATOM 127 C GLN A 9 -7.811 3.599 8.801 1.00 42.21 C ATOM 128 O GLN A 9 -8.435 2.583 9.107 1.00 42.21 O ATOM 129 CB GLN A 9 -7.945 5.671 10.302 1.00 42.21 C ATOM 130 CG GLN A 9 -9.455 5.511 10.284 1.00 42.21 C ATOM 131 CD GLN A 9 -10.094 5.770 11.636 1.00 42.21 C ATOM 132 OE1 GLN A 9 -10.470 6.897 11.954 1.00 42.21 O ATOM 133 NE2 GLN A 9 -10.215 4.720 12.440 1.00 42.21 N ATOM 0 H GLN A 9 -5.793 5.944 9.277 1.00 42.21 H new ATOM 0 HA GLN A 9 -6.989 3.792 10.735 1.00 42.21 H new ATOM 0 HB2 GLN A 9 -7.643 5.947 11.312 1.00 42.21 H new ATOM 0 HB3 GLN A 9 -7.682 6.505 9.651 1.00 42.21 H new ATOM 0 HG2 GLN A 9 -9.879 6.197 9.550 1.00 42.21 H new ATOM 0 HG3 GLN A 9 -9.704 4.501 9.958 1.00 42.21 H new ATOM 0 HE21 GLN A 9 -9.889 3.803 12.134 1.00 42.21 H new ATOM 0 HE22 GLN A 9 -10.634 4.830 13.363 1.00 42.21 H new ATOM 142 N ASP A 10 -7.695 4.026 7.553 1.00 76.39 N ATOM 143 CA ASP A 10 -8.309 3.308 6.447 1.00 76.39 C ATOM 144 C ASP A 10 -7.751 1.898 6.329 1.00 76.39 C ATOM 145 O ASP A 10 -8.514 0.934 6.336 1.00 76.39 O ATOM 146 CB ASP A 10 -8.109 4.068 5.134 1.00 76.39 C ATOM 147 CG ASP A 10 -8.857 5.386 5.101 1.00 76.39 C ATOM 148 OD1 ASP A 10 -9.707 5.613 5.989 1.00 76.39 O ATOM 149 OD2 ASP A 10 -8.593 6.194 4.185 1.00 76.39 O ATOM 0 H ASP A 10 -7.182 4.865 7.281 1.00 76.39 H new ATOM 0 HA ASP A 10 -9.377 3.235 6.651 1.00 76.39 H new ATOM 0 HB2 ASP A 10 -7.045 4.255 4.985 1.00 76.39 H new ATOM 0 HB3 ASP A 10 -8.442 3.445 4.304 1.00 76.39 H new ATOM 154 N LEU A 11 -6.424 1.757 6.259 1.00140.58 N ATOM 155 CA LEU A 11 -5.837 0.429 6.189 1.00140.58 C ATOM 156 C LEU A 11 -6.135 -0.299 7.483 1.00140.58 C ATOM 157 O LEU A 11 -6.387 -1.496 7.474 1.00140.58 O ATOM 158 CB LEU A 11 -4.347 0.483 5.870 1.00140.58 C ATOM 159 CG LEU A 11 -3.436 0.917 7.004 1.00140.58 C ATOM 160 CD1 LEU A 11 -3.098 -0.273 7.897 1.00140.58 C ATOM 161 CD2 LEU A 11 -2.178 1.556 6.423 1.00140.58 C ATOM 0 H LEU A 11 -5.756 2.528 6.250 1.00140.58 H new ATOM 0 HA LEU A 11 -6.284 -0.127 5.365 1.00140.58 H new ATOM 0 HB2 LEU A 11 -4.032 -0.506 5.536 1.00140.58 H new ATOM 0 HB3 LEU A 11 -4.200 1.164 5.032 1.00140.58 H new ATOM 0 HG LEU A 11 -3.945 1.656 7.623 1.00140.58 H new ATOM 0 HD11 LEU A 11 -2.444 0.053 8.706 1.00140.58 H new ATOM 0 HD12 LEU A 11 -4.016 -0.686 8.316 1.00140.58 H new ATOM 0 HD13 LEU A 11 -2.592 -1.038 7.308 1.00140.58 H new ATOM 0 HD21 LEU A 11 -1.521 1.869 7.234 1.00140.58 H new ATOM 0 HD22 LEU A 11 -1.659 0.832 5.795 1.00140.58 H new ATOM 0 HD23 LEU A 11 -2.454 2.424 5.824 1.00140.58 H new ATOM 173 N THR A 12 -6.182 0.452 8.594 1.00103.83 N ATOM 174 CA THR A 12 -6.534 -0.125 9.875 1.00103.83 C ATOM 175 C THR A 12 -7.945 -0.702 9.786 1.00103.83 C ATOM 176 O THR A 12 -8.229 -1.776 10.309 1.00103.83 O ATOM 177 CB THR A 12 -6.476 0.899 11.018 1.00103.83 C ATOM 178 OG1 THR A 12 -5.187 1.505 11.086 1.00103.83 O ATOM 179 CG2 THR A 12 -6.759 0.219 12.330 1.00103.83 C ATOM 0 H THR A 12 -5.980 1.452 8.619 1.00103.83 H new ATOM 0 HA THR A 12 -5.805 -0.904 10.100 1.00103.83 H new ATOM 0 HB THR A 12 -7.226 1.666 10.824 1.00103.83 H new ATOM 0 HG1 THR A 12 -5.204 2.364 10.614 1.00103.83 H new ATOM 0 HG21 THR A 12 -6.716 0.951 13.136 1.00103.83 H new ATOM 0 HG22 THR A 12 -7.752 -0.230 12.300 1.00103.83 H new ATOM 0 HG23 THR A 12 -6.014 -0.558 12.505 1.00103.83 H new ATOM 187 N ASN A 13 -8.816 -0.001 9.070 1.00 36.97 N ATOM 188 CA ASN A 13 -10.178 -0.481 8.862 1.00 36.97 C ATOM 189 C ASN A 13 -10.138 -1.777 8.056 1.00 36.97 C ATOM 190 O ASN A 13 -10.984 -2.656 8.223 1.00 36.97 O ATOM 191 CB ASN A 13 -11.034 0.576 8.161 1.00 36.97 C ATOM 192 CG ASN A 13 -11.313 1.769 9.054 1.00 36.97 C ATOM 193 OD1 ASN A 13 -11.200 1.681 10.277 1.00 36.97 O ATOM 194 ND2 ASN A 13 -11.676 2.894 8.449 1.00 36.97 N ATOM 0 H ASN A 13 -8.607 0.894 8.627 1.00 36.97 H new ATOM 0 HA ASN A 13 -10.638 -0.677 9.831 1.00 36.97 H new ATOM 0 HB2 ASN A 13 -10.526 0.912 7.257 1.00 36.97 H new ATOM 0 HB3 ASN A 13 -11.978 0.129 7.849 1.00 36.97 H new ATOM 0 HD21 ASN A 13 -11.873 3.729 9.001 1.00 36.97 H new ATOM 0 HD22 ASN A 13 -11.757 2.923 7.433 1.00 36.97 H new ATOM 201 N ASN A 14 -9.113 -1.901 7.207 1.00 84.59 N ATOM 202 CA ASN A 14 -8.912 -3.101 6.401 1.00 84.59 C ATOM 203 C ASN A 14 -7.936 -4.060 7.094 1.00 84.59 C ATOM 204 O ASN A 14 -7.616 -5.124 6.562 1.00 84.59 O ATOM 205 CB ASN A 14 -8.377 -2.721 5.020 1.00 84.59 C ATOM 206 CG ASN A 14 -9.361 -1.882 4.229 1.00 84.59 C ATOM 207 OD1 ASN A 14 -9.271 -0.567 4.378 1.00 84.59 O flip ATOM 208 ND2 ASN A 14 -10.197 -2.411 3.495 1.00 84.59 N flip ATOM 0 H ASN A 14 -8.408 -1.178 7.062 1.00 84.59 H new ATOM 0 HA ASN A 14 -9.872 -3.605 6.287 1.00 84.59 H new ATOM 0 HB2 ASN A 14 -7.444 -2.170 5.134 1.00 84.59 H new ATOM 0 HB3 ASN A 14 -8.145 -3.628 4.461 1.00 84.59 H new ATOM 0 HD21 ASN A 14 -10.231 -3.427 3.410 1.00 84.59 H new ATOM 0 HD22 ASN A 14 -10.855 -1.833 2.972 1.00 84.59 H new ATOM 215 N ILE A 15 -7.451 -3.662 8.273 1.00120.44 N ATOM 216 CA ILE A 15 -6.507 -4.444 9.032 1.00120.44 C ATOM 217 C ILE A 15 -7.195 -5.325 10.078 1.00120.44 C ATOM 218 O ILE A 15 -7.830 -4.830 11.008 1.00120.44 O ATOM 219 CB ILE A 15 -5.454 -3.486 9.681 1.00120.44 C ATOM 220 CG1 ILE A 15 -4.071 -4.050 9.522 1.00120.44 C ATOM 221 CG2 ILE A 15 -5.694 -3.164 11.153 1.00120.44 C ATOM 222 CD1 ILE A 15 -3.884 -5.375 10.220 1.00120.44 C ATOM 0 H ILE A 15 -7.711 -2.782 8.719 1.00120.44 H new ATOM 0 HA ILE A 15 -5.997 -5.130 8.355 1.00120.44 H new ATOM 0 HB ILE A 15 -5.564 -2.545 9.143 1.00120.44 H new ATOM 0 HG12 ILE A 15 -3.856 -4.173 8.461 1.00120.44 H new ATOM 0 HG13 ILE A 15 -3.347 -3.335 9.914 1.00120.44 H new ATOM 0 HG21 ILE A 15 -4.912 -2.494 11.511 1.00120.44 H new ATOM 0 HG22 ILE A 15 -6.665 -2.682 11.266 1.00120.44 H new ATOM 0 HG23 ILE A 15 -5.676 -4.086 11.735 1.00120.44 H new ATOM 0 HD11 ILE A 15 -2.864 -5.727 10.066 1.00120.44 H new ATOM 0 HD12 ILE A 15 -4.068 -5.253 11.287 1.00120.44 H new ATOM 0 HD13 ILE A 15 -4.585 -6.103 9.812 1.00120.44 H new ATOM 234 N THR A 16 -7.033 -6.630 9.940 1.00158.94 N ATOM 235 CA THR A 16 -7.599 -7.551 10.902 1.00158.94 C ATOM 236 C THR A 16 -6.601 -7.795 12.001 1.00158.94 C ATOM 237 O THR A 16 -5.399 -7.613 11.808 1.00158.94 O ATOM 238 CB THR A 16 -7.952 -8.914 10.299 1.00158.94 C ATOM 239 OG1 THR A 16 -6.769 -9.578 9.845 1.00158.94 O ATOM 240 CG2 THR A 16 -8.924 -8.768 9.161 1.00158.94 C ATOM 0 H THR A 16 -6.518 -7.070 9.177 1.00158.94 H new ATOM 0 HA THR A 16 -8.516 -7.088 11.267 1.00158.94 H new ATOM 0 HB THR A 16 -8.423 -9.513 11.079 1.00158.94 H new ATOM 0 HG1 THR A 16 -7.008 -10.448 9.463 1.00158.94 H new ATOM 0 HG21 THR A 16 -9.156 -9.751 8.753 1.00158.94 H new ATOM 0 HG22 THR A 16 -9.840 -8.300 9.522 1.00158.94 H new ATOM 0 HG23 THR A 16 -8.482 -8.147 8.382 1.00158.94 H new ATOM 248 N LEU A 17 -7.086 -8.246 13.139 1.00 50.69 N ATOM 249 CA LEU A 17 -6.194 -8.555 14.245 1.00 50.69 C ATOM 250 C LEU A 17 -5.212 -9.638 13.817 1.00 50.69 C ATOM 251 O LEU A 17 -4.043 -9.623 14.198 1.00 50.69 O ATOM 252 CB LEU A 17 -6.967 -8.996 15.487 1.00 50.69 C ATOM 253 CG LEU A 17 -6.092 -9.385 16.680 1.00 50.69 C ATOM 254 CD1 LEU A 17 -5.054 -8.304 16.963 1.00 50.69 C ATOM 255 CD2 LEU A 17 -6.953 -9.636 17.909 1.00 50.69 C ATOM 0 H LEU A 17 -8.076 -8.406 13.325 1.00 50.69 H new ATOM 0 HA LEU A 17 -5.648 -7.649 14.508 1.00 50.69 H new ATOM 0 HB2 LEU A 17 -7.632 -8.188 15.790 1.00 50.69 H new ATOM 0 HB3 LEU A 17 -7.597 -9.846 15.224 1.00 50.69 H new ATOM 0 HG LEU A 17 -5.564 -10.306 16.434 1.00 50.69 H new ATOM 0 HD11 LEU A 17 -4.443 -8.601 17.815 1.00 50.69 H new ATOM 0 HD12 LEU A 17 -4.418 -8.173 16.088 1.00 50.69 H new ATOM 0 HD13 LEU A 17 -5.559 -7.365 17.189 1.00 50.69 H new ATOM 0 HD21 LEU A 17 -6.316 -9.912 18.749 1.00 50.69 H new ATOM 0 HD22 LEU A 17 -7.508 -8.731 18.156 1.00 50.69 H new ATOM 0 HD23 LEU A 17 -7.653 -10.446 17.704 1.00 50.69 H new ATOM 267 N GLU A 18 -5.704 -10.565 12.998 1.00107.93 N ATOM 268 CA GLU A 18 -4.877 -11.644 12.488 1.00107.93 C ATOM 269 C GLU A 18 -3.856 -11.100 11.499 1.00107.93 C ATOM 270 O GLU A 18 -2.669 -11.432 11.556 1.00107.93 O ATOM 271 CB GLU A 18 -5.752 -12.701 11.815 1.00107.93 C ATOM 272 CG GLU A 18 -6.620 -13.470 12.795 1.00107.93 C ATOM 273 CD GLU A 18 -5.808 -14.279 13.788 1.00107.93 C ATOM 274 OE1 GLU A 18 -4.596 -14.469 13.551 1.00107.93 O ATOM 275 OE2 GLU A 18 -6.386 -14.726 14.801 1.00107.93 O ATOM 0 H GLU A 18 -6.672 -10.586 12.676 1.00107.93 H new ATOM 0 HA GLU A 18 -4.346 -12.105 13.321 1.00107.93 H new ATOM 0 HB2 GLU A 18 -6.391 -12.218 11.075 1.00107.93 H new ATOM 0 HB3 GLU A 18 -5.114 -13.402 11.276 1.00107.93 H new ATOM 0 HG2 GLU A 18 -7.256 -12.770 13.337 1.00107.93 H new ATOM 0 HG3 GLU A 18 -7.280 -14.138 12.242 1.00107.93 H new ATOM 282 N ASP A 19 -4.327 -10.243 10.600 1.00 35.40 N ATOM 283 CA ASP A 19 -3.459 -9.635 9.607 1.00 35.40 C ATOM 284 C ASP A 19 -2.343 -8.844 10.276 1.00 35.40 C ATOM 285 O ASP A 19 -1.201 -8.853 9.816 1.00 35.40 O ATOM 286 CB ASP A 19 -4.264 -8.740 8.663 1.00 35.40 C ATOM 287 CG ASP A 19 -5.104 -9.535 7.679 1.00 35.40 C ATOM 288 OD1 ASP A 19 -4.938 -10.772 7.615 1.00 35.40 O ATOM 289 OD2 ASP A 19 -5.928 -8.919 6.972 1.00 35.40 O ATOM 0 H ASP A 19 -5.304 -9.956 10.541 1.00 35.40 H new ATOM 0 HA ASP A 19 -3.005 -10.432 9.019 1.00 35.40 H new ATOM 0 HB2 ASP A 19 -4.915 -8.092 9.250 1.00 35.40 H new ATOM 0 HB3 ASP A 19 -3.582 -8.092 8.112 1.00 35.40 H new ATOM 294 N LEU A 20 -2.676 -8.163 11.370 1.00 45.47 N ATOM 295 CA LEU A 20 -1.688 -7.376 12.098 1.00 45.47 C ATOM 296 C LEU A 20 -0.527 -8.241 12.552 1.00 45.47 C ATOM 297 O LEU A 20 0.629 -7.872 12.387 1.00 45.47 O ATOM 298 CB LEU A 20 -2.316 -6.685 13.312 1.00 45.47 C ATOM 299 CG LEU A 20 -2.389 -5.164 13.231 1.00 45.47 C ATOM 300 CD1 LEU A 20 -2.861 -4.600 14.562 1.00 45.47 C ATOM 301 CD2 LEU A 20 -1.041 -4.555 12.833 1.00 45.47 C ATOM 0 H LEU A 20 -3.615 -8.141 11.768 1.00 45.47 H new ATOM 0 HA LEU A 20 -1.315 -6.615 11.413 1.00 45.47 H new ATOM 0 HB2 LEU A 20 -3.325 -7.074 13.449 1.00 45.47 H new ATOM 0 HB3 LEU A 20 -1.746 -6.958 14.200 1.00 45.47 H new ATOM 0 HG LEU A 20 -3.106 -4.898 12.454 1.00 45.47 H new ATOM 0 HD11 LEU A 20 -2.912 -3.513 14.499 1.00 45.47 H new ATOM 0 HD12 LEU A 20 -3.849 -4.996 14.795 1.00 45.47 H new ATOM 0 HD13 LEU A 20 -2.161 -4.886 15.347 1.00 45.47 H new ATOM 0 HD21 LEU A 20 -1.132 -3.470 12.785 1.00 45.47 H new ATOM 0 HD22 LEU A 20 -0.287 -4.824 13.573 1.00 45.47 H new ATOM 0 HD23 LEU A 20 -0.743 -4.937 11.857 1.00 45.47 H new ATOM 313 N GLU A 21 -0.841 -9.401 13.119 1.00 91.26 N ATOM 314 CA GLU A 21 0.195 -10.310 13.592 1.00 91.26 C ATOM 315 C GLU A 21 1.141 -10.668 12.455 1.00 91.26 C ATOM 316 O GLU A 21 2.316 -10.956 12.682 1.00 91.26 O ATOM 317 CB GLU A 21 -0.409 -11.579 14.186 1.00 91.26 C ATOM 318 CG GLU A 21 -1.417 -11.316 15.295 1.00 91.26 C ATOM 319 CD GLU A 21 -1.910 -12.586 15.965 1.00 91.26 C ATOM 320 OE1 GLU A 21 -1.496 -13.686 15.539 1.00 91.26 O ATOM 321 OE2 GLU A 21 -2.716 -12.481 16.914 1.00 91.26 O ATOM 0 H GLU A 21 -1.796 -9.731 13.261 1.00 91.26 H new ATOM 0 HA GLU A 21 0.753 -9.800 14.377 1.00 91.26 H new ATOM 0 HB2 GLU A 21 -0.896 -12.145 13.392 1.00 91.26 H new ATOM 0 HB3 GLU A 21 0.394 -12.204 14.577 1.00 91.26 H new ATOM 0 HG2 GLU A 21 -0.962 -10.669 16.045 1.00 91.26 H new ATOM 0 HG3 GLU A 21 -2.269 -10.775 14.883 1.00 91.26 H new ATOM 328 N GLN A 22 0.636 -10.607 11.224 1.00 87.96 N ATOM 329 CA GLN A 22 1.474 -10.886 10.071 1.00 87.96 C ATOM 330 C GLN A 22 2.410 -9.713 9.871 1.00 87.96 C ATOM 331 O GLN A 22 3.612 -9.886 9.672 1.00 87.96 O ATOM 332 CB GLN A 22 0.648 -11.141 8.813 1.00 87.96 C ATOM 333 CG GLN A 22 1.501 -11.577 7.633 1.00 87.96 C ATOM 334 CD GLN A 22 0.674 -12.030 6.445 1.00 87.96 C ATOM 335 OE1 GLN A 22 -0.553 -12.092 6.516 1.00 87.96 O ATOM 336 NE2 GLN A 22 1.346 -12.354 5.346 1.00 87.96 N ATOM 0 H GLN A 22 -0.332 -10.371 11.006 1.00 87.96 H new ATOM 0 HA GLN A 22 2.043 -11.797 10.256 1.00 87.96 H new ATOM 0 HB2 GLN A 22 -0.097 -11.909 9.021 1.00 87.96 H new ATOM 0 HB3 GLN A 22 0.105 -10.233 8.549 1.00 87.96 H new ATOM 0 HG2 GLN A 22 2.142 -10.750 7.329 1.00 87.96 H new ATOM 0 HG3 GLN A 22 2.156 -12.390 7.945 1.00 87.96 H new ATOM 0 HE21 GLN A 22 2.364 -12.287 5.332 1.00 87.96 H new ATOM 0 HE22 GLN A 22 0.844 -12.669 4.516 1.00 87.96 H new ATOM 345 N LEU A 23 1.852 -8.507 9.992 1.00 99.30 N ATOM 346 CA LEU A 23 2.635 -7.291 9.898 1.00 99.30 C ATOM 347 C LEU A 23 3.661 -7.315 11.021 1.00 99.30 C ATOM 348 O LEU A 23 4.847 -7.101 10.808 1.00 99.30 O ATOM 349 CB LEU A 23 1.723 -6.066 10.056 1.00 99.30 C ATOM 350 CG LEU A 23 0.555 -5.974 9.071 1.00 99.30 C ATOM 351 CD1 LEU A 23 -0.248 -4.700 9.308 1.00 99.30 C ATOM 352 CD2 LEU A 23 1.054 -6.036 7.631 1.00 99.30 C ATOM 0 H LEU A 23 0.857 -8.355 10.156 1.00 99.30 H new ATOM 0 HA LEU A 23 3.128 -7.230 8.928 1.00 99.30 H new ATOM 0 HB2 LEU A 23 1.320 -6.064 11.069 1.00 99.30 H new ATOM 0 HB3 LEU A 23 2.332 -5.168 9.954 1.00 99.30 H new ATOM 0 HG LEU A 23 -0.100 -6.829 9.240 1.00 99.30 H new ATOM 0 HD11 LEU A 23 -1.074 -4.653 8.598 1.00 99.30 H new ATOM 0 HD12 LEU A 23 -0.643 -4.702 10.324 1.00 99.30 H new ATOM 0 HD13 LEU A 23 0.398 -3.832 9.172 1.00 99.30 H new ATOM 0 HD21 LEU A 23 0.206 -5.969 6.949 1.00 99.30 H new ATOM 0 HD22 LEU A 23 1.735 -5.206 7.446 1.00 99.30 H new ATOM 0 HD23 LEU A 23 1.577 -6.978 7.468 1.00 99.30 H new ATOM 364 N LYS A 24 3.163 -7.634 12.215 1.00114.71 N ATOM 365 CA LYS A 24 3.988 -7.738 13.416 1.00114.71 C ATOM 366 C LYS A 24 5.110 -8.751 13.217 1.00114.71 C ATOM 367 O LYS A 24 6.234 -8.536 13.662 1.00114.71 O ATOM 368 CB LYS A 24 3.130 -8.170 14.612 1.00114.71 C ATOM 369 CG LYS A 24 2.097 -7.138 15.046 1.00114.71 C ATOM 370 CD LYS A 24 1.340 -7.592 16.290 1.00114.71 C ATOM 371 CE LYS A 24 -0.150 -7.740 16.026 1.00114.71 C ATOM 372 NZ LYS A 24 -0.853 -8.373 17.176 1.00114.71 N ATOM 0 H LYS A 24 2.175 -7.828 12.376 1.00114.71 H new ATOM 0 HA LYS A 24 4.423 -6.758 13.610 1.00114.71 H new ATOM 0 HB2 LYS A 24 2.616 -9.098 14.360 1.00114.71 H new ATOM 0 HB3 LYS A 24 3.786 -8.388 15.455 1.00114.71 H new ATOM 0 HG2 LYS A 24 2.593 -6.188 15.247 1.00114.71 H new ATOM 0 HG3 LYS A 24 1.392 -6.964 14.233 1.00114.71 H new ATOM 0 HD2 LYS A 24 1.744 -8.544 16.633 1.00114.71 H new ATOM 0 HD3 LYS A 24 1.496 -6.872 17.093 1.00114.71 H new ATOM 0 HE2 LYS A 24 -0.584 -6.760 15.829 1.00114.71 H new ATOM 0 HE3 LYS A 24 -0.303 -8.342 15.130 1.00114.71 H new ATOM 0 HZ1 LYS A 24 -1.674 -8.908 16.829 1.00114.71 H new ATOM 0 HZ2 LYS A 24 -0.202 -9.018 17.668 1.00114.71 H new ATOM 0 HZ3 LYS A 24 -1.174 -7.635 17.835 1.00114.71 H new ATOM 386 N SER A 25 4.801 -9.854 12.537 1.00 75.52 N ATOM 387 CA SER A 25 5.797 -10.890 12.267 1.00 75.52 C ATOM 388 C SER A 25 6.900 -10.298 11.415 1.00 75.52 C ATOM 389 O SER A 25 8.086 -10.522 11.653 1.00 75.52 O ATOM 390 CB SER A 25 5.160 -12.088 11.552 1.00 75.52 C ATOM 391 OG SER A 25 4.134 -12.668 12.338 1.00 75.52 O ATOM 0 H SER A 25 3.873 -10.053 12.164 1.00 75.52 H new ATOM 0 HA SER A 25 6.209 -11.246 13.211 1.00 75.52 H new ATOM 0 HB2 SER A 25 4.750 -11.767 10.594 1.00 75.52 H new ATOM 0 HB3 SER A 25 5.924 -12.835 11.338 1.00 75.52 H new ATOM 0 HG SER A 25 3.287 -12.209 12.160 1.00 75.52 H new ATOM 397 N ALA A 26 6.482 -9.495 10.448 1.00 32.46 N ATOM 398 CA ALA A 26 7.401 -8.801 9.575 1.00 32.46 C ATOM 399 C ALA A 26 8.111 -7.715 10.367 1.00 32.46 C ATOM 400 O ALA A 26 9.295 -7.446 10.162 1.00 32.46 O ATOM 401 CB ALA A 26 6.655 -8.216 8.386 1.00 32.46 C ATOM 0 H ALA A 26 5.498 -9.310 10.251 1.00 32.46 H new ATOM 0 HA ALA A 26 8.144 -9.498 9.188 1.00 32.46 H new ATOM 0 HB1 ALA A 26 7.358 -7.696 7.736 1.00 32.46 H new ATOM 0 HB2 ALA A 26 6.171 -9.019 7.829 1.00 32.46 H new ATOM 0 HB3 ALA A 26 5.900 -7.514 8.740 1.00 32.46 H new ATOM 407 N CYS A 27 7.369 -7.109 11.295 1.00 54.89 N ATOM 408 CA CYS A 27 7.916 -6.067 12.149 1.00 54.89 C ATOM 409 C CYS A 27 8.683 -6.656 13.319 1.00 54.89 C ATOM 410 O CYS A 27 9.238 -5.921 14.123 1.00 54.89 O ATOM 411 CB CYS A 27 6.821 -5.167 12.708 1.00 54.89 C ATOM 412 SG CYS A 27 5.708 -4.477 11.473 1.00 54.89 S ATOM 0 H CYS A 27 6.388 -7.326 11.470 1.00 54.89 H new ATOM 0 HA CYS A 27 8.588 -5.481 11.522 1.00 54.89 H new ATOM 0 HB2 CYS A 27 6.234 -5.737 13.428 1.00 54.89 H new ATOM 0 HB3 CYS A 27 7.287 -4.348 13.255 1.00 54.89 H new ATOM 0 HG CYS A 27 4.923 -3.607 12.035 1.00 54.89 H new ATOM 418 N LYS A 28 8.721 -7.983 13.438 1.00157.95 N ATOM 419 CA LYS A 28 9.430 -8.604 14.549 1.00157.95 C ATOM 420 C LYS A 28 10.868 -8.073 14.611 1.00157.95 C ATOM 421 O LYS A 28 11.446 -7.921 15.687 1.00157.95 O ATOM 422 CB LYS A 28 9.359 -10.139 14.417 1.00157.95 C ATOM 423 CG LYS A 28 10.499 -10.777 13.644 1.00157.95 C ATOM 424 CD LYS A 28 11.615 -11.186 14.582 1.00157.95 C ATOM 425 CE LYS A 28 12.549 -12.198 13.939 1.00157.95 C ATOM 426 NZ LYS A 28 13.199 -13.075 14.951 1.00157.95 N ATOM 0 H LYS A 28 8.278 -8.635 12.791 1.00157.95 H new ATOM 0 HA LYS A 28 8.956 -8.343 15.495 1.00157.95 H new ATOM 0 HB2 LYS A 28 9.333 -10.572 15.417 1.00157.95 H new ATOM 0 HB3 LYS A 28 8.420 -10.402 13.931 1.00157.95 H new ATOM 0 HG2 LYS A 28 10.134 -11.649 13.101 1.00157.95 H new ATOM 0 HG3 LYS A 28 10.879 -10.076 12.901 1.00157.95 H new ATOM 0 HD2 LYS A 28 12.183 -10.304 14.878 1.00157.95 H new ATOM 0 HD3 LYS A 28 11.189 -11.611 15.491 1.00157.95 H new ATOM 0 HE2 LYS A 28 11.989 -12.811 13.233 1.00157.95 H new ATOM 0 HE3 LYS A 28 13.315 -11.673 13.368 1.00157.95 H new ATOM 0 HZ1 LYS A 28 13.828 -13.751 14.472 1.00157.95 H new ATOM 0 HZ2 LYS A 28 13.754 -12.493 15.610 1.00157.95 H new ATOM 0 HZ3 LYS A 28 12.470 -13.595 15.479 1.00157.95 H new ATOM 440 N GLU A 29 11.411 -7.763 13.440 1.00243.70 N ATOM 441 CA GLU A 29 12.750 -7.213 13.327 1.00243.70 C ATOM 442 C GLU A 29 12.792 -5.712 13.646 1.00243.70 C ATOM 443 O GLU A 29 13.774 -5.220 14.200 1.00243.70 O ATOM 444 CB GLU A 29 13.285 -7.445 11.913 1.00243.70 C ATOM 445 CG GLU A 29 13.360 -8.912 11.522 1.00243.70 C ATOM 446 CD GLU A 29 13.971 -9.126 10.148 1.00243.70 C ATOM 447 OE1 GLU A 29 14.279 -8.124 9.467 1.00243.70 O ATOM 448 OE2 GLU A 29 14.146 -10.298 9.752 1.00243.70 O ATOM 0 H GLU A 29 10.935 -7.886 12.546 1.00243.70 H new ATOM 0 HA GLU A 29 13.374 -7.725 14.059 1.00243.70 H new ATOM 0 HB2 GLU A 29 12.647 -6.921 11.202 1.00243.70 H new ATOM 0 HB3 GLU A 29 14.279 -7.005 11.833 1.00243.70 H new ATOM 0 HG2 GLU A 29 13.949 -9.451 12.264 1.00243.70 H new ATOM 0 HG3 GLU A 29 12.357 -9.339 11.539 1.00243.70 H new ATOM 455 N ASP A 30 11.747 -4.979 13.246 1.00108.85 N ATOM 456 CA ASP A 30 11.709 -3.525 13.446 1.00108.85 C ATOM 457 C ASP A 30 11.018 -3.086 14.738 1.00108.85 C ATOM 458 O ASP A 30 11.504 -2.194 15.433 1.00108.85 O ATOM 459 CB ASP A 30 11.026 -2.859 12.245 1.00108.85 C ATOM 460 CG ASP A 30 11.829 -3.011 10.967 1.00108.85 C ATOM 461 OD1 ASP A 30 13.028 -3.353 11.054 1.00108.85 O ATOM 462 OD2 ASP A 30 11.259 -2.787 9.878 1.00108.85 O ATOM 0 H ASP A 30 10.922 -5.364 12.786 1.00108.85 H new ATOM 0 HA ASP A 30 12.747 -3.204 13.535 1.00108.85 H new ATOM 0 HB2 ASP A 30 10.037 -3.296 12.104 1.00108.85 H new ATOM 0 HB3 ASP A 30 10.879 -1.800 12.455 1.00108.85 H new ATOM 467 N ILE A 31 9.873 -3.680 15.040 1.00355.97 N ATOM 468 CA ILE A 31 9.107 -3.313 16.221 1.00355.97 C ATOM 469 C ILE A 31 9.256 -4.355 17.335 1.00355.97 C ATOM 470 O ILE A 31 9.166 -5.556 17.077 1.00355.97 O ATOM 471 CB ILE A 31 7.624 -3.090 15.836 1.00355.97 C ATOM 472 CG1 ILE A 31 6.951 -2.138 16.825 1.00355.97 C ATOM 473 CG2 ILE A 31 6.843 -4.394 15.680 1.00355.97 C ATOM 474 CD1 ILE A 31 6.438 -2.788 18.089 1.00355.97 C ATOM 0 H ILE A 31 9.453 -4.422 14.480 1.00355.97 H new ATOM 0 HA ILE A 31 9.503 -2.378 16.617 1.00355.97 H new ATOM 0 HB ILE A 31 7.616 -2.625 14.850 1.00355.97 H new ATOM 0 HG12 ILE A 31 7.663 -1.359 17.098 1.00355.97 H new ATOM 0 HG13 ILE A 31 6.118 -1.646 16.323 1.00355.97 H new ATOM 0 HG21 ILE A 31 5.811 -4.170 15.410 1.00355.97 H new ATOM 0 HG22 ILE A 31 7.300 -5.000 14.898 1.00355.97 H new ATOM 0 HG23 ILE A 31 6.861 -4.943 16.621 1.00355.97 H new ATOM 0 HD11 ILE A 31 5.978 -2.032 18.726 1.00355.97 H new ATOM 0 HD12 ILE A 31 5.698 -3.547 17.834 1.00355.97 H new ATOM 0 HD13 ILE A 31 7.267 -3.255 18.621 1.00355.97 H new ATOM 486 N PRO A 32 9.515 -3.920 18.588 1.00153.08 N ATOM 487 CA PRO A 32 9.702 -4.846 19.704 1.00153.08 C ATOM 488 C PRO A 32 8.484 -5.720 19.978 1.00153.08 C ATOM 489 O PRO A 32 7.346 -5.249 19.965 1.00153.08 O ATOM 490 CB PRO A 32 10.007 -3.940 20.901 1.00153.08 C ATOM 491 CG PRO A 32 9.522 -2.593 20.506 1.00153.08 C ATOM 492 CD PRO A 32 9.671 -2.518 19.015 1.00153.08 C ATOM 0 HA PRO A 32 10.498 -5.558 19.488 1.00153.08 H new ATOM 0 HB2 PRO A 32 9.501 -4.292 21.800 1.00153.08 H new ATOM 0 HB3 PRO A 32 11.074 -3.925 21.121 1.00153.08 H new ATOM 0 HG2 PRO A 32 8.482 -2.451 20.801 1.00153.08 H new ATOM 0 HG3 PRO A 32 10.102 -1.811 20.996 1.00153.08 H new ATOM 0 HD2 PRO A 32 8.914 -1.874 18.567 1.00153.08 H new ATOM 0 HD3 PRO A 32 10.642 -2.116 18.727 1.00153.08 H new ATOM 500 N SER A 33 8.744 -6.999 20.237 1.00 84.70 N ATOM 501 CA SER A 33 7.689 -7.962 20.528 1.00 84.70 C ATOM 502 C SER A 33 6.905 -7.550 21.768 1.00 84.70 C ATOM 503 O SER A 33 5.709 -7.825 21.884 1.00 84.70 O ATOM 504 CB SER A 33 8.291 -9.355 20.725 1.00 84.70 C ATOM 505 OG SER A 33 7.277 -10.339 20.835 1.00 84.70 O ATOM 0 H SER A 33 9.685 -7.393 20.251 1.00 84.70 H new ATOM 0 HA SER A 33 7.002 -7.986 19.682 1.00 84.70 H new ATOM 0 HB2 SER A 33 8.944 -9.594 19.886 1.00 84.70 H new ATOM 0 HB3 SER A 33 8.909 -9.364 21.623 1.00 84.70 H new ATOM 0 HG SER A 33 7.688 -11.220 20.959 1.00 84.70 H new ATOM 511 N GLU A 34 7.591 -6.884 22.694 1.00109.83 N ATOM 512 CA GLU A 34 6.971 -6.425 23.930 1.00109.83 C ATOM 513 C GLU A 34 5.805 -5.484 23.638 1.00109.83 C ATOM 514 O GLU A 34 4.864 -5.381 24.424 1.00109.83 O ATOM 515 CB GLU A 34 8.008 -5.719 24.804 1.00109.83 C ATOM 516 CG GLU A 34 7.486 -5.331 26.178 1.00109.83 C ATOM 517 CD GLU A 34 8.495 -4.535 26.987 1.00109.83 C ATOM 518 OE1 GLU A 34 9.613 -4.297 26.482 1.00109.83 O ATOM 519 OE2 GLU A 34 8.163 -4.146 28.126 1.00109.83 O ATOM 0 H GLU A 34 8.580 -6.651 22.609 1.00109.83 H new ATOM 0 HA GLU A 34 6.584 -7.294 24.463 1.00109.83 H new ATOM 0 HB2 GLU A 34 8.873 -6.371 24.924 1.00109.83 H new ATOM 0 HB3 GLU A 34 8.354 -4.822 24.290 1.00109.83 H new ATOM 0 HG2 GLU A 34 6.575 -4.744 26.063 1.00109.83 H new ATOM 0 HG3 GLU A 34 7.217 -6.233 26.728 1.00109.83 H new ATOM 526 N LYS A 35 5.871 -4.803 22.498 1.00 73.01 N ATOM 527 CA LYS A 35 4.820 -3.877 22.097 1.00 73.01 C ATOM 528 C LYS A 35 3.816 -4.556 21.168 1.00 73.01 C ATOM 529 O LYS A 35 2.661 -4.148 21.084 1.00 73.01 O ATOM 530 CB LYS A 35 5.446 -2.682 21.390 1.00 73.01 C ATOM 531 CG LYS A 35 6.422 -1.920 22.261 1.00 73.01 C ATOM 532 CD LYS A 35 5.692 -1.106 23.316 1.00 73.01 C ATOM 533 CE LYS A 35 6.648 -0.253 24.138 1.00 73.01 C ATOM 534 NZ LYS A 35 6.709 -0.701 25.558 1.00 73.01 N ATOM 0 H LYS A 35 6.643 -4.876 21.835 1.00 73.01 H new ATOM 0 HA LYS A 35 4.289 -3.546 22.989 1.00 73.01 H new ATOM 0 HB2 LYS A 35 5.961 -3.027 20.494 1.00 73.01 H new ATOM 0 HB3 LYS A 35 4.656 -2.006 21.063 1.00 73.01 H new ATOM 0 HG2 LYS A 35 7.105 -2.618 22.744 1.00 73.01 H new ATOM 0 HG3 LYS A 35 7.028 -1.259 21.641 1.00 73.01 H new ATOM 0 HD2 LYS A 35 4.956 -0.463 22.833 1.00 73.01 H new ATOM 0 HD3 LYS A 35 5.144 -1.777 23.977 1.00 73.01 H new ATOM 0 HE2 LYS A 35 7.645 -0.299 23.699 1.00 73.01 H new ATOM 0 HE3 LYS A 35 6.330 0.789 24.099 1.00 73.01 H new ATOM 0 HZ1 LYS A 35 7.370 -0.096 26.085 1.00 73.01 H new ATOM 0 HZ2 LYS A 35 5.763 -0.633 25.984 1.00 73.01 H new ATOM 0 HZ3 LYS A 35 7.036 -1.687 25.597 1.00 73.01 H new ATOM 548 N SER A 36 4.260 -5.603 20.485 1.00 80.12 N ATOM 549 CA SER A 36 3.403 -6.350 19.574 1.00 80.12 C ATOM 550 C SER A 36 2.190 -6.919 20.302 1.00 80.12 C ATOM 551 O SER A 36 1.116 -7.071 19.720 1.00 80.12 O ATOM 552 CB SER A 36 4.207 -7.468 18.925 1.00 80.12 C ATOM 553 OG SER A 36 3.403 -8.239 18.051 1.00 80.12 O ATOM 0 H SER A 36 5.215 -5.956 20.546 1.00 80.12 H new ATOM 0 HA SER A 36 3.037 -5.672 18.803 1.00 80.12 H new ATOM 0 HB2 SER A 36 5.045 -7.043 18.372 1.00 80.12 H new ATOM 0 HB3 SER A 36 4.629 -8.111 19.697 1.00 80.12 H new ATOM 0 HG SER A 36 3.946 -8.948 17.647 1.00 80.12 H new ATOM 559 N GLU A 37 2.376 -7.240 21.577 1.00 42.03 N ATOM 560 CA GLU A 37 1.306 -7.801 22.390 1.00 42.03 C ATOM 561 C GLU A 37 0.135 -6.831 22.516 1.00 42.03 C ATOM 562 O GLU A 37 -1.025 -7.239 22.473 1.00 42.03 O ATOM 563 CB GLU A 37 1.849 -8.153 23.771 1.00 42.03 C ATOM 564 CG GLU A 37 2.884 -9.261 23.731 1.00 42.03 C ATOM 565 CD GLU A 37 2.287 -10.610 23.377 1.00 42.03 C ATOM 566 OE1 GLU A 37 1.044 -10.741 23.419 1.00 42.03 O ATOM 567 OE2 GLU A 37 3.062 -11.537 23.062 1.00 42.03 O ATOM 0 H GLU A 37 3.261 -7.121 22.070 1.00 42.03 H new ATOM 0 HA GLU A 37 0.937 -8.702 21.900 1.00 42.03 H new ATOM 0 HB2 GLU A 37 2.292 -7.264 24.219 1.00 42.03 H new ATOM 0 HB3 GLU A 37 1.023 -8.457 24.414 1.00 42.03 H new ATOM 0 HG2 GLU A 37 3.654 -9.007 23.002 1.00 42.03 H new ATOM 0 HG3 GLU A 37 3.374 -9.329 24.702 1.00 42.03 H new ATOM 574 N GLU A 38 0.442 -5.546 22.660 1.00 75.99 N ATOM 575 CA GLU A 38 -0.602 -4.531 22.775 1.00 75.99 C ATOM 576 C GLU A 38 -1.054 -4.007 21.414 1.00 75.99 C ATOM 577 O GLU A 38 -1.979 -3.199 21.330 1.00 75.99 O ATOM 578 CB GLU A 38 -0.151 -3.374 23.665 1.00 75.99 C ATOM 579 CG GLU A 38 1.022 -2.581 23.105 1.00 75.99 C ATOM 580 CD GLU A 38 1.493 -1.483 24.043 1.00 75.99 C ATOM 581 OE1 GLU A 38 0.865 -1.296 25.108 1.00 75.99 O ATOM 582 OE2 GLU A 38 2.495 -0.812 23.715 1.00 75.99 O ATOM 0 H GLU A 38 1.395 -5.184 22.700 1.00 75.99 H new ATOM 0 HA GLU A 38 -1.459 -5.018 23.240 1.00 75.99 H new ATOM 0 HB2 GLU A 38 -0.992 -2.698 23.819 1.00 75.99 H new ATOM 0 HB3 GLU A 38 0.124 -3.768 24.643 1.00 75.99 H new ATOM 0 HG2 GLU A 38 1.850 -3.260 22.903 1.00 75.99 H new ATOM 0 HG3 GLU A 38 0.733 -2.139 22.152 1.00 75.99 H new ATOM 589 N ILE A 39 -0.418 -4.482 20.354 1.00131.16 N ATOM 590 CA ILE A 39 -0.776 -4.072 19.008 1.00131.16 C ATOM 591 C ILE A 39 -1.891 -4.963 18.474 1.00131.16 C ATOM 592 O ILE A 39 -1.684 -5.791 17.589 1.00131.16 O ATOM 593 CB ILE A 39 0.455 -4.089 18.072 1.00131.16 C ATOM 594 CG1 ILE A 39 1.415 -2.987 18.505 1.00131.16 C ATOM 595 CG2 ILE A 39 0.063 -3.901 16.608 1.00131.16 C ATOM 596 CD1 ILE A 39 2.771 -3.078 17.858 1.00131.16 C ATOM 0 H ILE A 39 0.349 -5.152 20.402 1.00131.16 H new ATOM 0 HA ILE A 39 -1.140 -3.045 19.041 1.00131.16 H new ATOM 0 HB ILE A 39 0.936 -5.064 18.151 1.00131.16 H new ATOM 0 HG12 ILE A 39 0.973 -2.019 18.268 1.00131.16 H new ATOM 0 HG13 ILE A 39 1.535 -3.027 19.588 1.00131.16 H new ATOM 0 HG21 ILE A 39 0.958 -3.919 15.986 1.00131.16 H new ATOM 0 HG22 ILE A 39 -0.606 -4.706 16.304 1.00131.16 H new ATOM 0 HG23 ILE A 39 -0.443 -2.943 16.487 1.00131.16 H new ATOM 0 HD11 ILE A 39 3.399 -2.262 18.214 1.00131.16 H new ATOM 0 HD12 ILE A 39 3.234 -4.031 18.115 1.00131.16 H new ATOM 0 HD13 ILE A 39 2.663 -3.007 16.776 1.00131.16 H new ATOM 608 N THR A 40 -3.073 -4.763 19.031 1.00160.31 N ATOM 609 CA THR A 40 -4.258 -5.519 18.637 1.00160.31 C ATOM 610 C THR A 40 -5.065 -4.787 17.554 1.00160.31 C ATOM 611 O THR A 40 -6.122 -5.255 17.129 1.00160.31 O ATOM 612 CB THR A 40 -5.160 -5.842 19.859 1.00160.31 C ATOM 613 OG1 THR A 40 -6.505 -6.103 19.436 1.00160.31 O ATOM 614 CG2 THR A 40 -5.158 -4.705 20.880 1.00160.31 C ATOM 0 H THR A 40 -3.242 -4.076 19.766 1.00160.31 H new ATOM 0 HA THR A 40 -3.905 -6.460 18.216 1.00160.31 H new ATOM 0 HB THR A 40 -4.749 -6.731 20.337 1.00160.31 H new ATOM 0 HG1 THR A 40 -6.530 -6.192 18.460 1.00160.31 H new ATOM 0 HG21 THR A 40 -5.801 -4.969 21.720 1.00160.31 H new ATOM 0 HG22 THR A 40 -4.142 -4.540 21.238 1.00160.31 H new ATOM 0 HG23 THR A 40 -5.530 -3.794 20.411 1.00160.31 H new ATOM 622 N THR A 41 -4.547 -3.650 17.108 1.00182.91 N ATOM 623 CA THR A 41 -5.176 -2.845 16.075 1.00182.91 C ATOM 624 C THR A 41 -4.147 -2.049 15.323 1.00182.91 C ATOM 625 O THR A 41 -3.129 -1.641 15.884 1.00182.91 O ATOM 626 CB THR A 41 -6.253 -1.870 16.629 1.00182.91 C ATOM 627 OG1 THR A 41 -6.368 -0.703 15.799 1.00182.91 O ATOM 628 CG2 THR A 41 -5.991 -1.430 18.071 1.00182.91 C ATOM 0 H THR A 41 -3.672 -3.260 17.457 1.00182.91 H new ATOM 0 HA THR A 41 -5.674 -3.551 15.411 1.00182.91 H new ATOM 0 HB THR A 41 -7.186 -2.433 16.619 1.00182.91 H new ATOM 0 HG1 THR A 41 -7.233 -0.271 15.960 1.00182.91 H new ATOM 0 HG21 THR A 41 -6.781 -0.751 18.393 1.00182.91 H new ATOM 0 HG22 THR A 41 -5.976 -2.305 18.721 1.00182.91 H new ATOM 0 HG23 THR A 41 -5.029 -0.920 18.127 1.00182.91 H new ATOM 636 N GLY A 42 -4.444 -1.772 14.059 1.00 66.60 N ATOM 637 CA GLY A 42 -3.550 -0.953 13.278 1.00 66.60 C ATOM 638 C GLY A 42 -3.426 0.402 13.941 1.00 66.60 C ATOM 639 O GLY A 42 -2.370 1.033 13.911 1.00 66.60 O ATOM 0 H GLY A 42 -5.278 -2.097 13.570 1.00 66.60 H new ATOM 0 HA2 GLY A 42 -2.572 -1.428 13.203 1.00 66.60 H new ATOM 0 HA3 GLY A 42 -3.929 -0.843 12.262 1.00 66.60 H new ATOM 643 N SER A 43 -4.515 0.812 14.605 1.00 41.24 N ATOM 644 CA SER A 43 -4.525 2.054 15.348 1.00 41.24 C ATOM 645 C SER A 43 -3.554 1.940 16.513 1.00 41.24 C ATOM 646 O SER A 43 -2.791 2.861 16.804 1.00 41.24 O ATOM 647 CB SER A 43 -5.934 2.371 15.856 1.00 41.24 C ATOM 648 OG SER A 43 -6.867 2.386 14.792 1.00 41.24 O ATOM 0 H SER A 43 -5.393 0.294 14.636 1.00 41.24 H new ATOM 0 HA SER A 43 -4.217 2.868 14.692 1.00 41.24 H new ATOM 0 HB2 SER A 43 -6.233 1.628 16.596 1.00 41.24 H new ATOM 0 HB3 SER A 43 -5.934 3.339 16.358 1.00 41.24 H new ATOM 0 HG SER A 43 -6.469 2.831 14.014 1.00 41.24 H new ATOM 654 N ALA A 44 -3.591 0.778 17.170 1.00 31.60 N ATOM 655 CA ALA A 44 -2.713 0.505 18.307 1.00 31.60 C ATOM 656 C ALA A 44 -1.254 0.508 17.880 1.00 31.60 C ATOM 657 O ALA A 44 -0.369 0.910 18.633 1.00 31.60 O ATOM 658 CB ALA A 44 -3.053 -0.839 18.931 1.00 31.60 C ATOM 0 H ALA A 44 -4.221 0.011 16.933 1.00 31.60 H new ATOM 0 HA ALA A 44 -2.867 1.294 19.043 1.00 31.60 H new ATOM 0 HB1 ALA A 44 -2.390 -1.026 19.776 1.00 31.60 H new ATOM 0 HB2 ALA A 44 -4.087 -0.829 19.277 1.00 31.60 H new ATOM 0 HB3 ALA A 44 -2.926 -1.627 18.189 1.00 31.60 H new ATOM 664 N TRP A 45 -1.019 0.050 16.661 1.00 71.86 N ATOM 665 CA TRP A 45 0.322 -0.015 16.115 1.00 71.86 C ATOM 666 C TRP A 45 0.756 1.344 15.647 1.00 71.86 C ATOM 667 O TRP A 45 1.791 1.849 16.070 1.00 71.86 O ATOM 668 CB TRP A 45 0.365 -0.986 14.951 1.00 71.86 C ATOM 669 CG TRP A 45 1.742 -1.224 14.436 1.00 71.86 C ATOM 670 CD1 TRP A 45 2.898 -1.326 15.157 1.00 71.86 C ATOM 671 CD2 TRP A 45 2.100 -1.385 13.075 1.00 71.86 C ATOM 672 NE1 TRP A 45 3.956 -1.536 14.309 1.00 71.86 N ATOM 673 CE2 TRP A 45 3.489 -1.575 13.024 1.00 71.86 C ATOM 674 CE3 TRP A 45 1.374 -1.387 11.891 1.00 71.86 C ATOM 675 CZ2 TRP A 45 4.167 -1.761 11.830 1.00 71.86 C ATOM 676 CZ3 TRP A 45 2.042 -1.575 10.707 1.00 71.86 C ATOM 677 CH2 TRP A 45 3.430 -1.760 10.679 1.00 71.86 C ATOM 0 H TRP A 45 -1.747 -0.284 16.029 1.00 71.86 H new ATOM 0 HA TRP A 45 0.999 -0.360 16.897 1.00 71.86 H new ATOM 0 HB2 TRP A 45 -0.069 -1.936 15.263 1.00 71.86 H new ATOM 0 HB3 TRP A 45 -0.257 -0.602 14.143 1.00 71.86 H new ATOM 0 HD1 TRP A 45 2.968 -1.252 16.232 1.00 71.86 H new ATOM 0 HE1 TRP A 45 4.930 -1.645 14.590 1.00 71.86 H new ATOM 0 HE3 TRP A 45 0.304 -1.243 11.902 1.00 71.86 H new ATOM 0 HZ2 TRP A 45 5.238 -1.901 11.810 1.00 71.86 H new ATOM 0 HZ3 TRP A 45 1.487 -1.580 9.780 1.00 71.86 H new ATOM 0 HH2 TRP A 45 3.927 -1.904 9.731 1.00 71.86 H new ATOM 688 N PHE A 46 -0.045 1.956 14.782 1.00 81.71 N ATOM 689 CA PHE A 46 0.274 3.275 14.286 1.00 81.71 C ATOM 690 C PHE A 46 0.456 4.236 15.451 1.00 81.71 C ATOM 691 O PHE A 46 1.340 5.075 15.432 1.00 81.71 O ATOM 692 CB PHE A 46 -0.832 3.781 13.377 1.00 81.71 C ATOM 693 CG PHE A 46 -0.947 3.033 12.086 1.00 81.71 C ATOM 694 CD1 PHE A 46 0.173 2.757 11.321 1.00 81.71 C ATOM 695 CD2 PHE A 46 -2.185 2.642 11.619 1.00 81.71 C ATOM 696 CE1 PHE A 46 0.056 2.095 10.113 1.00 81.71 C ATOM 697 CE2 PHE A 46 -2.309 1.995 10.411 1.00 81.71 C ATOM 698 CZ PHE A 46 -1.192 1.720 9.657 1.00 81.71 C ATOM 0 H PHE A 46 -0.910 1.559 14.417 1.00 81.71 H new ATOM 0 HA PHE A 46 1.201 3.217 13.716 1.00 81.71 H new ATOM 0 HB2 PHE A 46 -1.782 3.718 13.908 1.00 81.71 H new ATOM 0 HB3 PHE A 46 -0.657 4.835 13.160 1.00 81.71 H new ATOM 0 HD1 PHE A 46 1.148 3.062 11.671 1.00 81.71 H new ATOM 0 HD2 PHE A 46 -3.067 2.846 12.208 1.00 81.71 H new ATOM 0 HE1 PHE A 46 0.937 1.872 9.529 1.00 81.71 H new ATOM 0 HE2 PHE A 46 -3.285 1.702 10.054 1.00 81.71 H new ATOM 0 HZ PHE A 46 -1.291 1.211 8.709 1.00 81.71 H new ATOM 708 N SER A 47 -0.376 4.088 16.478 1.00 81.62 N ATOM 709 CA SER A 47 -0.267 4.941 17.654 1.00 81.62 C ATOM 710 C SER A 47 1.053 4.695 18.357 1.00 81.62 C ATOM 711 O SER A 47 1.743 5.639 18.740 1.00 81.62 O ATOM 712 CB SER A 47 -1.443 4.712 18.608 1.00 81.62 C ATOM 713 OG SER A 47 -2.671 5.084 18.004 1.00 81.62 O ATOM 0 H SER A 47 -1.123 3.395 16.519 1.00 81.62 H new ATOM 0 HA SER A 47 -0.300 5.981 17.330 1.00 81.62 H new ATOM 0 HB2 SER A 47 -1.480 3.662 18.898 1.00 81.62 H new ATOM 0 HB3 SER A 47 -1.293 5.290 19.520 1.00 81.62 H new ATOM 0 HG SER A 47 -3.128 4.283 17.672 1.00 81.62 H new ATOM 719 N PHE A 48 1.439 3.428 18.478 1.00 49.76 N ATOM 720 CA PHE A 48 2.713 3.096 19.080 1.00 49.76 C ATOM 721 C PHE A 48 3.816 3.656 18.174 1.00 49.76 C ATOM 722 O PHE A 48 4.734 4.342 18.623 1.00 49.76 O ATOM 723 CB PHE A 48 2.842 1.573 19.247 1.00 49.76 C ATOM 724 CG PHE A 48 4.262 1.124 19.233 1.00 49.76 C ATOM 725 CD1 PHE A 48 4.859 0.835 18.034 1.00 49.76 C ATOM 726 CD2 PHE A 48 5.004 1.075 20.391 1.00 49.76 C ATOM 727 CE1 PHE A 48 6.189 0.491 17.979 1.00 49.76 C ATOM 728 CE2 PHE A 48 6.336 0.720 20.354 1.00 49.76 C ATOM 729 CZ PHE A 48 6.934 0.429 19.143 1.00 49.76 C ATOM 0 H PHE A 48 0.890 2.626 18.169 1.00 49.76 H new ATOM 0 HA PHE A 48 2.798 3.534 20.074 1.00 49.76 H new ATOM 0 HB2 PHE A 48 2.377 1.271 20.185 1.00 49.76 H new ATOM 0 HB3 PHE A 48 2.297 1.074 18.446 1.00 49.76 H new ATOM 0 HD1 PHE A 48 4.279 0.878 17.124 1.00 49.76 H new ATOM 0 HD2 PHE A 48 4.540 1.316 21.336 1.00 49.76 H new ATOM 0 HE1 PHE A 48 6.651 0.270 17.028 1.00 49.76 H new ATOM 0 HE2 PHE A 48 6.909 0.670 21.268 1.00 49.76 H new ATOM 0 HZ PHE A 48 7.978 0.154 19.105 1.00 49.76 H new ATOM 739 N LEU A 49 3.678 3.357 16.884 1.00 52.14 N ATOM 740 CA LEU A 49 4.608 3.813 15.864 1.00 52.14 C ATOM 741 C LEU A 49 4.732 5.341 15.925 1.00 52.14 C ATOM 742 O LEU A 49 5.834 5.887 15.902 1.00 52.14 O ATOM 743 CB LEU A 49 4.098 3.359 14.487 1.00 52.14 C ATOM 744 CG LEU A 49 4.913 2.264 13.784 1.00 52.14 C ATOM 745 CD1 LEU A 49 5.241 1.125 14.742 1.00 52.14 C ATOM 746 CD2 LEU A 49 4.149 1.737 12.582 1.00 52.14 C ATOM 0 H LEU A 49 2.913 2.789 16.520 1.00 52.14 H new ATOM 0 HA LEU A 49 5.595 3.384 16.035 1.00 52.14 H new ATOM 0 HB2 LEU A 49 3.075 3.002 14.602 1.00 52.14 H new ATOM 0 HB3 LEU A 49 4.060 4.230 13.833 1.00 52.14 H new ATOM 0 HG LEU A 49 5.852 2.701 13.446 1.00 52.14 H new ATOM 0 HD11 LEU A 49 5.819 0.364 14.218 1.00 52.14 H new ATOM 0 HD12 LEU A 49 5.823 1.510 15.579 1.00 52.14 H new ATOM 0 HD13 LEU A 49 4.316 0.686 15.115 1.00 52.14 H new ATOM 0 HD21 LEU A 49 4.735 0.961 12.090 1.00 52.14 H new ATOM 0 HD22 LEU A 49 3.197 1.320 12.910 1.00 52.14 H new ATOM 0 HD23 LEU A 49 3.966 2.552 11.882 1.00 52.14 H new ATOM 758 N GLU A 50 3.582 6.018 16.041 1.00 63.10 N ATOM 759 CA GLU A 50 3.563 7.478 16.151 1.00 63.10 C ATOM 760 C GLU A 50 4.217 7.902 17.455 1.00 63.10 C ATOM 761 O GLU A 50 4.995 8.855 17.500 1.00 63.10 O ATOM 762 CB GLU A 50 2.139 8.047 16.088 1.00 63.10 C ATOM 763 CG GLU A 50 1.517 8.023 14.700 1.00 63.10 C ATOM 764 CD GLU A 50 0.196 8.771 14.637 1.00 63.10 C ATOM 765 OE1 GLU A 50 -0.278 9.240 15.695 1.00 63.10 O ATOM 766 OE2 GLU A 50 -0.364 8.889 13.526 1.00 63.10 O ATOM 0 H GLU A 50 2.661 5.580 16.061 1.00 63.10 H new ATOM 0 HA GLU A 50 4.118 7.876 15.301 1.00 63.10 H new ATOM 0 HB2 GLU A 50 1.503 7.480 16.768 1.00 63.10 H new ATOM 0 HB3 GLU A 50 2.155 9.075 16.449 1.00 63.10 H new ATOM 0 HG2 GLU A 50 2.214 8.463 13.986 1.00 63.10 H new ATOM 0 HG3 GLU A 50 1.359 6.989 14.395 1.00 63.10 H new ATOM 773 N SER A 51 3.900 7.164 18.515 1.00 75.02 N ATOM 774 CA SER A 51 4.464 7.432 19.834 1.00 75.02 C ATOM 775 C SER A 51 5.986 7.327 19.792 1.00 75.02 C ATOM 776 O SER A 51 6.689 7.967 20.573 1.00 75.02 O ATOM 777 CB SER A 51 3.904 6.450 20.866 1.00 75.02 C ATOM 778 OG SER A 51 2.491 6.532 20.934 1.00 75.02 O ATOM 0 H SER A 51 3.255 6.375 18.486 1.00 75.02 H new ATOM 0 HA SER A 51 4.186 8.445 20.125 1.00 75.02 H new ATOM 0 HB2 SER A 51 4.200 5.434 20.604 1.00 75.02 H new ATOM 0 HB3 SER A 51 4.331 6.664 21.846 1.00 75.02 H new ATOM 0 HG SER A 51 2.095 5.819 20.390 1.00 75.02 H new ATOM 784 N HIS A 52 6.484 6.513 18.867 1.00122.90 N ATOM 785 CA HIS A 52 7.911 6.317 18.704 1.00122.90 C ATOM 786 C HIS A 52 8.386 7.013 17.438 1.00122.90 C ATOM 787 O HIS A 52 7.611 7.693 16.767 1.00122.90 O ATOM 788 CB HIS A 52 8.225 4.823 18.631 1.00122.90 C ATOM 789 CG HIS A 52 8.032 4.121 19.928 1.00122.90 C ATOM 790 ND1 HIS A 52 9.028 3.424 20.578 1.00122.90 N ATOM 791 CD2 HIS A 52 6.935 4.017 20.696 1.00122.90 C ATOM 792 CE1 HIS A 52 8.544 2.918 21.698 1.00122.90 C ATOM 793 NE2 HIS A 52 7.272 3.266 21.794 1.00122.90 N ATOM 0 H HIS A 52 5.911 5.976 18.216 1.00122.90 H new ATOM 0 HA HIS A 52 8.431 6.746 19.560 1.00122.90 H new ATOM 0 HB2 HIS A 52 7.588 4.361 17.877 1.00122.90 H new ATOM 0 HB3 HIS A 52 9.256 4.690 18.303 1.00122.90 H new ATOM 0 HD2 HIS A 52 5.966 4.446 20.488 1.00122.90 H new ATOM 0 HE1 HIS A 52 9.093 2.322 22.412 1.00122.90 H new ATOM 0 HE2 HIS A 52 6.644 3.017 22.559 1.00122.90 H new ATOM 801 N ASN A 53 9.656 6.834 17.104 1.00225.56 N ATOM 802 CA ASN A 53 10.222 7.442 15.906 1.00225.56 C ATOM 803 C ASN A 53 10.134 6.487 14.719 1.00225.56 C ATOM 804 O ASN A 53 11.033 6.444 13.879 1.00225.56 O ATOM 805 CB ASN A 53 11.679 7.843 16.150 1.00225.56 C ATOM 806 CG ASN A 53 11.823 8.859 17.267 1.00225.56 C ATOM 807 OD1 ASN A 53 12.632 8.685 18.177 1.00225.56 O ATOM 808 ND2 ASN A 53 11.037 9.928 17.202 1.00225.56 N ATOM 0 H ASN A 53 10.315 6.273 17.645 1.00225.56 H new ATOM 0 HA ASN A 53 9.643 8.336 15.673 1.00225.56 H new ATOM 0 HB2 ASN A 53 12.261 6.954 16.394 1.00225.56 H new ATOM 0 HB3 ASN A 53 12.097 8.255 15.232 1.00225.56 H new ATOM 0 HD21 ASN A 53 11.091 10.645 17.925 1.00225.56 H new ATOM 0 HD22 ASN A 53 10.380 10.032 16.429 1.00225.56 H new ATOM 815 N LYS A 54 9.054 5.715 14.659 1.00217.59 N ATOM 816 CA LYS A 54 8.864 4.759 13.581 1.00217.59 C ATOM 817 C LYS A 54 7.878 5.271 12.539 1.00217.59 C ATOM 818 O LYS A 54 7.826 4.745 11.428 1.00217.59 O ATOM 819 CB LYS A 54 8.327 3.444 14.137 1.00217.59 C ATOM 820 CG LYS A 54 9.101 2.909 15.327 1.00217.59 C ATOM 821 CD LYS A 54 10.566 2.694 14.989 1.00217.59 C ATOM 822 CE LYS A 54 10.744 1.646 13.901 1.00217.59 C ATOM 823 NZ LYS A 54 11.534 0.480 14.381 1.00217.59 N ATOM 0 H LYS A 54 8.299 5.735 15.345 1.00217.59 H new ATOM 0 HA LYS A 54 9.835 4.612 13.109 1.00217.59 H new ATOM 0 HB2 LYS A 54 7.286 3.584 14.428 1.00217.59 H new ATOM 0 HB3 LYS A 54 8.338 2.696 13.344 1.00217.59 H new ATOM 0 HG2 LYS A 54 9.018 3.607 16.160 1.00217.59 H new ATOM 0 HG3 LYS A 54 8.661 1.967 15.655 1.00217.59 H new ATOM 0 HD2 LYS A 54 11.006 3.636 14.662 1.00217.59 H new ATOM 0 HD3 LYS A 54 11.104 2.384 15.885 1.00217.59 H new ATOM 0 HE2 LYS A 54 9.766 1.307 13.560 1.00217.59 H new ATOM 0 HE3 LYS A 54 11.243 2.095 13.042 1.00217.59 H new ATOM 0 HZ1 LYS A 54 12.072 0.075 13.588 1.00217.59 H new ATOM 0 HZ2 LYS A 54 12.193 0.789 15.124 1.00217.59 H new ATOM 0 HZ3 LYS A 54 10.891 -0.240 14.767 1.00217.59 H new ATOM 837 N LEU A 55 7.081 6.280 12.885 1.00 97.75 N ATOM 838 CA LEU A 55 6.097 6.789 11.935 1.00 97.75 C ATOM 839 C LEU A 55 5.641 8.211 12.231 1.00 97.75 C ATOM 840 O LEU A 55 4.879 8.466 13.163 1.00 97.75 O ATOM 841 CB LEU A 55 4.887 5.875 11.921 1.00 97.75 C ATOM 842 CG LEU A 55 3.749 6.311 11.005 1.00 97.75 C ATOM 843 CD1 LEU A 55 2.966 5.106 10.506 1.00 97.75 C ATOM 844 CD2 LEU A 55 2.840 7.275 11.744 1.00 97.75 C ATOM 0 H LEU A 55 7.095 6.750 13.790 1.00 97.75 H new ATOM 0 HA LEU A 55 6.589 6.809 10.963 1.00 97.75 H new ATOM 0 HB2 LEU A 55 5.210 4.878 11.622 1.00 97.75 H new ATOM 0 HB3 LEU A 55 4.502 5.794 12.938 1.00 97.75 H new ATOM 0 HG LEU A 55 4.169 6.817 10.136 1.00 97.75 H new ATOM 0 HD11 LEU A 55 2.159 5.441 9.854 1.00 97.75 H new ATOM 0 HD12 LEU A 55 3.631 4.445 9.950 1.00 97.75 H new ATOM 0 HD13 LEU A 55 2.546 4.568 11.356 1.00 97.75 H new ATOM 0 HD21 LEU A 55 2.027 7.585 11.087 1.00 97.75 H new ATOM 0 HD22 LEU A 55 2.427 6.783 12.625 1.00 97.75 H new ATOM 0 HD23 LEU A 55 3.412 8.150 12.052 1.00 97.75 H new ATOM 856 N ASP A 56 6.073 9.111 11.370 1.00109.16 N ATOM 857 CA ASP A 56 5.686 10.514 11.439 1.00109.16 C ATOM 858 C ASP A 56 4.364 10.728 10.709 1.00109.16 C ATOM 859 O ASP A 56 3.819 9.802 10.112 1.00109.16 O ATOM 860 CB ASP A 56 6.766 11.420 10.844 1.00109.16 C ATOM 861 CG ASP A 56 8.040 11.432 11.668 1.00109.16 C ATOM 862 OD1 ASP A 56 8.005 10.961 12.824 1.00109.16 O ATOM 863 OD2 ASP A 56 9.072 11.914 11.157 1.00109.16 O ATOM 0 H ASP A 56 6.704 8.893 10.599 1.00109.16 H new ATOM 0 HA ASP A 56 5.566 10.779 12.490 1.00109.16 H new ATOM 0 HB2 ASP A 56 6.996 11.088 9.832 1.00109.16 H new ATOM 0 HB3 ASP A 56 6.379 12.436 10.766 1.00109.16 H new ATOM 868 N LYS A 57 3.878 11.960 10.729 1.00 65.03 N ATOM 869 CA LYS A 57 2.637 12.315 10.037 1.00 65.03 C ATOM 870 C LYS A 57 2.803 12.176 8.518 1.00 65.03 C ATOM 871 O LYS A 57 1.818 12.062 7.788 1.00 65.03 O ATOM 872 CB LYS A 57 2.194 13.741 10.416 1.00 65.03 C ATOM 873 CG LYS A 57 2.952 14.849 9.702 1.00 65.03 C ATOM 874 CD LYS A 57 4.421 14.826 10.062 1.00 65.03 C ATOM 875 CE LYS A 57 5.186 15.957 9.390 1.00 65.03 C ATOM 876 NZ LYS A 57 4.953 17.264 10.063 1.00 65.03 N ATOM 0 H LYS A 57 4.322 12.737 11.218 1.00 65.03 H new ATOM 0 HA LYS A 57 1.857 11.623 10.354 1.00 65.03 H new ATOM 0 HB2 LYS A 57 1.131 13.847 10.199 1.00 65.03 H new ATOM 0 HB3 LYS A 57 2.314 13.871 11.492 1.00 65.03 H new ATOM 0 HG2 LYS A 57 2.837 14.736 8.624 1.00 65.03 H new ATOM 0 HG3 LYS A 57 2.525 15.816 9.968 1.00 65.03 H new ATOM 0 HD2 LYS A 57 4.531 14.905 11.144 1.00 65.03 H new ATOM 0 HD3 LYS A 57 4.853 13.870 9.767 1.00 65.03 H new ATOM 0 HE2 LYS A 57 6.252 15.729 9.399 1.00 65.03 H new ATOM 0 HE3 LYS A 57 4.884 16.028 8.345 1.00 65.03 H new ATOM 0 HZ1 LYS A 57 5.492 18.007 9.574 1.00 65.03 H new ATOM 0 HZ2 LYS A 57 3.939 17.494 10.032 1.00 65.03 H new ATOM 0 HZ3 LYS A 57 5.265 17.205 11.053 1.00 65.03 H new ATOM 890 N ASP A 58 4.053 12.196 8.051 1.00165.72 N ATOM 891 CA ASP A 58 4.344 12.078 6.629 1.00165.72 C ATOM 892 C ASP A 58 5.260 10.885 6.330 1.00165.72 C ATOM 893 O ASP A 58 5.397 10.487 5.173 1.00165.72 O ATOM 894 CB ASP A 58 4.990 13.368 6.122 1.00165.72 C ATOM 895 CG ASP A 58 4.033 14.545 6.157 1.00165.72 C ATOM 896 OD1 ASP A 58 2.807 14.312 6.210 1.00165.72 O ATOM 897 OD2 ASP A 58 4.510 15.699 6.134 1.00165.72 O ATOM 0 H ASP A 58 4.879 12.293 8.642 1.00165.72 H new ATOM 0 HA ASP A 58 3.400 11.909 6.111 1.00165.72 H new ATOM 0 HB2 ASP A 58 5.865 13.596 6.730 1.00165.72 H new ATOM 0 HB3 ASP A 58 5.341 13.219 5.101 1.00165.72 H new ATOM 902 N ASN A 59 5.894 10.316 7.361 1.00 98.89 N ATOM 903 CA ASN A 59 6.792 9.175 7.152 1.00 98.89 C ATOM 904 C ASN A 59 6.066 7.852 7.330 1.00 98.89 C ATOM 905 O ASN A 59 5.640 7.494 8.428 1.00 98.89 O ATOM 906 CB ASN A 59 7.998 9.239 8.091 1.00 98.89 C ATOM 907 CG ASN A 59 8.970 10.341 7.715 1.00 98.89 C ATOM 908 OD1 ASN A 59 8.517 11.586 7.792 1.00 98.89 O flip ATOM 909 ND2 ASN A 59 10.119 10.075 7.361 1.00 98.89 N flip ATOM 0 H ASN A 59 5.805 10.619 8.331 1.00 98.89 H new ATOM 0 HA ASN A 59 7.147 9.235 6.123 1.00 98.89 H new ATOM 0 HB2 ASN A 59 7.651 9.398 9.112 1.00 98.89 H new ATOM 0 HB3 ASN A 59 8.517 8.281 8.076 1.00 98.89 H new ATOM 0 HD21 ASN A 59 10.427 9.104 7.316 1.00 98.89 H new ATOM 0 HD22 ASN A 59 10.763 10.826 7.113 1.00 98.89 H new ATOM 916 N LEU A 60 5.955 7.129 6.227 1.00196.24 N ATOM 917 CA LEU A 60 5.311 5.825 6.206 1.00196.24 C ATOM 918 C LEU A 60 6.209 4.790 5.525 1.00196.24 C ATOM 919 O LEU A 60 5.766 3.681 5.226 1.00196.24 O ATOM 920 CB LEU A 60 3.976 5.906 5.461 1.00196.24 C ATOM 921 CG LEU A 60 3.952 6.884 4.276 1.00196.24 C ATOM 922 CD1 LEU A 60 3.259 6.267 3.070 1.00196.24 C ATOM 923 CD2 LEU A 60 3.276 8.183 4.681 1.00196.24 C ATOM 0 H LEU A 60 6.310 7.430 5.319 1.00196.24 H new ATOM 0 HA LEU A 60 5.134 5.518 7.237 1.00196.24 H new ATOM 0 HB2 LEU A 60 3.719 4.911 5.097 1.00196.24 H new ATOM 0 HB3 LEU A 60 3.199 6.197 6.168 1.00196.24 H new ATOM 0 HG LEU A 60 4.981 7.102 3.991 1.00196.24 H new ATOM 0 HD11 LEU A 60 3.257 6.981 2.247 1.00196.24 H new ATOM 0 HD12 LEU A 60 3.791 5.365 2.767 1.00196.24 H new ATOM 0 HD13 LEU A 60 2.232 6.012 3.332 1.00196.24 H new ATOM 0 HD21 LEU A 60 3.265 8.867 3.833 1.00196.24 H new ATOM 0 HD22 LEU A 60 2.252 7.978 4.995 1.00196.24 H new ATOM 0 HD23 LEU A 60 3.825 8.637 5.506 1.00196.24 H new ATOM 935 N SER A 61 7.466 5.159 5.253 1.00 66.14 N ATOM 936 CA SER A 61 8.390 4.249 4.581 1.00 66.14 C ATOM 937 C SER A 61 8.545 2.926 5.323 1.00 66.14 C ATOM 938 O SER A 61 8.612 1.866 4.701 1.00 66.14 O ATOM 939 CB SER A 61 9.761 4.906 4.405 1.00 66.14 C ATOM 940 OG SER A 61 9.665 6.092 3.635 1.00 66.14 O ATOM 0 H SER A 61 7.860 6.071 5.486 1.00 66.14 H new ATOM 0 HA SER A 61 7.961 4.032 3.603 1.00 66.14 H new ATOM 0 HB2 SER A 61 10.185 5.137 5.382 1.00 66.14 H new ATOM 0 HB3 SER A 61 10.442 4.208 3.919 1.00 66.14 H new ATOM 0 HG SER A 61 10.554 6.493 3.539 1.00 66.14 H new ATOM 946 N TYR A 62 8.605 2.980 6.647 1.00 59.69 N ATOM 947 CA TYR A 62 8.755 1.769 7.440 1.00 59.69 C ATOM 948 C TYR A 62 7.476 0.935 7.415 1.00 59.69 C ATOM 949 O TYR A 62 7.537 -0.280 7.325 1.00 59.69 O ATOM 950 CB TYR A 62 9.170 2.116 8.888 1.00 59.69 C ATOM 951 CG TYR A 62 8.692 1.130 9.945 1.00 59.69 C ATOM 952 CD1 TYR A 62 8.997 -0.224 9.866 1.00 59.69 C ATOM 953 CD2 TYR A 62 7.904 1.561 10.997 1.00 59.69 C ATOM 954 CE1 TYR A 62 8.530 -1.114 10.814 1.00 59.69 C ATOM 955 CE2 TYR A 62 7.440 0.682 11.950 1.00 59.69 C ATOM 956 CZ TYR A 62 7.754 -0.656 11.856 1.00 59.69 C ATOM 957 OH TYR A 62 7.285 -1.542 12.802 1.00 59.69 O ATOM 0 H TYR A 62 8.553 3.842 7.190 1.00 59.69 H new ATOM 0 HA TYR A 62 9.548 1.167 6.997 1.00 59.69 H new ATOM 0 HB2 TYR A 62 10.257 2.177 8.934 1.00 59.69 H new ATOM 0 HB3 TYR A 62 8.784 3.105 9.134 1.00 59.69 H new ATOM 0 HD1 TYR A 62 9.608 -0.585 9.052 1.00 59.69 H new ATOM 0 HD2 TYR A 62 7.648 2.607 11.072 1.00 59.69 H new ATOM 0 HE1 TYR A 62 8.772 -2.164 10.738 1.00 59.69 H new ATOM 0 HE2 TYR A 62 6.832 1.040 12.768 1.00 59.69 H new ATOM 0 HH TYR A 62 7.036 -2.384 12.367 1.00 59.69 H new ATOM 967 N ILE A 63 6.330 1.588 7.525 1.00 95.89 N ATOM 968 CA ILE A 63 5.060 0.880 7.541 1.00 95.89 C ATOM 969 C ILE A 63 4.744 0.341 6.165 1.00 95.89 C ATOM 970 O ILE A 63 4.415 -0.834 6.000 1.00 95.89 O ATOM 971 CB ILE A 63 3.915 1.774 8.074 1.00 95.89 C ATOM 972 CG1 ILE A 63 3.350 2.721 7.006 1.00 95.89 C ATOM 973 CG2 ILE A 63 4.394 2.588 9.272 1.00 95.89 C ATOM 974 CD1 ILE A 63 2.162 3.503 7.501 1.00 95.89 C ATOM 0 H ILE A 63 6.253 2.602 7.604 1.00 95.89 H new ATOM 0 HA ILE A 63 5.150 0.038 8.227 1.00 95.89 H new ATOM 0 HB ILE A 63 3.110 1.102 8.373 1.00 95.89 H new ATOM 0 HG12 ILE A 63 4.130 3.413 6.689 1.00 95.89 H new ATOM 0 HG13 ILE A 63 3.061 2.143 6.128 1.00 95.89 H new ATOM 0 HG21 ILE A 63 3.579 3.213 9.637 1.00 95.89 H new ATOM 0 HG22 ILE A 63 4.717 1.913 10.065 1.00 95.89 H new ATOM 0 HG23 ILE A 63 5.229 3.221 8.971 1.00 95.89 H new ATOM 0 HD11 ILE A 63 1.801 4.157 6.708 1.00 95.89 H new ATOM 0 HD12 ILE A 63 1.369 2.814 7.793 1.00 95.89 H new ATOM 0 HD13 ILE A 63 2.455 4.104 8.362 1.00 95.89 H new ATOM 986 N GLU A 64 4.900 1.199 5.169 1.00 77.41 N ATOM 987 CA GLU A 64 4.689 0.803 3.783 1.00 77.41 C ATOM 988 C GLU A 64 5.530 -0.439 3.492 1.00 77.41 C ATOM 989 O GLU A 64 5.147 -1.300 2.702 1.00 77.41 O ATOM 990 CB GLU A 64 5.078 1.940 2.836 1.00 77.41 C ATOM 991 CG GLU A 64 4.763 1.651 1.376 1.00 77.41 C ATOM 992 CD GLU A 64 5.256 2.740 0.441 1.00 77.41 C ATOM 993 OE1 GLU A 64 5.980 3.647 0.909 1.00 77.41 O ATOM 994 OE2 GLU A 64 4.916 2.690 -0.759 1.00 77.41 O ATOM 0 H GLU A 64 5.172 2.174 5.293 1.00 77.41 H new ATOM 0 HA GLU A 64 3.634 0.578 3.625 1.00 77.41 H new ATOM 0 HB2 GLU A 64 4.557 2.848 3.139 1.00 77.41 H new ATOM 0 HB3 GLU A 64 6.145 2.137 2.937 1.00 77.41 H new ATOM 0 HG2 GLU A 64 5.217 0.702 1.092 1.00 77.41 H new ATOM 0 HG3 GLU A 64 3.686 1.537 1.257 1.00 77.41 H new ATOM 1001 N HIS A 65 6.665 -0.541 4.186 1.00 68.54 N ATOM 1002 CA HIS A 65 7.531 -1.697 4.047 1.00 68.54 C ATOM 1003 C HIS A 65 6.849 -2.909 4.649 1.00 68.54 C ATOM 1004 O HIS A 65 6.858 -3.983 4.062 1.00 68.54 O ATOM 1005 CB HIS A 65 8.888 -1.434 4.713 1.00 68.54 C ATOM 1006 CG HIS A 65 9.766 -2.641 4.835 1.00 68.54 C ATOM 1007 ND1 HIS A 65 10.590 -3.090 3.825 1.00 68.54 N ATOM 1008 CD2 HIS A 65 9.938 -3.493 5.869 1.00 68.54 C ATOM 1009 CE1 HIS A 65 11.232 -4.170 4.235 1.00 68.54 C ATOM 1010 NE2 HIS A 65 10.854 -4.435 5.473 1.00 68.54 N ATOM 0 H HIS A 65 6.999 0.163 4.845 1.00 68.54 H new ATOM 0 HA HIS A 65 7.716 -1.889 2.990 1.00 68.54 H new ATOM 0 HB2 HIS A 65 9.417 -0.672 4.141 1.00 68.54 H new ATOM 0 HB3 HIS A 65 8.716 -1.024 5.708 1.00 68.54 H new ATOM 0 HD2 HIS A 65 9.446 -3.442 6.829 1.00 68.54 H new ATOM 0 HE1 HIS A 65 11.945 -4.739 3.656 1.00 68.54 H new ATOM 0 HE2 HIS A 65 11.188 -5.213 6.042 1.00 68.54 H new ATOM 1018 N ILE A 66 6.242 -2.717 5.817 1.00 44.28 N ATOM 1019 CA ILE A 66 5.533 -3.790 6.498 1.00 44.28 C ATOM 1020 C ILE A 66 4.427 -4.311 5.610 1.00 44.28 C ATOM 1021 O ILE A 66 4.313 -5.512 5.365 1.00 44.28 O ATOM 1022 CB ILE A 66 4.945 -3.291 7.831 1.00 44.28 C ATOM 1023 CG1 ILE A 66 6.073 -2.724 8.691 1.00 44.28 C ATOM 1024 CG2 ILE A 66 4.188 -4.397 8.561 1.00 44.28 C ATOM 1025 CD1 ILE A 66 7.242 -3.650 8.871 1.00 44.28 C ATOM 0 H ILE A 66 6.229 -1.825 6.311 1.00 44.28 H new ATOM 0 HA ILE A 66 6.237 -4.595 6.711 1.00 44.28 H new ATOM 0 HB ILE A 66 4.220 -2.504 7.627 1.00 44.28 H new ATOM 0 HG12 ILE A 66 6.426 -1.796 8.240 1.00 44.28 H new ATOM 0 HG13 ILE A 66 5.672 -2.469 9.672 1.00 44.28 H new ATOM 0 HG21 ILE A 66 3.788 -4.007 9.497 1.00 44.28 H new ATOM 0 HG22 ILE A 66 3.369 -4.751 7.935 1.00 44.28 H new ATOM 0 HG23 ILE A 66 4.866 -5.224 8.773 1.00 44.28 H new ATOM 0 HD11 ILE A 66 7.995 -3.168 9.494 1.00 44.28 H new ATOM 0 HD12 ILE A 66 6.907 -4.569 9.352 1.00 44.28 H new ATOM 0 HD13 ILE A 66 7.673 -3.886 7.898 1.00 44.28 H new ATOM 1037 N PHE A 67 3.633 -3.383 5.106 1.00103.95 N ATOM 1038 CA PHE A 67 2.548 -3.724 4.213 1.00103.95 C ATOM 1039 C PHE A 67 3.103 -4.359 2.934 1.00103.95 C ATOM 1040 O PHE A 67 2.458 -5.214 2.326 1.00103.95 O ATOM 1041 CB PHE A 67 1.732 -2.474 3.912 1.00103.95 C ATOM 1042 CG PHE A 67 1.239 -1.829 5.170 1.00103.95 C ATOM 1043 CD1 PHE A 67 0.549 -2.575 6.112 1.00103.95 C ATOM 1044 CD2 PHE A 67 1.491 -0.494 5.428 1.00103.95 C ATOM 1045 CE1 PHE A 67 0.120 -2.001 7.290 1.00103.95 C ATOM 1046 CE2 PHE A 67 1.057 0.089 6.603 1.00103.95 C ATOM 1047 CZ PHE A 67 0.372 -0.668 7.536 1.00103.95 C ATOM 0 H PHE A 67 3.722 -2.386 5.303 1.00103.95 H new ATOM 0 HA PHE A 67 1.892 -4.455 4.685 1.00103.95 H new ATOM 0 HB2 PHE A 67 2.342 -1.765 3.353 1.00103.95 H new ATOM 0 HB3 PHE A 67 0.884 -2.735 3.278 1.00103.95 H new ATOM 0 HD1 PHE A 67 0.345 -3.618 5.921 1.00103.95 H new ATOM 0 HD2 PHE A 67 2.032 0.098 4.705 1.00103.95 H new ATOM 0 HE1 PHE A 67 -0.412 -2.594 8.019 1.00103.95 H new ATOM 0 HE2 PHE A 67 1.252 1.134 6.793 1.00103.95 H new ATOM 0 HZ PHE A 67 0.035 -0.215 8.457 1.00103.95 H new ATOM 1057 N GLU A 68 4.315 -3.941 2.538 1.00 76.40 N ATOM 1058 CA GLU A 68 4.959 -4.484 1.342 1.00 76.40 C ATOM 1059 C GLU A 68 5.485 -5.887 1.603 1.00 76.40 C ATOM 1060 O GLU A 68 5.177 -6.821 0.863 1.00 76.40 O ATOM 1061 CB GLU A 68 6.107 -3.575 0.894 1.00 76.40 C ATOM 1062 CG GLU A 68 6.840 -4.084 -0.337 1.00 76.40 C ATOM 1063 CD GLU A 68 8.031 -3.222 -0.703 1.00 76.40 C ATOM 1064 OE1 GLU A 68 8.729 -2.752 0.219 1.00 76.40 O ATOM 1065 OE2 GLU A 68 8.263 -3.013 -1.912 1.00 76.40 O ATOM 0 H GLU A 68 4.862 -3.233 3.028 1.00 76.40 H new ATOM 0 HA GLU A 68 4.213 -4.532 0.549 1.00 76.40 H new ATOM 0 HB2 GLU A 68 5.712 -2.580 0.686 1.00 76.40 H new ATOM 0 HB3 GLU A 68 6.818 -3.471 1.713 1.00 76.40 H new ATOM 0 HG2 GLU A 68 7.176 -5.105 -0.159 1.00 76.40 H new ATOM 0 HG3 GLU A 68 6.149 -4.118 -1.179 1.00 76.40 H new ATOM 1072 N ILE A 69 6.266 -6.035 2.666 1.00 33.63 N ATOM 1073 CA ILE A 69 6.806 -7.333 3.015 1.00 33.63 C ATOM 1074 C ILE A 69 5.683 -8.281 3.405 1.00 33.63 C ATOM 1075 O ILE A 69 5.763 -9.489 3.185 1.00 33.63 O ATOM 1076 CB ILE A 69 7.834 -7.236 4.143 1.00 33.63 C ATOM 1077 CG1 ILE A 69 7.196 -6.706 5.431 1.00 33.63 C ATOM 1078 CG2 ILE A 69 9.016 -6.374 3.704 1.00 33.63 C ATOM 1079 CD1 ILE A 69 8.204 -6.413 6.522 1.00 33.63 C ATOM 0 H ILE A 69 6.535 -5.277 3.293 1.00 33.63 H new ATOM 0 HA ILE A 69 7.318 -7.725 2.136 1.00 33.63 H new ATOM 0 HB ILE A 69 8.206 -8.237 4.361 1.00 33.63 H new ATOM 0 HG12 ILE A 69 6.640 -5.796 5.205 1.00 33.63 H new ATOM 0 HG13 ILE A 69 6.475 -7.436 5.798 1.00 33.63 H new ATOM 0 HG21 ILE A 69 9.742 -6.312 4.515 1.00 33.63 H new ATOM 0 HG22 ILE A 69 9.487 -6.821 2.829 1.00 33.63 H new ATOM 0 HG23 ILE A 69 8.664 -5.373 3.455 1.00 33.63 H new ATOM 0 HD11 ILE A 69 7.686 -6.041 7.406 1.00 33.63 H new ATOM 0 HD12 ILE A 69 8.743 -7.326 6.775 1.00 33.63 H new ATOM 0 HD13 ILE A 69 8.910 -5.660 6.172 1.00 33.63 H new ATOM 1091 N SER A 70 4.615 -7.707 3.941 1.00 80.34 N ATOM 1092 CA SER A 70 3.440 -8.472 4.316 1.00 80.34 C ATOM 1093 C SER A 70 2.646 -8.760 3.048 1.00 80.34 C ATOM 1094 O SER A 70 2.579 -7.920 2.150 1.00 80.34 O ATOM 1095 CB SER A 70 2.584 -7.691 5.314 1.00 80.34 C ATOM 1096 OG SER A 70 1.483 -8.465 5.757 1.00 80.34 O ATOM 0 H SER A 70 4.541 -6.707 4.126 1.00 80.34 H new ATOM 0 HA SER A 70 3.738 -9.404 4.797 1.00 80.34 H new ATOM 0 HB2 SER A 70 3.193 -7.397 6.169 1.00 80.34 H new ATOM 0 HB3 SER A 70 2.224 -6.773 4.849 1.00 80.34 H new ATOM 0 HG SER A 70 0.659 -7.941 5.672 1.00 80.34 H new ATOM 1102 N ARG A 71 2.082 -9.954 2.950 1.00144.05 N ATOM 1103 CA ARG A 71 1.344 -10.337 1.754 1.00144.05 C ATOM 1104 C ARG A 71 -0.068 -9.763 1.736 1.00144.05 C ATOM 1105 O ARG A 71 -1.054 -10.498 1.678 1.00144.05 O ATOM 1106 CB ARG A 71 1.315 -11.857 1.616 1.00144.05 C ATOM 1107 CG ARG A 71 2.697 -12.460 1.442 1.00144.05 C ATOM 1108 CD ARG A 71 3.372 -11.966 0.171 1.00144.05 C ATOM 1109 NE ARG A 71 2.641 -12.359 -1.033 1.00144.05 N ATOM 1110 CZ ARG A 71 2.605 -13.602 -1.515 1.00144.05 C ATOM 1111 NH1 ARG A 71 3.246 -14.587 -0.896 1.00144.05 N ATOM 1112 NH2 ARG A 71 1.923 -13.861 -2.623 1.00144.05 N ATOM 0 H ARG A 71 2.120 -10.669 3.676 1.00144.05 H new ATOM 0 HA ARG A 71 1.867 -9.912 0.897 1.00144.05 H new ATOM 0 HB2 ARG A 71 0.844 -12.288 2.500 1.00144.05 H new ATOM 0 HB3 ARG A 71 0.696 -12.128 0.761 1.00144.05 H new ATOM 0 HG2 ARG A 71 3.315 -12.208 2.304 1.00144.05 H new ATOM 0 HG3 ARG A 71 2.619 -13.547 1.413 1.00144.05 H new ATOM 0 HD2 ARG A 71 3.455 -10.880 0.205 1.00144.05 H new ATOM 0 HD3 ARG A 71 4.386 -12.362 0.123 1.00144.05 H new ATOM 0 HE ARG A 71 2.126 -11.637 -1.536 1.00144.05 H new ATOM 0 HH11 ARG A 71 3.772 -14.396 -0.043 1.00144.05 H new ATOM 0 HH12 ARG A 71 3.212 -15.534 -1.273 1.00144.05 H new ATOM 0 HH21 ARG A 71 1.428 -13.110 -3.104 1.00144.05 H new ATOM 0 HH22 ARG A 71 1.894 -14.811 -2.994 1.00144.05 H new ATOM 1126 N ARG A 72 -0.150 -8.438 1.757 1.00183.66 N ATOM 1127 CA ARG A 72 -1.436 -7.754 1.713 1.00183.66 C ATOM 1128 C ARG A 72 -1.316 -6.416 0.985 1.00183.66 C ATOM 1129 O ARG A 72 -1.337 -5.354 1.609 1.00183.66 O ATOM 1130 CB ARG A 72 -1.994 -7.546 3.117 1.00183.66 C ATOM 1131 CG ARG A 72 -3.491 -7.826 3.212 1.00183.66 C ATOM 1132 CD ARG A 72 -3.788 -9.026 4.098 1.00183.66 C ATOM 1133 NE ARG A 72 -2.999 -8.989 5.324 1.00183.66 N ATOM 1134 CZ ARG A 72 -2.641 -10.067 6.023 1.00183.66 C ATOM 1135 NH1 ARG A 72 -3.051 -11.277 5.660 1.00183.66 N ATOM 1136 NH2 ARG A 72 -1.873 -9.931 7.094 1.00183.66 N ATOM 0 H ARG A 72 0.658 -7.817 1.804 1.00183.66 H new ATOM 0 HA ARG A 72 -2.130 -8.387 1.160 1.00183.66 H new ATOM 0 HB2 ARG A 72 -1.464 -8.196 3.813 1.00183.66 H new ATOM 0 HB3 ARG A 72 -1.801 -6.520 3.430 1.00183.66 H new ATOM 0 HG2 ARG A 72 -4.000 -6.947 3.608 1.00183.66 H new ATOM 0 HG3 ARG A 72 -3.891 -8.004 2.214 1.00183.66 H new ATOM 0 HD2 ARG A 72 -4.849 -9.043 4.347 1.00183.66 H new ATOM 0 HD3 ARG A 72 -3.573 -9.945 3.553 1.00183.66 H new ATOM 0 HE ARG A 72 -2.701 -8.077 5.670 1.00183.66 H new ATOM 0 HH11 ARG A 72 -3.646 -11.389 4.839 1.00183.66 H new ATOM 0 HH12 ARG A 72 -2.771 -12.094 6.202 1.00183.66 H new ATOM 0 HH21 ARG A 72 -1.558 -9.004 7.381 1.00183.66 H new ATOM 0 HH22 ARG A 72 -1.597 -10.753 7.631 1.00183.66 H new ATOM 1150 N PRO A 73 -1.184 -6.438 -0.353 1.00130.67 N ATOM 1151 CA PRO A 73 -1.061 -5.214 -1.142 1.00130.67 C ATOM 1152 C PRO A 73 -2.269 -4.284 -1.006 1.00130.67 C ATOM 1153 O PRO A 73 -2.210 -3.133 -1.431 1.00130.67 O ATOM 1154 CB PRO A 73 -0.946 -5.710 -2.589 1.00130.67 C ATOM 1155 CG PRO A 73 -0.544 -7.140 -2.484 1.00130.67 C ATOM 1156 CD PRO A 73 -1.135 -7.644 -1.200 1.00130.67 C ATOM 0 HA PRO A 73 -0.209 -4.623 -0.806 1.00130.67 H new ATOM 0 HB2 PRO A 73 -1.894 -5.606 -3.117 1.00130.67 H new ATOM 0 HB3 PRO A 73 -0.207 -5.133 -3.145 1.00130.67 H new ATOM 0 HG2 PRO A 73 -0.914 -7.712 -3.335 1.00130.67 H new ATOM 0 HG3 PRO A 73 0.541 -7.241 -2.480 1.00130.67 H new ATOM 0 HD2 PRO A 73 -2.127 -8.069 -1.353 1.00130.67 H new ATOM 0 HD3 PRO A 73 -0.520 -8.425 -0.753 1.00130.67 H new ATOM 1164 N ASP A 74 -3.372 -4.775 -0.429 1.00 56.92 N ATOM 1165 CA ASP A 74 -4.569 -3.948 -0.287 1.00 56.92 C ATOM 1166 C ASP A 74 -4.331 -2.782 0.662 1.00 56.92 C ATOM 1167 O ASP A 74 -4.695 -1.646 0.357 1.00 56.92 O ATOM 1168 CB ASP A 74 -5.745 -4.792 0.210 1.00 56.92 C ATOM 1169 CG ASP A 74 -6.175 -5.838 -0.801 1.00 56.92 C ATOM 1170 OD1 ASP A 74 -5.858 -5.673 -1.996 1.00 56.92 O ATOM 1171 OD2 ASP A 74 -6.829 -6.822 -0.395 1.00 56.92 O ATOM 0 H ASP A 74 -3.458 -5.722 -0.060 1.00 56.92 H new ATOM 0 HA ASP A 74 -4.808 -3.542 -1.270 1.00 56.92 H new ATOM 0 HB2 ASP A 74 -5.467 -5.284 1.142 1.00 56.92 H new ATOM 0 HB3 ASP A 74 -6.588 -4.139 0.434 1.00 56.92 H new ATOM 1176 N LEU A 75 -3.704 -3.050 1.801 1.00 72.53 N ATOM 1177 CA LEU A 75 -3.413 -1.992 2.757 1.00 72.53 C ATOM 1178 C LEU A 75 -2.322 -1.096 2.197 1.00 72.53 C ATOM 1179 O LEU A 75 -2.425 0.127 2.243 1.00 72.53 O ATOM 1180 CB LEU A 75 -2.965 -2.571 4.096 1.00 72.53 C ATOM 1181 CG LEU A 75 -4.042 -3.282 4.924 1.00 72.53 C ATOM 1182 CD1 LEU A 75 -4.805 -4.293 4.081 1.00 72.53 C ATOM 1183 CD2 LEU A 75 -3.372 -3.968 6.100 1.00 72.53 C ATOM 0 H LEU A 75 -3.391 -3.979 2.082 1.00 72.53 H new ATOM 0 HA LEU A 75 -4.322 -1.414 2.923 1.00 72.53 H new ATOM 0 HB2 LEU A 75 -2.155 -3.277 3.910 1.00 72.53 H new ATOM 0 HB3 LEU A 75 -2.550 -1.762 4.697 1.00 72.53 H new ATOM 0 HG LEU A 75 -4.764 -2.548 5.283 1.00 72.53 H new ATOM 0 HD11 LEU A 75 -5.562 -4.781 4.695 1.00 72.53 H new ATOM 0 HD12 LEU A 75 -5.288 -3.782 3.248 1.00 72.53 H new ATOM 0 HD13 LEU A 75 -4.113 -5.041 3.695 1.00 72.53 H new ATOM 0 HD21 LEU A 75 -4.125 -4.479 6.700 1.00 72.53 H new ATOM 0 HD22 LEU A 75 -2.646 -4.694 5.733 1.00 72.53 H new ATOM 0 HD23 LEU A 75 -2.863 -3.224 6.713 1.00 72.53 H new ATOM 1195 N LEU A 76 -1.282 -1.724 1.641 1.00 57.08 N ATOM 1196 CA LEU A 76 -0.170 -0.991 1.043 1.00 57.08 C ATOM 1197 C LEU A 76 -0.676 -0.024 -0.017 1.00 57.08 C ATOM 1198 O LEU A 76 -0.232 1.115 -0.097 1.00 57.08 O ATOM 1199 CB LEU A 76 0.830 -1.950 0.404 1.00 57.08 C ATOM 1200 CG LEU A 76 2.087 -1.275 -0.160 1.00 57.08 C ATOM 1201 CD1 LEU A 76 3.303 -1.616 0.677 1.00 57.08 C ATOM 1202 CD2 LEU A 76 2.309 -1.662 -1.618 1.00 57.08 C ATOM 0 H LEU A 76 -1.190 -2.739 1.594 1.00 57.08 H new ATOM 0 HA LEU A 76 0.324 -0.433 1.838 1.00 57.08 H new ATOM 0 HB2 LEU A 76 1.132 -2.688 1.147 1.00 57.08 H new ATOM 0 HB3 LEU A 76 0.332 -2.492 -0.400 1.00 57.08 H new ATOM 0 HG LEU A 76 1.936 -0.196 -0.118 1.00 57.08 H new ATOM 0 HD11 LEU A 76 4.182 -1.126 0.258 1.00 57.08 H new ATOM 0 HD12 LEU A 76 3.149 -1.272 1.700 1.00 57.08 H new ATOM 0 HD13 LEU A 76 3.454 -2.695 0.676 1.00 57.08 H new ATOM 0 HD21 LEU A 76 3.206 -1.170 -1.993 1.00 57.08 H new ATOM 0 HD22 LEU A 76 2.430 -2.743 -1.693 1.00 57.08 H new ATOM 0 HD23 LEU A 76 1.450 -1.351 -2.212 1.00 57.08 H new ATOM 1214 N THR A 77 -1.619 -0.500 -0.823 1.00 38.46 N ATOM 1215 CA THR A 77 -2.211 0.296 -1.877 1.00 38.46 C ATOM 1216 C THR A 77 -2.820 1.577 -1.321 1.00 38.46 C ATOM 1217 O THR A 77 -2.668 2.644 -1.902 1.00 38.46 O ATOM 1218 CB THR A 77 -3.296 -0.516 -2.608 1.00 38.46 C ATOM 1219 OG1 THR A 77 -2.700 -1.616 -3.304 1.00 38.46 O ATOM 1220 CG2 THR A 77 -4.083 0.342 -3.586 1.00 38.46 C ATOM 0 H THR A 77 -1.990 -1.448 -0.759 1.00 38.46 H new ATOM 0 HA THR A 77 -1.422 0.564 -2.579 1.00 38.46 H new ATOM 0 HB THR A 77 -3.990 -0.888 -1.855 1.00 38.46 H new ATOM 0 HG1 THR A 77 -2.754 -2.422 -2.749 1.00 38.46 H new ATOM 0 HG21 THR A 77 -4.838 -0.269 -4.080 1.00 38.46 H new ATOM 0 HG22 THR A 77 -4.570 1.155 -3.047 1.00 38.46 H new ATOM 0 HG23 THR A 77 -3.406 0.757 -4.333 1.00 38.46 H new ATOM 1228 N MET A 78 -3.522 1.463 -0.203 1.00 70.15 N ATOM 1229 CA MET A 78 -4.149 2.625 0.398 1.00 70.15 C ATOM 1230 C MET A 78 -3.088 3.619 0.836 1.00 70.15 C ATOM 1231 O MET A 78 -3.250 4.828 0.677 1.00 70.15 O ATOM 1232 CB MET A 78 -5.033 2.203 1.567 1.00 70.15 C ATOM 1233 CG MET A 78 -6.201 1.333 1.123 1.00 70.15 C ATOM 1234 SD MET A 78 -7.365 0.980 2.453 1.00 70.15 S ATOM 1235 CE MET A 78 -8.534 -0.078 1.602 1.00 70.15 C ATOM 0 H MET A 78 -3.669 0.588 0.299 1.00 70.15 H new ATOM 0 HA MET A 78 -4.785 3.113 -0.341 1.00 70.15 H new ATOM 0 HB2 MET A 78 -4.433 1.658 2.295 1.00 70.15 H new ATOM 0 HB3 MET A 78 -5.415 3.091 2.070 1.00 70.15 H new ATOM 0 HG2 MET A 78 -6.728 1.831 0.309 1.00 70.15 H new ATOM 0 HG3 MET A 78 -5.816 0.394 0.726 1.00 70.15 H new ATOM 0 HE1 MET A 78 -9.538 0.107 1.985 1.00 70.15 H new ATOM 0 HE2 MET A 78 -8.508 0.137 0.534 1.00 70.15 H new ATOM 0 HE3 MET A 78 -8.268 -1.122 1.769 1.00 70.15 H new ATOM 1245 N VAL A 79 -1.986 3.094 1.354 1.00 44.32 N ATOM 1246 CA VAL A 79 -0.874 3.923 1.781 1.00 44.32 C ATOM 1247 C VAL A 79 -0.162 4.497 0.562 1.00 44.32 C ATOM 1248 O VAL A 79 0.167 5.682 0.510 1.00 44.32 O ATOM 1249 CB VAL A 79 0.123 3.101 2.618 1.00 44.32 C ATOM 1250 CG1 VAL A 79 1.239 3.979 3.151 1.00 44.32 C ATOM 1251 CG2 VAL A 79 -0.601 2.388 3.746 1.00 44.32 C ATOM 0 H VAL A 79 -1.841 2.093 1.488 1.00 44.32 H new ATOM 0 HA VAL A 79 -1.263 4.735 2.395 1.00 44.32 H new ATOM 0 HB VAL A 79 0.578 2.349 1.974 1.00 44.32 H new ATOM 0 HG11 VAL A 79 1.929 3.374 3.739 1.00 44.32 H new ATOM 0 HG12 VAL A 79 1.774 4.433 2.317 1.00 44.32 H new ATOM 0 HG13 VAL A 79 0.817 4.762 3.781 1.00 44.32 H new ATOM 0 HG21 VAL A 79 0.115 1.810 4.330 1.00 44.32 H new ATOM 0 HG22 VAL A 79 -1.085 3.123 4.389 1.00 44.32 H new ATOM 0 HG23 VAL A 79 -1.353 1.718 3.329 1.00 44.32 H new ATOM 1261 N VAL A 80 0.054 3.633 -0.423 1.00 90.77 N ATOM 1262 CA VAL A 80 0.706 4.010 -1.667 1.00 90.77 C ATOM 1263 C VAL A 80 -0.137 5.028 -2.433 1.00 90.77 C ATOM 1264 O VAL A 80 0.367 6.049 -2.896 1.00 90.77 O ATOM 1265 CB VAL A 80 0.939 2.760 -2.551 1.00 90.77 C ATOM 1266 CG1 VAL A 80 1.522 3.144 -3.908 1.00 90.77 C ATOM 1267 CG2 VAL A 80 1.835 1.751 -1.836 1.00 90.77 C ATOM 0 H VAL A 80 -0.219 2.651 -0.380 1.00 90.77 H new ATOM 0 HA VAL A 80 1.667 4.462 -1.422 1.00 90.77 H new ATOM 0 HB VAL A 80 -0.028 2.290 -2.728 1.00 90.77 H new ATOM 0 HG11 VAL A 80 1.674 2.245 -4.506 1.00 90.77 H new ATOM 0 HG12 VAL A 80 0.832 3.811 -4.425 1.00 90.77 H new ATOM 0 HG13 VAL A 80 2.477 3.650 -3.764 1.00 90.77 H new ATOM 0 HG21 VAL A 80 1.985 0.881 -2.475 1.00 90.77 H new ATOM 0 HG22 VAL A 80 2.799 2.211 -1.617 1.00 90.77 H new ATOM 0 HG23 VAL A 80 1.362 1.440 -0.905 1.00 90.77 H new ATOM 1277 N ASP A 81 -1.423 4.736 -2.569 1.00 37.97 N ATOM 1278 CA ASP A 81 -2.333 5.622 -3.277 1.00 37.97 C ATOM 1279 C ASP A 81 -2.386 6.974 -2.589 1.00 37.97 C ATOM 1280 O ASP A 81 -2.432 8.015 -3.244 1.00 37.97 O ATOM 1281 CB ASP A 81 -3.730 5.000 -3.358 1.00 37.97 C ATOM 1282 CG ASP A 81 -3.775 3.789 -4.271 1.00 37.97 C ATOM 1283 OD1 ASP A 81 -2.779 3.543 -4.986 1.00 37.97 O ATOM 1284 OD2 ASP A 81 -4.806 3.087 -4.273 1.00 37.97 O ATOM 0 H ASP A 81 -1.859 3.892 -2.198 1.00 37.97 H new ATOM 0 HA ASP A 81 -1.965 5.765 -4.293 1.00 37.97 H new ATOM 0 HB2 ASP A 81 -4.053 4.710 -2.358 1.00 37.97 H new ATOM 0 HB3 ASP A 81 -4.437 5.748 -3.717 1.00 37.97 H new ATOM 1289 N TYR A 82 -2.360 6.952 -1.261 1.00130.70 N ATOM 1290 CA TYR A 82 -2.384 8.174 -0.490 1.00130.70 C ATOM 1291 C TYR A 82 -1.151 9.022 -0.786 1.00130.70 C ATOM 1292 O TYR A 82 -1.242 10.243 -0.915 1.00130.70 O ATOM 1293 CB TYR A 82 -2.448 7.832 0.996 1.00130.70 C ATOM 1294 CG TYR A 82 -2.078 8.968 1.921 1.00130.70 C ATOM 1295 CD1 TYR A 82 -0.743 9.283 2.141 1.00130.70 C ATOM 1296 CD2 TYR A 82 -3.044 9.710 2.573 1.00130.70 C ATOM 1297 CE1 TYR A 82 -0.386 10.310 2.983 1.00130.70 C ATOM 1298 CE2 TYR A 82 -2.692 10.734 3.419 1.00130.70 C ATOM 1299 CZ TYR A 82 -1.364 11.034 3.621 1.00130.70 C ATOM 1300 OH TYR A 82 -1.015 12.061 4.466 1.00130.70 O ATOM 0 H TYR A 82 -2.322 6.099 -0.703 1.00130.70 H new ATOM 0 HA TYR A 82 -3.265 8.752 -0.767 1.00130.70 H new ATOM 0 HB2 TYR A 82 -3.458 7.501 1.236 1.00130.70 H new ATOM 0 HB3 TYR A 82 -1.782 6.991 1.191 1.00130.70 H new ATOM 0 HD1 TYR A 82 0.027 8.712 1.643 1.00130.70 H new ATOM 0 HD2 TYR A 82 -4.088 9.483 2.416 1.00130.70 H new ATOM 0 HE1 TYR A 82 0.656 10.546 3.142 1.00130.70 H new ATOM 0 HE2 TYR A 82 -3.457 11.303 3.925 1.00130.70 H new ATOM 0 HH TYR A 82 -1.801 12.617 4.647 1.00130.70 H new ATOM 1310 N ARG A 83 0.005 8.365 -0.879 1.00265.02 N ATOM 1311 CA ARG A 83 1.263 9.057 -1.146 1.00265.02 C ATOM 1312 C ARG A 83 1.103 9.977 -2.345 1.00265.02 C ATOM 1313 O ARG A 83 1.488 11.137 -2.295 1.00265.02 O ATOM 1314 CB ARG A 83 2.378 8.011 -1.367 1.00265.02 C ATOM 1315 CG ARG A 83 3.612 8.508 -2.126 1.00265.02 C ATOM 1316 CD ARG A 83 3.744 7.816 -3.479 1.00265.02 C ATOM 1317 NE ARG A 83 5.138 7.729 -3.922 1.00265.02 N ATOM 1318 CZ ARG A 83 5.514 7.334 -5.141 1.00265.02 C ATOM 1319 NH1 ARG A 83 4.607 6.996 -6.052 1.00265.02 N ATOM 1320 NH2 ARG A 83 6.805 7.280 -5.449 1.00265.02 N ATOM 0 H ARG A 83 0.095 7.355 -0.773 1.00265.02 H new ATOM 0 HA ARG A 83 1.541 9.677 -0.294 1.00265.02 H new ATOM 0 HB2 ARG A 83 2.698 7.637 -0.395 1.00265.02 H new ATOM 0 HB3 ARG A 83 1.956 7.166 -1.910 1.00265.02 H new ATOM 0 HG2 ARG A 83 3.543 9.586 -2.271 1.00265.02 H new ATOM 0 HG3 ARG A 83 4.507 8.323 -1.531 1.00265.02 H new ATOM 0 HD2 ARG A 83 3.321 6.813 -3.415 1.00265.02 H new ATOM 0 HD3 ARG A 83 3.162 8.361 -4.222 1.00265.02 H new ATOM 0 HE ARG A 83 5.867 7.986 -3.257 1.00265.02 H new ATOM 0 HH11 ARG A 83 3.614 7.037 -5.823 1.00265.02 H new ATOM 0 HH12 ARG A 83 4.904 6.696 -6.980 1.00265.02 H new ATOM 0 HH21 ARG A 83 7.506 7.540 -4.755 1.00265.02 H new ATOM 0 HH22 ARG A 83 7.095 6.979 -6.379 1.00265.02 H new ATOM 1334 N THR A 84 0.514 9.451 -3.398 1.00259.68 N ATOM 1335 CA THR A 84 0.273 10.212 -4.598 1.00259.68 C ATOM 1336 C THR A 84 -0.967 11.105 -4.488 1.00259.68 C ATOM 1337 O THR A 84 -0.979 12.225 -4.997 1.00259.68 O ATOM 1338 CB THR A 84 0.084 9.272 -5.790 1.00259.68 C ATOM 1339 OG1 THR A 84 1.221 8.410 -5.931 1.00259.68 O ATOM 1340 CG2 THR A 84 -0.127 10.063 -7.061 1.00259.68 C ATOM 0 H THR A 84 0.190 8.485 -3.443 1.00259.68 H new ATOM 0 HA THR A 84 1.145 10.850 -4.741 1.00259.68 H new ATOM 0 HB THR A 84 -0.800 8.661 -5.608 1.00259.68 H new ATOM 0 HG1 THR A 84 1.086 7.813 -6.696 1.00259.68 H new ATOM 0 HG21 THR A 84 -0.260 9.378 -7.898 1.00259.68 H new ATOM 0 HG22 THR A 84 -1.015 10.687 -6.958 1.00259.68 H new ATOM 0 HG23 THR A 84 0.741 10.696 -7.244 1.00259.68 H new ATOM 1348 N ARG A 85 -2.030 10.575 -3.891 1.00220.68 N ATOM 1349 CA ARG A 85 -3.285 11.310 -3.811 1.00220.68 C ATOM 1350 C ARG A 85 -3.148 12.586 -2.972 1.00220.68 C ATOM 1351 O ARG A 85 -3.579 13.656 -3.398 1.00220.68 O ATOM 1352 CB ARG A 85 -4.422 10.396 -3.295 1.00220.68 C ATOM 1353 CG ARG A 85 -4.682 10.443 -1.796 1.00220.68 C ATOM 1354 CD ARG A 85 -5.532 11.646 -1.433 1.00220.68 C ATOM 1355 NE ARG A 85 -6.895 11.273 -1.055 1.00220.68 N ATOM 1356 CZ ARG A 85 -7.688 12.011 -0.272 1.00220.68 C ATOM 1357 NH1 ARG A 85 -7.250 13.149 0.260 1.00220.68 N ATOM 1358 NH2 ARG A 85 -8.925 11.605 -0.015 1.00220.68 N ATOM 0 H ARG A 85 -2.047 9.650 -3.461 1.00220.68 H new ATOM 0 HA ARG A 85 -3.549 11.631 -4.819 1.00220.68 H new ATOM 0 HB2 ARG A 85 -5.342 10.666 -3.813 1.00220.68 H new ATOM 0 HB3 ARG A 85 -4.190 9.368 -3.572 1.00220.68 H new ATOM 0 HG2 ARG A 85 -5.185 9.529 -1.481 1.00220.68 H new ATOM 0 HG3 ARG A 85 -3.734 10.487 -1.259 1.00220.68 H new ATOM 0 HD2 ARG A 85 -5.063 12.183 -0.608 1.00220.68 H new ATOM 0 HD3 ARG A 85 -5.568 12.331 -2.280 1.00220.68 H new ATOM 0 HE ARG A 85 -7.264 10.392 -1.412 1.00220.68 H new ATOM 0 HH11 ARG A 85 -6.299 13.467 0.072 1.00220.68 H new ATOM 0 HH12 ARG A 85 -7.865 13.703 0.856 1.00220.68 H new ATOM 0 HH21 ARG A 85 -9.269 10.732 -0.415 1.00220.68 H new ATOM 0 HH22 ARG A 85 -9.532 12.166 0.582 1.00220.68 H new ATOM 1372 N VAL A 86 -2.525 12.481 -1.802 1.00 63.58 N ATOM 1373 CA VAL A 86 -2.327 13.651 -0.957 1.00 63.58 C ATOM 1374 C VAL A 86 -1.228 14.522 -1.564 1.00 63.58 C ATOM 1375 O VAL A 86 -1.271 15.749 -1.477 1.00 63.58 O ATOM 1376 CB VAL A 86 -2.006 13.265 0.515 1.00 63.58 C ATOM 1377 CG1 VAL A 86 -1.546 14.475 1.325 1.00 63.58 C ATOM 1378 CG2 VAL A 86 -3.238 12.649 1.165 1.00 63.58 C ATOM 0 H VAL A 86 -2.154 11.610 -1.422 1.00 63.58 H new ATOM 0 HA VAL A 86 -3.257 14.218 -0.921 1.00 63.58 H new ATOM 0 HB VAL A 86 -1.192 12.540 0.503 1.00 63.58 H new ATOM 0 HG11 VAL A 86 -1.331 14.167 2.348 1.00 63.58 H new ATOM 0 HG12 VAL A 86 -0.646 14.893 0.875 1.00 63.58 H new ATOM 0 HG13 VAL A 86 -2.333 15.229 1.331 1.00 63.58 H new ATOM 0 HG21 VAL A 86 -3.009 12.380 2.196 1.00 63.58 H new ATOM 0 HG22 VAL A 86 -4.056 13.370 1.151 1.00 63.58 H new ATOM 0 HG23 VAL A 86 -3.532 11.756 0.614 1.00 63.58 H new ATOM 1583 N LEU A 99 16.799 28.208 -3.869 1.00281.45 N ATOM 1584 CA LEU A 99 17.200 29.360 -3.070 1.00281.45 C ATOM 1585 C LEU A 99 17.803 28.942 -1.739 1.00281.45 C ATOM 1586 O LEU A 99 17.164 28.252 -0.944 1.00281.45 O ATOM 1587 CB LEU A 99 15.994 30.258 -2.813 1.00281.45 C ATOM 1588 CG LEU A 99 15.581 31.135 -3.990 1.00281.45 C ATOM 1589 CD1 LEU A 99 15.064 30.277 -5.132 1.00281.45 C ATOM 1590 CD2 LEU A 99 14.532 32.143 -3.550 1.00281.45 C ATOM 0 HA LEU A 99 17.960 29.901 -3.634 1.00281.45 H new ATOM 0 HB2 LEU A 99 15.147 29.632 -2.531 1.00281.45 H new ATOM 0 HB3 LEU A 99 16.213 30.900 -1.960 1.00281.45 H new ATOM 0 HG LEU A 99 16.454 31.683 -4.346 1.00281.45 H new ATOM 0 HD11 LEU A 99 14.773 30.917 -5.965 1.00281.45 H new ATOM 0 HD12 LEU A 99 15.848 29.593 -5.457 1.00281.45 H new ATOM 0 HD13 LEU A 99 14.200 29.705 -4.795 1.00281.45 H new ATOM 0 HD21 LEU A 99 14.245 32.764 -4.399 1.00281.45 H new ATOM 0 HD22 LEU A 99 13.656 31.615 -3.174 1.00281.45 H new ATOM 0 HD23 LEU A 99 14.942 32.774 -2.762 1.00281.45 H new ATOM 1602 N THR A 100 19.031 29.379 -1.495 1.00235.89 N ATOM 1603 CA THR A 100 19.714 29.067 -0.252 1.00235.89 C ATOM 1604 C THR A 100 19.683 30.253 0.719 1.00235.89 C ATOM 1605 O THR A 100 18.773 30.360 1.543 1.00235.89 O ATOM 1606 CB THR A 100 21.164 28.626 -0.509 1.00235.89 C ATOM 1607 OG1 THR A 100 21.907 29.687 -1.121 1.00235.89 O ATOM 1608 CG2 THR A 100 21.198 27.402 -1.395 1.00235.89 C ATOM 0 H THR A 100 19.573 29.951 -2.143 1.00235.89 H new ATOM 0 HA THR A 100 19.178 28.237 0.209 1.00235.89 H new ATOM 0 HB THR A 100 21.620 28.379 0.450 1.00235.89 H new ATOM 0 HG1 THR A 100 22.829 29.393 -1.277 1.00235.89 H new ATOM 0 HG21 THR A 100 22.233 27.105 -1.566 1.00235.89 H new ATOM 0 HG22 THR A 100 20.662 26.587 -0.910 1.00235.89 H new ATOM 0 HG23 THR A 100 20.724 27.631 -2.350 1.00235.89 H new ATOM 1616 N ARG A 101 20.679 31.140 0.629 1.00326.00 N ATOM 1617 CA ARG A 101 20.751 32.303 1.509 1.00326.00 C ATOM 1618 C ARG A 101 20.159 33.529 0.836 1.00326.00 C ATOM 1619 O ARG A 101 20.865 34.297 0.182 1.00326.00 O ATOM 1620 CB ARG A 101 22.205 32.575 1.931 1.00326.00 C ATOM 1621 CG ARG A 101 23.098 31.334 2.005 1.00326.00 C ATOM 1622 CD ARG A 101 22.397 30.136 2.646 1.00326.00 C ATOM 1623 NE ARG A 101 23.085 29.671 3.847 1.00326.00 N ATOM 1624 CZ ARG A 101 22.697 28.620 4.571 1.00326.00 C ATOM 1625 NH1 ARG A 101 21.627 27.914 4.221 1.00326.00 N ATOM 1626 NH2 ARG A 101 23.383 28.274 5.651 1.00326.00 N ATOM 0 H ARG A 101 21.443 31.072 -0.043 1.00326.00 H new ATOM 0 HA ARG A 101 20.165 32.086 2.402 1.00326.00 H new ATOM 0 HB2 ARG A 101 22.646 33.281 1.227 1.00326.00 H new ATOM 0 HB3 ARG A 101 22.200 33.060 2.907 1.00326.00 H new ATOM 0 HG2 ARG A 101 23.421 31.064 1.000 1.00326.00 H new ATOM 0 HG3 ARG A 101 23.996 31.572 2.576 1.00326.00 H new ATOM 0 HD2 ARG A 101 21.373 30.410 2.899 1.00326.00 H new ATOM 0 HD3 ARG A 101 22.340 29.322 1.924 1.00326.00 H new ATOM 0 HE ARG A 101 23.914 30.182 4.151 1.00326.00 H new ATOM 0 HH11 ARG A 101 21.093 28.174 3.391 1.00326.00 H new ATOM 0 HH12 ARG A 101 21.339 27.112 4.782 1.00326.00 H new ATOM 0 HH21 ARG A 101 24.205 28.811 5.927 1.00326.00 H new ATOM 0 HH22 ARG A 101 23.089 27.471 6.207 1.00326.00 H new ATOM 1640 N ILE A 102 18.856 33.698 0.989 1.00164.55 N ATOM 1641 CA ILE A 102 18.152 34.818 0.390 1.00164.55 C ATOM 1642 C ILE A 102 17.612 35.739 1.482 1.00164.55 C ATOM 1643 O ILE A 102 16.436 35.682 1.826 1.00164.55 O ATOM 1644 CB ILE A 102 16.993 34.334 -0.516 1.00164.55 C ATOM 1645 CG1 ILE A 102 17.518 33.468 -1.674 1.00164.55 C ATOM 1646 CG2 ILE A 102 16.207 35.515 -1.082 1.00164.55 C ATOM 1647 CD1 ILE A 102 18.262 32.218 -1.254 1.00164.55 C ATOM 0 H ILE A 102 18.261 33.068 1.527 1.00164.55 H new ATOM 0 HA ILE A 102 18.859 35.368 -0.231 1.00164.55 H new ATOM 0 HB ILE A 102 16.330 33.731 0.105 1.00164.55 H new ATOM 0 HG12 ILE A 102 16.675 33.177 -2.301 1.00164.55 H new ATOM 0 HG13 ILE A 102 18.180 34.076 -2.291 1.00164.55 H new ATOM 0 HG21 ILE A 102 15.400 35.145 -1.714 1.00164.55 H new ATOM 0 HG22 ILE A 102 15.788 36.099 -0.263 1.00164.55 H new ATOM 0 HG23 ILE A 102 16.872 36.144 -1.674 1.00164.55 H new ATOM 0 HD11 ILE A 102 18.592 31.676 -2.140 1.00164.55 H new ATOM 0 HD12 ILE A 102 19.129 32.495 -0.654 1.00164.55 H new ATOM 0 HD13 ILE A 102 17.601 31.582 -0.665 1.00164.55 H new ATOM 1659 N PRO A 103 18.464 36.607 2.050 1.00 72.69 N ATOM 1660 CA PRO A 103 18.048 37.527 3.106 1.00 72.69 C ATOM 1661 C PRO A 103 16.828 38.357 2.710 1.00 72.69 C ATOM 1662 O PRO A 103 16.089 38.837 3.570 1.00 72.69 O ATOM 1663 CB PRO A 103 19.271 38.424 3.317 1.00 72.69 C ATOM 1664 CG PRO A 103 20.158 38.174 2.147 1.00 72.69 C ATOM 1665 CD PRO A 103 19.889 36.763 1.724 1.00 72.69 C ATOM 0 HA PRO A 103 17.744 36.994 4.007 1.00 72.69 H new ATOM 0 HB2 PRO A 103 18.982 39.474 3.373 1.00 72.69 H new ATOM 0 HB3 PRO A 103 19.778 38.183 4.252 1.00 72.69 H new ATOM 0 HG2 PRO A 103 19.944 38.872 1.338 1.00 72.69 H new ATOM 0 HG3 PRO A 103 21.206 38.309 2.415 1.00 72.69 H new ATOM 0 HD2 PRO A 103 20.082 36.613 0.662 1.00 72.69 H new ATOM 0 HD3 PRO A 103 20.511 36.050 2.265 1.00 72.69 H new ATOM 1673 N SER A 104 16.611 38.511 1.407 1.00159.85 N ATOM 1674 CA SER A 104 15.467 39.268 0.911 1.00159.85 C ATOM 1675 C SER A 104 14.187 38.422 0.916 1.00159.85 C ATOM 1676 O SER A 104 13.110 38.921 0.591 1.00159.85 O ATOM 1677 CB SER A 104 15.746 39.781 -0.503 1.00159.85 C ATOM 1678 OG SER A 104 15.696 38.726 -1.448 1.00159.85 O ATOM 0 H SER A 104 17.210 38.123 0.678 1.00159.85 H new ATOM 0 HA SER A 104 15.314 40.115 1.580 1.00159.85 H new ATOM 0 HB2 SER A 104 15.014 40.545 -0.767 1.00159.85 H new ATOM 0 HB3 SER A 104 16.727 40.255 -0.534 1.00159.85 H new ATOM 0 HG SER A 104 15.876 39.080 -2.344 1.00159.85 H new ATOM 1684 N ALA A 105 14.304 37.142 1.283 1.00293.58 N ATOM 1685 CA ALA A 105 13.155 36.248 1.323 1.00293.58 C ATOM 1686 C ALA A 105 13.333 35.190 2.407 1.00293.58 C ATOM 1687 O ALA A 105 12.602 35.168 3.398 1.00293.58 O ATOM 1688 CB ALA A 105 12.964 35.588 -0.031 1.00293.58 C ATOM 0 H ALA A 105 15.185 36.707 1.556 1.00293.58 H new ATOM 0 HA ALA A 105 12.267 36.834 1.560 1.00293.58 H new ATOM 0 HB1 ALA A 105 12.103 34.921 0.008 1.00293.58 H new ATOM 0 HB2 ALA A 105 12.796 36.354 -0.789 1.00293.58 H new ATOM 0 HB3 ALA A 105 13.856 35.015 -0.285 1.00293.58 H new ATOM 1694 N LYS A 106 14.319 34.323 2.213 1.00328.40 N ATOM 1695 CA LYS A 106 14.618 33.266 3.169 1.00328.40 C ATOM 1696 C LYS A 106 15.499 33.812 4.288 1.00328.40 C ATOM 1697 O LYS A 106 16.503 34.474 4.024 1.00328.40 O ATOM 1698 CB LYS A 106 15.328 32.114 2.457 1.00328.40 C ATOM 1699 CG LYS A 106 14.599 31.636 1.211 1.00328.40 C ATOM 1700 CD LYS A 106 15.256 30.404 0.610 1.00328.40 C ATOM 1701 CE LYS A 106 14.771 29.129 1.281 1.00328.40 C ATOM 1702 NZ LYS A 106 13.407 28.745 0.819 1.00328.40 N ATOM 0 H LYS A 106 14.929 34.332 1.396 1.00328.40 H new ATOM 0 HA LYS A 106 13.687 32.898 3.601 1.00328.40 H new ATOM 0 HB2 LYS A 106 16.334 32.431 2.182 1.00328.40 H new ATOM 0 HB3 LYS A 106 15.435 31.279 3.149 1.00328.40 H new ATOM 0 HG2 LYS A 106 13.562 31.410 1.461 1.00328.40 H new ATOM 0 HG3 LYS A 106 14.581 32.436 0.471 1.00328.40 H new ATOM 0 HD2 LYS A 106 15.040 30.359 -0.457 1.00328.40 H new ATOM 0 HD3 LYS A 106 16.338 30.481 0.713 1.00328.40 H new ATOM 0 HE2 LYS A 106 15.468 28.319 1.069 1.00328.40 H new ATOM 0 HE3 LYS A 106 14.763 29.268 2.362 1.00328.40 H new ATOM 0 HZ1 LYS A 106 13.152 27.820 1.220 1.00328.40 H new ATOM 0 HZ2 LYS A 106 12.720 29.460 1.133 1.00328.40 H new ATOM 0 HZ3 LYS A 106 13.396 28.687 -0.219 1.00328.40 H new ATOM 1716 N LYS A 107 15.127 33.543 5.534 1.00281.61 N ATOM 1717 CA LYS A 107 15.905 34.029 6.665 1.00281.61 C ATOM 1718 C LYS A 107 16.883 32.984 7.180 1.00281.61 C ATOM 1719 O LYS A 107 16.571 31.798 7.277 1.00281.61 O ATOM 1720 CB LYS A 107 15.002 34.488 7.805 1.00281.61 C ATOM 1721 CG LYS A 107 14.139 35.689 7.450 1.00281.61 C ATOM 1722 CD LYS A 107 14.969 36.967 7.359 1.00281.61 C ATOM 1723 CE LYS A 107 14.449 38.042 8.301 1.00281.61 C ATOM 1724 NZ LYS A 107 14.620 39.408 7.735 1.00281.61 N ATOM 0 H LYS A 107 14.302 32.998 5.784 1.00281.61 H new ATOM 0 HA LYS A 107 16.477 34.881 6.299 1.00281.61 H new ATOM 0 HB2 LYS A 107 14.356 33.662 8.101 1.00281.61 H new ATOM 0 HB3 LYS A 107 15.619 34.736 8.669 1.00281.61 H new ATOM 0 HG2 LYS A 107 13.639 35.510 6.498 1.00281.61 H new ATOM 0 HG3 LYS A 107 13.359 35.813 8.202 1.00281.61 H new ATOM 0 HD2 LYS A 107 16.009 36.744 7.599 1.00281.61 H new ATOM 0 HD3 LYS A 107 14.952 37.340 6.335 1.00281.61 H new ATOM 0 HE2 LYS A 107 13.394 37.864 8.507 1.00281.61 H new ATOM 0 HE3 LYS A 107 14.975 37.975 9.253 1.00281.61 H new ATOM 0 HZ1 LYS A 107 14.253 40.111 8.408 1.00281.61 H new ATOM 0 HZ2 LYS A 107 15.630 39.588 7.562 1.00281.61 H new ATOM 0 HZ3 LYS A 107 14.097 39.481 6.839 1.00281.61 H new ATOM 1738 N TYR A 108 18.065 33.467 7.526 1.00309.62 N ATOM 1739 CA TYR A 108 19.141 32.645 8.064 1.00309.62 C ATOM 1740 C TYR A 108 18.682 31.846 9.280 1.00309.62 C ATOM 1741 O TYR A 108 17.976 32.372 10.141 1.00309.62 O ATOM 1742 CB TYR A 108 20.274 33.575 8.498 1.00309.62 C ATOM 1743 CG TYR A 108 19.830 34.496 9.619 1.00309.62 C ATOM 1744 CD1 TYR A 108 19.178 35.693 9.348 1.00309.62 C ATOM 1745 CD2 TYR A 108 20.029 34.141 10.947 1.00309.62 C ATOM 1746 CE1 TYR A 108 18.741 36.513 10.369 1.00309.62 C ATOM 1747 CE2 TYR A 108 19.598 34.956 11.976 1.00309.62 C ATOM 1748 CZ TYR A 108 18.953 36.141 11.682 1.00309.62 C ATOM 1749 OH TYR A 108 18.518 36.956 12.702 1.00309.62 O ATOM 0 H TYR A 108 18.309 34.454 7.441 1.00309.62 H new ATOM 0 HA TYR A 108 19.463 31.943 7.295 1.00309.62 H new ATOM 0 HB2 TYR A 108 21.128 32.983 8.827 1.00309.62 H new ATOM 0 HB3 TYR A 108 20.607 34.169 7.647 1.00309.62 H new ATOM 0 HD1 TYR A 108 19.011 35.986 8.322 1.00309.62 H new ATOM 0 HD2 TYR A 108 20.529 33.212 11.179 1.00309.62 H new ATOM 0 HE1 TYR A 108 18.236 37.440 10.142 1.00309.62 H new ATOM 0 HE2 TYR A 108 19.764 34.668 13.004 1.00309.62 H new ATOM 0 HH TYR A 108 17.723 37.449 12.410 1.00309.62 H new ATOM 1759 N LYS A 109 19.114 30.598 9.374 1.00276.51 N ATOM 1760 CA LYS A 109 18.767 29.779 10.525 1.00276.51 C ATOM 1761 C LYS A 109 19.944 29.648 11.478 1.00276.51 C ATOM 1762 O LYS A 109 19.981 28.741 12.309 1.00276.51 O ATOM 1763 CB LYS A 109 18.260 28.410 10.093 1.00276.51 C ATOM 1764 CG LYS A 109 17.267 28.488 8.942 1.00276.51 C ATOM 1765 CD LYS A 109 15.883 28.010 9.355 1.00276.51 C ATOM 1766 CE LYS A 109 15.906 26.554 9.777 1.00276.51 C ATOM 1767 NZ LYS A 109 16.327 25.657 8.663 1.00276.51 N ATOM 0 H LYS A 109 19.698 30.135 8.677 1.00276.51 H new ATOM 0 HA LYS A 109 17.959 30.281 11.057 1.00276.51 H new ATOM 0 HB2 LYS A 109 19.106 27.791 9.796 1.00276.51 H new ATOM 0 HB3 LYS A 109 17.787 27.917 10.943 1.00276.51 H new ATOM 0 HG2 LYS A 109 17.205 29.516 8.585 1.00276.51 H new ATOM 0 HG3 LYS A 109 17.627 27.883 8.110 1.00276.51 H new ATOM 0 HD2 LYS A 109 15.515 28.623 10.177 1.00276.51 H new ATOM 0 HD3 LYS A 109 15.189 28.139 8.525 1.00276.51 H new ATOM 0 HE2 LYS A 109 16.587 26.431 10.619 1.00276.51 H new ATOM 0 HE3 LYS A 109 14.915 26.261 10.124 1.00276.51 H new ATOM 0 HZ1 LYS A 109 16.137 24.668 8.923 1.00276.51 H new ATOM 0 HZ2 LYS A 109 15.794 25.898 7.803 1.00276.51 H new ATOM 0 HZ3 LYS A 109 17.344 25.779 8.485 1.00276.51 H new ATOM 1781 N ASP A 110 20.893 30.584 11.383 1.00203.92 N ATOM 1782 CA ASP A 110 22.054 30.593 12.269 1.00203.92 C ATOM 1783 C ASP A 110 21.589 30.620 13.724 1.00203.92 C ATOM 1784 O ASP A 110 22.282 30.146 14.623 1.00203.92 O ATOM 1785 CB ASP A 110 22.936 31.807 11.978 1.00203.92 C ATOM 1786 CG ASP A 110 23.528 31.770 10.583 1.00203.92 C ATOM 1787 OD1 ASP A 110 23.628 30.664 10.009 1.00203.92 O ATOM 1788 OD2 ASP A 110 23.895 32.845 10.064 1.00203.92 O ATOM 0 H ASP A 110 20.878 31.343 10.702 1.00203.92 H new ATOM 0 HA ASP A 110 22.639 29.690 12.095 1.00203.92 H new ATOM 0 HB2 ASP A 110 22.348 32.717 12.096 1.00203.92 H new ATOM 0 HB3 ASP A 110 23.742 31.851 12.711 1.00203.92 H new ATOM 1793 N ILE A 111 20.385 31.157 13.931 1.00 50.97 N ATOM 1794 CA ILE A 111 19.789 31.225 15.242 1.00 50.97 C ATOM 1795 C ILE A 111 19.106 29.887 15.540 1.00 50.97 C ATOM 1796 O ILE A 111 18.576 29.241 14.636 1.00 50.97 O ATOM 1797 CB ILE A 111 18.802 32.429 15.309 1.00 50.97 C ATOM 1798 CG1 ILE A 111 19.581 33.721 15.569 1.00 50.97 C ATOM 1799 CG2 ILE A 111 17.718 32.240 16.364 1.00 50.97 C ATOM 1800 CD1 ILE A 111 18.791 34.977 15.272 1.00 50.97 C ATOM 0 H ILE A 111 19.807 31.552 13.189 1.00 50.97 H new ATOM 0 HA ILE A 111 20.547 31.394 16.007 1.00 50.97 H new ATOM 0 HB ILE A 111 18.295 32.491 14.346 1.00 50.97 H new ATOM 0 HG12 ILE A 111 19.899 33.740 16.612 1.00 50.97 H new ATOM 0 HG13 ILE A 111 20.485 33.719 14.960 1.00 50.97 H new ATOM 0 HG21 ILE A 111 17.059 33.108 16.368 1.00 50.97 H new ATOM 0 HG22 ILE A 111 17.139 31.345 16.135 1.00 50.97 H new ATOM 0 HG23 ILE A 111 18.180 32.131 17.345 1.00 50.97 H new ATOM 0 HD11 ILE A 111 19.407 35.852 15.480 1.00 50.97 H new ATOM 0 HD12 ILE A 111 18.496 34.982 14.223 1.00 50.97 H new ATOM 0 HD13 ILE A 111 17.900 35.003 15.900 1.00 50.97 H new ATOM 1812 N ILE A 112 19.133 29.468 16.798 1.00108.96 N ATOM 1813 CA ILE A 112 18.525 28.201 17.174 1.00108.96 C ATOM 1814 C ILE A 112 17.067 28.391 17.555 1.00108.96 C ATOM 1815 O ILE A 112 16.737 29.177 18.444 1.00108.96 O ATOM 1816 CB ILE A 112 19.278 27.536 18.349 1.00108.96 C ATOM 1817 CG1 ILE A 112 20.771 27.408 18.027 1.00108.96 C ATOM 1818 CG2 ILE A 112 18.685 26.166 18.667 1.00108.96 C ATOM 1819 CD1 ILE A 112 21.057 26.705 16.715 1.00108.96 C ATOM 0 H ILE A 112 19.564 29.981 17.567 1.00108.96 H new ATOM 0 HA ILE A 112 18.588 27.547 16.304 1.00108.96 H new ATOM 0 HB ILE A 112 19.164 28.171 19.227 1.00108.96 H new ATOM 0 HG12 ILE A 112 21.213 28.404 17.999 1.00108.96 H new ATOM 0 HG13 ILE A 112 21.262 26.864 18.834 1.00108.96 H new ATOM 0 HG21 ILE A 112 19.231 25.717 19.497 1.00108.96 H new ATOM 0 HG22 ILE A 112 17.636 26.278 18.941 1.00108.96 H new ATOM 0 HG23 ILE A 112 18.764 25.523 17.790 1.00108.96 H new ATOM 0 HD11 ILE A 112 22.134 26.653 16.557 1.00108.96 H new ATOM 0 HD12 ILE A 112 20.646 25.696 16.746 1.00108.96 H new ATOM 0 HD13 ILE A 112 20.597 27.260 15.897 1.00108.96 H new