USER MOD reduce.3.24.130724 H: found=0, std=0, add=808, rem=0, adj=27 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 53 ASN : amide:sc= -0.905 K(o=-0.9,f=-9.5!) USER MOD Set 1.2: A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 27 CYS SG : rot -173:sc= -4.37! USER MOD Set 2.2: A 62 TYR OH : rot -34:sc= -0.283 USER MOD Set 3.1: A 14 ASN :FLIP amide:sc= -0.21 F(o=-2.1,f=-0.39) USER MOD Set 3.2: A 78 MET CE :methyl -137:sc= -0.182 (180deg=0) USER MOD Set 4.1: A 9 GLN : amide:sc= 0.0675 X(o=-0.57,f=-0.7) USER MOD Set 4.2: A 13 ASN : amide:sc= -0.639 K(o=-0.57,f=-1.9) USER MOD Single : A 4 TYR OH : rot 80:sc= -3.57! USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot 100:sc= 0.321 USER MOD Single : A 16 THR OG1 : rot 180:sc= -1.99 USER MOD Single : A 22 GLN : amide:sc= -0.901 X(o=-0.9,f=-0.99) USER MOD Single : A 24 LYS NZ :NH3+ -131:sc= 0.962 (180deg=-1.1) USER MOD Single : A 25 SER OG : rot 88:sc= 1.16 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= -1.75 USER MOD Single : A 40 THR OG1 : rot 12:sc= 0.228! USER MOD Single : A 41 THR OG1 : rot 160:sc= 0.416 USER MOD Single : A 43 SER OG : rot 180:sc= -1.57! USER MOD Single : A 47 SER OG : rot 100:sc= 1.23 USER MOD Single : A 51 SER OG : rot 53:sc= 1.18 USER MOD Single : A 52 HIS : no HD1:sc= -1.52 X(o=-1.5,f=-2) 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=-0.97,f=0) USER MOD Single : A 61 SER OG : rot 180:sc=-0.00452 USER MOD Single : A 65 HIS : no HD1:sc= -4.71! C(o=-4.7!,f=-4.3!) USER MOD Single : A 70 SER OG : rot -130:sc= -0.449 USER MOD Single : A 77 THR OG1 : rot 100:sc= 1.17 USER MOD Single : A 82 TYR OH : rot 30:sc= -3.53 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0.539 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0359) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 TYR OH : rot 30:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 20 N ALA A 2 -3.999 15.170 8.598 1.00 35.11 N ATOM 21 CA ALA A 2 -5.362 14.674 8.729 1.00 35.11 C ATOM 22 C ALA A 2 -5.635 13.546 7.754 1.00 35.11 C ATOM 23 O ALA A 2 -6.191 12.515 8.133 1.00 35.11 O ATOM 24 CB ALA A 2 -6.363 15.805 8.547 1.00 35.11 C ATOM 0 HA ALA A 2 -5.477 14.273 9.736 1.00 35.11 H new ATOM 0 HB1 ALA A 2 -7.376 15.415 8.648 1.00 35.11 H new ATOM 0 HB2 ALA A 2 -6.191 16.569 9.305 1.00 35.11 H new ATOM 0 HB3 ALA A 2 -6.241 16.243 7.557 1.00 35.11 H new ATOM 30 N GLU A 3 -5.220 13.717 6.502 1.00 71.76 N ATOM 31 CA GLU A 3 -5.410 12.668 5.511 1.00 71.76 C ATOM 32 C GLU A 3 -4.627 11.446 5.949 1.00 71.76 C ATOM 33 O GLU A 3 -5.101 10.314 5.846 1.00 71.76 O ATOM 34 CB GLU A 3 -4.930 13.130 4.133 1.00 71.76 C ATOM 35 CG GLU A 3 -5.573 14.415 3.665 1.00 71.76 C ATOM 36 CD GLU A 3 -5.194 14.773 2.240 1.00 71.76 C ATOM 37 OE1 GLU A 3 -4.073 15.285 2.033 1.00 71.76 O ATOM 38 OE2 GLU A 3 -6.020 14.547 1.332 1.00 71.76 O ATOM 0 H GLU A 3 -4.758 14.558 6.156 1.00 71.76 H new ATOM 0 HA GLU A 3 -6.471 12.429 5.434 1.00 71.76 H new ATOM 0 HB2 GLU A 3 -3.849 13.264 4.161 1.00 71.76 H new ATOM 0 HB3 GLU A 3 -5.135 12.345 3.405 1.00 71.76 H new ATOM 0 HG2 GLU A 3 -6.657 14.321 3.736 1.00 71.76 H new ATOM 0 HG3 GLU A 3 -5.279 15.227 4.330 1.00 71.76 H new ATOM 45 N TYR A 4 -3.419 11.694 6.442 1.00112.05 N ATOM 46 CA TYR A 4 -2.559 10.622 6.901 1.00112.05 C ATOM 47 C TYR A 4 -3.215 9.877 8.056 1.00112.05 C ATOM 48 O TYR A 4 -3.159 8.648 8.118 1.00112.05 O ATOM 49 CB TYR A 4 -1.181 11.151 7.308 1.00112.05 C ATOM 50 CG TYR A 4 -0.192 10.058 7.628 1.00112.05 C ATOM 51 CD1 TYR A 4 0.221 9.163 6.650 1.00112.05 C ATOM 52 CD2 TYR A 4 0.323 9.918 8.907 1.00112.05 C ATOM 53 CE1 TYR A 4 1.125 8.159 6.939 1.00112.05 C ATOM 54 CE2 TYR A 4 1.225 8.919 9.204 1.00112.05 C ATOM 55 CZ TYR A 4 1.625 8.041 8.218 1.00112.05 C ATOM 56 OH TYR A 4 2.524 7.043 8.512 1.00112.05 O ATOM 0 H TYR A 4 -3.018 12.628 6.532 1.00112.05 H new ATOM 0 HA TYR A 4 -2.414 9.926 6.075 1.00112.05 H new ATOM 0 HB2 TYR A 4 -0.783 11.766 6.501 1.00112.05 H new ATOM 0 HB3 TYR A 4 -1.291 11.798 8.178 1.00112.05 H new ATOM 0 HD1 TYR A 4 -0.171 9.253 5.648 1.00112.05 H new ATOM 0 HD2 TYR A 4 0.013 10.602 9.683 1.00112.05 H new ATOM 0 HE1 TYR A 4 1.438 7.471 6.168 1.00112.05 H new ATOM 0 HE2 TYR A 4 1.617 8.824 10.206 1.00112.05 H new ATOM 0 HH TYR A 4 3.418 7.309 8.212 1.00112.05 H new ATOM 66 N GLY A 5 -3.860 10.620 8.965 1.00 23.54 N ATOM 67 CA GLY A 5 -4.532 9.977 10.082 1.00 23.54 C ATOM 68 C GLY A 5 -5.599 9.016 9.598 1.00 23.54 C ATOM 69 O GLY A 5 -5.693 7.883 10.065 1.00 23.54 O ATOM 0 H GLY A 5 -3.926 11.638 8.945 1.00 23.54 H new ATOM 0 HA2 GLY A 5 -3.803 9.440 10.689 1.00 23.54 H new ATOM 0 HA3 GLY A 5 -4.984 10.734 10.723 1.00 23.54 H new ATOM 73 N THR A 6 -6.377 9.477 8.626 1.00 90.84 N ATOM 74 CA THR A 6 -7.423 8.679 8.021 1.00 90.84 C ATOM 75 C THR A 6 -6.822 7.569 7.173 1.00 90.84 C ATOM 76 O THR A 6 -7.346 6.462 7.135 1.00 90.84 O ATOM 77 CB THR A 6 -8.352 9.580 7.181 1.00 90.84 C ATOM 78 OG1 THR A 6 -9.098 10.447 8.041 1.00 90.84 O ATOM 79 CG2 THR A 6 -9.304 8.780 6.316 1.00 90.84 C ATOM 0 H THR A 6 -6.296 10.417 8.238 1.00 90.84 H new ATOM 0 HA THR A 6 -8.016 8.213 8.808 1.00 90.84 H new ATOM 0 HB THR A 6 -7.718 10.166 6.516 1.00 90.84 H new ATOM 0 HG1 THR A 6 -9.684 11.017 7.502 1.00 90.84 H new ATOM 0 HG21 THR A 6 -9.936 9.460 5.745 1.00 90.84 H new ATOM 0 HG22 THR A 6 -8.733 8.153 5.631 1.00 90.84 H new ATOM 0 HG23 THR A 6 -9.929 8.150 6.949 1.00 90.84 H new ATOM 87 N LEU A 7 -5.711 7.862 6.505 1.00 63.89 N ATOM 88 CA LEU A 7 -5.036 6.863 5.680 1.00 63.89 C ATOM 89 C LEU A 7 -4.768 5.608 6.494 1.00 63.89 C ATOM 90 O LEU A 7 -5.243 4.518 6.174 1.00 63.89 O ATOM 91 CB LEU A 7 -3.706 7.410 5.166 1.00 63.89 C ATOM 92 CG LEU A 7 -2.849 6.389 4.419 1.00 63.89 C ATOM 93 CD1 LEU A 7 -3.550 5.946 3.151 1.00 63.89 C ATOM 94 CD2 LEU A 7 -1.462 6.946 4.129 1.00 63.89 C ATOM 0 H LEU A 7 -5.260 8.777 6.517 1.00 63.89 H new ATOM 0 HA LEU A 7 -5.683 6.624 4.836 1.00 63.89 H new ATOM 0 HB2 LEU A 7 -3.905 8.253 4.504 1.00 63.89 H new ATOM 0 HB3 LEU A 7 -3.135 7.796 6.011 1.00 63.89 H new ATOM 0 HG LEU A 7 -2.716 5.514 5.055 1.00 63.89 H new ATOM 0 HD11 LEU A 7 -2.930 5.219 2.627 1.00 63.89 H new ATOM 0 HD12 LEU A 7 -4.507 5.491 3.405 1.00 63.89 H new ATOM 0 HD13 LEU A 7 -3.718 6.810 2.507 1.00 63.89 H new ATOM 0 HD21 LEU A 7 -0.874 6.198 3.597 1.00 63.89 H new ATOM 0 HD22 LEU A 7 -1.551 7.842 3.515 1.00 63.89 H new ATOM 0 HD23 LEU A 7 -0.967 7.197 5.067 1.00 63.89 H new ATOM 106 N LEU A 8 -4.012 5.791 7.564 1.00 67.93 N ATOM 107 CA LEU A 8 -3.674 4.706 8.460 1.00 67.93 C ATOM 108 C LEU A 8 -4.938 4.085 9.038 1.00 67.93 C ATOM 109 O LEU A 8 -5.033 2.874 9.180 1.00 67.93 O ATOM 110 CB LEU A 8 -2.765 5.225 9.573 1.00 67.93 C ATOM 111 CG LEU A 8 -1.259 5.269 9.247 1.00 67.93 C ATOM 112 CD1 LEU A 8 -0.999 5.662 7.797 1.00 67.93 C ATOM 113 CD2 LEU A 8 -0.541 6.224 10.192 1.00 67.93 C ATOM 0 H LEU A 8 -3.619 6.693 7.832 1.00 67.93 H new ATOM 0 HA LEU A 8 -3.142 3.933 7.905 1.00 67.93 H new ATOM 0 HB2 LEU A 8 -3.089 6.231 9.840 1.00 67.93 H new ATOM 0 HB3 LEU A 8 -2.908 4.599 10.454 1.00 67.93 H new ATOM 0 HG LEU A 8 -0.865 4.262 9.387 1.00 67.93 H new ATOM 0 HD11 LEU A 8 0.075 5.680 7.612 1.00 67.93 H new ATOM 0 HD12 LEU A 8 -1.469 4.936 7.133 1.00 67.93 H new ATOM 0 HD13 LEU A 8 -1.417 6.651 7.608 1.00 67.93 H new ATOM 0 HD21 LEU A 8 0.522 6.245 9.950 1.00 67.93 H new ATOM 0 HD22 LEU A 8 -0.958 7.225 10.083 1.00 67.93 H new ATOM 0 HD23 LEU A 8 -0.672 5.886 11.220 1.00 67.93 H new ATOM 125 N GLN A 9 -5.925 4.928 9.324 1.00 42.21 N ATOM 126 CA GLN A 9 -7.197 4.469 9.848 1.00 42.21 C ATOM 127 C GLN A 9 -7.885 3.587 8.806 1.00 42.21 C ATOM 128 O GLN A 9 -8.493 2.571 9.140 1.00 42.21 O ATOM 129 CB GLN A 9 -8.024 5.717 10.209 1.00 42.21 C ATOM 130 CG GLN A 9 -9.528 5.536 10.269 1.00 42.21 C ATOM 131 CD GLN A 9 -10.071 5.558 11.686 1.00 42.21 C ATOM 132 OE1 GLN A 9 -10.095 6.602 12.340 1.00 42.21 O ATOM 133 NE2 GLN A 9 -10.508 4.401 12.168 1.00 42.21 N ATOM 0 H GLN A 9 -5.863 5.938 9.199 1.00 42.21 H new ATOM 0 HA GLN A 9 -7.075 3.860 10.744 1.00 42.21 H new ATOM 0 HB2 GLN A 9 -7.685 6.082 11.178 1.00 42.21 H new ATOM 0 HB3 GLN A 9 -7.803 6.496 9.479 1.00 42.21 H new ATOM 0 HG2 GLN A 9 -10.007 6.325 9.690 1.00 42.21 H new ATOM 0 HG3 GLN A 9 -9.794 4.589 9.798 1.00 42.21 H new ATOM 0 HE21 GLN A 9 -10.469 3.561 11.591 1.00 42.21 H new ATOM 0 HE22 GLN A 9 -10.883 4.352 13.115 1.00 42.21 H new ATOM 142 N ASP A 10 -7.783 3.989 7.544 1.00 76.39 N ATOM 143 CA ASP A 10 -8.393 3.241 6.452 1.00 76.39 C ATOM 144 C ASP A 10 -7.822 1.834 6.353 1.00 76.39 C ATOM 145 O ASP A 10 -8.579 0.863 6.356 1.00 76.39 O ATOM 146 CB ASP A 10 -8.209 3.982 5.124 1.00 76.39 C ATOM 147 CG ASP A 10 -8.951 5.305 5.092 1.00 76.39 C ATOM 148 OD1 ASP A 10 -9.885 5.481 5.902 1.00 76.39 O ATOM 149 OD2 ASP A 10 -8.594 6.165 4.260 1.00 76.39 O ATOM 0 H ASP A 10 -7.283 4.829 7.252 1.00 76.39 H new ATOM 0 HA ASP A 10 -9.459 3.157 6.665 1.00 76.39 H new ATOM 0 HB2 ASP A 10 -7.147 4.160 4.955 1.00 76.39 H new ATOM 0 HB3 ASP A 10 -8.561 3.351 4.307 1.00 76.39 H new ATOM 154 N LEU A 11 -6.492 1.702 6.305 1.00140.58 N ATOM 155 CA LEU A 11 -5.897 0.378 6.256 1.00140.58 C ATOM 156 C LEU A 11 -6.178 -0.323 7.565 1.00140.58 C ATOM 157 O LEU A 11 -6.406 -1.523 7.584 1.00140.58 O ATOM 158 CB LEU A 11 -4.411 0.428 5.923 1.00140.58 C ATOM 159 CG LEU A 11 -3.494 0.916 7.033 1.00140.58 C ATOM 160 CD1 LEU A 11 -3.049 -0.260 7.895 1.00140.58 C ATOM 161 CD2 LEU A 11 -2.300 1.652 6.433 1.00140.58 C ATOM 0 H LEU A 11 -5.829 2.477 6.299 1.00140.58 H new ATOM 0 HA LEU A 11 -6.349 -0.194 5.445 1.00140.58 H new ATOM 0 HB2 LEU A 11 -4.091 -0.572 5.628 1.00140.58 H new ATOM 0 HB3 LEU A 11 -4.275 1.075 5.056 1.00140.58 H new ATOM 0 HG LEU A 11 -4.034 1.615 7.672 1.00140.58 H new ATOM 0 HD11 LEU A 11 -2.392 0.098 8.688 1.00140.58 H new ATOM 0 HD12 LEU A 11 -3.923 -0.739 8.336 1.00140.58 H new ATOM 0 HD13 LEU A 11 -2.513 -0.981 7.278 1.00140.58 H new ATOM 0 HD21 LEU A 11 -1.647 1.999 7.234 1.00140.58 H new ATOM 0 HD22 LEU A 11 -1.747 0.977 5.780 1.00140.58 H new ATOM 0 HD23 LEU A 11 -2.652 2.507 5.856 1.00140.58 H new ATOM 173 N THR A 12 -6.233 0.451 8.657 1.00103.83 N ATOM 174 CA THR A 12 -6.568 -0.100 9.954 1.00103.83 C ATOM 175 C THR A 12 -7.974 -0.692 9.885 1.00103.83 C ATOM 176 O THR A 12 -8.247 -1.750 10.442 1.00103.83 O ATOM 177 CB THR A 12 -6.508 0.954 11.073 1.00103.83 C ATOM 178 OG1 THR A 12 -5.210 1.541 11.141 1.00103.83 O ATOM 179 CG2 THR A 12 -6.813 0.315 12.398 1.00103.83 C ATOM 0 H THR A 12 -6.049 1.454 8.657 1.00103.83 H new ATOM 0 HA THR A 12 -5.832 -0.867 10.195 1.00103.83 H new ATOM 0 HB THR A 12 -7.245 1.725 10.850 1.00103.83 H new ATOM 0 HG1 THR A 12 -5.221 2.412 10.692 1.00103.83 H new ATOM 0 HG21 THR A 12 -6.768 1.069 13.184 1.00103.83 H new ATOM 0 HG22 THR A 12 -7.811 -0.122 12.370 1.00103.83 H new ATOM 0 HG23 THR A 12 -6.081 -0.466 12.602 1.00103.83 H new ATOM 187 N ASN A 13 -8.850 -0.018 9.149 1.00 36.97 N ATOM 188 CA ASN A 13 -10.207 -0.507 8.959 1.00 36.97 C ATOM 189 C ASN A 13 -10.159 -1.820 8.179 1.00 36.97 C ATOM 190 O ASN A 13 -10.987 -2.708 8.379 1.00 36.97 O ATOM 191 CB ASN A 13 -11.063 0.527 8.226 1.00 36.97 C ATOM 192 CG ASN A 13 -11.231 1.803 9.028 1.00 36.97 C ATOM 193 OD1 ASN A 13 -10.976 1.831 10.231 1.00 36.97 O ATOM 194 ND2 ASN A 13 -11.662 2.868 8.363 1.00 36.97 N ATOM 0 H ASN A 13 -8.645 0.863 8.677 1.00 36.97 H new ATOM 0 HA ASN A 13 -10.665 -0.680 9.933 1.00 36.97 H new ATOM 0 HB2 ASN A 13 -10.604 0.761 7.266 1.00 36.97 H new ATOM 0 HB3 ASN A 13 -12.044 0.101 8.015 1.00 36.97 H new ATOM 0 HD21 ASN A 13 -11.794 3.754 8.850 1.00 36.97 H new ATOM 0 HD22 ASN A 13 -11.861 2.800 7.365 1.00 36.97 H new ATOM 201 N ASN A 14 -9.149 -1.941 7.311 1.00 84.59 N ATOM 202 CA ASN A 14 -8.946 -3.149 6.524 1.00 84.59 C ATOM 203 C ASN A 14 -7.936 -4.078 7.204 1.00 84.59 C ATOM 204 O ASN A 14 -7.586 -5.128 6.663 1.00 84.59 O ATOM 205 CB ASN A 14 -8.455 -2.782 5.123 1.00 84.59 C ATOM 206 CG ASN A 14 -9.508 -2.044 4.321 1.00 84.59 C ATOM 207 OD1 ASN A 14 -9.395 -0.724 4.267 1.00 84.59 O flip ATOM 208 ND2 ASN A 14 -10.419 -2.654 3.760 1.00 84.59 N flip ATOM 0 H ASN A 14 -8.459 -1.209 7.139 1.00 84.59 H new ATOM 0 HA ASN A 14 -9.898 -3.673 6.447 1.00 84.59 H new ATOM 0 HB2 ASN A 14 -7.562 -2.162 5.204 1.00 84.59 H new ATOM 0 HB3 ASN A 14 -8.166 -3.689 4.592 1.00 84.59 H new ATOM 0 HD21 ASN A 14 -10.469 -3.671 3.827 1.00 84.59 H new ATOM 0 HD22 ASN A 14 -11.124 -2.143 3.228 1.00 84.59 H new ATOM 215 N ILE A 15 -7.454 -3.676 8.383 1.00120.44 N ATOM 216 CA ILE A 15 -6.481 -4.442 9.121 1.00120.44 C ATOM 217 C ILE A 15 -7.141 -5.407 10.106 1.00120.44 C ATOM 218 O ILE A 15 -7.829 -4.992 11.039 1.00120.44 O ATOM 219 CB ILE A 15 -5.489 -3.465 9.833 1.00120.44 C ATOM 220 CG1 ILE A 15 -4.078 -3.965 9.703 1.00120.44 C ATOM 221 CG2 ILE A 15 -5.799 -3.194 11.305 1.00120.44 C ATOM 222 CD1 ILE A 15 -3.828 -5.258 10.446 1.00120.44 C ATOM 0 H ILE A 15 -7.735 -2.809 8.841 1.00120.44 H new ATOM 0 HA ILE A 15 -5.921 -5.065 8.424 1.00120.44 H new ATOM 0 HB ILE A 15 -5.613 -2.512 9.319 1.00120.44 H new ATOM 0 HG12 ILE A 15 -3.848 -4.111 8.648 1.00120.44 H new ATOM 0 HG13 ILE A 15 -3.394 -3.202 10.076 1.00120.44 H new ATOM 0 HG21 ILE A 15 -5.058 -2.506 11.712 1.00120.44 H new ATOM 0 HG22 ILE A 15 -6.791 -2.751 11.392 1.00120.44 H new ATOM 0 HG23 ILE A 15 -5.769 -4.131 11.862 1.00120.44 H new ATOM 0 HD11 ILE A 15 -2.790 -5.561 10.309 1.00120.44 H new ATOM 0 HD12 ILE A 15 -4.027 -5.112 11.508 1.00120.44 H new ATOM 0 HD13 ILE A 15 -4.487 -6.034 10.057 1.00120.44 H new ATOM 234 N THR A 16 -6.905 -6.692 9.907 1.00158.94 N ATOM 235 CA THR A 16 -7.447 -7.691 10.801 1.00158.94 C ATOM 236 C THR A 16 -6.473 -7.942 11.919 1.00158.94 C ATOM 237 O THR A 16 -5.269 -7.739 11.760 1.00158.94 O ATOM 238 CB THR A 16 -7.708 -9.029 10.105 1.00158.94 C ATOM 239 OG1 THR A 16 -6.492 -9.556 9.570 1.00158.94 O ATOM 240 CG2 THR A 16 -8.733 -8.876 9.008 1.00158.94 C ATOM 0 H THR A 16 -6.345 -7.063 9.139 1.00158.94 H new ATOM 0 HA THR A 16 -8.396 -7.301 11.168 1.00158.94 H new ATOM 0 HB THR A 16 -8.100 -9.725 10.846 1.00158.94 H new ATOM 0 HG1 THR A 16 -6.673 -10.412 9.129 1.00158.94 H new ATOM 0 HG21 THR A 16 -8.900 -9.841 8.529 1.00158.94 H new ATOM 0 HG22 THR A 16 -9.669 -8.514 9.433 1.00158.94 H new ATOM 0 HG23 THR A 16 -8.371 -8.162 8.268 1.00158.94 H new ATOM 248 N LEU A 17 -6.979 -8.423 13.038 1.00 50.69 N ATOM 249 CA LEU A 17 -6.111 -8.744 14.157 1.00 50.69 C ATOM 250 C LEU A 17 -5.104 -9.803 13.713 1.00 50.69 C ATOM 251 O LEU A 17 -3.945 -9.790 14.119 1.00 50.69 O ATOM 252 CB LEU A 17 -6.917 -9.224 15.362 1.00 50.69 C ATOM 253 CG LEU A 17 -6.087 -9.554 16.604 1.00 50.69 C ATOM 254 CD1 LEU A 17 -5.277 -8.341 17.053 1.00 50.69 C ATOM 255 CD2 LEU A 17 -6.993 -10.041 17.726 1.00 50.69 C ATOM 0 H LEU A 17 -7.971 -8.599 13.197 1.00 50.69 H new ATOM 0 HA LEU A 17 -5.578 -7.845 14.468 1.00 50.69 H new ATOM 0 HB2 LEU A 17 -7.645 -8.456 15.623 1.00 50.69 H new ATOM 0 HB3 LEU A 17 -7.480 -10.111 15.073 1.00 50.69 H new ATOM 0 HG LEU A 17 -5.387 -10.350 16.351 1.00 50.69 H new ATOM 0 HD11 LEU A 17 -4.695 -8.599 17.938 1.00 50.69 H new ATOM 0 HD12 LEU A 17 -4.604 -8.036 16.252 1.00 50.69 H new ATOM 0 HD13 LEU A 17 -5.953 -7.520 17.291 1.00 50.69 H new ATOM 0 HD21 LEU A 17 -6.391 -10.273 18.605 1.00 50.69 H new ATOM 0 HD22 LEU A 17 -7.714 -9.263 17.975 1.00 50.69 H new ATOM 0 HD23 LEU A 17 -7.523 -10.937 17.403 1.00 50.69 H new ATOM 267 N GLU A 18 -5.568 -10.700 12.841 1.00107.93 N ATOM 268 CA GLU A 18 -4.722 -11.748 12.299 1.00107.93 C ATOM 269 C GLU A 18 -3.685 -11.147 11.360 1.00107.93 C ATOM 270 O GLU A 18 -2.495 -11.446 11.453 1.00107.93 O ATOM 271 CB GLU A 18 -5.577 -12.771 11.546 1.00107.93 C ATOM 272 CG GLU A 18 -6.576 -13.499 12.433 1.00107.93 C ATOM 273 CD GLU A 18 -7.364 -14.556 11.684 1.00107.93 C ATOM 274 OE1 GLU A 18 -7.338 -14.545 10.435 1.00107.93 O ATOM 275 OE2 GLU A 18 -8.010 -15.394 12.347 1.00107.93 O ATOM 0 H GLU A 18 -6.529 -10.716 12.498 1.00107.93 H new ATOM 0 HA GLU A 18 -4.208 -12.249 13.120 1.00107.93 H new ATOM 0 HB2 GLU A 18 -6.116 -12.263 10.746 1.00107.93 H new ATOM 0 HB3 GLU A 18 -4.922 -13.503 11.074 1.00107.93 H new ATOM 0 HG2 GLU A 18 -6.045 -13.967 13.262 1.00107.93 H new ATOM 0 HG3 GLU A 18 -7.267 -12.775 12.865 1.00107.93 H new ATOM 282 N ASP A 19 -4.149 -10.281 10.459 1.00 35.40 N ATOM 283 CA ASP A 19 -3.259 -9.622 9.512 1.00 35.40 C ATOM 284 C ASP A 19 -2.216 -8.787 10.238 1.00 35.40 C ATOM 285 O ASP A 19 -1.055 -8.745 9.831 1.00 35.40 O ATOM 286 CB ASP A 19 -4.049 -8.755 8.526 1.00 35.40 C ATOM 287 CG ASP A 19 -4.772 -9.575 7.470 1.00 35.40 C ATOM 288 OD1 ASP A 19 -4.636 -10.816 7.482 1.00 35.40 O ATOM 289 OD2 ASP A 19 -5.481 -8.973 6.635 1.00 35.40 O ATOM 0 H ASP A 19 -5.131 -10.022 10.367 1.00 35.40 H new ATOM 0 HA ASP A 19 -2.744 -10.398 8.946 1.00 35.40 H new ATOM 0 HB2 ASP A 19 -4.776 -8.157 9.076 1.00 35.40 H new ATOM 0 HB3 ASP A 19 -3.369 -8.058 8.036 1.00 35.40 H new ATOM 294 N LEU A 20 -2.628 -8.123 11.323 1.00 45.47 N ATOM 295 CA LEU A 20 -1.703 -7.297 12.094 1.00 45.47 C ATOM 296 C LEU A 20 -0.542 -8.139 12.588 1.00 45.47 C ATOM 297 O LEU A 20 0.606 -7.727 12.491 1.00 45.47 O ATOM 298 CB LEU A 20 -2.397 -6.629 13.283 1.00 45.47 C ATOM 299 CG LEU A 20 -1.715 -5.363 13.799 1.00 45.47 C ATOM 300 CD1 LEU A 20 -1.461 -4.366 12.676 1.00 45.47 C ATOM 301 CD2 LEU A 20 -2.560 -4.729 14.900 1.00 45.47 C ATOM 0 H LEU A 20 -3.583 -8.142 11.681 1.00 45.47 H new ATOM 0 HA LEU A 20 -1.334 -6.512 11.434 1.00 45.47 H new ATOM 0 HB2 LEU A 20 -3.419 -6.382 12.996 1.00 45.47 H new ATOM 0 HB3 LEU A 20 -2.460 -7.349 14.099 1.00 45.47 H new ATOM 0 HG LEU A 20 -0.745 -5.644 14.210 1.00 45.47 H new ATOM 0 HD11 LEU A 20 -0.975 -3.478 13.081 1.00 45.47 H new ATOM 0 HD12 LEU A 20 -0.817 -4.821 11.924 1.00 45.47 H new ATOM 0 HD13 LEU A 20 -2.409 -4.084 12.219 1.00 45.47 H new ATOM 0 HD21 LEU A 20 -2.067 -3.827 15.263 1.00 45.47 H new ATOM 0 HD22 LEU A 20 -3.542 -4.471 14.502 1.00 45.47 H new ATOM 0 HD23 LEU A 20 -2.675 -5.435 15.722 1.00 45.47 H new ATOM 313 N GLU A 21 -0.846 -9.336 13.086 1.00 91.26 N ATOM 314 CA GLU A 21 0.192 -10.238 13.570 1.00 91.26 C ATOM 315 C GLU A 21 1.161 -10.576 12.447 1.00 91.26 C ATOM 316 O GLU A 21 2.345 -10.803 12.686 1.00 91.26 O ATOM 317 CB GLU A 21 -0.413 -11.510 14.158 1.00 91.26 C ATOM 318 CG GLU A 21 -1.283 -11.260 15.383 1.00 91.26 C ATOM 319 CD GLU A 21 -1.821 -12.538 16.000 1.00 91.26 C ATOM 320 OE1 GLU A 21 -1.657 -13.614 15.386 1.00 91.26 O ATOM 321 OE2 GLU A 21 -2.407 -12.462 17.101 1.00 91.26 O ATOM 0 H GLU A 21 -1.796 -9.700 13.164 1.00 91.26 H new ATOM 0 HA GLU A 21 0.739 -9.731 14.365 1.00 91.26 H new ATOM 0 HB2 GLU A 21 -1.011 -12.006 13.393 1.00 91.26 H new ATOM 0 HB3 GLU A 21 0.391 -12.194 14.427 1.00 91.26 H new ATOM 0 HG2 GLU A 21 -0.702 -10.719 16.130 1.00 91.26 H new ATOM 0 HG3 GLU A 21 -2.119 -10.618 15.103 1.00 91.26 H new ATOM 328 N GLN A 22 0.660 -10.573 11.214 1.00 87.96 N ATOM 329 CA GLN A 22 1.505 -10.841 10.067 1.00 87.96 C ATOM 330 C GLN A 22 2.425 -9.655 9.884 1.00 87.96 C ATOM 331 O GLN A 22 3.629 -9.807 9.676 1.00 87.96 O ATOM 332 CB GLN A 22 0.675 -11.081 8.805 1.00 87.96 C ATOM 333 CG GLN A 22 1.500 -11.603 7.641 1.00 87.96 C ATOM 334 CD GLN A 22 0.652 -11.957 6.435 1.00 87.96 C ATOM 335 OE1 GLN A 22 -0.573 -12.037 6.522 1.00 87.96 O ATOM 336 NE2 GLN A 22 1.303 -12.166 5.297 1.00 87.96 N ATOM 0 H GLN A 22 -0.318 -10.389 10.991 1.00 87.96 H new ATOM 0 HA GLN A 22 2.083 -11.749 10.240 1.00 87.96 H new ATOM 0 HB2 GLN A 22 -0.119 -11.794 9.029 1.00 87.96 H new ATOM 0 HB3 GLN A 22 0.192 -10.149 8.512 1.00 87.96 H new ATOM 0 HG2 GLN A 22 2.235 -10.850 7.355 1.00 87.96 H new ATOM 0 HG3 GLN A 22 2.055 -12.485 7.961 1.00 87.96 H new ATOM 0 HE21 GLN A 22 2.320 -12.089 5.270 1.00 87.96 H new ATOM 0 HE22 GLN A 22 0.786 -12.403 4.450 1.00 87.96 H new ATOM 345 N LEU A 23 1.853 -8.457 10.026 1.00 99.30 N ATOM 346 CA LEU A 23 2.623 -7.233 9.946 1.00 99.30 C ATOM 347 C LEU A 23 3.631 -7.246 11.089 1.00 99.30 C ATOM 348 O LEU A 23 4.816 -6.995 10.901 1.00 99.30 O ATOM 349 CB LEU A 23 1.689 -6.019 10.073 1.00 99.30 C ATOM 350 CG LEU A 23 0.532 -5.962 9.065 1.00 99.30 C ATOM 351 CD1 LEU A 23 -0.256 -4.663 9.214 1.00 99.30 C ATOM 352 CD2 LEU A 23 1.045 -6.117 7.637 1.00 99.30 C ATOM 0 H LEU A 23 0.857 -8.318 10.197 1.00 99.30 H new ATOM 0 HA LEU A 23 3.139 -7.164 8.988 1.00 99.30 H new ATOM 0 HB2 LEU A 23 1.271 -6.009 11.080 1.00 99.30 H new ATOM 0 HB3 LEU A 23 2.285 -5.112 9.966 1.00 99.30 H new ATOM 0 HG LEU A 23 -0.139 -6.795 9.278 1.00 99.30 H new ATOM 0 HD11 LEU A 23 -1.070 -4.646 8.489 1.00 99.30 H new ATOM 0 HD12 LEU A 23 -0.666 -4.600 10.222 1.00 99.30 H new ATOM 0 HD13 LEU A 23 0.405 -3.814 9.037 1.00 99.30 H new ATOM 0 HD21 LEU A 23 0.206 -6.073 6.942 1.00 99.30 H new ATOM 0 HD22 LEU A 23 1.745 -5.312 7.412 1.00 99.30 H new ATOM 0 HD23 LEU A 23 1.551 -7.077 7.534 1.00 99.30 H new ATOM 364 N LYS A 24 3.125 -7.604 12.269 1.00114.71 N ATOM 365 CA LYS A 24 3.940 -7.713 13.478 1.00114.71 C ATOM 366 C LYS A 24 5.072 -8.715 13.265 1.00114.71 C ATOM 367 O LYS A 24 6.208 -8.488 13.683 1.00114.71 O ATOM 368 CB LYS A 24 3.091 -8.196 14.667 1.00114.71 C ATOM 369 CG LYS A 24 2.040 -7.204 15.168 1.00114.71 C ATOM 370 CD LYS A 24 1.443 -7.660 16.498 1.00114.71 C ATOM 371 CE LYS A 24 -0.055 -7.907 16.401 1.00114.71 C ATOM 372 NZ LYS A 24 -0.620 -8.388 17.695 1.00114.71 N ATOM 0 H LYS A 24 2.140 -7.826 12.413 1.00114.71 H new ATOM 0 HA LYS A 24 4.346 -6.724 13.692 1.00114.71 H new ATOM 0 HB2 LYS A 24 2.587 -9.119 14.381 1.00114.71 H new ATOM 0 HB3 LYS A 24 3.759 -8.440 15.493 1.00114.71 H new ATOM 0 HG2 LYS A 24 2.492 -6.220 15.287 1.00114.71 H new ATOM 0 HG3 LYS A 24 1.248 -7.103 14.426 1.00114.71 H new ATOM 0 HD2 LYS A 24 1.940 -8.574 16.823 1.00114.71 H new ATOM 0 HD3 LYS A 24 1.636 -6.904 17.259 1.00114.71 H new ATOM 0 HE2 LYS A 24 -0.557 -6.986 16.105 1.00114.71 H new ATOM 0 HE3 LYS A 24 -0.253 -8.643 15.622 1.00114.71 H new ATOM 0 HZ1 LYS A 24 -1.208 -9.229 17.526 1.00114.71 H new ATOM 0 HZ2 LYS A 24 0.156 -8.632 18.343 1.00114.71 H new ATOM 0 HZ3 LYS A 24 -1.203 -7.638 18.119 1.00114.71 H new ATOM 386 N SER A 25 4.742 -9.825 12.604 1.00 75.52 N ATOM 387 CA SER A 25 5.712 -10.878 12.318 1.00 75.52 C ATOM 388 C SER A 25 6.834 -10.322 11.463 1.00 75.52 C ATOM 389 O SER A 25 8.014 -10.549 11.723 1.00 75.52 O ATOM 390 CB SER A 25 5.029 -12.039 11.593 1.00 75.52 C ATOM 391 OG SER A 25 4.017 -12.617 12.398 1.00 75.52 O ATOM 0 H SER A 25 3.803 -10.017 12.255 1.00 75.52 H new ATOM 0 HA SER A 25 6.126 -11.245 13.257 1.00 75.52 H new ATOM 0 HB2 SER A 25 4.596 -11.684 10.658 1.00 75.52 H new ATOM 0 HB3 SER A 25 5.769 -12.796 11.334 1.00 75.52 H new ATOM 0 HG SER A 25 3.173 -12.141 12.254 1.00 75.52 H new ATOM 397 N ALA A 26 6.441 -9.552 10.466 1.00 32.46 N ATOM 398 CA ALA A 26 7.377 -8.900 9.581 1.00 32.46 C ATOM 399 C ALA A 26 8.112 -7.810 10.346 1.00 32.46 C ATOM 400 O ALA A 26 9.280 -7.521 10.084 1.00 32.46 O ATOM 401 CB ALA A 26 6.640 -8.330 8.379 1.00 32.46 C ATOM 0 H ALA A 26 5.462 -9.363 10.250 1.00 32.46 H new ATOM 0 HA ALA A 26 8.108 -9.620 9.214 1.00 32.46 H new ATOM 0 HB1 ALA A 26 7.352 -7.839 7.715 1.00 32.46 H new ATOM 0 HB2 ALA A 26 6.140 -9.137 7.843 1.00 32.46 H new ATOM 0 HB3 ALA A 26 5.899 -7.605 8.717 1.00 32.46 H new ATOM 407 N CYS A 27 7.412 -7.213 11.311 1.00 54.89 N ATOM 408 CA CYS A 27 7.990 -6.163 12.131 1.00 54.89 C ATOM 409 C CYS A 27 8.812 -6.726 13.278 1.00 54.89 C ATOM 410 O CYS A 27 9.365 -5.961 14.061 1.00 54.89 O ATOM 411 CB CYS A 27 6.925 -5.248 12.711 1.00 54.89 C ATOM 412 SG CYS A 27 5.900 -4.423 11.487 1.00 54.89 S ATOM 0 H CYS A 27 6.445 -7.443 11.539 1.00 54.89 H new ATOM 0 HA CYS A 27 8.638 -5.592 11.466 1.00 54.89 H new ATOM 0 HB2 CYS A 27 6.282 -5.832 13.370 1.00 54.89 H new ATOM 0 HB3 CYS A 27 7.411 -4.492 13.328 1.00 54.89 H new ATOM 0 HG CYS A 27 5.121 -3.567 12.079 1.00 54.89 H new ATOM 418 N LYS A 28 8.900 -8.054 13.406 1.00157.95 N ATOM 419 CA LYS A 28 9.677 -8.639 14.508 1.00157.95 C ATOM 420 C LYS A 28 11.072 -8.017 14.556 1.00157.95 C ATOM 421 O LYS A 28 11.652 -7.827 15.625 1.00157.95 O ATOM 422 CB LYS A 28 9.801 -10.156 14.344 1.00157.95 C ATOM 423 CG LYS A 28 8.479 -10.894 14.450 1.00157.95 C ATOM 424 CD LYS A 28 8.056 -11.072 15.901 1.00157.95 C ATOM 425 CE LYS A 28 8.605 -12.365 16.494 1.00157.95 C ATOM 426 NZ LYS A 28 9.291 -12.138 17.801 1.00157.95 N ATOM 0 H LYS A 28 8.458 -8.729 12.782 1.00157.95 H new ATOM 0 HA LYS A 28 9.152 -8.429 15.440 1.00157.95 H new ATOM 0 HB2 LYS A 28 10.250 -10.372 13.374 1.00157.95 H new ATOM 0 HB3 LYS A 28 10.482 -10.540 15.103 1.00157.95 H new ATOM 0 HG2 LYS A 28 7.709 -10.343 13.910 1.00157.95 H new ATOM 0 HG3 LYS A 28 8.566 -11.870 13.973 1.00157.95 H new ATOM 0 HD2 LYS A 28 8.407 -10.224 16.489 1.00157.95 H new ATOM 0 HD3 LYS A 28 6.968 -11.075 15.965 1.00157.95 H new ATOM 0 HE2 LYS A 28 7.789 -13.075 16.632 1.00157.95 H new ATOM 0 HE3 LYS A 28 9.305 -12.817 15.791 1.00157.95 H new ATOM 0 HZ1 LYS A 28 9.648 -13.043 18.167 1.00157.95 H new ATOM 0 HZ2 LYS A 28 10.086 -11.481 17.666 1.00157.95 H new ATOM 0 HZ3 LYS A 28 8.617 -11.731 18.481 1.00157.95 H new ATOM 440 N GLU A 29 11.585 -7.686 13.378 1.00243.70 N ATOM 441 CA GLU A 29 12.892 -7.066 13.252 1.00243.70 C ATOM 442 C GLU A 29 12.863 -5.573 13.595 1.00243.70 C ATOM 443 O GLU A 29 13.819 -5.042 14.162 1.00243.70 O ATOM 444 CB GLU A 29 13.415 -7.232 11.823 1.00243.70 C ATOM 445 CG GLU A 29 13.504 -8.676 11.356 1.00243.70 C ATOM 446 CD GLU A 29 14.103 -8.807 9.967 1.00243.70 C ATOM 447 OE1 GLU A 29 14.369 -7.766 9.330 1.00243.70 O ATOM 448 OE2 GLU A 29 14.306 -9.954 9.515 1.00243.70 O ATOM 0 H GLU A 29 11.108 -7.840 12.490 1.00243.70 H new ATOM 0 HA GLU A 29 13.550 -7.567 13.962 1.00243.70 H new ATOM 0 HB2 GLU A 29 12.764 -6.682 11.144 1.00243.70 H new ATOM 0 HB3 GLU A 29 14.404 -6.778 11.755 1.00243.70 H new ATOM 0 HG2 GLU A 29 14.108 -9.245 12.063 1.00243.70 H new ATOM 0 HG3 GLU A 29 12.507 -9.117 11.360 1.00243.70 H new ATOM 455 N ASP A 30 11.795 -4.886 13.187 1.00108.85 N ATOM 456 CA ASP A 30 11.696 -3.438 13.394 1.00108.85 C ATOM 457 C ASP A 30 10.989 -3.022 14.684 1.00108.85 C ATOM 458 O ASP A 30 11.434 -2.099 15.365 1.00108.85 O ATOM 459 CB ASP A 30 10.987 -2.803 12.195 1.00108.85 C ATOM 460 CG ASP A 30 11.746 -3.008 10.896 1.00108.85 C ATOM 461 OD1 ASP A 30 12.924 -3.420 10.952 1.00108.85 O ATOM 462 OD2 ASP A 30 11.159 -2.755 9.823 1.00108.85 O ATOM 0 H ASP A 30 10.992 -5.303 12.715 1.00108.85 H new ATOM 0 HA ASP A 30 12.721 -3.079 13.490 1.00108.85 H new ATOM 0 HB2 ASP A 30 9.988 -3.229 12.100 1.00108.85 H new ATOM 0 HB3 ASP A 30 10.862 -1.735 12.375 1.00108.85 H new ATOM 467 N ILE A 31 9.872 -3.663 15.000 1.00355.97 N ATOM 468 CA ILE A 31 9.100 -3.305 16.181 1.00355.97 C ATOM 469 C ILE A 31 9.285 -4.321 17.315 1.00355.97 C ATOM 470 O ILE A 31 9.280 -5.527 17.077 1.00355.97 O ATOM 471 CB ILE A 31 7.609 -3.125 15.800 1.00355.97 C ATOM 472 CG1 ILE A 31 6.921 -2.168 16.770 1.00355.97 C ATOM 473 CG2 ILE A 31 6.857 -4.446 15.680 1.00355.97 C ATOM 474 CD1 ILE A 31 6.456 -2.791 18.066 1.00355.97 C ATOM 0 H ILE A 31 9.481 -4.432 14.456 1.00355.97 H new ATOM 0 HA ILE A 31 9.474 -2.355 16.562 1.00355.97 H new ATOM 0 HB ILE A 31 7.586 -2.684 14.804 1.00355.97 H new ATOM 0 HG12 ILE A 31 7.609 -1.355 17.002 1.00355.97 H new ATOM 0 HG13 ILE A 31 6.060 -1.725 16.269 1.00355.97 H new ATOM 0 HG21 ILE A 31 5.819 -4.251 15.411 1.00355.97 H new ATOM 0 HG22 ILE A 31 7.322 -5.061 14.909 1.00355.97 H new ATOM 0 HG23 ILE A 31 6.892 -4.972 16.634 1.00355.97 H new ATOM 0 HD11 ILE A 31 5.981 -2.030 18.685 1.00355.97 H new ATOM 0 HD12 ILE A 31 5.740 -3.584 17.852 1.00355.97 H new ATOM 0 HD13 ILE A 31 7.312 -3.209 18.597 1.00355.97 H new ATOM 486 N PRO A 32 9.487 -3.848 18.568 1.00153.08 N ATOM 487 CA PRO A 32 9.711 -4.735 19.710 1.00153.08 C ATOM 488 C PRO A 32 8.538 -5.655 20.015 1.00153.08 C ATOM 489 O PRO A 32 7.374 -5.263 19.925 1.00153.08 O ATOM 490 CB PRO A 32 9.975 -3.783 20.880 1.00153.08 C ATOM 491 CG PRO A 32 9.389 -2.487 20.458 1.00153.08 C ATOM 492 CD PRO A 32 9.549 -2.430 18.968 1.00153.08 C ATOM 0 HA PRO A 32 10.536 -5.419 19.508 1.00153.08 H new ATOM 0 HB2 PRO A 32 9.511 -4.146 21.797 1.00153.08 H new ATOM 0 HB3 PRO A 32 11.043 -3.688 21.079 1.00153.08 H new ATOM 0 HG2 PRO A 32 8.338 -2.423 20.741 1.00153.08 H new ATOM 0 HG3 PRO A 32 9.900 -1.652 20.938 1.00153.08 H new ATOM 0 HD2 PRO A 32 8.757 -1.845 18.500 1.00153.08 H new ATOM 0 HD3 PRO A 32 10.496 -1.972 18.682 1.00153.08 H new ATOM 500 N SER A 33 8.868 -6.887 20.388 1.00 84.70 N ATOM 501 CA SER A 33 7.869 -7.892 20.728 1.00 84.70 C ATOM 502 C SER A 33 7.046 -7.453 21.935 1.00 84.70 C ATOM 503 O SER A 33 5.860 -7.768 22.040 1.00 84.70 O ATOM 504 CB SER A 33 8.553 -9.230 21.025 1.00 84.70 C ATOM 505 OG SER A 33 7.603 -10.275 21.138 1.00 84.70 O ATOM 0 H SER A 33 9.831 -7.215 20.463 1.00 84.70 H new ATOM 0 HA SER A 33 7.198 -8.010 19.877 1.00 84.70 H new ATOM 0 HB2 SER A 33 9.262 -9.463 20.231 1.00 84.70 H new ATOM 0 HB3 SER A 33 9.124 -9.152 21.950 1.00 84.70 H new ATOM 0 HG SER A 33 8.065 -11.118 21.326 1.00 84.70 H new ATOM 511 N GLU A 34 7.689 -6.727 22.846 1.00109.83 N ATOM 512 CA GLU A 34 7.028 -6.245 24.053 1.00109.83 C ATOM 513 C GLU A 34 5.845 -5.343 23.711 1.00109.83 C ATOM 514 O GLU A 34 4.889 -5.238 24.480 1.00109.83 O ATOM 515 CB GLU A 34 8.023 -5.482 24.928 1.00109.83 C ATOM 516 CG GLU A 34 7.477 -5.122 26.300 1.00109.83 C ATOM 517 CD GLU A 34 8.438 -4.275 27.113 1.00109.83 C ATOM 518 OE1 GLU A 34 9.487 -3.872 26.569 1.00109.83 O ATOM 519 OE2 GLU A 34 8.140 -4.017 28.299 1.00109.83 O ATOM 0 H GLU A 34 8.670 -6.460 22.770 1.00109.83 H new ATOM 0 HA GLU A 34 6.653 -7.110 24.599 1.00109.83 H new ATOM 0 HB2 GLU A 34 8.922 -6.085 25.051 1.00109.83 H new ATOM 0 HB3 GLU A 34 8.320 -4.568 24.413 1.00109.83 H new ATOM 0 HG2 GLU A 34 6.537 -4.584 26.182 1.00109.83 H new ATOM 0 HG3 GLU A 34 7.254 -6.037 26.848 1.00109.83 H new ATOM 526 N LYS A 35 5.919 -4.692 22.555 1.00 73.01 N ATOM 527 CA LYS A 35 4.858 -3.798 22.112 1.00 73.01 C ATOM 528 C LYS A 35 3.884 -4.518 21.189 1.00 73.01 C ATOM 529 O LYS A 35 2.707 -4.172 21.120 1.00 73.01 O ATOM 530 CB LYS A 35 5.474 -2.614 21.382 1.00 73.01 C ATOM 531 CG LYS A 35 6.412 -1.808 22.254 1.00 73.01 C ATOM 532 CD LYS A 35 5.635 -0.955 23.239 1.00 73.01 C ATOM 533 CE LYS A 35 6.559 -0.087 24.077 1.00 73.01 C ATOM 534 NZ LYS A 35 7.235 -0.868 25.149 1.00 73.01 N ATOM 0 H LYS A 35 6.704 -4.768 21.908 1.00 73.01 H new ATOM 0 HA LYS A 35 4.306 -3.453 22.986 1.00 73.01 H new ATOM 0 HB2 LYS A 35 6.018 -2.975 20.509 1.00 73.01 H new ATOM 0 HB3 LYS A 35 4.678 -1.965 21.016 1.00 73.01 H new ATOM 0 HG2 LYS A 35 7.079 -2.479 22.795 1.00 73.01 H new ATOM 0 HG3 LYS A 35 7.038 -1.171 21.630 1.00 73.01 H new ATOM 0 HD2 LYS A 35 4.932 -0.322 22.698 1.00 73.01 H new ATOM 0 HD3 LYS A 35 5.046 -1.598 23.893 1.00 73.01 H new ATOM 0 HE2 LYS A 35 7.310 0.371 23.433 1.00 73.01 H new ATOM 0 HE3 LYS A 35 5.986 0.725 24.526 1.00 73.01 H new ATOM 0 HZ1 LYS A 35 7.856 -0.239 25.697 1.00 73.01 H new ATOM 0 HZ2 LYS A 35 6.520 -1.284 25.779 1.00 73.01 H new ATOM 0 HZ3 LYS A 35 7.802 -1.627 24.720 1.00 73.01 H new ATOM 548 N SER A 36 4.381 -5.531 20.494 1.00 80.12 N ATOM 549 CA SER A 36 3.563 -6.317 19.584 1.00 80.12 C ATOM 550 C SER A 36 2.372 -6.934 20.310 1.00 80.12 C ATOM 551 O SER A 36 1.312 -7.148 19.721 1.00 80.12 O ATOM 552 CB SER A 36 4.421 -7.407 18.950 1.00 80.12 C ATOM 553 OG SER A 36 3.642 -8.276 18.151 1.00 80.12 O ATOM 0 H SER A 36 5.355 -5.829 20.545 1.00 80.12 H new ATOM 0 HA SER A 36 3.173 -5.661 18.806 1.00 80.12 H new ATOM 0 HB2 SER A 36 5.201 -6.950 18.340 1.00 80.12 H new ATOM 0 HB3 SER A 36 4.922 -7.979 19.731 1.00 80.12 H new ATOM 0 HG SER A 36 4.219 -8.963 17.757 1.00 80.12 H new ATOM 559 N GLU A 37 2.564 -7.229 21.590 1.00 42.03 N ATOM 560 CA GLU A 37 1.519 -7.835 22.403 1.00 42.03 C ATOM 561 C GLU A 37 0.295 -6.928 22.518 1.00 42.03 C ATOM 562 O GLU A 37 -0.841 -7.399 22.461 1.00 42.03 O ATOM 563 CB GLU A 37 2.077 -8.149 23.787 1.00 42.03 C ATOM 564 CG GLU A 37 3.249 -9.120 23.751 1.00 42.03 C ATOM 565 CD GLU A 37 3.792 -9.446 25.131 1.00 42.03 C ATOM 566 OE1 GLU A 37 3.306 -8.857 26.120 1.00 42.03 O ATOM 567 OE2 GLU A 37 4.711 -10.287 25.222 1.00 42.03 O ATOM 0 H GLU A 37 3.437 -7.057 22.088 1.00 42.03 H new ATOM 0 HA GLU A 37 1.196 -8.755 21.917 1.00 42.03 H new ATOM 0 HB2 GLU A 37 2.395 -7.222 24.263 1.00 42.03 H new ATOM 0 HB3 GLU A 37 1.284 -8.569 24.406 1.00 42.03 H new ATOM 0 HG2 GLU A 37 2.934 -10.043 23.263 1.00 42.03 H new ATOM 0 HG3 GLU A 37 4.048 -8.694 23.144 1.00 42.03 H new ATOM 574 N GLU A 38 0.525 -5.628 22.674 1.00 75.99 N ATOM 575 CA GLU A 38 -0.578 -4.676 22.787 1.00 75.99 C ATOM 576 C GLU A 38 -1.057 -4.173 21.430 1.00 75.99 C ATOM 577 O GLU A 38 -1.981 -3.361 21.355 1.00 75.99 O ATOM 578 CB GLU A 38 -0.199 -3.496 23.679 1.00 75.99 C ATOM 579 CG GLU A 38 0.903 -2.613 23.111 1.00 75.99 C ATOM 580 CD GLU A 38 1.328 -1.522 24.074 1.00 75.99 C ATOM 581 OE1 GLU A 38 0.554 -0.560 24.264 1.00 75.99 O ATOM 582 OE2 GLU A 38 2.437 -1.630 24.641 1.00 75.99 O ATOM 0 H GLU A 38 1.455 -5.211 22.725 1.00 75.99 H new ATOM 0 HA GLU A 38 -1.405 -5.218 23.247 1.00 75.99 H new ATOM 0 HB2 GLU A 38 -1.086 -2.886 23.851 1.00 75.99 H new ATOM 0 HB3 GLU A 38 0.120 -3.876 24.650 1.00 75.99 H new ATOM 0 HG2 GLU A 38 1.766 -3.230 22.862 1.00 75.99 H new ATOM 0 HG3 GLU A 38 0.558 -2.159 22.182 1.00 75.99 H new ATOM 589 N ILE A 39 -0.447 -4.663 20.363 1.00131.16 N ATOM 590 CA ILE A 39 -0.843 -4.262 19.028 1.00131.16 C ATOM 591 C ILE A 39 -1.962 -5.158 18.524 1.00131.16 C ATOM 592 O ILE A 39 -1.745 -6.080 17.746 1.00131.16 O ATOM 593 CB ILE A 39 0.364 -4.249 18.058 1.00131.16 C ATOM 594 CG1 ILE A 39 1.303 -3.130 18.483 1.00131.16 C ATOM 595 CG2 ILE A 39 -0.066 -4.051 16.603 1.00131.16 C ATOM 596 CD1 ILE A 39 2.619 -3.116 17.756 1.00131.16 C ATOM 0 H ILE A 39 0.320 -5.335 20.397 1.00131.16 H new ATOM 0 HA ILE A 39 -1.220 -3.240 19.072 1.00131.16 H new ATOM 0 HB ILE A 39 0.864 -5.216 18.109 1.00131.16 H new ATOM 0 HG12 ILE A 39 0.804 -2.174 18.325 1.00131.16 H new ATOM 0 HG13 ILE A 39 1.493 -3.218 19.553 1.00131.16 H new ATOM 0 HG21 ILE A 39 0.814 -4.049 15.960 1.00131.16 H new ATOM 0 HG22 ILE A 39 -0.730 -4.863 16.306 1.00131.16 H new ATOM 0 HG23 ILE A 39 -0.589 -3.100 16.504 1.00131.16 H new ATOM 0 HD11 ILE A 39 3.227 -2.288 18.120 1.00131.16 H new ATOM 0 HD12 ILE A 39 3.143 -4.055 17.933 1.00131.16 H new ATOM 0 HD13 ILE A 39 2.443 -2.995 16.687 1.00131.16 H new ATOM 608 N THR A 40 -3.162 -4.849 18.977 1.00160.31 N ATOM 609 CA THR A 40 -4.355 -5.584 18.578 1.00160.31 C ATOM 610 C THR A 40 -5.115 -4.847 17.466 1.00160.31 C ATOM 611 O THR A 40 -6.159 -5.307 17.002 1.00160.31 O ATOM 612 CB THR A 40 -5.292 -5.873 19.789 1.00160.31 C ATOM 613 OG1 THR A 40 -6.656 -5.978 19.357 1.00160.31 O ATOM 614 CG2 THR A 40 -5.184 -4.795 20.873 1.00160.31 C ATOM 0 H THR A 40 -3.341 -4.085 19.629 1.00160.31 H new ATOM 0 HA THR A 40 -4.021 -6.544 18.185 1.00160.31 H new ATOM 0 HB THR A 40 -4.968 -6.820 20.220 1.00160.31 H new ATOM 0 HG1 THR A 40 -6.686 -6.033 18.379 1.00160.31 H new ATOM 0 HG21 THR A 40 -5.855 -5.039 21.697 1.00160.31 H new ATOM 0 HG22 THR A 40 -4.159 -4.750 21.241 1.00160.31 H new ATOM 0 HG23 THR A 40 -5.461 -3.828 20.453 1.00160.31 H new ATOM 622 N THR A 41 -4.574 -3.705 17.048 1.00182.91 N ATOM 623 CA THR A 41 -5.160 -2.886 16.002 1.00182.91 C ATOM 624 C THR A 41 -4.103 -2.093 15.282 1.00182.91 C ATOM 625 O THR A 41 -3.090 -1.707 15.869 1.00182.91 O ATOM 626 CB THR A 41 -6.233 -1.898 16.540 1.00182.91 C ATOM 627 OG1 THR A 41 -6.321 -0.728 15.711 1.00182.91 O ATOM 628 CG2 THR A 41 -5.992 -1.467 17.990 1.00182.91 C ATOM 0 H THR A 41 -3.710 -3.323 17.432 1.00182.91 H new ATOM 0 HA THR A 41 -5.644 -3.583 15.318 1.00182.91 H new ATOM 0 HB THR A 41 -7.173 -2.448 16.512 1.00182.91 H new ATOM 0 HG1 THR A 41 -7.183 -0.286 15.859 1.00182.91 H new ATOM 0 HG21 THR A 41 -6.778 -0.778 18.300 1.00182.91 H new ATOM 0 HG22 THR A 41 -6.002 -2.344 18.637 1.00182.91 H new ATOM 0 HG23 THR A 41 -5.024 -0.971 18.066 1.00182.91 H new ATOM 636 N GLY A 42 -4.377 -1.785 14.020 1.00 66.60 N ATOM 637 CA GLY A 42 -3.464 -0.959 13.270 1.00 66.60 C ATOM 638 C GLY A 42 -3.348 0.388 13.952 1.00 66.60 C ATOM 639 O GLY A 42 -2.287 1.008 13.958 1.00 66.60 O ATOM 0 H GLY A 42 -5.207 -2.091 13.511 1.00 66.60 H new ATOM 0 HA2 GLY A 42 -2.486 -1.437 13.210 1.00 66.60 H new ATOM 0 HA3 GLY A 42 -3.821 -0.834 12.248 1.00 66.60 H new ATOM 643 N SER A 43 -4.453 0.801 14.591 1.00 41.24 N ATOM 644 CA SER A 43 -4.466 2.038 15.347 1.00 41.24 C ATOM 645 C SER A 43 -3.518 1.908 16.528 1.00 41.24 C ATOM 646 O SER A 43 -2.753 2.821 16.836 1.00 41.24 O ATOM 647 CB SER A 43 -5.877 2.372 15.833 1.00 41.24 C ATOM 648 OG SER A 43 -6.770 2.533 14.745 1.00 41.24 O ATOM 0 H SER A 43 -5.337 0.293 14.593 1.00 41.24 H new ATOM 0 HA SER A 43 -4.139 2.851 14.700 1.00 41.24 H new ATOM 0 HB2 SER A 43 -6.236 1.578 16.487 1.00 41.24 H new ATOM 0 HB3 SER A 43 -5.853 3.287 16.426 1.00 41.24 H new ATOM 0 HG SER A 43 -7.665 2.744 15.085 1.00 41.24 H new ATOM 654 N ALA A 44 -3.576 0.744 17.179 1.00 31.60 N ATOM 655 CA ALA A 44 -2.722 0.460 18.329 1.00 31.60 C ATOM 656 C ALA A 44 -1.258 0.459 17.925 1.00 31.60 C ATOM 657 O ALA A 44 -0.384 0.868 18.690 1.00 31.60 O ATOM 658 CB ALA A 44 -3.085 -0.884 18.935 1.00 31.60 C ATOM 0 H ALA A 44 -4.207 -0.017 16.927 1.00 31.60 H new ATOM 0 HA ALA A 44 -2.881 1.243 19.070 1.00 31.60 H new ATOM 0 HB1 ALA A 44 -2.441 -1.083 19.791 1.00 31.60 H new ATOM 0 HB2 ALA A 44 -4.125 -0.868 19.260 1.00 31.60 H new ATOM 0 HB3 ALA A 44 -2.950 -1.668 18.189 1.00 31.60 H new ATOM 664 N TRP A 45 -1.005 -0.005 16.713 1.00 71.86 N ATOM 665 CA TRP A 45 0.345 -0.071 16.180 1.00 71.86 C ATOM 666 C TRP A 45 0.776 1.295 15.721 1.00 71.86 C ATOM 667 O TRP A 45 1.807 1.805 16.148 1.00 71.86 O ATOM 668 CB TRP A 45 0.393 -1.045 15.016 1.00 71.86 C ATOM 669 CG TRP A 45 1.765 -1.257 14.473 1.00 71.86 C ATOM 670 CD1 TRP A 45 2.939 -1.320 15.171 1.00 71.86 C ATOM 671 CD2 TRP A 45 2.100 -1.442 13.105 1.00 71.86 C ATOM 672 NE1 TRP A 45 3.983 -1.525 14.305 1.00 71.86 N ATOM 673 CE2 TRP A 45 3.492 -1.601 13.030 1.00 71.86 C ATOM 674 CE3 TRP A 45 1.351 -1.484 11.934 1.00 71.86 C ATOM 675 CZ2 TRP A 45 4.152 -1.799 11.828 1.00 71.86 C ATOM 676 CZ3 TRP A 45 2.001 -1.684 10.740 1.00 71.86 C ATOM 677 CH2 TRP A 45 3.396 -1.840 10.688 1.00 71.86 C ATOM 0 H TRP A 45 -1.724 -0.344 16.074 1.00 71.86 H new ATOM 0 HA TRP A 45 1.022 -0.417 16.961 1.00 71.86 H new ATOM 0 HB2 TRP A 45 -0.014 -2.004 15.338 1.00 71.86 H new ATOM 0 HB3 TRP A 45 -0.252 -0.677 14.218 1.00 71.86 H new ATOM 0 HD1 TRP A 45 3.031 -1.223 16.243 1.00 71.86 H new ATOM 0 HE1 TRP A 45 4.965 -1.607 14.568 1.00 71.86 H new ATOM 0 HE3 TRP A 45 0.278 -1.362 11.963 1.00 71.86 H new ATOM 0 HZ2 TRP A 45 5.225 -1.917 11.792 1.00 71.86 H new ATOM 0 HZ3 TRP A 45 1.429 -1.722 9.825 1.00 71.86 H new ATOM 0 HH2 TRP A 45 3.879 -1.995 9.734 1.00 71.86 H new ATOM 688 N PHE A 46 -0.031 1.909 14.860 1.00 81.71 N ATOM 689 CA PHE A 46 0.277 3.238 14.378 1.00 81.71 C ATOM 690 C PHE A 46 0.453 4.185 15.555 1.00 81.71 C ATOM 691 O PHE A 46 1.322 5.036 15.541 1.00 81.71 O ATOM 692 CB PHE A 46 -0.836 3.751 13.478 1.00 81.71 C ATOM 693 CG PHE A 46 -0.952 3.029 12.167 1.00 81.71 C ATOM 694 CD1 PHE A 46 0.167 2.770 11.390 1.00 81.71 C ATOM 695 CD2 PHE A 46 -2.191 2.648 11.694 1.00 81.71 C ATOM 696 CE1 PHE A 46 0.046 2.138 10.165 1.00 81.71 C ATOM 697 CE2 PHE A 46 -2.322 2.029 10.468 1.00 81.71 C ATOM 698 CZ PHE A 46 -1.205 1.772 9.701 1.00 81.71 C ATOM 0 H PHE A 46 -0.892 1.507 14.489 1.00 81.71 H new ATOM 0 HA PHE A 46 1.202 3.192 13.803 1.00 81.71 H new ATOM 0 HB2 PHE A 46 -1.784 3.669 14.010 1.00 81.71 H new ATOM 0 HB3 PHE A 46 -0.670 4.810 13.283 1.00 81.71 H new ATOM 0 HD1 PHE A 46 1.144 3.065 11.745 1.00 81.71 H new ATOM 0 HD2 PHE A 46 -3.070 2.837 12.292 1.00 81.71 H new ATOM 0 HE1 PHE A 46 0.925 1.931 9.573 1.00 81.71 H new ATOM 0 HE2 PHE A 46 -3.300 1.745 10.109 1.00 81.71 H new ATOM 0 HZ PHE A 46 -1.306 1.287 8.742 1.00 81.71 H new ATOM 708 N SER A 47 -0.370 4.014 16.586 1.00 81.62 N ATOM 709 CA SER A 47 -0.261 4.860 17.772 1.00 81.62 C ATOM 710 C SER A 47 1.078 4.644 18.449 1.00 81.62 C ATOM 711 O SER A 47 1.754 5.603 18.818 1.00 81.62 O ATOM 712 CB SER A 47 -1.404 4.586 18.752 1.00 81.62 C ATOM 713 OG SER A 47 -2.661 4.898 18.178 1.00 81.62 O ATOM 0 H SER A 47 -1.108 3.311 16.626 1.00 81.62 H new ATOM 0 HA SER A 47 -0.332 5.900 17.454 1.00 81.62 H new ATOM 0 HB2 SER A 47 -1.388 3.537 19.049 1.00 81.62 H new ATOM 0 HB3 SER A 47 -1.259 5.176 19.657 1.00 81.62 H new ATOM 0 HG SER A 47 -3.090 4.075 17.863 1.00 81.62 H new ATOM 719 N PHE A 48 1.492 3.384 18.568 1.00 49.76 N ATOM 720 CA PHE A 48 2.782 3.086 19.151 1.00 49.76 C ATOM 721 C PHE A 48 3.856 3.658 18.220 1.00 49.76 C ATOM 722 O PHE A 48 4.757 4.381 18.645 1.00 49.76 O ATOM 723 CB PHE A 48 2.943 1.571 19.345 1.00 49.76 C ATOM 724 CG PHE A 48 4.366 1.143 19.267 1.00 49.76 C ATOM 725 CD1 PHE A 48 4.901 0.818 18.048 1.00 49.76 C ATOM 726 CD2 PHE A 48 5.168 1.149 20.383 1.00 49.76 C ATOM 727 CE1 PHE A 48 6.229 0.489 17.930 1.00 49.76 C ATOM 728 CE2 PHE A 48 6.502 0.810 20.285 1.00 49.76 C ATOM 729 CZ PHE A 48 7.037 0.480 19.053 1.00 49.76 C ATOM 0 H PHE A 48 0.956 2.569 18.271 1.00 49.76 H new ATOM 0 HA PHE A 48 2.878 3.540 20.137 1.00 49.76 H new ATOM 0 HB2 PHE A 48 2.532 1.285 20.313 1.00 49.76 H new ATOM 0 HB3 PHE A 48 2.365 1.046 18.585 1.00 49.76 H new ATOM 0 HD1 PHE A 48 4.271 0.821 17.171 1.00 49.76 H new ATOM 0 HD2 PHE A 48 4.752 1.421 21.342 1.00 49.76 H new ATOM 0 HE1 PHE A 48 6.641 0.238 16.964 1.00 49.76 H new ATOM 0 HE2 PHE A 48 7.126 0.802 21.167 1.00 49.76 H new ATOM 0 HZ PHE A 48 8.081 0.216 18.968 1.00 49.76 H new ATOM 739 N LEU A 49 3.716 3.330 16.935 1.00 52.14 N ATOM 740 CA LEU A 49 4.625 3.801 15.896 1.00 52.14 C ATOM 741 C LEU A 49 4.724 5.332 15.965 1.00 52.14 C ATOM 742 O LEU A 49 5.815 5.900 15.952 1.00 52.14 O ATOM 743 CB LEU A 49 4.092 3.351 14.524 1.00 52.14 C ATOM 744 CG LEU A 49 4.928 2.301 13.778 1.00 52.14 C ATOM 745 CD1 LEU A 49 5.322 1.161 14.706 1.00 52.14 C ATOM 746 CD2 LEU A 49 4.153 1.765 12.583 1.00 52.14 C ATOM 0 H LEU A 49 2.968 2.730 16.588 1.00 52.14 H new ATOM 0 HA LEU A 49 5.620 3.381 16.044 1.00 52.14 H new ATOM 0 HB2 LEU A 49 3.087 2.952 14.662 1.00 52.14 H new ATOM 0 HB3 LEU A 49 4.001 4.231 13.887 1.00 52.14 H new ATOM 0 HG LEU A 49 5.840 2.780 13.422 1.00 52.14 H new ATOM 0 HD11 LEU A 49 5.913 0.430 14.154 1.00 52.14 H new ATOM 0 HD12 LEU A 49 5.911 1.554 15.535 1.00 52.14 H new ATOM 0 HD13 LEU A 49 4.424 0.681 15.095 1.00 52.14 H new ATOM 0 HD21 LEU A 49 4.756 1.021 12.062 1.00 52.14 H new ATOM 0 HD22 LEU A 49 3.227 1.305 12.927 1.00 52.14 H new ATOM 0 HD23 LEU A 49 3.920 2.584 11.903 1.00 52.14 H new ATOM 758 N GLU A 50 3.557 5.977 16.077 1.00 63.10 N ATOM 759 CA GLU A 50 3.480 7.433 16.194 1.00 63.10 C ATOM 760 C GLU A 50 4.118 7.882 17.496 1.00 63.10 C ATOM 761 O GLU A 50 4.861 8.862 17.537 1.00 63.10 O ATOM 762 CB GLU A 50 2.028 7.928 16.146 1.00 63.10 C ATOM 763 CG GLU A 50 1.405 7.902 14.759 1.00 63.10 C ATOM 764 CD GLU A 50 0.019 8.518 14.733 1.00 63.10 C ATOM 765 OE1 GLU A 50 -0.587 8.672 15.815 1.00 63.10 O ATOM 766 OE2 GLU A 50 -0.458 8.855 13.630 1.00 63.10 O ATOM 0 H GLU A 50 2.651 5.509 16.089 1.00 63.10 H new ATOM 0 HA GLU A 50 4.017 7.861 15.347 1.00 63.10 H new ATOM 0 HB2 GLU A 50 1.425 7.314 16.814 1.00 63.10 H new ATOM 0 HB3 GLU A 50 1.991 8.948 16.529 1.00 63.10 H new ATOM 0 HG2 GLU A 50 2.051 8.439 14.064 1.00 63.10 H new ATOM 0 HG3 GLU A 50 1.348 6.871 14.409 1.00 63.10 H new ATOM 773 N SER A 51 3.833 7.137 18.561 1.00 75.02 N ATOM 774 CA SER A 51 4.394 7.435 19.880 1.00 75.02 C ATOM 775 C SER A 51 5.917 7.406 19.816 1.00 75.02 C ATOM 776 O SER A 51 6.597 8.116 20.556 1.00 75.02 O ATOM 777 CB SER A 51 3.887 6.433 20.919 1.00 75.02 C ATOM 778 OG SER A 51 2.477 6.490 21.031 1.00 75.02 O ATOM 0 H SER A 51 3.218 6.323 18.539 1.00 75.02 H new ATOM 0 HA SER A 51 4.071 8.432 20.180 1.00 75.02 H new ATOM 0 HB2 SER A 51 4.193 5.425 20.638 1.00 75.02 H new ATOM 0 HB3 SER A 51 4.341 6.645 21.887 1.00 75.02 H new ATOM 0 HG SER A 51 2.074 6.395 20.143 1.00 75.02 H new ATOM 784 N HIS A 52 6.439 6.589 18.904 1.00122.90 N ATOM 785 CA HIS A 52 7.872 6.465 18.697 1.00122.90 C ATOM 786 C HIS A 52 8.255 7.171 17.405 1.00122.90 C ATOM 787 O HIS A 52 7.413 7.792 16.757 1.00122.90 O ATOM 788 CB HIS A 52 8.271 4.990 18.618 1.00122.90 C ATOM 789 CG HIS A 52 8.091 4.260 19.902 1.00122.90 C ATOM 790 ND1 HIS A 52 9.094 3.548 20.526 1.00122.90 N ATOM 791 CD2 HIS A 52 7.002 4.136 20.674 1.00122.90 C ATOM 792 CE1 HIS A 52 8.618 3.013 21.637 1.00122.90 C ATOM 793 NE2 HIS A 52 7.347 3.357 21.751 1.00122.90 N ATOM 0 H HIS A 52 5.878 5.997 18.291 1.00122.90 H new ATOM 0 HA HIS A 52 8.396 6.924 19.536 1.00122.90 H new ATOM 0 HB2 HIS A 52 7.678 4.502 17.845 1.00122.90 H new ATOM 0 HB3 HIS A 52 9.315 4.919 18.312 1.00122.90 H new ATOM 0 HD2 HIS A 52 6.031 4.569 20.484 1.00122.90 H new ATOM 0 HE1 HIS A 52 9.172 2.400 22.332 1.00122.90 H new ATOM 0 HE2 HIS A 52 6.725 3.088 22.513 1.00122.90 H new ATOM 801 N ASN A 53 9.518 7.070 17.027 1.00225.56 N ATOM 802 CA ASN A 53 9.994 7.698 15.804 1.00225.56 C ATOM 803 C ASN A 53 9.910 6.744 14.612 1.00225.56 C ATOM 804 O ASN A 53 10.713 6.831 13.685 1.00225.56 O ATOM 805 CB ASN A 53 11.426 8.198 15.991 1.00225.56 C ATOM 806 CG ASN A 53 12.369 7.093 16.417 1.00225.56 C ATOM 807 OD1 ASN A 53 11.974 6.155 17.107 1.00225.56 O ATOM 808 ND2 ASN A 53 13.624 7.199 16.007 1.00225.56 N ATOM 0 H ASN A 53 10.232 6.560 17.548 1.00225.56 H new ATOM 0 HA ASN A 53 9.346 8.548 15.590 1.00225.56 H new ATOM 0 HB2 ASN A 53 11.781 8.636 15.058 1.00225.56 H new ATOM 0 HB3 ASN A 53 11.437 8.991 16.739 1.00225.56 H new ATOM 0 HD21 ASN A 53 14.306 6.485 16.263 1.00225.56 H new ATOM 0 HD22 ASN A 53 13.908 7.995 15.436 1.00225.56 H new ATOM 815 N LYS A 54 8.940 5.832 14.640 1.00217.59 N ATOM 816 CA LYS A 54 8.766 4.868 13.565 1.00217.59 C ATOM 817 C LYS A 54 7.748 5.340 12.537 1.00217.59 C ATOM 818 O LYS A 54 7.678 4.791 11.439 1.00217.59 O ATOM 819 CB LYS A 54 8.272 3.541 14.139 1.00217.59 C ATOM 820 CG LYS A 54 9.136 3.000 15.264 1.00217.59 C ATOM 821 CD LYS A 54 10.582 2.858 14.824 1.00217.59 C ATOM 822 CE LYS A 54 11.458 3.933 15.435 1.00217.59 C ATOM 823 NZ LYS A 54 12.797 3.404 15.821 1.00217.59 N ATOM 0 H LYS A 54 8.264 5.744 15.398 1.00217.59 H new ATOM 0 HA LYS A 54 9.734 4.752 13.078 1.00217.59 H new ATOM 0 HB2 LYS A 54 7.254 3.671 14.506 1.00217.59 H new ATOM 0 HB3 LYS A 54 8.230 2.803 13.338 1.00217.59 H new ATOM 0 HG2 LYS A 54 9.078 3.667 16.124 1.00217.59 H new ATOM 0 HG3 LYS A 54 8.754 2.031 15.586 1.00217.59 H new ATOM 0 HD2 LYS A 54 10.956 1.876 15.112 1.00217.59 H new ATOM 0 HD3 LYS A 54 10.640 2.915 13.737 1.00217.59 H new ATOM 0 HE2 LYS A 54 11.581 4.749 14.723 1.00217.59 H new ATOM 0 HE3 LYS A 54 10.964 4.348 16.314 1.00217.59 H new ATOM 0 HZ1 LYS A 54 13.366 4.169 16.235 1.00217.59 H new ATOM 0 HZ2 LYS A 54 12.681 2.642 16.519 1.00217.59 H new ATOM 0 HZ3 LYS A 54 13.279 3.031 14.978 1.00217.59 H new ATOM 837 N LEU A 55 6.952 6.350 12.874 1.00 97.75 N ATOM 838 CA LEU A 55 5.954 6.828 11.930 1.00 97.75 C ATOM 839 C LEU A 55 5.473 8.239 12.216 1.00 97.75 C ATOM 840 O LEU A 55 4.679 8.482 13.125 1.00 97.75 O ATOM 841 CB LEU A 55 4.764 5.886 11.917 1.00 97.75 C ATOM 842 CG LEU A 55 3.634 6.291 10.976 1.00 97.75 C ATOM 843 CD1 LEU A 55 2.932 5.064 10.421 1.00 97.75 C ATOM 844 CD2 LEU A 55 2.651 7.190 11.713 1.00 97.75 C ATOM 0 H LEU A 55 6.977 6.840 13.768 1.00 97.75 H new ATOM 0 HA LEU A 55 6.442 6.851 10.955 1.00 97.75 H new ATOM 0 HB2 LEU A 55 5.110 4.891 11.638 1.00 97.75 H new ATOM 0 HB3 LEU A 55 4.366 5.813 12.929 1.00 97.75 H new ATOM 0 HG LEU A 55 4.054 6.843 10.135 1.00 97.75 H new ATOM 0 HD11 LEU A 55 2.129 5.375 9.752 1.00 97.75 H new ATOM 0 HD12 LEU A 55 3.647 4.454 9.870 1.00 97.75 H new ATOM 0 HD13 LEU A 55 2.515 4.481 11.242 1.00 97.75 H new ATOM 0 HD21 LEU A 55 1.845 7.478 11.038 1.00 97.75 H new ATOM 0 HD22 LEU A 55 2.236 6.653 12.566 1.00 97.75 H new ATOM 0 HD23 LEU A 55 3.167 8.084 12.063 1.00 97.75 H new ATOM 856 N ASP A 56 5.926 9.143 11.370 1.00109.16 N ATOM 857 CA ASP A 56 5.529 10.543 11.423 1.00109.16 C ATOM 858 C ASP A 56 4.218 10.723 10.663 1.00109.16 C ATOM 859 O ASP A 56 3.636 9.750 10.189 1.00109.16 O ATOM 860 CB ASP A 56 6.619 11.441 10.835 1.00109.16 C ATOM 861 CG ASP A 56 7.887 11.445 11.669 1.00109.16 C ATOM 862 OD1 ASP A 56 7.865 10.898 12.792 1.00109.16 O ATOM 863 OD2 ASP A 56 8.901 12.003 11.199 1.00109.16 O ATOM 0 H ASP A 56 6.584 8.929 10.621 1.00109.16 H new ATOM 0 HA ASP A 56 5.386 10.834 12.464 1.00109.16 H new ATOM 0 HB2 ASP A 56 6.854 11.106 9.825 1.00109.16 H new ATOM 0 HB3 ASP A 56 6.240 12.460 10.753 1.00109.16 H new ATOM 868 N LYS A 57 3.774 11.962 10.510 1.00 65.03 N ATOM 869 CA LYS A 57 2.548 12.234 9.762 1.00 65.03 C ATOM 870 C LYS A 57 2.779 12.053 8.255 1.00 65.03 C ATOM 871 O LYS A 57 1.835 11.853 7.495 1.00 65.03 O ATOM 872 CB LYS A 57 2.001 13.637 10.072 1.00 65.03 C ATOM 873 CG LYS A 57 2.708 14.762 9.344 1.00 65.03 C ATOM 874 CD LYS A 57 4.155 14.855 9.775 1.00 65.03 C ATOM 875 CE LYS A 57 4.804 16.142 9.299 1.00 65.03 C ATOM 876 NZ LYS A 57 4.612 17.251 10.276 1.00 65.03 N ATOM 0 H LYS A 57 4.236 12.789 10.888 1.00 65.03 H new ATOM 0 HA LYS A 57 1.796 11.512 10.080 1.00 65.03 H new ATOM 0 HB2 LYS A 57 0.942 13.665 9.816 1.00 65.03 H new ATOM 0 HB3 LYS A 57 2.075 13.813 11.145 1.00 65.03 H new ATOM 0 HG2 LYS A 57 2.654 14.595 8.268 1.00 65.03 H new ATOM 0 HG3 LYS A 57 2.202 15.706 9.546 1.00 65.03 H new ATOM 0 HD2 LYS A 57 4.215 14.798 10.862 1.00 65.03 H new ATOM 0 HD3 LYS A 57 4.707 14.002 9.380 1.00 65.03 H new ATOM 0 HE2 LYS A 57 5.870 15.976 9.142 1.00 65.03 H new ATOM 0 HE3 LYS A 57 4.381 16.428 8.336 1.00 65.03 H new ATOM 0 HZ1 LYS A 57 5.069 18.113 9.916 1.00 65.03 H new ATOM 0 HZ2 LYS A 57 3.595 17.426 10.407 1.00 65.03 H new ATOM 0 HZ3 LYS A 57 5.038 16.988 11.188 1.00 65.03 H new ATOM 890 N ASP A 58 4.040 12.131 7.830 1.00165.72 N ATOM 891 CA ASP A 58 4.385 11.978 6.421 1.00165.72 C ATOM 892 C ASP A 58 5.318 10.785 6.188 1.00165.72 C ATOM 893 O ASP A 58 5.484 10.342 5.052 1.00165.72 O ATOM 894 CB ASP A 58 5.035 13.258 5.896 1.00165.72 C ATOM 895 CG ASP A 58 4.075 14.432 5.893 1.00165.72 C ATOM 896 OD1 ASP A 58 2.889 14.227 5.556 1.00165.72 O ATOM 897 OD2 ASP A 58 4.508 15.555 6.221 1.00165.72 O ATOM 0 H ASP A 58 4.838 12.299 8.443 1.00165.72 H new ATOM 0 HA ASP A 58 3.460 11.788 5.876 1.00165.72 H new ATOM 0 HB2 ASP A 58 5.901 13.502 6.511 1.00165.72 H new ATOM 0 HB3 ASP A 58 5.401 13.088 4.883 1.00165.72 H new ATOM 902 N ASN A 59 5.932 10.268 7.255 1.00 98.89 N ATOM 903 CA ASN A 59 6.845 9.127 7.118 1.00 98.89 C ATOM 904 C ASN A 59 6.111 7.806 7.275 1.00 98.89 C ATOM 905 O ASN A 59 5.705 7.424 8.373 1.00 98.89 O ATOM 906 CB ASN A 59 7.984 9.212 8.139 1.00 98.89 C ATOM 907 CG ASN A 59 8.977 10.311 7.818 1.00 98.89 C ATOM 908 OD1 ASN A 59 8.518 11.555 7.868 1.00 98.89 O flip ATOM 909 ND2 ASN A 59 10.145 10.047 7.530 1.00 98.89 N flip ATOM 0 H ASN A 59 5.818 10.613 8.208 1.00 98.89 H new ATOM 0 HA ASN A 59 7.266 9.170 6.113 1.00 98.89 H new ATOM 0 HB2 ASN A 59 7.565 9.385 9.131 1.00 98.89 H new ATOM 0 HB3 ASN A 59 8.506 8.256 8.175 1.00 98.89 H new ATOM 0 HD21 ASN A 59 10.457 9.076 7.503 1.00 98.89 H new ATOM 0 HD22 ASN A 59 10.801 10.799 7.318 1.00 98.89 H new ATOM 916 N LEU A 60 5.968 7.104 6.160 1.00196.24 N ATOM 917 CA LEU A 60 5.310 5.807 6.135 1.00196.24 C ATOM 918 C LEU A 60 6.198 4.756 5.463 1.00196.24 C ATOM 919 O LEU A 60 5.738 3.654 5.167 1.00196.24 O ATOM 920 CB LEU A 60 3.978 5.897 5.386 1.00196.24 C ATOM 921 CG LEU A 60 3.972 6.844 4.177 1.00196.24 C ATOM 922 CD1 LEU A 60 3.242 6.213 2.998 1.00196.24 C ATOM 923 CD2 LEU A 60 3.343 8.176 4.554 1.00196.24 C ATOM 0 H LEU A 60 6.304 7.417 5.249 1.00196.24 H new ATOM 0 HA LEU A 60 5.126 5.508 7.167 1.00196.24 H new ATOM 0 HB2 LEU A 60 3.702 4.899 5.047 1.00196.24 H new ATOM 0 HB3 LEU A 60 3.207 6.221 6.085 1.00196.24 H new ATOM 0 HG LEU A 60 5.003 7.024 3.874 1.00196.24 H new ATOM 0 HD11 LEU A 60 3.251 6.902 2.154 1.00196.24 H new ATOM 0 HD12 LEU A 60 3.741 5.286 2.715 1.00196.24 H new ATOM 0 HD13 LEU A 60 2.211 5.999 3.281 1.00196.24 H new ATOM 0 HD21 LEU A 60 3.345 8.838 3.688 1.00196.24 H new ATOM 0 HD22 LEU A 60 2.317 8.013 4.884 1.00196.24 H new ATOM 0 HD23 LEU A 60 3.915 8.633 5.361 1.00196.24 H new ATOM 935 N SER A 61 7.460 5.102 5.191 1.00 66.14 N ATOM 936 CA SER A 61 8.370 4.174 4.520 1.00 66.14 C ATOM 937 C SER A 61 8.533 2.857 5.278 1.00 66.14 C ATOM 938 O SER A 61 8.553 1.789 4.667 1.00 66.14 O ATOM 939 CB SER A 61 9.741 4.824 4.319 1.00 66.14 C ATOM 940 OG SER A 61 10.394 5.030 5.559 1.00 66.14 O ATOM 0 H SER A 61 7.869 6.007 5.423 1.00 66.14 H new ATOM 0 HA SER A 61 7.923 3.942 3.553 1.00 66.14 H new ATOM 0 HB2 SER A 61 10.357 4.191 3.681 1.00 66.14 H new ATOM 0 HB3 SER A 61 9.623 5.777 3.804 1.00 66.14 H new ATOM 0 HG SER A 61 11.268 5.445 5.403 1.00 66.14 H new ATOM 946 N TYR A 62 8.648 2.924 6.600 1.00 59.69 N ATOM 947 CA TYR A 62 8.806 1.718 7.400 1.00 59.69 C ATOM 948 C TYR A 62 7.524 0.889 7.392 1.00 59.69 C ATOM 949 O TYR A 62 7.577 -0.328 7.289 1.00 59.69 O ATOM 950 CB TYR A 62 9.242 2.080 8.839 1.00 59.69 C ATOM 951 CG TYR A 62 8.751 1.126 9.917 1.00 59.69 C ATOM 952 CD1 TYR A 62 8.977 -0.243 9.831 1.00 59.69 C ATOM 953 CD2 TYR A 62 8.025 1.600 10.997 1.00 59.69 C ATOM 954 CE1 TYR A 62 8.492 -1.105 10.795 1.00 59.69 C ATOM 955 CE2 TYR A 62 7.543 0.748 11.965 1.00 59.69 C ATOM 956 CZ TYR A 62 7.776 -0.604 11.863 1.00 59.69 C ATOM 957 OH TYR A 62 7.288 -1.457 12.828 1.00 59.69 O ATOM 0 H TYR A 62 8.635 3.792 7.135 1.00 59.69 H new ATOM 0 HA TYR A 62 9.591 1.106 6.957 1.00 59.69 H new ATOM 0 HB2 TYR A 62 10.331 2.116 8.875 1.00 59.69 H new ATOM 0 HB3 TYR A 62 8.882 3.083 9.070 1.00 59.69 H new ATOM 0 HD1 TYR A 62 9.540 -0.638 8.998 1.00 59.69 H new ATOM 0 HD2 TYR A 62 7.833 2.659 11.082 1.00 59.69 H new ATOM 0 HE1 TYR A 62 8.672 -2.167 10.713 1.00 59.69 H new ATOM 0 HE2 TYR A 62 6.984 1.140 12.802 1.00 59.69 H new ATOM 0 HH TYR A 62 7.036 -2.309 12.414 1.00 59.69 H new ATOM 967 N ILE A 63 6.384 1.550 7.520 1.00 95.89 N ATOM 968 CA ILE A 63 5.106 0.855 7.546 1.00 95.89 C ATOM 969 C ILE A 63 4.771 0.327 6.169 1.00 95.89 C ATOM 970 O ILE A 63 4.411 -0.838 5.998 1.00 95.89 O ATOM 971 CB ILE A 63 3.972 1.765 8.086 1.00 95.89 C ATOM 972 CG1 ILE A 63 3.399 2.712 7.024 1.00 95.89 C ATOM 973 CG2 ILE A 63 4.467 2.585 9.271 1.00 95.89 C ATOM 974 CD1 ILE A 63 2.200 3.477 7.524 1.00 95.89 C ATOM 0 H ILE A 63 6.317 2.564 7.607 1.00 95.89 H new ATOM 0 HA ILE A 63 5.194 0.011 8.230 1.00 95.89 H new ATOM 0 HB ILE A 63 3.169 1.096 8.395 1.00 95.89 H new ATOM 0 HG12 ILE A 63 4.172 3.415 6.713 1.00 95.89 H new ATOM 0 HG13 ILE A 63 3.118 2.137 6.142 1.00 95.89 H new ATOM 0 HG21 ILE A 63 3.659 3.218 9.638 1.00 95.89 H new ATOM 0 HG22 ILE A 63 4.793 1.915 10.066 1.00 95.89 H new ATOM 0 HG23 ILE A 63 5.304 3.209 8.957 1.00 95.89 H new ATOM 0 HD11 ILE A 63 1.832 4.133 6.735 1.00 95.89 H new ATOM 0 HD12 ILE A 63 1.415 2.777 7.809 1.00 95.89 H new ATOM 0 HD13 ILE A 63 2.485 4.075 8.390 1.00 95.89 H new ATOM 986 N GLU A 64 4.937 1.191 5.180 1.00 77.41 N ATOM 987 CA GLU A 64 4.702 0.823 3.792 1.00 77.41 C ATOM 988 C GLU A 64 5.494 -0.441 3.466 1.00 77.41 C ATOM 989 O GLU A 64 5.079 -1.264 2.657 1.00 77.41 O ATOM 990 CB GLU A 64 5.123 1.965 2.864 1.00 77.41 C ATOM 991 CG GLU A 64 4.794 1.722 1.401 1.00 77.41 C ATOM 992 CD GLU A 64 5.293 2.832 0.495 1.00 77.41 C ATOM 993 OE1 GLU A 64 6.008 3.732 0.987 1.00 77.41 O ATOM 994 OE2 GLU A 64 4.971 2.801 -0.712 1.00 77.41 O ATOM 0 H GLU A 64 5.235 2.157 5.314 1.00 77.41 H new ATOM 0 HA GLU A 64 3.639 0.633 3.643 1.00 77.41 H new ATOM 0 HB2 GLU A 64 4.634 2.883 3.189 1.00 77.41 H new ATOM 0 HB3 GLU A 64 6.197 2.124 2.963 1.00 77.41 H new ATOM 0 HG2 GLU A 64 5.235 0.776 1.086 1.00 77.41 H new ATOM 0 HG3 GLU A 64 3.714 1.624 1.287 1.00 77.41 H new ATOM 1001 N HIS A 65 6.626 -0.601 4.147 1.00 68.54 N ATOM 1002 CA HIS A 65 7.453 -1.780 3.967 1.00 68.54 C ATOM 1003 C HIS A 65 6.752 -2.987 4.555 1.00 68.54 C ATOM 1004 O HIS A 65 6.741 -4.058 3.962 1.00 68.54 O ATOM 1005 CB HIS A 65 8.827 -1.554 4.615 1.00 68.54 C ATOM 1006 CG HIS A 65 9.665 -2.787 4.773 1.00 68.54 C ATOM 1007 ND1 HIS A 65 10.351 -3.384 3.737 1.00 68.54 N ATOM 1008 CD2 HIS A 65 9.926 -3.527 5.875 1.00 68.54 C ATOM 1009 CE1 HIS A 65 11.001 -4.441 4.196 1.00 68.54 C ATOM 1010 NE2 HIS A 65 10.759 -4.548 5.491 1.00 68.54 N ATOM 0 H HIS A 65 6.986 0.071 4.825 1.00 68.54 H new ATOM 0 HA HIS A 65 7.610 -1.965 2.904 1.00 68.54 H new ATOM 0 HB2 HIS A 65 9.380 -0.832 4.015 1.00 68.54 H new ATOM 0 HB3 HIS A 65 8.679 -1.105 5.597 1.00 68.54 H new ATOM 0 HD2 HIS A 65 9.549 -3.348 6.871 1.00 68.54 H new ATOM 0 HE1 HIS A 65 11.623 -5.103 3.612 1.00 68.54 H new ATOM 0 HE2 HIS A 65 11.131 -5.272 6.106 1.00 68.54 H new ATOM 1018 N ILE A 66 6.163 -2.789 5.726 1.00 44.28 N ATOM 1019 CA ILE A 66 5.442 -3.846 6.417 1.00 44.28 C ATOM 1020 C ILE A 66 4.311 -4.351 5.556 1.00 44.28 C ATOM 1021 O ILE A 66 4.163 -5.552 5.333 1.00 44.28 O ATOM 1022 CB ILE A 66 4.892 -3.322 7.756 1.00 44.28 C ATOM 1023 CG1 ILE A 66 6.051 -2.764 8.577 1.00 44.28 C ATOM 1024 CG2 ILE A 66 4.136 -4.401 8.524 1.00 44.28 C ATOM 1025 CD1 ILE A 66 7.210 -3.710 8.731 1.00 44.28 C ATOM 0 H ILE A 66 6.172 -1.897 6.220 1.00 44.28 H new ATOM 0 HA ILE A 66 6.129 -4.669 6.615 1.00 44.28 H new ATOM 0 HB ILE A 66 4.171 -2.530 7.556 1.00 44.28 H new ATOM 0 HG12 ILE A 66 6.406 -1.847 8.107 1.00 44.28 H new ATOM 0 HG13 ILE A 66 5.683 -2.494 9.567 1.00 44.28 H new ATOM 0 HG21 ILE A 66 3.765 -3.988 9.462 1.00 44.28 H new ATOM 0 HG22 ILE A 66 3.296 -4.753 7.925 1.00 44.28 H new ATOM 0 HG23 ILE A 66 4.806 -5.235 8.734 1.00 44.28 H new ATOM 0 HD11 ILE A 66 7.990 -3.236 9.327 1.00 44.28 H new ATOM 0 HD12 ILE A 66 6.874 -4.619 9.230 1.00 44.28 H new ATOM 0 HD13 ILE A 66 7.607 -3.962 7.748 1.00 44.28 H new ATOM 1037 N PHE A 67 3.526 -3.415 5.054 1.00103.95 N ATOM 1038 CA PHE A 67 2.420 -3.755 4.191 1.00103.95 C ATOM 1039 C PHE A 67 2.944 -4.409 2.907 1.00103.95 C ATOM 1040 O PHE A 67 2.275 -5.258 2.319 1.00103.95 O ATOM 1041 CB PHE A 67 1.599 -2.505 3.896 1.00103.95 C ATOM 1042 CG PHE A 67 1.149 -1.831 5.157 1.00103.95 C ATOM 1043 CD1 PHE A 67 0.443 -2.540 6.113 1.00103.95 C ATOM 1044 CD2 PHE A 67 1.452 -0.501 5.399 1.00103.95 C ATOM 1045 CE1 PHE A 67 0.048 -1.938 7.290 1.00103.95 C ATOM 1046 CE2 PHE A 67 1.055 0.109 6.573 1.00103.95 C ATOM 1047 CZ PHE A 67 0.351 -0.613 7.520 1.00103.95 C ATOM 0 H PHE A 67 3.637 -2.417 5.231 1.00103.95 H new ATOM 0 HA PHE A 67 1.769 -4.475 4.687 1.00103.95 H new ATOM 0 HB2 PHE A 67 2.194 -1.810 3.303 1.00103.95 H new ATOM 0 HB3 PHE A 67 0.730 -2.773 3.296 1.00103.95 H new ATOM 0 HD1 PHE A 67 0.198 -3.577 5.936 1.00103.95 H new ATOM 0 HD2 PHE A 67 2.004 0.064 4.663 1.00103.95 H new ATOM 0 HE1 PHE A 67 -0.498 -2.504 8.030 1.00103.95 H new ATOM 0 HE2 PHE A 67 1.294 1.147 6.751 1.00103.95 H new ATOM 0 HZ PHE A 67 0.039 -0.139 8.439 1.00103.95 H new ATOM 1057 N GLU A 68 4.161 -4.015 2.485 1.00 76.40 N ATOM 1058 CA GLU A 68 4.773 -4.582 1.282 1.00 76.40 C ATOM 1059 C GLU A 68 5.296 -5.987 1.543 1.00 76.40 C ATOM 1060 O GLU A 68 4.958 -6.927 0.821 1.00 76.40 O ATOM 1061 CB GLU A 68 5.913 -3.689 0.780 1.00 76.40 C ATOM 1062 CG GLU A 68 6.590 -4.223 -0.474 1.00 76.40 C ATOM 1063 CD GLU A 68 7.781 -3.386 -0.906 1.00 76.40 C ATOM 1064 OE1 GLU A 68 8.155 -2.451 -0.166 1.00 76.40 O ATOM 1065 OE2 GLU A 68 8.343 -3.670 -1.986 1.00 76.40 O ATOM 0 H GLU A 68 4.730 -3.313 2.958 1.00 76.40 H new ATOM 0 HA GLU A 68 4.001 -4.636 0.514 1.00 76.40 H new ATOM 0 HB2 GLU A 68 5.521 -2.692 0.576 1.00 76.40 H new ATOM 0 HB3 GLU A 68 6.657 -3.584 1.569 1.00 76.40 H new ATOM 0 HG2 GLU A 68 6.918 -5.247 -0.295 1.00 76.40 H new ATOM 0 HG3 GLU A 68 5.864 -4.258 -1.286 1.00 76.40 H new ATOM 1072 N ILE A 69 6.111 -6.133 2.583 1.00 33.63 N ATOM 1073 CA ILE A 69 6.653 -7.438 2.926 1.00 33.63 C ATOM 1074 C ILE A 69 5.528 -8.380 3.325 1.00 33.63 C ATOM 1075 O ILE A 69 5.585 -9.582 3.075 1.00 33.63 O ATOM 1076 CB ILE A 69 7.683 -7.349 4.051 1.00 33.63 C ATOM 1077 CG1 ILE A 69 7.055 -6.797 5.334 1.00 33.63 C ATOM 1078 CG2 ILE A 69 8.872 -6.509 3.600 1.00 33.63 C ATOM 1079 CD1 ILE A 69 8.066 -6.483 6.411 1.00 33.63 C ATOM 0 H ILE A 69 6.406 -5.372 3.195 1.00 33.63 H new ATOM 0 HA ILE A 69 7.160 -7.827 2.043 1.00 33.63 H new ATOM 0 HB ILE A 69 8.041 -8.353 4.280 1.00 33.63 H new ATOM 0 HG12 ILE A 69 6.496 -5.892 5.096 1.00 33.63 H new ATOM 0 HG13 ILE A 69 6.338 -7.522 5.720 1.00 33.63 H new ATOM 0 HG21 ILE A 69 9.602 -6.450 4.407 1.00 33.63 H new ATOM 0 HG22 ILE A 69 9.333 -6.970 2.726 1.00 33.63 H new ATOM 0 HG23 ILE A 69 8.532 -5.506 3.344 1.00 33.63 H new ATOM 0 HD11 ILE A 69 7.552 -6.096 7.291 1.00 33.63 H new ATOM 0 HD12 ILE A 69 8.608 -7.391 6.677 1.00 33.63 H new ATOM 0 HD13 ILE A 69 8.769 -5.735 6.043 1.00 33.63 H new ATOM 1091 N SER A 70 4.486 -7.802 3.905 1.00 80.34 N ATOM 1092 CA SER A 70 3.311 -8.556 4.298 1.00 80.34 C ATOM 1093 C SER A 70 2.470 -8.803 3.055 1.00 80.34 C ATOM 1094 O SER A 70 2.381 -7.939 2.182 1.00 80.34 O ATOM 1095 CB SER A 70 2.493 -7.781 5.335 1.00 80.34 C ATOM 1096 OG SER A 70 1.365 -8.527 5.760 1.00 80.34 O ATOM 0 H SER A 70 4.434 -6.805 4.114 1.00 80.34 H new ATOM 0 HA SER A 70 3.614 -9.501 4.748 1.00 80.34 H new ATOM 0 HB2 SER A 70 3.121 -7.545 6.194 1.00 80.34 H new ATOM 0 HB3 SER A 70 2.166 -6.833 4.909 1.00 80.34 H new ATOM 0 HG SER A 70 0.562 -7.968 5.703 1.00 80.34 H new ATOM 1102 N ARG A 71 1.881 -9.983 2.953 1.00144.05 N ATOM 1103 CA ARG A 71 1.084 -10.323 1.783 1.00144.05 C ATOM 1104 C ARG A 71 -0.321 -9.730 1.855 1.00144.05 C ATOM 1105 O ARG A 71 -1.320 -10.446 1.793 1.00144.05 O ATOM 1106 CB ARG A 71 1.033 -11.836 1.610 1.00144.05 C ATOM 1107 CG ARG A 71 2.408 -12.445 1.411 1.00144.05 C ATOM 1108 CD ARG A 71 3.015 -12.018 0.085 1.00144.05 C ATOM 1109 NE ARG A 71 2.202 -12.452 -1.051 1.00144.05 N ATOM 1110 CZ ARG A 71 2.540 -12.270 -2.328 1.00144.05 C ATOM 1111 NH1 ARG A 71 3.690 -11.688 -2.648 1.00144.05 N ATOM 1112 NH2 ARG A 71 1.724 -12.678 -3.289 1.00144.05 N ATOM 0 H ARG A 71 1.938 -10.717 3.659 1.00144.05 H new ATOM 0 HA ARG A 71 1.565 -9.883 0.909 1.00144.05 H new ATOM 0 HB2 ARG A 71 0.565 -12.283 2.487 1.00144.05 H new ATOM 0 HB3 ARG A 71 0.404 -12.079 0.754 1.00144.05 H new ATOM 0 HG2 ARG A 71 3.064 -12.142 2.228 1.00144.05 H new ATOM 0 HG3 ARG A 71 2.335 -13.532 1.447 1.00144.05 H new ATOM 0 HD2 ARG A 71 3.117 -10.933 0.065 1.00144.05 H new ATOM 0 HD3 ARG A 71 4.018 -12.434 -0.006 1.00144.05 H new ATOM 0 HE ARG A 71 1.320 -12.924 -0.854 1.00144.05 H new ATOM 0 HH11 ARG A 71 4.325 -11.375 -1.914 1.00144.05 H new ATOM 0 HH12 ARG A 71 3.938 -11.554 -3.628 1.00144.05 H new ATOM 0 HH21 ARG A 71 0.841 -13.129 -3.051 1.00144.05 H new ATOM 0 HH22 ARG A 71 1.979 -12.541 -4.267 1.00144.05 H new ATOM 1126 N ARG A 72 -0.381 -8.405 1.962 1.00183.66 N ATOM 1127 CA ARG A 72 -1.647 -7.683 2.016 1.00183.66 C ATOM 1128 C ARG A 72 -1.507 -6.345 1.290 1.00183.66 C ATOM 1129 O ARG A 72 -1.508 -5.283 1.916 1.00183.66 O ATOM 1130 CB ARG A 72 -2.084 -7.459 3.466 1.00183.66 C ATOM 1131 CG ARG A 72 -2.731 -8.677 4.102 1.00183.66 C ATOM 1132 CD ARG A 72 -4.006 -9.086 3.380 1.00183.66 C ATOM 1133 NE ARG A 72 -4.973 -7.991 3.311 1.00183.66 N ATOM 1134 CZ ARG A 72 -6.152 -8.076 2.696 1.00183.66 C ATOM 1135 NH1 ARG A 72 -6.518 -9.196 2.082 1.00183.66 N ATOM 1136 NH2 ARG A 72 -6.971 -7.033 2.696 1.00183.66 N ATOM 0 H ARG A 72 0.442 -7.805 2.013 1.00183.66 H new ATOM 0 HA ARG A 72 -2.413 -8.281 1.522 1.00183.66 H new ATOM 0 HB2 ARG A 72 -1.216 -7.169 4.058 1.00183.66 H new ATOM 0 HB3 ARG A 72 -2.786 -6.626 3.500 1.00183.66 H new ATOM 0 HG2 ARG A 72 -2.026 -9.508 4.093 1.00183.66 H new ATOM 0 HG3 ARG A 72 -2.958 -8.463 5.146 1.00183.66 H new ATOM 0 HD2 ARG A 72 -3.761 -9.417 2.371 1.00183.66 H new ATOM 0 HD3 ARG A 72 -4.457 -9.935 3.893 1.00183.66 H new ATOM 0 HE ARG A 72 -4.730 -7.108 3.761 1.00183.66 H new ATOM 0 HH11 ARG A 72 -5.894 -10.003 2.078 1.00183.66 H new ATOM 0 HH12 ARG A 72 -7.423 -9.249 1.615 1.00183.66 H new ATOM 0 HH21 ARG A 72 -6.698 -6.170 3.166 1.00183.66 H new ATOM 0 HH22 ARG A 72 -7.874 -7.094 2.226 1.00183.66 H new ATOM 1150 N PRO A 73 -1.365 -6.378 -0.052 1.00130.67 N ATOM 1151 CA PRO A 73 -1.203 -5.169 -0.864 1.00130.67 C ATOM 1152 C PRO A 73 -2.403 -4.226 -0.798 1.00130.67 C ATOM 1153 O PRO A 73 -2.319 -3.088 -1.254 1.00130.67 O ATOM 1154 CB PRO A 73 -1.024 -5.703 -2.293 1.00130.67 C ATOM 1155 CG PRO A 73 -0.640 -7.132 -2.128 1.00130.67 C ATOM 1156 CD PRO A 73 -1.330 -7.596 -0.883 1.00130.67 C ATOM 0 HA PRO A 73 -0.365 -4.572 -0.506 1.00130.67 H new ATOM 0 HB2 PRO A 73 -1.945 -5.606 -2.868 1.00130.67 H new ATOM 0 HB3 PRO A 73 -0.254 -5.147 -2.828 1.00130.67 H new ATOM 0 HG2 PRO A 73 -0.949 -7.723 -2.990 1.00130.67 H new ATOM 0 HG3 PRO A 73 0.441 -7.239 -2.040 1.00130.67 H new ATOM 0 HD2 PRO A 73 -2.332 -7.971 -1.092 1.00130.67 H new ATOM 0 HD3 PRO A 73 -0.783 -8.403 -0.395 1.00130.67 H new ATOM 1164 N ASP A 74 -3.519 -4.689 -0.236 1.00 56.92 N ATOM 1165 CA ASP A 74 -4.705 -3.847 -0.140 1.00 56.92 C ATOM 1166 C ASP A 74 -4.438 -2.668 0.781 1.00 56.92 C ATOM 1167 O ASP A 74 -4.809 -1.535 0.479 1.00 56.92 O ATOM 1168 CB ASP A 74 -5.894 -4.653 0.383 1.00 56.92 C ATOM 1169 CG ASP A 74 -6.316 -5.756 -0.568 1.00 56.92 C ATOM 1170 OD1 ASP A 74 -5.902 -5.717 -1.745 1.00 56.92 O ATOM 1171 OD2 ASP A 74 -7.061 -6.659 -0.134 1.00 56.92 O ATOM 0 H ASP A 74 -3.624 -5.626 0.153 1.00 56.92 H new ATOM 0 HA ASP A 74 -4.944 -3.475 -1.136 1.00 56.92 H new ATOM 0 HB2 ASP A 74 -5.636 -5.090 1.348 1.00 56.92 H new ATOM 0 HB3 ASP A 74 -6.736 -3.982 0.552 1.00 56.92 H new ATOM 1176 N LEU A 75 -3.773 -2.938 1.894 1.00 72.53 N ATOM 1177 CA LEU A 75 -3.437 -1.890 2.844 1.00 72.53 C ATOM 1178 C LEU A 75 -2.336 -1.014 2.264 1.00 72.53 C ATOM 1179 O LEU A 75 -2.412 0.214 2.305 1.00 72.53 O ATOM 1180 CB LEU A 75 -2.976 -2.498 4.168 1.00 72.53 C ATOM 1181 CG LEU A 75 -4.049 -3.232 4.983 1.00 72.53 C ATOM 1182 CD1 LEU A 75 -4.639 -4.386 4.186 1.00 72.53 C ATOM 1183 CD2 LEU A 75 -3.433 -3.750 6.270 1.00 72.53 C ATOM 0 H LEU A 75 -3.457 -3.870 2.160 1.00 72.53 H new ATOM 0 HA LEU A 75 -4.323 -1.284 3.032 1.00 72.53 H new ATOM 0 HB2 LEU A 75 -2.165 -3.196 3.961 1.00 72.53 H new ATOM 0 HB3 LEU A 75 -2.561 -1.701 4.786 1.00 72.53 H new ATOM 0 HG LEU A 75 -4.854 -2.535 5.215 1.00 72.53 H new ATOM 0 HD11 LEU A 75 -5.397 -4.891 4.784 1.00 72.53 H new ATOM 0 HD12 LEU A 75 -5.094 -4.002 3.273 1.00 72.53 H new ATOM 0 HD13 LEU A 75 -3.849 -5.092 3.929 1.00 72.53 H new ATOM 0 HD21 LEU A 75 -4.192 -4.272 6.852 1.00 72.53 H new ATOM 0 HD22 LEU A 75 -2.620 -4.437 6.034 1.00 72.53 H new ATOM 0 HD23 LEU A 75 -3.043 -2.913 6.850 1.00 72.53 H new ATOM 1195 N LEU A 76 -1.315 -1.668 1.704 1.00 57.08 N ATOM 1196 CA LEU A 76 -0.194 -0.964 1.088 1.00 57.08 C ATOM 1197 C LEU A 76 -0.682 -0.030 -0.003 1.00 57.08 C ATOM 1198 O LEU A 76 -0.265 1.120 -0.085 1.00 57.08 O ATOM 1199 CB LEU A 76 0.798 -1.951 0.478 1.00 57.08 C ATOM 1200 CG LEU A 76 2.021 -1.295 -0.177 1.00 57.08 C ATOM 1201 CD1 LEU A 76 3.272 -1.557 0.632 1.00 57.08 C ATOM 1202 CD2 LEU A 76 2.197 -1.779 -1.610 1.00 57.08 C ATOM 0 H LEU A 76 -1.244 -2.685 1.666 1.00 57.08 H new ATOM 0 HA LEU A 76 0.300 -0.388 1.871 1.00 57.08 H new ATOM 0 HB2 LEU A 76 1.140 -2.633 1.257 1.00 57.08 H new ATOM 0 HB3 LEU A 76 0.280 -2.554 -0.268 1.00 57.08 H new ATOM 0 HG LEU A 76 1.850 -0.219 -0.201 1.00 57.08 H new ATOM 0 HD11 LEU A 76 4.125 -1.082 0.147 1.00 57.08 H new ATOM 0 HD12 LEU A 76 3.150 -1.147 1.634 1.00 57.08 H new ATOM 0 HD13 LEU A 76 3.444 -2.631 0.698 1.00 57.08 H new ATOM 0 HD21 LEU A 76 3.070 -1.299 -2.051 1.00 57.08 H new ATOM 0 HD22 LEU A 76 2.336 -2.860 -1.614 1.00 57.08 H new ATOM 0 HD23 LEU A 76 1.311 -1.525 -2.191 1.00 57.08 H new ATOM 1214 N THR A 77 -1.576 -0.546 -0.845 1.00 38.46 N ATOM 1215 CA THR A 77 -2.139 0.216 -1.942 1.00 38.46 C ATOM 1216 C THR A 77 -2.754 1.516 -1.445 1.00 38.46 C ATOM 1217 O THR A 77 -2.570 2.570 -2.051 1.00 38.46 O ATOM 1218 CB THR A 77 -3.203 -0.621 -2.677 1.00 38.46 C ATOM 1219 OG1 THR A 77 -2.591 -1.749 -3.314 1.00 38.46 O ATOM 1220 CG2 THR A 77 -3.957 0.200 -3.708 1.00 38.46 C ATOM 0 H THR A 77 -1.925 -1.502 -0.780 1.00 38.46 H new ATOM 0 HA THR A 77 -1.333 0.461 -2.634 1.00 38.46 H new ATOM 0 HB THR A 77 -3.920 -0.963 -1.931 1.00 38.46 H new ATOM 0 HG1 THR A 77 -2.719 -2.547 -2.760 1.00 38.46 H new ATOM 0 HG21 THR A 77 -4.697 -0.429 -4.203 1.00 38.46 H new ATOM 0 HG22 THR A 77 -4.459 1.032 -3.214 1.00 38.46 H new ATOM 0 HG23 THR A 77 -3.257 0.587 -4.448 1.00 38.46 H new ATOM 1228 N MET A 78 -3.481 1.439 -0.337 1.00 70.15 N ATOM 1229 CA MET A 78 -4.104 2.623 0.225 1.00 70.15 C ATOM 1230 C MET A 78 -3.031 3.607 0.649 1.00 70.15 C ATOM 1231 O MET A 78 -3.162 4.812 0.445 1.00 70.15 O ATOM 1232 CB MET A 78 -5.000 2.239 1.403 1.00 70.15 C ATOM 1233 CG MET A 78 -6.178 1.378 0.980 1.00 70.15 C ATOM 1234 SD MET A 78 -7.277 0.964 2.347 1.00 70.15 S ATOM 1235 CE MET A 78 -8.447 -0.111 1.518 1.00 70.15 C ATOM 0 H MET A 78 -3.650 0.578 0.183 1.00 70.15 H new ATOM 0 HA MET A 78 -4.731 3.099 -0.529 1.00 70.15 H new ATOM 0 HB2 MET A 78 -4.409 1.702 2.145 1.00 70.15 H new ATOM 0 HB3 MET A 78 -5.370 3.144 1.885 1.00 70.15 H new ATOM 0 HG2 MET A 78 -6.746 1.902 0.211 1.00 70.15 H new ATOM 0 HG3 MET A 78 -5.805 0.458 0.530 1.00 70.15 H new ATOM 0 HE1 MET A 78 -9.459 0.134 1.841 1.00 70.15 H new ATOM 0 HE2 MET A 78 -8.367 0.027 0.440 1.00 70.15 H new ATOM 0 HE3 MET A 78 -8.228 -1.149 1.768 1.00 70.15 H new ATOM 1245 N VAL A 79 -1.954 3.072 1.206 1.00 44.32 N ATOM 1246 CA VAL A 79 -0.833 3.883 1.632 1.00 44.32 C ATOM 1247 C VAL A 79 -0.114 4.452 0.417 1.00 44.32 C ATOM 1248 O VAL A 79 0.240 5.630 0.381 1.00 44.32 O ATOM 1249 CB VAL A 79 0.156 3.041 2.463 1.00 44.32 C ATOM 1250 CG1 VAL A 79 1.237 3.919 3.068 1.00 44.32 C ATOM 1251 CG2 VAL A 79 -0.582 2.245 3.534 1.00 44.32 C ATOM 0 H VAL A 79 -1.837 2.072 1.372 1.00 44.32 H new ATOM 0 HA VAL A 79 -1.211 4.699 2.248 1.00 44.32 H new ATOM 0 HB VAL A 79 0.645 2.329 1.798 1.00 44.32 H new ATOM 0 HG11 VAL A 79 1.923 3.303 3.650 1.00 44.32 H new ATOM 0 HG12 VAL A 79 1.786 4.421 2.271 1.00 44.32 H new ATOM 0 HG13 VAL A 79 0.779 4.665 3.718 1.00 44.32 H new ATOM 0 HG21 VAL A 79 0.134 1.658 4.109 1.00 44.32 H new ATOM 0 HG22 VAL A 79 -1.107 2.930 4.200 1.00 44.32 H new ATOM 0 HG23 VAL A 79 -1.301 1.577 3.060 1.00 44.32 H new ATOM 1261 N VAL A 80 0.085 3.598 -0.578 1.00 90.77 N ATOM 1262 CA VAL A 80 0.747 3.986 -1.813 1.00 90.77 C ATOM 1263 C VAL A 80 -0.076 5.017 -2.582 1.00 90.77 C ATOM 1264 O VAL A 80 0.434 6.068 -2.969 1.00 90.77 O ATOM 1265 CB VAL A 80 0.986 2.748 -2.714 1.00 90.77 C ATOM 1266 CG1 VAL A 80 1.642 3.153 -4.030 1.00 90.77 C ATOM 1267 CG2 VAL A 80 1.825 1.703 -1.981 1.00 90.77 C ATOM 0 H VAL A 80 -0.207 2.621 -0.551 1.00 90.77 H new ATOM 0 HA VAL A 80 1.705 4.431 -1.544 1.00 90.77 H new ATOM 0 HB VAL A 80 0.019 2.302 -2.947 1.00 90.77 H new ATOM 0 HG11 VAL A 80 1.800 2.267 -4.646 1.00 90.77 H new ATOM 0 HG12 VAL A 80 0.995 3.852 -4.559 1.00 90.77 H new ATOM 0 HG13 VAL A 80 2.601 3.629 -3.827 1.00 90.77 H new ATOM 0 HG21 VAL A 80 1.982 0.842 -2.630 1.00 90.77 H new ATOM 0 HG22 VAL A 80 2.789 2.134 -1.711 1.00 90.77 H new ATOM 0 HG23 VAL A 80 1.304 1.386 -1.078 1.00 90.77 H new ATOM 1277 N ASP A 81 -1.349 4.710 -2.810 1.00 37.97 N ATOM 1278 CA ASP A 81 -2.222 5.620 -3.539 1.00 37.97 C ATOM 1279 C ASP A 81 -2.345 6.935 -2.793 1.00 37.97 C ATOM 1280 O ASP A 81 -2.373 8.006 -3.397 1.00 37.97 O ATOM 1281 CB ASP A 81 -3.602 4.999 -3.745 1.00 37.97 C ATOM 1282 CG ASP A 81 -4.449 5.766 -4.744 1.00 37.97 C ATOM 1283 OD1 ASP A 81 -3.891 6.610 -5.474 1.00 37.97 O ATOM 1284 OD2 ASP A 81 -5.671 5.514 -4.798 1.00 37.97 O ATOM 0 H ASP A 81 -1.795 3.846 -2.503 1.00 37.97 H new ATOM 0 HA ASP A 81 -1.782 5.808 -4.518 1.00 37.97 H new ATOM 0 HB2 ASP A 81 -3.485 3.971 -4.088 1.00 37.97 H new ATOM 0 HB3 ASP A 81 -4.124 4.959 -2.789 1.00 37.97 H new ATOM 1289 N TYR A 82 -2.401 6.848 -1.470 1.00130.70 N ATOM 1290 CA TYR A 82 -2.502 8.033 -0.646 1.00130.70 C ATOM 1291 C TYR A 82 -1.271 8.908 -0.817 1.00130.70 C ATOM 1292 O TYR A 82 -1.373 10.131 -0.917 1.00130.70 O ATOM 1293 CB TYR A 82 -2.656 7.617 0.810 1.00130.70 C ATOM 1294 CG TYR A 82 -2.412 8.727 1.803 1.00130.70 C ATOM 1295 CD1 TYR A 82 -1.115 9.105 2.132 1.00130.70 C ATOM 1296 CD2 TYR A 82 -3.459 9.394 2.403 1.00130.70 C ATOM 1297 CE1 TYR A 82 -0.878 10.116 3.035 1.00130.70 C ATOM 1298 CE2 TYR A 82 -3.226 10.394 3.304 1.00130.70 C ATOM 1299 CZ TYR A 82 -1.938 10.757 3.621 1.00130.70 C ATOM 1300 OH TYR A 82 -1.714 11.775 4.514 1.00130.70 O ATOM 0 H TYR A 82 -2.378 5.970 -0.952 1.00130.70 H new ATOM 0 HA TYR A 82 -3.373 8.611 -0.953 1.00130.70 H new ATOM 0 HB2 TYR A 82 -3.663 7.227 0.959 1.00130.70 H new ATOM 0 HB3 TYR A 82 -1.964 6.801 1.018 1.00130.70 H new ATOM 0 HD1 TYR A 82 -0.280 8.597 1.672 1.00130.70 H new ATOM 0 HD2 TYR A 82 -4.475 9.123 2.158 1.00130.70 H new ATOM 0 HE1 TYR A 82 0.134 10.402 3.280 1.00130.70 H new ATOM 0 HE2 TYR A 82 -4.057 10.902 3.770 1.00130.70 H new ATOM 0 HH TYR A 82 -0.878 12.232 4.286 1.00130.70 H new ATOM 1310 N ARG A 83 -0.101 8.274 -0.838 1.00265.02 N ATOM 1311 CA ARG A 83 1.156 8.995 -0.982 1.00265.02 C ATOM 1312 C ARG A 83 1.073 9.949 -2.157 1.00265.02 C ATOM 1313 O ARG A 83 1.364 11.123 -2.020 1.00265.02 O ATOM 1314 CB ARG A 83 2.301 7.984 -1.165 1.00265.02 C ATOM 1315 CG ARG A 83 3.604 8.574 -1.705 1.00265.02 C ATOM 1316 CD ARG A 83 3.903 8.039 -3.100 1.00265.02 C ATOM 1317 NE ARG A 83 5.331 8.071 -3.412 1.00265.02 N ATOM 1318 CZ ARG A 83 5.880 7.452 -4.459 1.00265.02 C ATOM 1319 NH1 ARG A 83 5.128 6.752 -5.303 1.00265.02 N ATOM 1320 NH2 ARG A 83 7.186 7.535 -4.663 1.00265.02 N ATOM 0 H ARG A 83 0.000 7.262 -0.757 1.00265.02 H new ATOM 0 HA ARG A 83 1.352 9.584 -0.086 1.00265.02 H new ATOM 0 HB2 ARG A 83 2.505 7.511 -0.204 1.00265.02 H new ATOM 0 HB3 ARG A 83 1.967 7.198 -1.843 1.00265.02 H new ATOM 0 HG2 ARG A 83 3.531 9.661 -1.735 1.00265.02 H new ATOM 0 HG3 ARG A 83 4.426 8.328 -1.033 1.00265.02 H new ATOM 0 HD2 ARG A 83 3.539 7.015 -3.180 1.00265.02 H new ATOM 0 HD3 ARG A 83 3.359 8.629 -3.837 1.00265.02 H new ATOM 0 HE ARG A 83 5.945 8.599 -2.792 1.00265.02 H new ATOM 0 HH11 ARG A 83 4.121 6.684 -5.153 1.00265.02 H new ATOM 0 HH12 ARG A 83 5.558 6.283 -6.100 1.00265.02 H new ATOM 0 HH21 ARG A 83 7.769 8.071 -4.021 1.00265.02 H new ATOM 0 HH22 ARG A 83 7.608 7.063 -5.462 1.00265.02 H new ATOM 1334 N THR A 84 0.647 9.436 -3.287 1.00259.68 N ATOM 1335 CA THR A 84 0.504 10.235 -4.473 1.00259.68 C ATOM 1336 C THR A 84 -0.706 11.169 -4.406 1.00259.68 C ATOM 1337 O THR A 84 -0.640 12.314 -4.857 1.00259.68 O ATOM 1338 CB THR A 84 0.354 9.334 -5.699 1.00259.68 C ATOM 1339 OG1 THR A 84 1.461 8.426 -5.785 1.00259.68 O ATOM 1340 CG2 THR A 84 0.272 10.177 -6.952 1.00259.68 C ATOM 0 H THR A 84 0.391 8.456 -3.406 1.00259.68 H new ATOM 0 HA THR A 84 1.404 10.845 -4.550 1.00259.68 H new ATOM 0 HB THR A 84 -0.565 8.755 -5.602 1.00259.68 H new ATOM 0 HG1 THR A 84 1.354 7.853 -6.573 1.00259.68 H new ATOM 0 HG21 THR A 84 0.165 9.528 -7.821 1.00259.68 H new ATOM 0 HG22 THR A 84 -0.590 10.842 -6.888 1.00259.68 H new ATOM 0 HG23 THR A 84 1.181 10.770 -7.052 1.00259.68 H new ATOM 1348 N ARG A 85 -1.819 10.661 -3.896 1.00220.68 N ATOM 1349 CA ARG A 85 -3.040 11.450 -3.843 1.00220.68 C ATOM 1350 C ARG A 85 -2.861 12.673 -2.941 1.00220.68 C ATOM 1351 O ARG A 85 -3.217 13.788 -3.318 1.00220.68 O ATOM 1352 CB ARG A 85 -4.234 10.568 -3.402 1.00220.68 C ATOM 1353 CG ARG A 85 -4.532 10.557 -1.907 1.00220.68 C ATOM 1354 CD ARG A 85 -5.267 11.819 -1.485 1.00220.68 C ATOM 1355 NE ARG A 85 -6.445 11.528 -0.670 1.00220.68 N ATOM 1356 CZ ARG A 85 -7.610 11.108 -1.168 1.00220.68 C ATOM 1357 NH1 ARG A 85 -7.762 10.928 -2.475 1.00220.68 N ATOM 1358 NH2 ARG A 85 -8.627 10.864 -0.352 1.00220.68 N ATOM 0 H ARG A 85 -1.902 9.717 -3.517 1.00220.68 H new ATOM 0 HA ARG A 85 -3.261 11.823 -4.843 1.00220.68 H new ATOM 0 HB2 ARG A 85 -5.126 10.907 -3.929 1.00220.68 H new ATOM 0 HB3 ARG A 85 -4.043 9.544 -3.723 1.00220.68 H new ATOM 0 HG2 ARG A 85 -5.134 9.682 -1.660 1.00220.68 H new ATOM 0 HG3 ARG A 85 -3.600 10.471 -1.348 1.00220.68 H new ATOM 0 HD2 ARG A 85 -4.589 12.461 -0.923 1.00220.68 H new ATOM 0 HD3 ARG A 85 -5.570 12.374 -2.373 1.00220.68 H new ATOM 0 HE ARG A 85 -6.372 11.653 0.340 1.00220.68 H new ATOM 0 HH11 ARG A 85 -6.984 11.111 -3.109 1.00220.68 H new ATOM 0 HH12 ARG A 85 -8.657 10.607 -2.845 1.00220.68 H new ATOM 0 HH21 ARG A 85 -8.518 10.997 0.653 1.00220.68 H new ATOM 0 HH22 ARG A 85 -9.518 10.543 -0.730 1.00220.68 H new ATOM 1372 N VAL A 86 -2.282 12.465 -1.766 1.00 63.58 N ATOM 1373 CA VAL A 86 -2.035 13.565 -0.848 1.00 63.58 C ATOM 1374 C VAL A 86 -0.889 14.412 -1.392 1.00 63.58 C ATOM 1375 O VAL A 86 -0.825 15.608 -1.153 1.00 63.58 O ATOM 1376 CB VAL A 86 -1.743 13.067 0.593 1.00 63.58 C ATOM 1377 CG1 VAL A 86 -1.218 14.188 1.485 1.00 63.58 C ATOM 1378 CG2 VAL A 86 -3.010 12.480 1.198 1.00 63.58 C ATOM 0 H VAL A 86 -1.977 11.552 -1.429 1.00 63.58 H new ATOM 0 HA VAL A 86 -2.935 14.176 -0.778 1.00 63.58 H new ATOM 0 HB VAL A 86 -0.970 12.301 0.531 1.00 63.58 H new ATOM 0 HG11 VAL A 86 -1.026 13.798 2.485 1.00 63.58 H new ATOM 0 HG12 VAL A 86 -0.293 14.583 1.066 1.00 63.58 H new ATOM 0 HG13 VAL A 86 -1.960 14.985 1.543 1.00 63.58 H new ATOM 0 HG21 VAL A 86 -2.802 12.131 2.210 1.00 63.58 H new ATOM 0 HG22 VAL A 86 -3.786 13.245 1.230 1.00 63.58 H new ATOM 0 HG23 VAL A 86 -3.350 11.643 0.588 1.00 63.58 H new ATOM 1583 N LEU A 99 18.237 22.659 1.065 1.00281.45 N ATOM 1584 CA LEU A 99 18.813 23.748 1.842 1.00281.45 C ATOM 1585 C LEU A 99 18.182 23.831 3.230 1.00281.45 C ATOM 1586 O LEU A 99 16.960 23.793 3.369 1.00281.45 O ATOM 1587 CB LEU A 99 18.603 25.065 1.102 1.00281.45 C ATOM 1588 CG LEU A 99 19.040 25.073 -0.366 1.00281.45 C ATOM 1589 CD1 LEU A 99 18.963 26.485 -0.934 1.00281.45 C ATOM 1590 CD2 LEU A 99 20.449 24.504 -0.516 1.00281.45 C ATOM 0 HA LEU A 99 19.879 23.556 1.966 1.00281.45 H new ATOM 0 HB2 LEU A 99 17.545 25.324 1.150 1.00281.45 H new ATOM 0 HB3 LEU A 99 19.147 25.849 1.629 1.00281.45 H new ATOM 0 HG LEU A 99 18.359 24.437 -0.931 1.00281.45 H new ATOM 0 HD11 LEU A 99 19.277 26.475 -1.978 1.00281.45 H new ATOM 0 HD12 LEU A 99 17.938 26.849 -0.867 1.00281.45 H new ATOM 0 HD13 LEU A 99 19.620 27.143 -0.364 1.00281.45 H new ATOM 0 HD21 LEU A 99 20.738 24.520 -1.567 1.00281.45 H new ATOM 0 HD22 LEU A 99 21.149 25.108 0.062 1.00281.45 H new ATOM 0 HD23 LEU A 99 20.468 23.477 -0.150 1.00281.45 H new ATOM 1602 N THR A 100 19.022 23.939 4.259 1.00235.89 N ATOM 1603 CA THR A 100 18.534 24.019 5.632 1.00235.89 C ATOM 1604 C THR A 100 18.453 25.466 6.142 1.00235.89 C ATOM 1605 O THR A 100 17.465 26.156 5.895 1.00235.89 O ATOM 1606 CB THR A 100 19.392 23.160 6.584 1.00235.89 C ATOM 1607 OG1 THR A 100 20.750 23.618 6.569 1.00235.89 O ATOM 1608 CG2 THR A 100 19.348 21.701 6.180 1.00235.89 C ATOM 0 H THR A 100 20.037 23.973 4.167 1.00235.89 H new ATOM 0 HA THR A 100 17.520 23.619 5.622 1.00235.89 H new ATOM 0 HB THR A 100 18.984 23.258 7.590 1.00235.89 H new ATOM 0 HG1 THR A 100 21.287 23.069 7.177 1.00235.89 H new ATOM 0 HG21 THR A 100 19.960 21.115 6.866 1.00235.89 H new ATOM 0 HG22 THR A 100 18.319 21.344 6.217 1.00235.89 H new ATOM 0 HG23 THR A 100 19.733 21.592 5.166 1.00235.89 H new ATOM 1616 N ARG A 101 19.481 25.924 6.867 1.00326.00 N ATOM 1617 CA ARG A 101 19.491 27.272 7.408 1.00326.00 C ATOM 1618 C ARG A 101 20.173 28.239 6.453 1.00326.00 C ATOM 1619 O ARG A 101 21.388 28.434 6.506 1.00326.00 O ATOM 1620 CB ARG A 101 20.183 27.267 8.765 1.00326.00 C ATOM 1621 CG ARG A 101 19.532 26.306 9.744 1.00326.00 C ATOM 1622 CD ARG A 101 20.137 24.916 9.659 1.00326.00 C ATOM 1623 NE ARG A 101 20.532 24.421 10.977 1.00326.00 N ATOM 1624 CZ ARG A 101 21.201 23.289 11.184 1.00326.00 C ATOM 1625 NH1 ARG A 101 21.554 22.514 10.164 1.00326.00 N ATOM 1626 NH2 ARG A 101 21.511 22.927 12.420 1.00326.00 N ATOM 0 H ARG A 101 20.312 25.375 7.088 1.00326.00 H new ATOM 0 HA ARG A 101 18.463 27.611 7.534 1.00326.00 H new ATOM 0 HB2 ARG A 101 21.230 26.994 8.635 1.00326.00 H new ATOM 0 HB3 ARG A 101 20.165 28.274 9.182 1.00326.00 H new ATOM 0 HG2 ARG A 101 19.644 26.689 10.758 1.00326.00 H new ATOM 0 HG3 ARG A 101 18.463 26.250 9.541 1.00326.00 H new ATOM 0 HD2 ARG A 101 19.416 24.231 9.213 1.00326.00 H new ATOM 0 HD3 ARG A 101 21.006 24.936 9.001 1.00326.00 H new ATOM 0 HE ARG A 101 20.278 24.980 11.792 1.00326.00 H new ATOM 0 HH11 ARG A 101 21.313 22.784 9.211 1.00326.00 H new ATOM 0 HH12 ARG A 101 22.066 21.649 10.334 1.00326.00 H new ATOM 0 HH21 ARG A 101 21.237 23.515 13.207 1.00326.00 H new ATOM 0 HH22 ARG A 101 22.024 22.061 12.584 1.00326.00 H new ATOM 1640 N ILE A 102 19.381 28.831 5.568 1.00164.55 N ATOM 1641 CA ILE A 102 19.896 29.766 4.583 1.00164.55 C ATOM 1642 C ILE A 102 19.019 31.019 4.538 1.00164.55 C ATOM 1643 O ILE A 102 18.371 31.303 3.536 1.00164.55 O ATOM 1644 CB ILE A 102 19.964 29.112 3.183 1.00164.55 C ATOM 1645 CG1 ILE A 102 20.783 27.814 3.241 1.00164.55 C ATOM 1646 CG2 ILE A 102 20.575 30.069 2.163 1.00164.55 C ATOM 1647 CD1 ILE A 102 20.080 26.660 3.927 1.00164.55 C ATOM 0 H ILE A 102 18.374 28.677 5.515 1.00164.55 H new ATOM 0 HA ILE A 102 20.907 30.049 4.876 1.00164.55 H new ATOM 0 HB ILE A 102 18.947 28.878 2.869 1.00164.55 H new ATOM 0 HG12 ILE A 102 21.039 27.515 2.225 1.00164.55 H new ATOM 0 HG13 ILE A 102 21.720 28.013 3.761 1.00164.55 H new ATOM 0 HG21 ILE A 102 20.612 29.585 1.187 1.00164.55 H new ATOM 0 HG22 ILE A 102 19.965 30.970 2.099 1.00164.55 H new ATOM 0 HG23 ILE A 102 21.585 30.336 2.474 1.00164.55 H new ATOM 0 HD11 ILE A 102 20.729 25.784 3.923 1.00164.55 H new ATOM 0 HD12 ILE A 102 19.848 26.935 4.956 1.00164.55 H new ATOM 0 HD13 ILE A 102 19.156 26.429 3.396 1.00164.55 H new ATOM 1659 N PRO A 103 18.984 31.789 5.643 1.00 72.69 N ATOM 1660 CA PRO A 103 18.177 33.010 5.731 1.00 72.69 C ATOM 1661 C PRO A 103 18.406 33.951 4.550 1.00 72.69 C ATOM 1662 O PRO A 103 17.538 34.759 4.211 1.00 72.69 O ATOM 1663 CB PRO A 103 18.671 33.658 7.022 1.00 72.69 C ATOM 1664 CG PRO A 103 19.155 32.526 7.858 1.00 72.69 C ATOM 1665 CD PRO A 103 19.718 31.520 6.897 1.00 72.69 C ATOM 0 HA PRO A 103 17.109 32.793 5.718 1.00 72.69 H new ATOM 0 HB2 PRO A 103 19.470 34.373 6.825 1.00 72.69 H new ATOM 0 HB3 PRO A 103 17.871 34.204 7.521 1.00 72.69 H new ATOM 0 HG2 PRO A 103 19.915 32.859 8.565 1.00 72.69 H new ATOM 0 HG3 PRO A 103 18.342 32.096 8.443 1.00 72.69 H new ATOM 0 HD2 PRO A 103 20.793 31.647 6.768 1.00 72.69 H new ATOM 0 HD3 PRO A 103 19.557 30.500 7.245 1.00 72.69 H new ATOM 1673 N SER A 104 19.573 33.840 3.920 1.00159.85 N ATOM 1674 CA SER A 104 19.904 34.682 2.772 1.00159.85 C ATOM 1675 C SER A 104 19.262 34.157 1.481 1.00159.85 C ATOM 1676 O SER A 104 19.358 34.794 0.431 1.00159.85 O ATOM 1677 CB SER A 104 21.422 34.770 2.602 1.00159.85 C ATOM 1678 OG SER A 104 22.017 35.456 3.690 1.00159.85 O ATOM 0 H SER A 104 20.303 33.178 4.183 1.00159.85 H new ATOM 0 HA SER A 104 19.503 35.677 2.965 1.00159.85 H new ATOM 0 HB2 SER A 104 21.842 33.767 2.527 1.00159.85 H new ATOM 0 HB3 SER A 104 21.658 35.285 1.671 1.00159.85 H new ATOM 0 HG SER A 104 22.987 35.498 3.559 1.00159.85 H new ATOM 1684 N ALA A 105 18.596 33.007 1.563 1.00293.58 N ATOM 1685 CA ALA A 105 17.930 32.417 0.413 1.00293.58 C ATOM 1686 C ALA A 105 16.630 31.766 0.855 1.00293.58 C ATOM 1687 O ALA A 105 15.540 32.229 0.518 1.00293.58 O ATOM 1688 CB ALA A 105 18.834 31.397 -0.255 1.00293.58 C ATOM 0 H ALA A 105 18.505 32.465 2.422 1.00293.58 H new ATOM 0 HA ALA A 105 17.706 33.201 -0.311 1.00293.58 H new ATOM 0 HB1 ALA A 105 18.322 30.964 -1.114 1.00293.58 H new ATOM 0 HB2 ALA A 105 19.750 31.885 -0.587 1.00293.58 H new ATOM 0 HB3 ALA A 105 19.080 30.608 0.456 1.00293.58 H new ATOM 1694 N LYS A 106 16.762 30.706 1.642 1.00328.40 N ATOM 1695 CA LYS A 106 15.613 29.995 2.176 1.00328.40 C ATOM 1696 C LYS A 106 15.175 30.643 3.477 1.00328.40 C ATOM 1697 O LYS A 106 16.011 31.064 4.279 1.00328.40 O ATOM 1698 CB LYS A 106 15.960 28.527 2.416 1.00328.40 C ATOM 1699 CG LYS A 106 16.586 27.855 1.207 1.00328.40 C ATOM 1700 CD LYS A 106 15.674 26.788 0.620 1.00328.40 C ATOM 1701 CE LYS A 106 14.452 27.405 -0.035 1.00328.40 C ATOM 1702 NZ LYS A 106 14.788 28.041 -1.338 1.00328.40 N ATOM 0 H LYS A 106 17.662 30.319 1.925 1.00328.40 H new ATOM 0 HA LYS A 106 14.798 30.045 1.454 1.00328.40 H new ATOM 0 HB2 LYS A 106 16.647 28.456 3.259 1.00328.40 H new ATOM 0 HB3 LYS A 106 15.055 27.987 2.696 1.00328.40 H new ATOM 0 HG2 LYS A 106 16.805 28.605 0.447 1.00328.40 H new ATOM 0 HG3 LYS A 106 17.536 27.404 1.493 1.00328.40 H new ATOM 0 HD2 LYS A 106 16.225 26.200 -0.114 1.00328.40 H new ATOM 0 HD3 LYS A 106 15.360 26.102 1.407 1.00328.40 H new ATOM 0 HE2 LYS A 106 13.695 26.636 -0.190 1.00328.40 H new ATOM 0 HE3 LYS A 106 14.018 28.150 0.632 1.00328.40 H new ATOM 0 HZ1 LYS A 106 13.914 28.346 -1.811 1.00328.40 H new ATOM 0 HZ2 LYS A 106 15.399 28.866 -1.174 1.00328.40 H new ATOM 0 HZ3 LYS A 106 15.286 27.355 -1.941 1.00328.40 H new ATOM 1716 N LYS A 107 13.872 30.733 3.689 1.00281.61 N ATOM 1717 CA LYS A 107 13.360 31.345 4.902 1.00281.61 C ATOM 1718 C LYS A 107 13.022 30.300 5.954 1.00281.61 C ATOM 1719 O LYS A 107 12.506 29.225 5.650 1.00281.61 O ATOM 1720 CB LYS A 107 12.138 32.207 4.602 1.00281.61 C ATOM 1721 CG LYS A 107 12.432 33.346 3.638 1.00281.61 C ATOM 1722 CD LYS A 107 11.218 34.240 3.444 1.00281.61 C ATOM 1723 CE LYS A 107 10.938 35.077 4.683 1.00281.61 C ATOM 1724 NZ LYS A 107 9.485 35.129 5.001 1.00281.61 N ATOM 0 H LYS A 107 13.158 30.394 3.045 1.00281.61 H new ATOM 0 HA LYS A 107 14.148 31.983 5.302 1.00281.61 H new ATOM 0 HB2 LYS A 107 11.352 31.579 4.183 1.00281.61 H new ATOM 0 HB3 LYS A 107 11.754 32.619 5.535 1.00281.61 H new ATOM 0 HG2 LYS A 107 13.265 33.939 4.017 1.00281.61 H new ATOM 0 HG3 LYS A 107 12.742 32.939 2.676 1.00281.61 H new ATOM 0 HD2 LYS A 107 11.381 34.897 2.589 1.00281.61 H new ATOM 0 HD3 LYS A 107 10.347 33.627 3.213 1.00281.61 H new ATOM 0 HE2 LYS A 107 11.481 34.662 5.532 1.00281.61 H new ATOM 0 HE3 LYS A 107 11.313 36.089 4.530 1.00281.61 H new ATOM 0 HZ1 LYS A 107 9.336 35.709 5.852 1.00281.61 H new ATOM 0 HZ2 LYS A 107 8.969 35.549 4.201 1.00281.61 H new ATOM 0 HZ3 LYS A 107 9.133 34.166 5.173 1.00281.61 H new ATOM 1738 N TYR A 108 13.321 30.649 7.196 1.00309.62 N ATOM 1739 CA TYR A 108 13.069 29.788 8.347 1.00309.62 C ATOM 1740 C TYR A 108 11.648 29.242 8.352 1.00309.62 C ATOM 1741 O TYR A 108 10.699 29.939 7.987 1.00309.62 O ATOM 1742 CB TYR A 108 13.285 30.604 9.617 1.00309.62 C ATOM 1743 CG TYR A 108 12.339 31.782 9.696 1.00309.62 C ATOM 1744 CD1 TYR A 108 12.650 32.984 9.077 1.00309.62 C ATOM 1745 CD2 TYR A 108 11.127 31.680 10.368 1.00309.62 C ATOM 1746 CE1 TYR A 108 11.782 34.056 9.128 1.00309.62 C ATOM 1747 CE2 TYR A 108 10.252 32.747 10.424 1.00309.62 C ATOM 1748 CZ TYR A 108 10.585 33.933 9.803 1.00309.62 C ATOM 1749 OH TYR A 108 9.718 34.998 9.855 1.00309.62 O ATOM 0 H TYR A 108 13.748 31.543 7.438 1.00309.62 H new ATOM 0 HA TYR A 108 13.753 28.941 8.295 1.00309.62 H new ATOM 0 HB2 TYR A 108 13.143 29.965 10.488 1.00309.62 H new ATOM 0 HB3 TYR A 108 14.314 30.962 9.649 1.00309.62 H new ATOM 0 HD1 TYR A 108 13.586 33.082 8.547 1.00309.62 H new ATOM 0 HD2 TYR A 108 10.865 30.752 10.854 1.00309.62 H new ATOM 0 HE1 TYR A 108 12.038 34.986 8.642 1.00309.62 H new ATOM 0 HE2 TYR A 108 9.314 32.654 10.950 1.00309.62 H new ATOM 0 HH TYR A 108 9.820 35.542 9.046 1.00309.62 H new ATOM 1759 N LYS A 109 11.513 28.009 8.808 1.00276.51 N ATOM 1760 CA LYS A 109 10.202 27.372 8.914 1.00276.51 C ATOM 1761 C LYS A 109 9.733 27.312 10.359 1.00276.51 C ATOM 1762 O LYS A 109 8.835 26.540 10.695 1.00276.51 O ATOM 1763 CB LYS A 109 10.165 25.972 8.268 1.00276.51 C ATOM 1764 CG LYS A 109 11.502 25.235 8.217 1.00276.51 C ATOM 1765 CD LYS A 109 11.919 24.921 6.786 1.00276.51 C ATOM 1766 CE LYS A 109 12.399 26.166 6.050 1.00276.51 C ATOM 1767 NZ LYS A 109 13.784 26.004 5.525 1.00276.51 N ATOM 0 H LYS A 109 12.292 27.425 9.112 1.00276.51 H new ATOM 0 HA LYS A 109 9.510 27.999 8.351 1.00276.51 H new ATOM 0 HB2 LYS A 109 9.452 25.357 8.816 1.00276.51 H new ATOM 0 HB3 LYS A 109 9.785 26.070 7.251 1.00276.51 H new ATOM 0 HG2 LYS A 109 12.271 25.842 8.695 1.00276.51 H new ATOM 0 HG3 LYS A 109 11.428 24.308 8.786 1.00276.51 H new ATOM 0 HD2 LYS A 109 12.714 24.175 6.794 1.00276.51 H new ATOM 0 HD3 LYS A 109 11.077 24.484 6.250 1.00276.51 H new ATOM 0 HE2 LYS A 109 11.721 26.383 5.224 1.00276.51 H new ATOM 0 HE3 LYS A 109 12.364 27.022 6.724 1.00276.51 H new ATOM 0 HZ1 LYS A 109 14.072 26.873 5.031 1.00276.51 H new ATOM 0 HZ2 LYS A 109 14.436 25.822 6.315 1.00276.51 H new ATOM 0 HZ3 LYS A 109 13.812 25.204 4.862 1.00276.51 H new ATOM 1781 N ASP A 110 10.311 28.159 11.212 1.00203.92 N ATOM 1782 CA ASP A 110 9.909 28.223 12.612 1.00203.92 C ATOM 1783 C ASP A 110 8.418 28.537 12.692 1.00203.92 C ATOM 1784 O ASP A 110 7.711 28.064 13.581 1.00203.92 O ATOM 1785 CB ASP A 110 10.711 29.297 13.348 1.00203.92 C ATOM 1786 CG ASP A 110 12.178 28.937 13.483 1.00203.92 C ATOM 1787 OD1 ASP A 110 12.518 27.747 13.307 1.00203.92 O ATOM 1788 OD2 ASP A 110 12.987 29.845 13.766 1.00203.92 O ATOM 0 H ASP A 110 11.056 28.807 10.956 1.00203.92 H new ATOM 0 HA ASP A 110 10.106 27.262 13.086 1.00203.92 H new ATOM 0 HB2 ASP A 110 10.620 30.243 12.814 1.00203.92 H new ATOM 0 HB3 ASP A 110 10.285 29.448 14.340 1.00203.92 H new ATOM 1793 N ILE A 111 7.951 29.317 11.719 1.00 50.97 N ATOM 1794 CA ILE A 111 6.557 29.681 11.619 1.00 50.97 C ATOM 1795 C ILE A 111 5.815 28.608 10.822 1.00 50.97 C ATOM 1796 O ILE A 111 6.359 28.052 9.870 1.00 50.97 O ATOM 1797 CB ILE A 111 6.418 31.080 10.964 1.00 50.97 C ATOM 1798 CG1 ILE A 111 6.924 32.155 11.926 1.00 50.97 C ATOM 1799 CG2 ILE A 111 4.985 31.367 10.547 1.00 50.97 C ATOM 1800 CD1 ILE A 111 7.010 33.532 11.304 1.00 50.97 C ATOM 0 H ILE A 111 8.537 29.710 10.982 1.00 50.97 H new ATOM 0 HA ILE A 111 6.113 29.740 12.613 1.00 50.97 H new ATOM 0 HB ILE A 111 7.026 31.092 10.059 1.00 50.97 H new ATOM 0 HG12 ILE A 111 6.263 32.197 12.791 1.00 50.97 H new ATOM 0 HG13 ILE A 111 7.910 31.868 12.292 1.00 50.97 H new ATOM 0 HG21 ILE A 111 4.929 32.356 10.093 1.00 50.97 H new ATOM 0 HG22 ILE A 111 4.659 30.618 9.826 1.00 50.97 H new ATOM 0 HG23 ILE A 111 4.337 31.333 11.423 1.00 50.97 H new ATOM 0 HD11 ILE A 111 7.376 34.243 12.044 1.00 50.97 H new ATOM 0 HD12 ILE A 111 7.694 33.506 10.456 1.00 50.97 H new ATOM 0 HD13 ILE A 111 6.021 33.840 10.963 1.00 50.97 H new ATOM 1812 N ILE A 112 4.582 28.312 11.214 1.00108.96 N ATOM 1813 CA ILE A 112 3.798 27.295 10.527 1.00108.96 C ATOM 1814 C ILE A 112 3.040 27.908 9.357 1.00108.96 C ATOM 1815 O ILE A 112 2.138 28.726 9.548 1.00108.96 O ATOM 1816 CB ILE A 112 2.788 26.622 11.485 1.00108.96 C ATOM 1817 CG1 ILE A 112 3.489 26.109 12.752 1.00108.96 C ATOM 1818 CG2 ILE A 112 2.062 25.484 10.780 1.00108.96 C ATOM 1819 CD1 ILE A 112 4.717 25.262 12.482 1.00108.96 C ATOM 0 H ILE A 112 4.107 28.758 11.998 1.00108.96 H new ATOM 0 HA ILE A 112 4.493 26.540 10.160 1.00108.96 H new ATOM 0 HB ILE A 112 2.054 27.371 11.784 1.00108.96 H new ATOM 0 HG12 ILE A 112 3.778 26.963 13.365 1.00108.96 H new ATOM 0 HG13 ILE A 112 2.778 25.523 13.335 1.00108.96 H new ATOM 0 HG21 ILE A 112 1.355 25.021 11.469 1.00108.96 H new ATOM 0 HG22 ILE A 112 1.524 25.875 9.916 1.00108.96 H new ATOM 0 HG23 ILE A 112 2.786 24.740 10.450 1.00108.96 H new ATOM 0 HD11 ILE A 112 5.152 24.940 13.428 1.00108.96 H new ATOM 0 HD12 ILE A 112 4.434 24.387 11.897 1.00108.96 H new ATOM 0 HD13 ILE A 112 5.449 25.849 11.927 1.00108.96 H new