USER MOD reduce.3.24.130724 H: found=0, std=0, add=1188, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1189 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 40 ASN :FLIP amide:sc= -7.34! C(o=-13!,f=-10!) USER MOD Set 1.2: B 40 ASN : amide:sc= -3.01! C(o=-10!,f=-13!) USER MOD Set 2.1: A 21 ASN : amide:sc= -0.33 K(o=-0.94,f=-1.7!) USER MOD Set 2.2: A 65 ASN :FLIP amide:sc= -0.613 F(o=-2.7,f=-0.94) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot -140:sc= -1.72! USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot -82:sc= 0.427 USER MOD Single : A 23 MET CE :methyl -167:sc=-0.00592 (180deg=-0.241) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot 85:sc= 0.961 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 30 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 38 MET CE :methyl -141:sc= -1.11 (180deg=-2.4) USER MOD Single : A 42 SER OG : rot -82:sc= 1.2 USER MOD Single : A 45 SER OG : rot 75:sc= 1.27 USER MOD Single : A 49 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.074) USER MOD Single : A 52 GLN : amide:sc= -1.27 K(o=-1.3,f=-3.5!) USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 90:sc= 1.29 USER MOD Single : A 59 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0366) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 GLN :FLIP amide:sc= -0.167 F(o=-1.4!,f=-0.17) USER MOD Single : A 70 LYS NZ :NH3+ -179:sc= 1.12 (180deg=1.04) USER MOD Single : A 73 GLN : amide:sc= 1.13 K(o=1.1,f=-0.05) USER MOD Single : A 74 MET CE :methyl -165:sc= -2.24 (180deg=-2.57) USER MOD Single : A 78 THR OG1 : rot -6:sc= 0.214 USER MOD Single : A 83 THR OG1 : rot 68:sc= 0.0323 USER MOD Single : A 84 MET CE :methyl -151:sc= -0.213 (180deg=-0.981) USER MOD Single : B 11 SER OG : rot 180:sc= 0 USER MOD Single : B 13 THR OG1 : rot 180:sc= -0.0669 USER MOD Single : B 14 TYR OH : rot 180:sc= 0 USER MOD Single : B 16 THR OG1 : rot 81:sc= 1.21 USER MOD Single : B 21 ASN :FLIP amide:sc= -0.796 F(o=-1.3!,f=-0.8) USER MOD Single : B 23 MET CE :methyl -167:sc= -0.0383 (180deg=-0.284) USER MOD Single : B 25 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0192) USER MOD Single : B 26 THR OG1 : rot 180:sc= 0 USER MOD Single : B 28 SER OG : rot 180:sc= 0 USER MOD Single : B 30 GLN : amide:sc= 0.0201 K(o=0.02,f=-1.1) USER MOD Single : B 38 MET CE :methyl -147:sc= -1.4 (180deg=-2.46) USER MOD Single : B 42 SER OG : rot 180:sc= 0 USER MOD Single : B 45 SER OG : rot -110:sc= 0.39 USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 52 GLN : amide:sc= -1.52! C(o=-1.5!,f=-2.5!) USER MOD Single : B 53 SER OG : rot 170:sc= -0.0607 USER MOD Single : B 57 SER OG : rot -143:sc= -0.0578 USER MOD Single : B 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 63 LYS NZ :NH3+ -166:sc= 0.464 (180deg=0.401) USER MOD Single : B 65 ASN : amide:sc= 0.578 K(o=0.58,f=-0.27) USER MOD Single : B 66 GLN :FLIP amide:sc= -0.0824 F(o=-0.9,f=-0.082) USER MOD Single : B 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 73 GLN : amide:sc= -0.0454 K(o=-0.045,f=-0.59) USER MOD Single : B 74 MET CE :methyl -134:sc= -0.482 (180deg=-0.801) USER MOD Single : B 78 THR OG1 : rot 180:sc= 0 USER MOD Single : B 83 THR OG1 : rot 76:sc= 1.29 USER MOD Single : B 84 MET CE :methyl 152:sc= -5.88! (180deg=-7.28!) USER MOD ----------------------------------------------------------------- ATOM 41 N PRO A 10 16.862 -8.135 -3.858 1.00 0.00 N ATOM 42 CA PRO A 10 16.989 -7.793 -2.436 1.00 0.00 C ATOM 43 C PRO A 10 16.160 -8.745 -1.565 1.00 0.00 C ATOM 44 O PRO A 10 15.187 -9.326 -2.040 1.00 0.00 O ATOM 45 CB PRO A 10 16.437 -6.355 -2.348 1.00 0.00 C ATOM 46 CG PRO A 10 15.863 -6.053 -3.698 1.00 0.00 C ATOM 47 CD PRO A 10 16.553 -6.957 -4.671 1.00 0.00 C ATOM 0 HA PRO A 10 18.015 -7.875 -2.078 1.00 0.00 H new ATOM 0 HB2 PRO A 10 15.675 -6.276 -1.573 1.00 0.00 H new ATOM 0 HB3 PRO A 10 17.227 -5.648 -2.092 1.00 0.00 H new ATOM 0 HG2 PRO A 10 14.786 -6.224 -3.708 1.00 0.00 H new ATOM 0 HG3 PRO A 10 16.022 -5.007 -3.961 1.00 0.00 H new ATOM 0 HD2 PRO A 10 15.912 -7.206 -5.516 1.00 0.00 H new ATOM 0 HD3 PRO A 10 17.454 -6.499 -5.079 1.00 0.00 H new ATOM 55 N SER A 11 16.536 -8.880 -0.296 1.00 0.00 N ATOM 56 CA SER A 11 15.905 -9.842 0.623 1.00 0.00 C ATOM 57 C SER A 11 14.371 -9.838 0.549 1.00 0.00 C ATOM 58 O SER A 11 13.765 -10.845 0.210 1.00 0.00 O ATOM 59 CB SER A 11 16.358 -9.564 2.050 1.00 0.00 C ATOM 60 OG SER A 11 16.260 -8.177 2.350 1.00 0.00 O ATOM 0 H SER A 11 17.283 -8.331 0.130 1.00 0.00 H new ATOM 0 HA SER A 11 16.228 -10.835 0.309 1.00 0.00 H new ATOM 0 HB2 SER A 11 15.747 -10.136 2.748 1.00 0.00 H new ATOM 0 HB3 SER A 11 17.388 -9.897 2.181 1.00 0.00 H new ATOM 0 HG SER A 11 16.554 -8.020 3.272 1.00 0.00 H new ATOM 66 N GLU A 12 13.766 -8.693 0.834 1.00 0.00 N ATOM 67 CA GLU A 12 12.306 -8.547 0.835 1.00 0.00 C ATOM 68 C GLU A 12 11.701 -8.906 -0.526 1.00 0.00 C ATOM 69 O GLU A 12 10.642 -9.526 -0.606 1.00 0.00 O ATOM 70 CB GLU A 12 11.936 -7.106 1.208 1.00 0.00 C ATOM 71 CG GLU A 12 12.449 -6.677 2.577 1.00 0.00 C ATOM 72 CD GLU A 12 12.311 -5.188 2.819 1.00 0.00 C ATOM 73 OE1 GLU A 12 11.240 -4.749 3.273 1.00 0.00 O ATOM 74 OE2 GLU A 12 13.288 -4.444 2.557 1.00 0.00 O ATOM 0 H GLU A 12 14.267 -7.837 1.071 1.00 0.00 H new ATOM 0 HA GLU A 12 11.897 -9.238 1.572 1.00 0.00 H new ATOM 0 HB2 GLU A 12 12.336 -6.430 0.452 1.00 0.00 H new ATOM 0 HB3 GLU A 12 10.851 -7.002 1.187 1.00 0.00 H new ATOM 0 HG2 GLU A 12 11.903 -7.218 3.350 1.00 0.00 H new ATOM 0 HG3 GLU A 12 13.498 -6.960 2.671 1.00 0.00 H new ATOM 81 N THR A 13 12.390 -8.527 -1.582 1.00 0.00 N ATOM 82 CA THR A 13 11.929 -8.763 -2.938 1.00 0.00 C ATOM 83 C THR A 13 12.153 -10.229 -3.364 1.00 0.00 C ATOM 84 O THR A 13 11.614 -10.688 -4.373 1.00 0.00 O ATOM 85 CB THR A 13 12.672 -7.820 -3.903 1.00 0.00 C ATOM 86 OG1 THR A 13 12.736 -6.509 -3.316 1.00 0.00 O ATOM 87 CG2 THR A 13 11.956 -7.724 -5.239 1.00 0.00 C ATOM 0 H THR A 13 13.287 -8.046 -1.526 1.00 0.00 H new ATOM 0 HA THR A 13 10.858 -8.564 -2.974 1.00 0.00 H new ATOM 0 HB THR A 13 13.672 -8.219 -4.074 1.00 0.00 H new ATOM 0 HG1 THR A 13 12.587 -5.833 -4.009 1.00 0.00 H new ATOM 0 HG21 THR A 13 12.505 -7.051 -5.898 1.00 0.00 H new ATOM 0 HG22 THR A 13 11.901 -8.713 -5.694 1.00 0.00 H new ATOM 0 HG23 THR A 13 10.948 -7.339 -5.085 1.00 0.00 H new ATOM 95 N TYR A 14 12.921 -10.956 -2.574 1.00 0.00 N ATOM 96 CA TYR A 14 13.245 -12.332 -2.862 1.00 0.00 C ATOM 97 C TYR A 14 12.446 -13.266 -1.936 1.00 0.00 C ATOM 98 O TYR A 14 12.609 -14.491 -1.951 1.00 0.00 O ATOM 99 CB TYR A 14 14.759 -12.531 -2.675 1.00 0.00 C ATOM 100 CG TYR A 14 15.240 -13.927 -2.950 1.00 0.00 C ATOM 101 CD1 TYR A 14 15.250 -14.430 -4.236 1.00 0.00 C ATOM 102 CD2 TYR A 14 15.679 -14.738 -1.919 1.00 0.00 C ATOM 103 CE1 TYR A 14 15.685 -15.708 -4.493 1.00 0.00 C ATOM 104 CE2 TYR A 14 16.115 -16.019 -2.163 1.00 0.00 C ATOM 105 CZ TYR A 14 16.117 -16.503 -3.455 1.00 0.00 C ATOM 106 OH TYR A 14 16.559 -17.784 -3.713 1.00 0.00 O ATOM 0 H TYR A 14 13.337 -10.603 -1.712 1.00 0.00 H new ATOM 0 HA TYR A 14 12.977 -12.574 -3.890 1.00 0.00 H new ATOM 0 HB2 TYR A 14 15.288 -11.841 -3.333 1.00 0.00 H new ATOM 0 HB3 TYR A 14 15.025 -12.263 -1.652 1.00 0.00 H new ATOM 0 HD1 TYR A 14 14.911 -13.810 -5.052 1.00 0.00 H new ATOM 0 HD2 TYR A 14 15.679 -14.359 -0.908 1.00 0.00 H new ATOM 0 HE1 TYR A 14 15.688 -16.087 -5.504 1.00 0.00 H new ATOM 0 HE2 TYR A 14 16.454 -16.642 -1.349 1.00 0.00 H new ATOM 0 HH TYR A 14 16.830 -18.212 -2.874 1.00 0.00 H new ATOM 116 N ILE A 15 11.556 -12.684 -1.166 1.00 0.00 N ATOM 117 CA ILE A 15 10.765 -13.432 -0.212 1.00 0.00 C ATOM 118 C ILE A 15 9.408 -13.816 -0.811 1.00 0.00 C ATOM 119 O ILE A 15 8.893 -13.128 -1.694 1.00 0.00 O ATOM 120 CB ILE A 15 10.609 -12.619 1.112 1.00 0.00 C ATOM 121 CG1 ILE A 15 11.950 -12.566 1.843 1.00 0.00 C ATOM 122 CG2 ILE A 15 9.538 -13.183 2.024 1.00 0.00 C ATOM 123 CD1 ILE A 15 12.593 -13.928 2.026 1.00 0.00 C ATOM 0 H ILE A 15 11.359 -11.683 -1.182 1.00 0.00 H new ATOM 0 HA ILE A 15 11.283 -14.361 0.027 1.00 0.00 H new ATOM 0 HB ILE A 15 10.291 -11.612 0.840 1.00 0.00 H new ATOM 0 HG12 ILE A 15 12.632 -11.922 1.288 1.00 0.00 H new ATOM 0 HG13 ILE A 15 11.804 -12.107 2.821 1.00 0.00 H new ATOM 0 HG21 ILE A 15 9.474 -12.578 2.928 1.00 0.00 H new ATOM 0 HG22 ILE A 15 8.577 -13.169 1.509 1.00 0.00 H new ATOM 0 HG23 ILE A 15 9.791 -14.209 2.291 1.00 0.00 H new ATOM 0 HD11 ILE A 15 13.541 -13.815 2.552 1.00 0.00 H new ATOM 0 HD12 ILE A 15 11.930 -14.568 2.607 1.00 0.00 H new ATOM 0 HD13 ILE A 15 12.771 -14.380 1.050 1.00 0.00 H new ATOM 135 N THR A 16 8.857 -14.931 -0.358 1.00 0.00 N ATOM 136 CA THR A 16 7.595 -15.431 -0.874 1.00 0.00 C ATOM 137 C THR A 16 6.426 -14.846 -0.089 1.00 0.00 C ATOM 138 O THR A 16 6.612 -14.271 0.985 1.00 0.00 O ATOM 139 CB THR A 16 7.539 -16.968 -0.781 1.00 0.00 C ATOM 140 OG1 THR A 16 7.633 -17.368 0.587 1.00 0.00 O ATOM 141 CG2 THR A 16 8.677 -17.600 -1.563 1.00 0.00 C ATOM 0 H THR A 16 9.270 -15.511 0.373 1.00 0.00 H new ATOM 0 HA THR A 16 7.521 -15.128 -1.919 1.00 0.00 H new ATOM 0 HB THR A 16 6.593 -17.303 -1.206 1.00 0.00 H new ATOM 0 HG1 THR A 16 8.574 -17.374 0.862 1.00 0.00 H new ATOM 0 HG21 THR A 16 8.616 -18.685 -1.482 1.00 0.00 H new ATOM 0 HG22 THR A 16 8.604 -17.310 -2.611 1.00 0.00 H new ATOM 0 HG23 THR A 16 9.630 -17.259 -1.158 1.00 0.00 H new ATOM 149 N CYS A 17 5.215 -15.002 -0.613 1.00 0.00 N ATOM 150 CA CYS A 17 4.042 -14.499 0.083 1.00 0.00 C ATOM 151 C CYS A 17 3.712 -15.412 1.266 1.00 0.00 C ATOM 152 O CYS A 17 2.990 -15.027 2.183 1.00 0.00 O ATOM 153 CB CYS A 17 2.841 -14.380 -0.859 1.00 0.00 C ATOM 154 SG CYS A 17 1.703 -15.792 -0.810 1.00 0.00 S ATOM 0 H CYS A 17 5.024 -15.465 -1.502 1.00 0.00 H new ATOM 0 HA CYS A 17 4.265 -13.499 0.454 1.00 0.00 H new ATOM 0 HB2 CYS A 17 2.288 -13.475 -0.609 1.00 0.00 H new ATOM 0 HB3 CYS A 17 3.206 -14.259 -1.879 1.00 0.00 H new ATOM 159 N ALA A 18 4.245 -16.634 1.226 1.00 0.00 N ATOM 160 CA ALA A 18 4.085 -17.569 2.321 1.00 0.00 C ATOM 161 C ALA A 18 4.890 -17.093 3.522 1.00 0.00 C ATOM 162 O ALA A 18 4.358 -16.955 4.624 1.00 0.00 O ATOM 163 CB ALA A 18 4.523 -18.965 1.897 1.00 0.00 C ATOM 0 H ALA A 18 4.791 -16.992 0.442 1.00 0.00 H new ATOM 0 HA ALA A 18 3.032 -17.616 2.599 1.00 0.00 H new ATOM 0 HB1 ALA A 18 4.396 -19.655 2.731 1.00 0.00 H new ATOM 0 HB2 ALA A 18 3.915 -19.297 1.056 1.00 0.00 H new ATOM 0 HB3 ALA A 18 5.572 -18.943 1.600 1.00 0.00 H new ATOM 169 N GLU A 19 6.180 -16.824 3.292 1.00 0.00 N ATOM 170 CA GLU A 19 7.075 -16.310 4.331 1.00 0.00 C ATOM 171 C GLU A 19 6.601 -14.952 4.845 1.00 0.00 C ATOM 172 O GLU A 19 6.968 -14.534 5.945 1.00 0.00 O ATOM 173 CB GLU A 19 8.488 -16.161 3.777 1.00 0.00 C ATOM 174 CG GLU A 19 9.115 -17.452 3.293 1.00 0.00 C ATOM 175 CD GLU A 19 10.360 -17.202 2.466 1.00 0.00 C ATOM 176 OE1 GLU A 19 10.220 -16.923 1.250 1.00 0.00 O ATOM 177 OE2 GLU A 19 11.473 -17.272 3.023 1.00 0.00 O ATOM 0 H GLU A 19 6.629 -16.956 2.386 1.00 0.00 H new ATOM 0 HA GLU A 19 7.069 -17.022 5.156 1.00 0.00 H new ATOM 0 HB2 GLU A 19 8.467 -15.450 2.951 1.00 0.00 H new ATOM 0 HB3 GLU A 19 9.124 -15.731 4.551 1.00 0.00 H new ATOM 0 HG2 GLU A 19 9.368 -18.076 4.150 1.00 0.00 H new ATOM 0 HG3 GLU A 19 8.390 -18.007 2.698 1.00 0.00 H new ATOM 184 N ALA A 20 5.782 -14.269 4.043 1.00 0.00 N ATOM 185 CA ALA A 20 5.274 -12.963 4.408 1.00 0.00 C ATOM 186 C ALA A 20 4.422 -13.035 5.674 1.00 0.00 C ATOM 187 O ALA A 20 4.284 -12.048 6.391 1.00 0.00 O ATOM 188 CB ALA A 20 4.475 -12.368 3.259 1.00 0.00 C ATOM 0 H ALA A 20 5.461 -14.607 3.136 1.00 0.00 H new ATOM 0 HA ALA A 20 6.125 -12.315 4.616 1.00 0.00 H new ATOM 0 HB1 ALA A 20 4.099 -11.386 3.547 1.00 0.00 H new ATOM 0 HB2 ALA A 20 5.116 -12.268 2.383 1.00 0.00 H new ATOM 0 HB3 ALA A 20 3.636 -13.022 3.022 1.00 0.00 H new ATOM 194 N ASN A 21 3.889 -14.222 5.963 1.00 0.00 N ATOM 195 CA ASN A 21 3.042 -14.421 7.139 1.00 0.00 C ATOM 196 C ASN A 21 3.872 -14.360 8.393 1.00 0.00 C ATOM 197 O ASN A 21 3.453 -13.798 9.402 1.00 0.00 O ATOM 198 CB ASN A 21 2.319 -15.770 7.091 1.00 0.00 C ATOM 199 CG ASN A 21 1.111 -15.775 6.186 1.00 0.00 C ATOM 200 OD1 ASN A 21 0.466 -14.752 5.981 1.00 0.00 O ATOM 201 ND2 ASN A 21 0.781 -16.932 5.664 1.00 0.00 N ATOM 0 H ASN A 21 4.029 -15.060 5.399 1.00 0.00 H new ATOM 0 HA ASN A 21 2.298 -13.625 7.141 1.00 0.00 H new ATOM 0 HB2 ASN A 21 3.018 -16.536 6.755 1.00 0.00 H new ATOM 0 HB3 ASN A 21 2.008 -16.043 8.100 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -0.039 -17.005 5.062 1.00 0.00 H new ATOM 0 HD22 ASN A 21 1.345 -17.759 5.860 1.00 0.00 H new ATOM 208 N GLU A 22 5.057 -14.944 8.314 1.00 0.00 N ATOM 209 CA GLU A 22 5.968 -14.989 9.435 1.00 0.00 C ATOM 210 C GLU A 22 6.245 -13.584 9.959 1.00 0.00 C ATOM 211 O GLU A 22 6.049 -13.310 11.141 1.00 0.00 O ATOM 212 CB GLU A 22 7.265 -15.701 9.043 1.00 0.00 C ATOM 213 CG GLU A 22 8.208 -15.944 10.205 1.00 0.00 C ATOM 214 CD GLU A 22 9.294 -16.943 9.873 1.00 0.00 C ATOM 215 OE1 GLU A 22 9.049 -18.160 10.020 1.00 0.00 O ATOM 216 OE2 GLU A 22 10.403 -16.522 9.465 1.00 0.00 O ATOM 0 H GLU A 22 5.409 -15.398 7.471 1.00 0.00 H new ATOM 0 HA GLU A 22 5.502 -15.559 10.239 1.00 0.00 H new ATOM 0 HB2 GLU A 22 7.018 -16.657 8.582 1.00 0.00 H new ATOM 0 HB3 GLU A 22 7.780 -15.107 8.288 1.00 0.00 H new ATOM 0 HG2 GLU A 22 8.666 -15.000 10.500 1.00 0.00 H new ATOM 0 HG3 GLU A 22 7.638 -16.304 11.062 1.00 0.00 H new ATOM 223 N MET A 23 6.678 -12.693 9.074 1.00 0.00 N ATOM 224 CA MET A 23 6.942 -11.311 9.466 1.00 0.00 C ATOM 225 C MET A 23 5.650 -10.583 9.815 1.00 0.00 C ATOM 226 O MET A 23 5.621 -9.777 10.731 1.00 0.00 O ATOM 227 CB MET A 23 7.680 -10.542 8.364 1.00 0.00 C ATOM 228 CG MET A 23 8.984 -11.184 7.916 1.00 0.00 C ATOM 229 SD MET A 23 10.081 -10.018 7.072 1.00 0.00 S ATOM 230 CE MET A 23 8.986 -9.325 5.831 1.00 0.00 C ATOM 0 H MET A 23 6.853 -12.898 8.090 1.00 0.00 H new ATOM 0 HA MET A 23 7.580 -11.350 10.349 1.00 0.00 H new ATOM 0 HB2 MET A 23 7.021 -10.446 7.501 1.00 0.00 H new ATOM 0 HB3 MET A 23 7.889 -9.533 8.719 1.00 0.00 H new ATOM 0 HG2 MET A 23 9.498 -11.597 8.784 1.00 0.00 H new ATOM 0 HG3 MET A 23 8.764 -12.018 7.249 1.00 0.00 H new ATOM 0 HE1 MET A 23 9.572 -8.772 5.097 1.00 0.00 H new ATOM 0 HE2 MET A 23 8.446 -10.130 5.332 1.00 0.00 H new ATOM 0 HE3 MET A 23 8.274 -8.652 6.309 1.00 0.00 H new ATOM 240 N ALA A 24 4.581 -10.878 9.073 1.00 0.00 N ATOM 241 CA ALA A 24 3.273 -10.241 9.295 1.00 0.00 C ATOM 242 C ALA A 24 2.815 -10.365 10.748 1.00 0.00 C ATOM 243 O ALA A 24 2.184 -9.460 11.285 1.00 0.00 O ATOM 244 CB ALA A 24 2.222 -10.820 8.359 1.00 0.00 C ATOM 0 H ALA A 24 4.591 -11.555 8.310 1.00 0.00 H new ATOM 0 HA ALA A 24 3.393 -9.180 9.076 1.00 0.00 H new ATOM 0 HB1 ALA A 24 1.264 -10.333 8.542 1.00 0.00 H new ATOM 0 HB2 ALA A 24 2.523 -10.651 7.325 1.00 0.00 H new ATOM 0 HB3 ALA A 24 2.125 -11.891 8.538 1.00 0.00 H new ATOM 250 N LYS A 25 3.141 -11.489 11.370 1.00 0.00 N ATOM 251 CA LYS A 25 2.769 -11.744 12.766 1.00 0.00 C ATOM 252 C LYS A 25 3.317 -10.678 13.731 1.00 0.00 C ATOM 253 O LYS A 25 2.831 -10.552 14.857 1.00 0.00 O ATOM 254 CB LYS A 25 3.234 -13.135 13.203 1.00 0.00 C ATOM 255 CG LYS A 25 2.620 -14.269 12.395 1.00 0.00 C ATOM 256 CD LYS A 25 3.075 -15.635 12.896 1.00 0.00 C ATOM 257 CE LYS A 25 2.556 -15.917 14.296 1.00 0.00 C ATOM 258 NZ LYS A 25 2.920 -17.277 14.765 1.00 0.00 N ATOM 0 H LYS A 25 3.665 -12.247 10.932 1.00 0.00 H new ATOM 0 HA LYS A 25 1.681 -11.694 12.812 1.00 0.00 H new ATOM 0 HB2 LYS A 25 4.320 -13.188 13.120 1.00 0.00 H new ATOM 0 HB3 LYS A 25 2.988 -13.276 14.255 1.00 0.00 H new ATOM 0 HG2 LYS A 25 1.533 -14.206 12.449 1.00 0.00 H new ATOM 0 HG3 LYS A 25 2.894 -14.157 11.346 1.00 0.00 H new ATOM 0 HD2 LYS A 25 2.724 -16.409 12.214 1.00 0.00 H new ATOM 0 HD3 LYS A 25 4.164 -15.680 12.895 1.00 0.00 H new ATOM 0 HE2 LYS A 25 2.959 -15.176 14.987 1.00 0.00 H new ATOM 0 HE3 LYS A 25 1.472 -15.808 14.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 2.546 -17.425 15.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 2.515 -17.986 14.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 3.955 -17.374 14.779 1.00 0.00 H new ATOM 272 N THR A 26 4.309 -9.916 13.295 1.00 0.00 N ATOM 273 CA THR A 26 4.892 -8.872 14.131 1.00 0.00 C ATOM 274 C THR A 26 4.923 -7.528 13.406 1.00 0.00 C ATOM 275 O THR A 26 4.800 -6.470 14.024 1.00 0.00 O ATOM 276 CB THR A 26 6.324 -9.235 14.586 1.00 0.00 C ATOM 277 OG1 THR A 26 7.139 -9.557 13.445 1.00 0.00 O ATOM 278 CG2 THR A 26 6.308 -10.410 15.553 1.00 0.00 C ATOM 0 H THR A 26 4.728 -9.999 12.369 1.00 0.00 H new ATOM 0 HA THR A 26 4.253 -8.790 15.010 1.00 0.00 H new ATOM 0 HB THR A 26 6.745 -8.370 15.099 1.00 0.00 H new ATOM 0 HG1 THR A 26 7.511 -8.733 13.066 1.00 0.00 H new ATOM 0 HG21 THR A 26 7.328 -10.645 15.857 1.00 0.00 H new ATOM 0 HG22 THR A 26 5.718 -10.150 16.432 1.00 0.00 H new ATOM 0 HG23 THR A 26 5.867 -11.278 15.063 1.00 0.00 H new ATOM 286 N ASP A 27 5.072 -7.580 12.097 1.00 0.00 N ATOM 287 CA ASP A 27 5.197 -6.385 11.285 1.00 0.00 C ATOM 288 C ASP A 27 4.277 -6.464 10.076 1.00 0.00 C ATOM 289 O ASP A 27 4.715 -6.285 8.934 1.00 0.00 O ATOM 290 CB ASP A 27 6.650 -6.222 10.826 1.00 0.00 C ATOM 291 CG ASP A 27 7.614 -6.058 11.983 1.00 0.00 C ATOM 292 OD1 ASP A 27 8.124 -7.077 12.490 1.00 0.00 O ATOM 293 OD2 ASP A 27 7.868 -4.901 12.402 1.00 0.00 O ATOM 0 H ASP A 27 5.110 -8.450 11.567 1.00 0.00 H new ATOM 0 HA ASP A 27 4.908 -5.522 11.884 1.00 0.00 H new ATOM 0 HB2 ASP A 27 6.940 -7.092 10.237 1.00 0.00 H new ATOM 0 HB3 ASP A 27 6.724 -5.354 10.171 1.00 0.00 H new ATOM 298 N SER A 28 3.000 -6.727 10.337 1.00 0.00 N ATOM 299 CA SER A 28 1.988 -6.847 9.287 1.00 0.00 C ATOM 300 C SER A 28 1.986 -5.636 8.356 1.00 0.00 C ATOM 301 O SER A 28 1.819 -5.778 7.148 1.00 0.00 O ATOM 302 CB SER A 28 0.606 -7.041 9.919 1.00 0.00 C ATOM 303 OG SER A 28 0.365 -6.069 10.928 1.00 0.00 O ATOM 0 H SER A 28 2.636 -6.863 11.280 1.00 0.00 H new ATOM 0 HA SER A 28 2.235 -7.718 8.681 1.00 0.00 H new ATOM 0 HB2 SER A 28 -0.163 -6.970 9.150 1.00 0.00 H new ATOM 0 HB3 SER A 28 0.536 -8.041 10.348 1.00 0.00 H new ATOM 0 HG SER A 28 -0.524 -6.213 11.315 1.00 0.00 H new ATOM 309 N ALA A 29 2.181 -4.452 8.933 1.00 0.00 N ATOM 310 CA ALA A 29 2.211 -3.205 8.170 1.00 0.00 C ATOM 311 C ALA A 29 3.192 -3.286 6.996 1.00 0.00 C ATOM 312 O ALA A 29 2.786 -3.218 5.852 1.00 0.00 O ATOM 313 CB ALA A 29 2.567 -2.039 9.081 1.00 0.00 C ATOM 0 H ALA A 29 2.322 -4.330 9.936 1.00 0.00 H new ATOM 0 HA ALA A 29 1.215 -3.042 7.757 1.00 0.00 H new ATOM 0 HB1 ALA A 29 2.586 -1.117 8.501 1.00 0.00 H new ATOM 0 HB2 ALA A 29 1.822 -1.955 9.872 1.00 0.00 H new ATOM 0 HB3 ALA A 29 3.548 -2.210 9.524 1.00 0.00 H new ATOM 319 N GLN A 30 4.478 -3.480 7.300 1.00 0.00 N ATOM 320 CA GLN A 30 5.526 -3.556 6.277 1.00 0.00 C ATOM 321 C GLN A 30 5.205 -4.589 5.199 1.00 0.00 C ATOM 322 O GLN A 30 5.549 -4.404 4.032 1.00 0.00 O ATOM 323 CB GLN A 30 6.874 -3.886 6.916 1.00 0.00 C ATOM 324 CG GLN A 30 7.293 -2.911 7.995 1.00 0.00 C ATOM 325 CD GLN A 30 8.716 -3.137 8.459 1.00 0.00 C ATOM 326 OE1 GLN A 30 8.962 -3.888 9.396 1.00 0.00 O ATOM 327 NE2 GLN A 30 9.657 -2.486 7.810 1.00 0.00 N ATOM 0 H GLN A 30 4.821 -3.588 8.254 1.00 0.00 H new ATOM 0 HA GLN A 30 5.576 -2.577 5.800 1.00 0.00 H new ATOM 0 HB2 GLN A 30 6.828 -4.888 7.343 1.00 0.00 H new ATOM 0 HB3 GLN A 30 7.639 -3.905 6.140 1.00 0.00 H new ATOM 0 HG2 GLN A 30 7.194 -1.893 7.619 1.00 0.00 H new ATOM 0 HG3 GLN A 30 6.618 -3.003 8.846 1.00 0.00 H new ATOM 0 HE21 GLN A 30 9.410 -1.870 7.035 1.00 0.00 H new ATOM 0 HE22 GLN A 30 10.634 -2.597 8.081 1.00 0.00 H new ATOM 336 N VAL A 31 4.533 -5.656 5.591 1.00 0.00 N ATOM 337 CA VAL A 31 4.173 -6.713 4.666 1.00 0.00 C ATOM 338 C VAL A 31 3.044 -6.250 3.755 1.00 0.00 C ATOM 339 O VAL A 31 3.079 -6.464 2.549 1.00 0.00 O ATOM 340 CB VAL A 31 3.741 -7.995 5.416 1.00 0.00 C ATOM 341 CG1 VAL A 31 3.346 -9.089 4.437 1.00 0.00 C ATOM 342 CG2 VAL A 31 4.857 -8.476 6.334 1.00 0.00 C ATOM 0 H VAL A 31 4.224 -5.813 6.550 1.00 0.00 H new ATOM 0 HA VAL A 31 5.054 -6.946 4.068 1.00 0.00 H new ATOM 0 HB VAL A 31 2.870 -7.756 6.025 1.00 0.00 H new ATOM 0 HG11 VAL A 31 3.046 -9.980 4.989 1.00 0.00 H new ATOM 0 HG12 VAL A 31 2.513 -8.745 3.823 1.00 0.00 H new ATOM 0 HG13 VAL A 31 4.195 -9.328 3.796 1.00 0.00 H new ATOM 0 HG21 VAL A 31 4.537 -9.379 6.854 1.00 0.00 H new ATOM 0 HG22 VAL A 31 5.746 -8.694 5.742 1.00 0.00 H new ATOM 0 HG23 VAL A 31 5.088 -7.700 7.063 1.00 0.00 H new ATOM 352 N ALA A 32 2.069 -5.581 4.337 1.00 0.00 N ATOM 353 CA ALA A 32 0.928 -5.090 3.595 1.00 0.00 C ATOM 354 C ALA A 32 1.337 -3.961 2.658 1.00 0.00 C ATOM 355 O ALA A 32 0.765 -3.807 1.587 1.00 0.00 O ATOM 356 CB ALA A 32 -0.164 -4.623 4.547 1.00 0.00 C ATOM 0 H ALA A 32 2.046 -5.364 5.333 1.00 0.00 H new ATOM 0 HA ALA A 32 0.536 -5.908 2.991 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -1.015 -4.257 3.973 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -0.481 -5.456 5.174 1.00 0.00 H new ATOM 0 HB3 ALA A 32 0.221 -3.821 5.177 1.00 0.00 H new ATOM 362 N GLU A 33 2.364 -3.215 3.047 1.00 0.00 N ATOM 363 CA GLU A 33 2.820 -2.079 2.262 1.00 0.00 C ATOM 364 C GLU A 33 3.405 -2.555 0.959 1.00 0.00 C ATOM 365 O GLU A 33 2.902 -2.240 -0.112 1.00 0.00 O ATOM 366 CB GLU A 33 3.877 -1.271 3.027 1.00 0.00 C ATOM 367 CG GLU A 33 3.405 -0.734 4.359 1.00 0.00 C ATOM 368 CD GLU A 33 2.176 0.134 4.232 1.00 0.00 C ATOM 369 OE1 GLU A 33 1.067 -0.417 4.145 1.00 0.00 O ATOM 370 OE2 GLU A 33 2.328 1.367 4.221 1.00 0.00 O ATOM 0 H GLU A 33 2.896 -3.378 3.902 1.00 0.00 H new ATOM 0 HA GLU A 33 1.961 -1.437 2.068 1.00 0.00 H new ATOM 0 HB2 GLU A 33 4.751 -1.902 3.192 1.00 0.00 H new ATOM 0 HB3 GLU A 33 4.199 -0.436 2.405 1.00 0.00 H new ATOM 0 HG2 GLU A 33 3.189 -1.568 5.027 1.00 0.00 H new ATOM 0 HG3 GLU A 33 4.207 -0.157 4.819 1.00 0.00 H new ATOM 377 N ILE A 34 4.458 -3.342 1.063 1.00 0.00 N ATOM 378 CA ILE A 34 5.147 -3.860 -0.103 1.00 0.00 C ATOM 379 C ILE A 34 4.210 -4.676 -1.008 1.00 0.00 C ATOM 380 O ILE A 34 4.356 -4.666 -2.230 1.00 0.00 O ATOM 381 CB ILE A 34 6.396 -4.694 0.294 1.00 0.00 C ATOM 382 CG1 ILE A 34 7.116 -5.195 -0.952 1.00 0.00 C ATOM 383 CG2 ILE A 34 6.015 -5.859 1.203 1.00 0.00 C ATOM 384 CD1 ILE A 34 8.415 -5.926 -0.667 1.00 0.00 C ATOM 0 H ILE A 34 4.858 -3.639 1.953 1.00 0.00 H new ATOM 0 HA ILE A 34 5.488 -2.997 -0.675 1.00 0.00 H new ATOM 0 HB ILE A 34 7.074 -4.047 0.851 1.00 0.00 H new ATOM 0 HG12 ILE A 34 6.450 -5.861 -1.500 1.00 0.00 H new ATOM 0 HG13 ILE A 34 7.325 -4.346 -1.603 1.00 0.00 H new ATOM 0 HG21 ILE A 34 6.910 -6.424 1.464 1.00 0.00 H new ATOM 0 HG22 ILE A 34 5.550 -5.475 2.111 1.00 0.00 H new ATOM 0 HG23 ILE A 34 5.312 -6.511 0.684 1.00 0.00 H new ATOM 0 HD11 ILE A 34 8.864 -6.250 -1.606 1.00 0.00 H new ATOM 0 HD12 ILE A 34 9.102 -5.258 -0.147 1.00 0.00 H new ATOM 0 HD13 ILE A 34 8.213 -6.796 -0.042 1.00 0.00 H new ATOM 396 N VAL A 35 3.223 -5.342 -0.416 1.00 0.00 N ATOM 397 CA VAL A 35 2.297 -6.149 -1.192 1.00 0.00 C ATOM 398 C VAL A 35 1.238 -5.278 -1.879 1.00 0.00 C ATOM 399 O VAL A 35 1.031 -5.380 -3.093 1.00 0.00 O ATOM 400 CB VAL A 35 1.608 -7.227 -0.313 1.00 0.00 C ATOM 401 CG1 VAL A 35 0.495 -7.928 -1.074 1.00 0.00 C ATOM 402 CG2 VAL A 35 2.628 -8.246 0.170 1.00 0.00 C ATOM 0 H VAL A 35 3.047 -5.337 0.589 1.00 0.00 H new ATOM 0 HA VAL A 35 2.882 -6.654 -1.960 1.00 0.00 H new ATOM 0 HB VAL A 35 1.168 -6.725 0.549 1.00 0.00 H new ATOM 0 HG11 VAL A 35 0.031 -8.677 -0.432 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -0.254 -7.197 -1.378 1.00 0.00 H new ATOM 0 HG13 VAL A 35 0.908 -8.413 -1.958 1.00 0.00 H new ATOM 0 HG21 VAL A 35 2.130 -8.996 0.785 1.00 0.00 H new ATOM 0 HG22 VAL A 35 3.092 -8.731 -0.689 1.00 0.00 H new ATOM 0 HG23 VAL A 35 3.394 -7.743 0.760 1.00 0.00 H new ATOM 412 N ALA A 36 0.594 -4.404 -1.112 1.00 0.00 N ATOM 413 CA ALA A 36 -0.453 -3.553 -1.642 1.00 0.00 C ATOM 414 C ALA A 36 0.112 -2.535 -2.616 1.00 0.00 C ATOM 415 O ALA A 36 -0.494 -2.251 -3.655 1.00 0.00 O ATOM 416 CB ALA A 36 -1.195 -2.856 -0.513 1.00 0.00 C ATOM 0 H ALA A 36 0.783 -4.270 -0.119 1.00 0.00 H new ATOM 0 HA ALA A 36 -1.158 -4.183 -2.184 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -1.977 -2.221 -0.929 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -1.644 -3.602 0.143 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -0.497 -2.244 0.058 1.00 0.00 H new ATOM 422 N VAL A 37 1.274 -1.986 -2.283 1.00 0.00 N ATOM 423 CA VAL A 37 1.934 -1.024 -3.139 1.00 0.00 C ATOM 424 C VAL A 37 2.200 -1.597 -4.522 1.00 0.00 C ATOM 425 O VAL A 37 1.661 -1.093 -5.500 1.00 0.00 O ATOM 426 CB VAL A 37 3.238 -0.463 -2.502 1.00 0.00 C ATOM 427 CG1 VAL A 37 4.173 0.119 -3.555 1.00 0.00 C ATOM 428 CG2 VAL A 37 2.885 0.607 -1.477 1.00 0.00 C ATOM 0 H VAL A 37 1.776 -2.196 -1.420 1.00 0.00 H new ATOM 0 HA VAL A 37 1.248 -0.185 -3.252 1.00 0.00 H new ATOM 0 HB VAL A 37 3.758 -1.288 -2.015 1.00 0.00 H new ATOM 0 HG11 VAL A 37 5.072 0.501 -3.072 1.00 0.00 H new ATOM 0 HG12 VAL A 37 4.446 -0.658 -4.268 1.00 0.00 H new ATOM 0 HG13 VAL A 37 3.670 0.932 -4.079 1.00 0.00 H new ATOM 0 HG21 VAL A 37 3.799 0.999 -1.031 1.00 0.00 H new ATOM 0 HG22 VAL A 37 2.344 1.416 -1.967 1.00 0.00 H new ATOM 0 HG23 VAL A 37 2.259 0.172 -0.698 1.00 0.00 H new ATOM 438 N MET A 38 3.000 -2.666 -4.614 1.00 0.00 N ATOM 439 CA MET A 38 3.312 -3.270 -5.908 1.00 0.00 C ATOM 440 C MET A 38 2.069 -3.789 -6.589 1.00 0.00 C ATOM 441 O MET A 38 1.900 -3.616 -7.790 1.00 0.00 O ATOM 442 CB MET A 38 4.294 -4.421 -5.742 1.00 0.00 C ATOM 443 CG MET A 38 5.629 -4.022 -5.148 1.00 0.00 C ATOM 444 SD MET A 38 6.837 -5.364 -5.175 1.00 0.00 S ATOM 445 CE MET A 38 5.916 -6.675 -4.372 1.00 0.00 C ATOM 0 H MET A 38 3.438 -3.124 -3.815 1.00 0.00 H new ATOM 0 HA MET A 38 3.757 -2.490 -6.525 1.00 0.00 H new ATOM 0 HB2 MET A 38 3.840 -5.182 -5.107 1.00 0.00 H new ATOM 0 HB3 MET A 38 4.466 -4.880 -6.716 1.00 0.00 H new ATOM 0 HG2 MET A 38 6.027 -3.170 -5.700 1.00 0.00 H new ATOM 0 HG3 MET A 38 5.480 -3.694 -4.119 1.00 0.00 H new ATOM 0 HE1 MET A 38 6.581 -7.238 -3.717 1.00 0.00 H new ATOM 0 HE2 MET A 38 5.107 -6.243 -3.783 1.00 0.00 H new ATOM 0 HE3 MET A 38 5.499 -7.342 -5.127 1.00 0.00 H new ATOM 455 N GLY A 39 1.205 -4.433 -5.818 1.00 0.00 N ATOM 456 CA GLY A 39 -0.012 -4.982 -6.369 1.00 0.00 C ATOM 457 C GLY A 39 -0.830 -3.946 -7.096 1.00 0.00 C ATOM 458 O GLY A 39 -1.113 -4.090 -8.287 1.00 0.00 O ATOM 0 H GLY A 39 1.328 -4.584 -4.817 1.00 0.00 H new ATOM 0 HA2 GLY A 39 0.236 -5.793 -7.054 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -0.609 -5.415 -5.566 1.00 0.00 H new ATOM 462 N ASN A 40 -1.182 -2.892 -6.392 1.00 0.00 N ATOM 463 CA ASN A 40 -1.992 -1.833 -6.963 1.00 0.00 C ATOM 464 C ASN A 40 -1.220 -1.049 -8.046 1.00 0.00 C ATOM 465 O ASN A 40 -1.797 -0.644 -9.057 1.00 0.00 O ATOM 466 CB ASN A 40 -2.519 -0.907 -5.858 1.00 0.00 C ATOM 467 CG ASN A 40 -1.855 0.451 -5.827 1.00 0.00 C ATOM 468 OD1 ASN A 40 -0.803 0.576 -5.046 1.00 0.00 O flip ATOM 469 ND2 ASN A 40 -2.300 1.385 -6.486 1.00 0.00 N flip ATOM 0 H ASN A 40 -0.919 -2.744 -5.418 1.00 0.00 H new ATOM 0 HA ASN A 40 -2.850 -2.290 -7.457 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -3.592 -0.773 -5.992 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -2.376 -1.392 -4.892 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -3.118 1.246 -7.079 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -1.852 2.300 -6.441 1.00 0.00 H new ATOM 476 N ALA A 41 0.075 -0.852 -7.834 1.00 0.00 N ATOM 477 CA ALA A 41 0.903 -0.142 -8.805 1.00 0.00 C ATOM 478 C ALA A 41 1.023 -0.915 -10.114 1.00 0.00 C ATOM 479 O ALA A 41 1.055 -0.322 -11.194 1.00 0.00 O ATOM 480 CB ALA A 41 2.284 0.139 -8.233 1.00 0.00 C ATOM 0 H ALA A 41 0.574 -1.171 -7.004 1.00 0.00 H new ATOM 0 HA ALA A 41 0.411 0.807 -9.019 1.00 0.00 H new ATOM 0 HB1 ALA A 41 2.884 0.668 -8.973 1.00 0.00 H new ATOM 0 HB2 ALA A 41 2.189 0.753 -7.337 1.00 0.00 H new ATOM 0 HB3 ALA A 41 2.771 -0.802 -7.978 1.00 0.00 H new ATOM 486 N SER A 42 1.048 -2.237 -10.026 1.00 0.00 N ATOM 487 CA SER A 42 1.214 -3.060 -11.201 1.00 0.00 C ATOM 488 C SER A 42 -0.116 -3.224 -11.930 1.00 0.00 C ATOM 489 O SER A 42 -0.157 -3.222 -13.160 1.00 0.00 O ATOM 490 CB SER A 42 1.804 -4.426 -10.824 1.00 0.00 C ATOM 491 OG SER A 42 2.165 -5.174 -11.976 1.00 0.00 O ATOM 0 H SER A 42 0.955 -2.756 -9.153 1.00 0.00 H new ATOM 0 HA SER A 42 1.913 -2.564 -11.875 1.00 0.00 H new ATOM 0 HB2 SER A 42 2.681 -4.283 -10.193 1.00 0.00 H new ATOM 0 HB3 SER A 42 1.077 -4.988 -10.237 1.00 0.00 H new ATOM 0 HG SER A 42 1.371 -5.618 -12.340 1.00 0.00 H new ATOM 497 N VAL A 43 -1.211 -3.345 -11.175 1.00 0.00 N ATOM 498 CA VAL A 43 -2.523 -3.471 -11.793 1.00 0.00 C ATOM 499 C VAL A 43 -2.905 -2.183 -12.504 1.00 0.00 C ATOM 500 O VAL A 43 -3.503 -2.217 -13.578 1.00 0.00 O ATOM 501 CB VAL A 43 -3.645 -3.861 -10.789 1.00 0.00 C ATOM 502 CG1 VAL A 43 -3.416 -5.237 -10.218 1.00 0.00 C ATOM 503 CG2 VAL A 43 -3.755 -2.852 -9.684 1.00 0.00 C ATOM 0 H VAL A 43 -1.212 -3.358 -10.155 1.00 0.00 H new ATOM 0 HA VAL A 43 -2.438 -4.286 -12.512 1.00 0.00 H new ATOM 0 HB VAL A 43 -4.585 -3.873 -11.341 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -4.217 -5.479 -9.520 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -3.405 -5.969 -11.026 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -2.460 -5.259 -9.695 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -4.547 -3.150 -8.997 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -2.809 -2.798 -9.145 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -3.989 -1.875 -10.106 1.00 0.00 H new ATOM 513 N ALA A 44 -2.542 -1.031 -11.926 1.00 0.00 N ATOM 514 CA ALA A 44 -2.840 0.241 -12.543 1.00 0.00 C ATOM 515 C ALA A 44 -1.988 0.456 -13.779 1.00 0.00 C ATOM 516 O ALA A 44 -2.292 1.298 -14.601 1.00 0.00 O ATOM 517 CB ALA A 44 -2.628 1.371 -11.547 1.00 0.00 C ATOM 0 H ALA A 44 -2.045 -0.967 -11.038 1.00 0.00 H new ATOM 0 HA ALA A 44 -3.886 0.236 -12.850 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -2.856 2.324 -12.024 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -3.285 1.228 -10.689 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -1.591 1.371 -11.213 1.00 0.00 H new ATOM 523 N SER A 45 -0.946 -0.343 -13.920 1.00 0.00 N ATOM 524 CA SER A 45 -0.066 -0.229 -15.072 1.00 0.00 C ATOM 525 C SER A 45 -0.735 -0.832 -16.305 1.00 0.00 C ATOM 526 O SER A 45 -0.258 -0.674 -17.429 1.00 0.00 O ATOM 527 CB SER A 45 1.276 -0.923 -14.801 1.00 0.00 C ATOM 528 OG SER A 45 1.980 -0.295 -13.733 1.00 0.00 O ATOM 0 H SER A 45 -0.688 -1.074 -13.257 1.00 0.00 H new ATOM 0 HA SER A 45 0.127 0.828 -15.256 1.00 0.00 H new ATOM 0 HB2 SER A 45 1.103 -1.971 -14.558 1.00 0.00 H new ATOM 0 HB3 SER A 45 1.887 -0.902 -15.703 1.00 0.00 H new ATOM 0 HG SER A 45 1.562 -0.535 -12.880 1.00 0.00 H new ATOM 534 N ARG A 46 -1.849 -1.520 -16.086 1.00 0.00 N ATOM 535 CA ARG A 46 -2.576 -2.151 -17.170 1.00 0.00 C ATOM 536 C ARG A 46 -3.991 -1.583 -17.294 1.00 0.00 C ATOM 537 O ARG A 46 -4.611 -1.656 -18.359 1.00 0.00 O ATOM 538 CB ARG A 46 -2.642 -3.659 -16.922 1.00 0.00 C ATOM 539 CG ARG A 46 -3.372 -4.448 -17.997 1.00 0.00 C ATOM 540 CD ARG A 46 -3.794 -5.807 -17.470 1.00 0.00 C ATOM 541 NE ARG A 46 -4.670 -5.665 -16.306 1.00 0.00 N ATOM 542 CZ ARG A 46 -4.783 -6.544 -15.321 1.00 0.00 C ATOM 543 NH1 ARG A 46 -4.118 -7.694 -15.355 1.00 0.00 N ATOM 544 NH2 ARG A 46 -5.578 -6.268 -14.302 1.00 0.00 N ATOM 0 H ARG A 46 -2.266 -1.653 -15.164 1.00 0.00 H new ATOM 0 HA ARG A 46 -2.050 -1.949 -18.103 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -1.626 -4.044 -16.835 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -3.133 -3.835 -15.965 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -4.249 -3.893 -18.330 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -2.725 -4.574 -18.865 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -4.310 -6.361 -18.254 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -2.912 -6.386 -17.198 1.00 0.00 H new ATOM 0 HE ARG A 46 -5.240 -4.821 -16.248 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -3.511 -7.909 -16.146 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -4.214 -8.362 -14.590 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -6.094 -5.388 -14.281 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -5.676 -6.935 -13.536 1.00 0.00 H new ATOM 558 N ASP A 47 -4.495 -0.988 -16.221 1.00 0.00 N ATOM 559 CA ASP A 47 -5.874 -0.510 -16.218 1.00 0.00 C ATOM 560 C ASP A 47 -5.999 0.939 -15.778 1.00 0.00 C ATOM 561 O ASP A 47 -6.668 1.727 -16.436 1.00 0.00 O ATOM 562 CB ASP A 47 -6.751 -1.395 -15.320 1.00 0.00 C ATOM 563 CG ASP A 47 -6.839 -2.825 -15.809 1.00 0.00 C ATOM 564 OD1 ASP A 47 -7.533 -3.068 -16.813 1.00 0.00 O ATOM 565 OD2 ASP A 47 -6.200 -3.705 -15.198 1.00 0.00 O ATOM 0 H ASP A 47 -3.981 -0.826 -15.355 1.00 0.00 H new ATOM 0 HA ASP A 47 -6.219 -0.569 -17.250 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -6.349 -1.387 -14.307 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -7.754 -0.971 -15.269 1.00 0.00 H new ATOM 570 N LEU A 48 -5.369 1.278 -14.643 1.00 0.00 N ATOM 571 CA LEU A 48 -5.472 2.631 -14.037 1.00 0.00 C ATOM 572 C LEU A 48 -6.871 2.856 -13.452 1.00 0.00 C ATOM 573 O LEU A 48 -7.178 3.923 -12.918 1.00 0.00 O ATOM 574 CB LEU A 48 -5.138 3.746 -15.056 1.00 0.00 C ATOM 575 CG LEU A 48 -3.664 3.890 -15.446 1.00 0.00 C ATOM 576 CD1 LEU A 48 -3.522 4.807 -16.647 1.00 0.00 C ATOM 577 CD2 LEU A 48 -2.857 4.432 -14.274 1.00 0.00 C ATOM 0 H LEU A 48 -4.777 0.635 -14.117 1.00 0.00 H new ATOM 0 HA LEU A 48 -4.737 2.681 -13.234 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -5.716 3.565 -15.963 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -5.478 4.697 -14.646 1.00 0.00 H new ATOM 0 HG LEU A 48 -3.279 2.905 -15.711 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -2.469 4.899 -16.912 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -4.073 4.390 -17.490 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -3.922 5.791 -16.403 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -1.811 4.529 -14.566 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -3.245 5.409 -13.986 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -2.936 3.747 -13.430 1.00 0.00 H new ATOM 589 N LYS A 49 -7.701 1.829 -13.537 1.00 0.00 N ATOM 590 CA LYS A 49 -9.081 1.888 -13.070 1.00 0.00 C ATOM 591 C LYS A 49 -9.226 1.118 -11.776 1.00 0.00 C ATOM 592 O LYS A 49 -10.334 0.876 -11.299 1.00 0.00 O ATOM 593 CB LYS A 49 -9.992 1.289 -14.132 1.00 0.00 C ATOM 594 CG LYS A 49 -9.739 1.858 -15.507 1.00 0.00 C ATOM 595 CD LYS A 49 -10.311 0.979 -16.593 1.00 0.00 C ATOM 596 CE LYS A 49 -9.808 1.421 -17.950 1.00 0.00 C ATOM 597 NZ LYS A 49 -10.224 2.810 -18.273 1.00 0.00 N ATOM 0 H LYS A 49 -7.438 0.927 -13.933 1.00 0.00 H new ATOM 0 HA LYS A 49 -9.359 2.927 -12.891 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -9.850 0.209 -14.159 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -11.031 1.467 -13.855 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -10.180 2.853 -15.575 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -8.666 1.973 -15.661 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -10.030 -0.059 -16.415 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -11.400 1.023 -16.570 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -8.720 1.354 -17.973 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -10.185 0.742 -18.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -10.008 3.014 -19.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -11.246 2.912 -18.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -9.709 3.477 -17.664 1.00 0.00 H new ATOM 611 N ILE A 50 -8.096 0.725 -11.222 1.00 0.00 N ATOM 612 CA ILE A 50 -8.069 -0.024 -9.981 1.00 0.00 C ATOM 613 C ILE A 50 -8.564 0.861 -8.817 1.00 0.00 C ATOM 614 O ILE A 50 -8.378 2.080 -8.834 1.00 0.00 O ATOM 615 CB ILE A 50 -6.636 -0.563 -9.680 1.00 0.00 C ATOM 616 CG1 ILE A 50 -6.675 -1.610 -8.564 1.00 0.00 C ATOM 617 CG2 ILE A 50 -5.681 0.570 -9.320 1.00 0.00 C ATOM 618 CD1 ILE A 50 -7.284 -2.931 -8.996 1.00 0.00 C ATOM 0 H ILE A 50 -7.175 0.915 -11.617 1.00 0.00 H new ATOM 0 HA ILE A 50 -8.735 -0.880 -10.086 1.00 0.00 H new ATOM 0 HB ILE A 50 -6.263 -1.038 -10.587 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -5.661 -1.786 -8.206 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -7.245 -1.213 -7.724 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -4.691 0.161 -9.116 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -5.619 1.272 -10.152 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -6.049 1.088 -8.434 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -7.280 -3.626 -8.156 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -8.310 -2.768 -9.327 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -6.701 -3.350 -9.816 1.00 0.00 H new ATOM 630 N GLU A 51 -9.195 0.245 -7.824 1.00 0.00 N ATOM 631 CA GLU A 51 -9.744 0.986 -6.696 1.00 0.00 C ATOM 632 C GLU A 51 -8.813 0.925 -5.491 1.00 0.00 C ATOM 633 O GLU A 51 -8.551 -0.149 -4.941 1.00 0.00 O ATOM 634 CB GLU A 51 -11.126 0.454 -6.331 1.00 0.00 C ATOM 635 CG GLU A 51 -12.106 0.485 -7.492 1.00 0.00 C ATOM 636 CD GLU A 51 -13.486 0.016 -7.107 1.00 0.00 C ATOM 637 OE1 GLU A 51 -13.644 -1.172 -6.773 1.00 0.00 O ATOM 638 OE2 GLU A 51 -14.428 0.834 -7.139 1.00 0.00 O ATOM 0 H GLU A 51 -9.339 -0.764 -7.777 1.00 0.00 H new ATOM 0 HA GLU A 51 -9.839 2.030 -6.994 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -11.030 -0.571 -5.972 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -11.529 1.044 -5.508 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -12.168 1.501 -7.881 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -11.726 -0.142 -8.298 1.00 0.00 H new ATOM 645 N GLN A 52 -8.322 2.077 -5.088 1.00 0.00 N ATOM 646 CA GLN A 52 -7.394 2.181 -3.972 1.00 0.00 C ATOM 647 C GLN A 52 -8.129 2.135 -2.640 1.00 0.00 C ATOM 648 O GLN A 52 -8.520 3.166 -2.106 1.00 0.00 O ATOM 649 CB GLN A 52 -6.584 3.482 -4.065 1.00 0.00 C ATOM 650 CG GLN A 52 -5.698 3.617 -5.309 1.00 0.00 C ATOM 651 CD GLN A 52 -6.478 3.841 -6.590 1.00 0.00 C ATOM 652 OE1 GLN A 52 -7.568 4.413 -6.582 1.00 0.00 O ATOM 653 NE2 GLN A 52 -5.923 3.401 -7.697 1.00 0.00 N ATOM 0 H GLN A 52 -8.552 2.971 -5.522 1.00 0.00 H new ATOM 0 HA GLN A 52 -6.716 1.329 -4.026 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -7.276 4.324 -4.040 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -5.953 3.561 -3.180 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -5.007 4.448 -5.164 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -5.094 2.715 -5.414 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -5.018 2.932 -7.662 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -6.397 3.529 -8.591 1.00 0.00 H new ATOM 662 N SER A 53 -8.331 0.936 -2.119 1.00 0.00 N ATOM 663 CA SER A 53 -9.020 0.771 -0.850 1.00 0.00 C ATOM 664 C SER A 53 -8.359 -0.320 0.015 1.00 0.00 C ATOM 665 O SER A 53 -7.787 -1.280 -0.518 1.00 0.00 O ATOM 666 CB SER A 53 -10.492 0.435 -1.108 1.00 0.00 C ATOM 667 OG SER A 53 -10.615 -0.614 -2.062 1.00 0.00 O ATOM 0 H SER A 53 -8.028 0.064 -2.554 1.00 0.00 H new ATOM 0 HA SER A 53 -8.953 1.708 -0.297 1.00 0.00 H new ATOM 0 HB2 SER A 53 -10.971 0.140 -0.174 1.00 0.00 H new ATOM 0 HB3 SER A 53 -11.014 1.322 -1.468 1.00 0.00 H new ATOM 0 HG SER A 53 -11.563 -0.813 -2.209 1.00 0.00 H new ATOM 673 N PRO A 54 -8.440 -0.177 1.367 1.00 0.00 N ATOM 674 CA PRO A 54 -7.869 -1.155 2.337 1.00 0.00 C ATOM 675 C PRO A 54 -8.492 -2.544 2.189 1.00 0.00 C ATOM 676 O PRO A 54 -7.930 -3.551 2.619 1.00 0.00 O ATOM 677 CB PRO A 54 -8.266 -0.568 3.700 1.00 0.00 C ATOM 678 CG PRO A 54 -8.522 0.875 3.443 1.00 0.00 C ATOM 679 CD PRO A 54 -9.091 0.952 2.062 1.00 0.00 C ATOM 0 HA PRO A 54 -6.797 -1.288 2.194 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -9.153 -1.061 4.098 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -7.471 -0.702 4.433 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -9.218 1.284 4.175 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -7.602 1.454 3.519 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -10.176 0.850 2.067 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -8.862 1.905 1.585 1.00 0.00 H new ATOM 687 N GLU A 55 -9.656 -2.583 1.577 1.00 0.00 N ATOM 688 CA GLU A 55 -10.380 -3.821 1.398 1.00 0.00 C ATOM 689 C GLU A 55 -9.894 -4.602 0.197 1.00 0.00 C ATOM 690 O GLU A 55 -9.964 -5.833 0.183 1.00 0.00 O ATOM 691 CB GLU A 55 -11.872 -3.559 1.292 1.00 0.00 C ATOM 692 CG GLU A 55 -12.573 -3.519 2.634 1.00 0.00 C ATOM 693 CD GLU A 55 -11.959 -2.530 3.599 1.00 0.00 C ATOM 694 OE1 GLU A 55 -12.196 -1.318 3.448 1.00 0.00 O ATOM 695 OE2 GLU A 55 -11.243 -2.970 4.526 1.00 0.00 O ATOM 0 H GLU A 55 -10.124 -1.763 1.192 1.00 0.00 H new ATOM 0 HA GLU A 55 -10.189 -4.432 2.280 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -12.031 -2.611 0.779 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -12.327 -4.335 0.676 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -13.622 -3.264 2.481 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -12.548 -4.514 3.079 1.00 0.00 H new ATOM 702 N LEU A 56 -9.391 -3.904 -0.805 1.00 0.00 N ATOM 703 CA LEU A 56 -8.931 -4.568 -2.006 1.00 0.00 C ATOM 704 C LEU A 56 -7.526 -5.109 -1.807 1.00 0.00 C ATOM 705 O LEU A 56 -7.179 -6.166 -2.333 1.00 0.00 O ATOM 706 CB LEU A 56 -8.975 -3.626 -3.212 1.00 0.00 C ATOM 707 CG LEU A 56 -8.847 -4.301 -4.581 1.00 0.00 C ATOM 708 CD1 LEU A 56 -9.984 -5.286 -4.806 1.00 0.00 C ATOM 709 CD2 LEU A 56 -8.824 -3.263 -5.686 1.00 0.00 C ATOM 0 H LEU A 56 -9.292 -2.889 -0.810 1.00 0.00 H new ATOM 0 HA LEU A 56 -9.603 -5.402 -2.207 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -9.914 -3.073 -3.185 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -8.172 -2.896 -3.110 1.00 0.00 H new ATOM 0 HG LEU A 56 -7.907 -4.852 -4.601 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -9.872 -5.753 -5.784 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -9.959 -6.053 -4.032 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -10.937 -4.758 -4.763 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -8.733 -3.761 -6.651 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -9.748 -2.685 -5.662 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -7.975 -2.595 -5.540 1.00 0.00 H new ATOM 721 N SER A 57 -6.728 -4.395 -1.025 1.00 0.00 N ATOM 722 CA SER A 57 -5.362 -4.805 -0.755 1.00 0.00 C ATOM 723 C SER A 57 -5.342 -6.118 0.021 1.00 0.00 C ATOM 724 O SER A 57 -4.737 -7.101 -0.419 1.00 0.00 O ATOM 725 CB SER A 57 -4.637 -3.704 0.011 1.00 0.00 C ATOM 726 OG SER A 57 -5.463 -3.179 1.032 1.00 0.00 O ATOM 0 H SER A 57 -7.006 -3.527 -0.567 1.00 0.00 H new ATOM 0 HA SER A 57 -4.844 -4.970 -1.700 1.00 0.00 H new ATOM 0 HB2 SER A 57 -3.720 -4.100 0.446 1.00 0.00 H new ATOM 0 HB3 SER A 57 -4.347 -2.908 -0.674 1.00 0.00 H new ATOM 0 HG SER A 57 -5.328 -3.690 1.857 1.00 0.00 H new ATOM 732 N ALA A 58 -6.000 -6.118 1.184 1.00 0.00 N ATOM 733 CA ALA A 58 -6.149 -7.324 2.003 1.00 0.00 C ATOM 734 C ALA A 58 -6.634 -8.520 1.172 1.00 0.00 C ATOM 735 O ALA A 58 -6.307 -9.667 1.471 1.00 0.00 O ATOM 736 CB ALA A 58 -7.110 -7.059 3.151 1.00 0.00 C ATOM 0 H ALA A 58 -6.441 -5.289 1.582 1.00 0.00 H new ATOM 0 HA ALA A 58 -5.167 -7.577 2.403 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -7.214 -7.961 3.754 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -6.722 -6.251 3.771 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -8.084 -6.775 2.752 1.00 0.00 H new ATOM 742 N LYS A 59 -7.393 -8.237 0.125 1.00 0.00 N ATOM 743 CA LYS A 59 -7.930 -9.266 -0.754 1.00 0.00 C ATOM 744 C LYS A 59 -6.823 -9.902 -1.621 1.00 0.00 C ATOM 745 O LYS A 59 -6.683 -11.128 -1.660 1.00 0.00 O ATOM 746 CB LYS A 59 -9.026 -8.657 -1.638 1.00 0.00 C ATOM 747 CG LYS A 59 -9.726 -9.637 -2.565 1.00 0.00 C ATOM 748 CD LYS A 59 -10.815 -8.933 -3.364 1.00 0.00 C ATOM 749 CE LYS A 59 -11.578 -9.896 -4.258 1.00 0.00 C ATOM 750 NZ LYS A 59 -10.725 -10.467 -5.329 1.00 0.00 N ATOM 0 H LYS A 59 -7.655 -7.287 -0.140 1.00 0.00 H new ATOM 0 HA LYS A 59 -8.357 -10.060 -0.141 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -9.773 -8.192 -0.995 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -8.585 -7.863 -2.240 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -9.001 -10.085 -3.244 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -10.162 -10.449 -1.983 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -11.510 -8.446 -2.679 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -10.367 -8.149 -3.975 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -11.986 -10.705 -3.652 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -12.424 -9.377 -4.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -11.311 -11.037 -5.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -10.274 -9.696 -5.862 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -9.991 -11.069 -4.904 1.00 0.00 H new ATOM 764 N VAL A 60 -6.046 -9.054 -2.315 1.00 0.00 N ATOM 765 CA VAL A 60 -4.961 -9.533 -3.206 1.00 0.00 C ATOM 766 C VAL A 60 -3.893 -10.346 -2.462 1.00 0.00 C ATOM 767 O VAL A 60 -3.149 -11.079 -3.079 1.00 0.00 O ATOM 768 CB VAL A 60 -4.263 -8.392 -4.020 1.00 0.00 C ATOM 769 CG1 VAL A 60 -5.264 -7.362 -4.506 1.00 0.00 C ATOM 770 CG2 VAL A 60 -3.116 -7.745 -3.241 1.00 0.00 C ATOM 0 H VAL A 60 -6.143 -8.039 -2.281 1.00 0.00 H new ATOM 0 HA VAL A 60 -5.474 -10.185 -3.913 1.00 0.00 H new ATOM 0 HB VAL A 60 -3.820 -8.856 -4.901 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -4.744 -6.585 -5.067 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -5.999 -7.845 -5.150 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -5.770 -6.914 -3.651 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -2.663 -6.960 -3.846 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -3.501 -7.314 -2.317 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -2.366 -8.499 -3.004 1.00 0.00 H new ATOM 780 N VAL A 61 -3.834 -10.203 -1.140 1.00 0.00 N ATOM 781 CA VAL A 61 -2.829 -10.926 -0.351 1.00 0.00 C ATOM 782 C VAL A 61 -3.449 -12.155 0.335 1.00 0.00 C ATOM 783 O VAL A 61 -2.811 -13.207 0.456 1.00 0.00 O ATOM 784 CB VAL A 61 -2.108 -10.013 0.690 1.00 0.00 C ATOM 785 CG1 VAL A 61 -3.076 -9.458 1.718 1.00 0.00 C ATOM 786 CG2 VAL A 61 -0.953 -10.760 1.370 1.00 0.00 C ATOM 0 H VAL A 61 -4.457 -9.605 -0.596 1.00 0.00 H new ATOM 0 HA VAL A 61 -2.066 -11.265 -1.052 1.00 0.00 H new ATOM 0 HB VAL A 61 -1.691 -9.166 0.145 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -2.535 -8.828 2.424 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -3.841 -8.866 1.215 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -3.549 -10.281 2.254 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -0.468 -10.101 2.090 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -1.341 -11.638 1.886 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -0.228 -11.072 0.618 1.00 0.00 H new ATOM 796 N GLU A 62 -4.696 -12.005 0.771 1.00 0.00 N ATOM 797 CA GLU A 62 -5.440 -13.093 1.405 1.00 0.00 C ATOM 798 C GLU A 62 -5.459 -14.341 0.515 1.00 0.00 C ATOM 799 O GLU A 62 -5.063 -15.435 0.942 1.00 0.00 O ATOM 800 CB GLU A 62 -6.867 -12.647 1.711 1.00 0.00 C ATOM 801 CG GLU A 62 -7.699 -13.690 2.425 1.00 0.00 C ATOM 802 CD GLU A 62 -9.119 -13.236 2.644 1.00 0.00 C ATOM 803 OE1 GLU A 62 -9.878 -13.167 1.663 1.00 0.00 O ATOM 804 OE2 GLU A 62 -9.491 -12.963 3.800 1.00 0.00 O ATOM 0 H GLU A 62 -5.218 -11.132 0.696 1.00 0.00 H new ATOM 0 HA GLU A 62 -4.937 -13.348 2.338 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -6.832 -11.745 2.322 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -7.361 -12.380 0.777 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -7.700 -14.612 1.843 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -7.241 -13.921 3.387 1.00 0.00 H new ATOM 811 N LYS A 63 -5.905 -14.171 -0.724 1.00 0.00 N ATOM 812 CA LYS A 63 -5.965 -15.278 -1.669 1.00 0.00 C ATOM 813 C LYS A 63 -4.601 -15.548 -2.287 1.00 0.00 C ATOM 814 O LYS A 63 -4.348 -16.630 -2.812 1.00 0.00 O ATOM 815 CB LYS A 63 -7.017 -15.029 -2.745 1.00 0.00 C ATOM 816 CG LYS A 63 -8.441 -15.123 -2.222 1.00 0.00 C ATOM 817 CD LYS A 63 -9.458 -15.013 -3.341 1.00 0.00 C ATOM 818 CE LYS A 63 -10.858 -15.336 -2.848 1.00 0.00 C ATOM 819 NZ LYS A 63 -11.853 -15.302 -3.944 1.00 0.00 N ATOM 0 H LYS A 63 -6.230 -13.279 -1.097 1.00 0.00 H new ATOM 0 HA LYS A 63 -6.261 -16.169 -1.116 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -6.860 -14.040 -3.176 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -6.883 -15.753 -3.549 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -8.575 -16.071 -1.700 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -8.614 -14.331 -1.494 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -9.439 -14.005 -3.754 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -9.188 -15.694 -4.149 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -10.861 -16.323 -2.386 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -11.144 -14.622 -2.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -12.795 -15.528 -3.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -11.869 -14.353 -4.369 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -11.595 -16.001 -4.669 1.00 0.00 H new ATOM 833 N LEU A 64 -3.734 -14.556 -2.227 1.00 0.00 N ATOM 834 CA LEU A 64 -2.365 -14.693 -2.709 1.00 0.00 C ATOM 835 C LEU A 64 -1.673 -15.831 -1.979 1.00 0.00 C ATOM 836 O LEU A 64 -1.112 -16.737 -2.597 1.00 0.00 O ATOM 837 CB LEU A 64 -1.604 -13.400 -2.473 1.00 0.00 C ATOM 838 CG LEU A 64 -0.155 -13.375 -2.914 1.00 0.00 C ATOM 839 CD1 LEU A 64 -0.073 -13.511 -4.410 1.00 0.00 C ATOM 840 CD2 LEU A 64 0.515 -12.091 -2.453 1.00 0.00 C ATOM 0 H LEU A 64 -3.953 -13.636 -1.846 1.00 0.00 H new ATOM 0 HA LEU A 64 -2.384 -14.910 -3.777 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -2.131 -12.596 -2.988 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -1.640 -13.173 -1.407 1.00 0.00 H new ATOM 0 HG LEU A 64 0.370 -14.215 -2.459 1.00 0.00 H new ATOM 0 HD11 LEU A 64 0.972 -13.492 -4.720 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -0.525 -14.455 -4.715 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -0.606 -12.685 -4.880 1.00 0.00 H new ATOM 0 HD21 LEU A 64 1.556 -12.087 -2.777 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -0.003 -11.235 -2.885 1.00 0.00 H new ATOM 0 HD23 LEU A 64 0.473 -12.029 -1.366 1.00 0.00 H new ATOM 852 N ASN A 65 -1.729 -15.780 -0.651 1.00 0.00 N ATOM 853 CA ASN A 65 -1.129 -16.808 0.188 1.00 0.00 C ATOM 854 C ASN A 65 -1.734 -18.176 -0.098 1.00 0.00 C ATOM 855 O ASN A 65 -1.090 -19.206 0.108 1.00 0.00 O ATOM 856 CB ASN A 65 -1.285 -16.445 1.661 1.00 0.00 C ATOM 857 CG ASN A 65 -0.536 -17.393 2.574 1.00 0.00 C ATOM 858 OD1 ASN A 65 0.724 -17.095 2.825 1.00 0.00 O flip ATOM 859 ND2 ASN A 65 -1.087 -18.384 3.051 1.00 0.00 N flip ATOM 0 H ASN A 65 -2.188 -15.031 -0.132 1.00 0.00 H new ATOM 0 HA ASN A 65 -0.066 -16.861 -0.047 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -0.924 -15.429 1.822 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -2.343 -16.452 1.924 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -2.064 -18.579 2.832 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -0.567 -19.010 3.666 1.00 0.00 H new ATOM 866 N GLN A 66 -2.957 -18.177 -0.606 1.00 0.00 N ATOM 867 CA GLN A 66 -3.637 -19.412 -0.941 1.00 0.00 C ATOM 868 C GLN A 66 -2.902 -20.079 -2.091 1.00 0.00 C ATOM 869 O GLN A 66 -2.633 -21.280 -2.062 1.00 0.00 O ATOM 870 CB GLN A 66 -5.089 -19.138 -1.341 1.00 0.00 C ATOM 871 CG GLN A 66 -6.061 -20.173 -0.822 1.00 0.00 C ATOM 872 CD GLN A 66 -6.157 -20.151 0.689 1.00 0.00 C ATOM 873 OE1 GLN A 66 -6.044 -18.972 1.273 1.00 0.00 O flip ATOM 874 NE2 GLN A 66 -6.352 -21.181 1.320 1.00 0.00 N flip ATOM 0 H GLN A 66 -3.497 -17.333 -0.794 1.00 0.00 H new ATOM 0 HA GLN A 66 -3.642 -20.067 -0.070 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -5.382 -18.156 -0.968 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -5.157 -19.099 -2.428 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -7.047 -19.992 -1.251 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -5.747 -21.163 -1.151 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -6.433 -22.072 0.830 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -6.433 -21.149 2.336 1.00 0.00 H new ATOM 883 N VAL A 67 -2.584 -19.274 -3.095 1.00 0.00 N ATOM 884 CA VAL A 67 -1.830 -19.711 -4.262 1.00 0.00 C ATOM 885 C VAL A 67 -0.425 -20.167 -3.866 1.00 0.00 C ATOM 886 O VAL A 67 0.018 -21.236 -4.271 1.00 0.00 O ATOM 887 CB VAL A 67 -1.726 -18.583 -5.322 1.00 0.00 C ATOM 888 CG1 VAL A 67 -0.975 -19.063 -6.558 1.00 0.00 C ATOM 889 CG2 VAL A 67 -3.112 -18.077 -5.701 1.00 0.00 C ATOM 0 H VAL A 67 -2.845 -18.288 -3.123 1.00 0.00 H new ATOM 0 HA VAL A 67 -2.370 -20.552 -4.697 1.00 0.00 H new ATOM 0 HB VAL A 67 -1.164 -17.758 -4.884 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -0.916 -18.253 -7.285 1.00 0.00 H new ATOM 0 HG12 VAL A 67 0.032 -19.371 -6.275 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -1.503 -19.909 -6.999 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -3.020 -17.286 -6.445 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -3.699 -18.898 -6.114 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -3.611 -17.685 -4.815 1.00 0.00 H new ATOM 899 N CYS A 68 0.275 -19.351 -3.069 1.00 0.00 N ATOM 900 CA CYS A 68 1.622 -19.704 -2.594 1.00 0.00 C ATOM 901 C CYS A 68 1.616 -21.060 -1.900 1.00 0.00 C ATOM 902 O CYS A 68 2.503 -21.878 -2.111 1.00 0.00 O ATOM 903 CB CYS A 68 2.150 -18.647 -1.631 1.00 0.00 C ATOM 904 SG CYS A 68 2.293 -16.978 -2.333 1.00 0.00 S ATOM 0 H CYS A 68 -0.064 -18.447 -2.740 1.00 0.00 H new ATOM 0 HA CYS A 68 2.275 -19.753 -3.465 1.00 0.00 H new ATOM 0 HB2 CYS A 68 1.492 -18.605 -0.763 1.00 0.00 H new ATOM 0 HB3 CYS A 68 3.131 -18.960 -1.273 1.00 0.00 H new ATOM 909 N ALA A 69 0.618 -21.275 -1.051 1.00 0.00 N ATOM 910 CA ALA A 69 0.447 -22.550 -0.354 1.00 0.00 C ATOM 911 C ALA A 69 0.334 -23.722 -1.338 1.00 0.00 C ATOM 912 O ALA A 69 0.660 -24.860 -1.001 1.00 0.00 O ATOM 913 CB ALA A 69 -0.778 -22.497 0.545 1.00 0.00 C ATOM 0 H ALA A 69 -0.092 -20.578 -0.826 1.00 0.00 H new ATOM 0 HA ALA A 69 1.334 -22.716 0.258 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -0.894 -23.452 1.058 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -0.655 -21.702 1.281 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -1.664 -22.299 -0.058 1.00 0.00 H new ATOM 919 N LYS A 70 -0.125 -23.435 -2.550 1.00 0.00 N ATOM 920 CA LYS A 70 -0.285 -24.458 -3.579 1.00 0.00 C ATOM 921 C LYS A 70 1.019 -24.692 -4.314 1.00 0.00 C ATOM 922 O LYS A 70 1.337 -25.819 -4.695 1.00 0.00 O ATOM 923 CB LYS A 70 -1.360 -24.045 -4.582 1.00 0.00 C ATOM 924 CG LYS A 70 -2.677 -23.673 -3.947 1.00 0.00 C ATOM 925 CD LYS A 70 -3.203 -24.799 -3.094 1.00 0.00 C ATOM 926 CE LYS A 70 -4.484 -24.410 -2.406 1.00 0.00 C ATOM 927 NZ LYS A 70 -4.255 -23.442 -1.310 1.00 0.00 N ATOM 0 H LYS A 70 -0.395 -22.497 -2.847 1.00 0.00 H new ATOM 0 HA LYS A 70 -0.586 -25.382 -3.085 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -0.995 -23.198 -5.162 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -1.524 -24.864 -5.282 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -2.551 -22.778 -3.337 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -3.403 -23.430 -4.723 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -3.373 -25.679 -3.714 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -2.456 -25.074 -2.349 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -5.169 -23.977 -3.135 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -4.966 -25.302 -2.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -5.161 -23.215 -0.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -3.608 -23.857 -0.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -3.835 -22.573 -1.697 1.00 0.00 H new ATOM 941 N ASP A 71 1.773 -23.636 -4.499 1.00 0.00 N ATOM 942 CA ASP A 71 3.031 -23.713 -5.235 1.00 0.00 C ATOM 943 C ASP A 71 4.042 -22.732 -4.641 1.00 0.00 C ATOM 944 O ASP A 71 4.081 -21.563 -5.016 1.00 0.00 O ATOM 945 CB ASP A 71 2.789 -23.401 -6.712 1.00 0.00 C ATOM 946 CG ASP A 71 3.960 -23.760 -7.589 1.00 0.00 C ATOM 947 OD1 ASP A 71 4.835 -24.528 -7.141 1.00 0.00 O ATOM 948 OD2 ASP A 71 4.002 -23.290 -8.748 1.00 0.00 O ATOM 0 H ASP A 71 1.544 -22.705 -4.152 1.00 0.00 H new ATOM 0 HA ASP A 71 3.434 -24.722 -5.153 1.00 0.00 H new ATOM 0 HB2 ASP A 71 1.907 -23.944 -7.053 1.00 0.00 H new ATOM 0 HB3 ASP A 71 2.572 -22.339 -6.822 1.00 0.00 H new ATOM 953 N PRO A 72 4.863 -23.200 -3.684 1.00 0.00 N ATOM 954 CA PRO A 72 5.816 -22.349 -2.951 1.00 0.00 C ATOM 955 C PRO A 72 7.053 -21.931 -3.759 1.00 0.00 C ATOM 956 O PRO A 72 7.804 -21.058 -3.324 1.00 0.00 O ATOM 957 CB PRO A 72 6.239 -23.226 -1.754 1.00 0.00 C ATOM 958 CG PRO A 72 5.337 -24.420 -1.791 1.00 0.00 C ATOM 959 CD PRO A 72 4.922 -24.583 -3.219 1.00 0.00 C ATOM 0 HA PRO A 72 5.347 -21.402 -2.682 1.00 0.00 H new ATOM 0 HB2 PRO A 72 7.285 -23.522 -1.835 1.00 0.00 H new ATOM 0 HB3 PRO A 72 6.133 -22.684 -0.814 1.00 0.00 H new ATOM 0 HG2 PRO A 72 5.854 -25.310 -1.431 1.00 0.00 H new ATOM 0 HG3 PRO A 72 4.470 -24.273 -1.147 1.00 0.00 H new ATOM 0 HD2 PRO A 72 5.641 -25.173 -3.787 1.00 0.00 H new ATOM 0 HD3 PRO A 72 3.958 -25.084 -3.308 1.00 0.00 H new ATOM 967 N GLN A 73 7.270 -22.554 -4.914 1.00 0.00 N ATOM 968 CA GLN A 73 8.444 -22.244 -5.750 1.00 0.00 C ATOM 969 C GLN A 73 8.469 -20.780 -6.233 1.00 0.00 C ATOM 970 O GLN A 73 9.521 -20.271 -6.633 1.00 0.00 O ATOM 971 CB GLN A 73 8.506 -23.187 -6.955 1.00 0.00 C ATOM 972 CG GLN A 73 7.478 -22.881 -8.036 1.00 0.00 C ATOM 973 CD GLN A 73 7.526 -23.870 -9.175 1.00 0.00 C ATOM 974 OE1 GLN A 73 8.282 -23.698 -10.131 1.00 0.00 O ATOM 975 NE2 GLN A 73 6.711 -24.892 -9.094 1.00 0.00 N ATOM 0 H GLN A 73 6.657 -23.273 -5.298 1.00 0.00 H new ATOM 0 HA GLN A 73 9.320 -22.390 -5.118 1.00 0.00 H new ATOM 0 HB2 GLN A 73 9.503 -23.136 -7.392 1.00 0.00 H new ATOM 0 HB3 GLN A 73 8.361 -24.211 -6.610 1.00 0.00 H new ATOM 0 HG2 GLN A 73 6.481 -22.886 -7.596 1.00 0.00 H new ATOM 0 HG3 GLN A 73 7.651 -21.877 -8.423 1.00 0.00 H new ATOM 0 HE21 GLN A 73 6.101 -24.995 -8.283 1.00 0.00 H new ATOM 0 HE22 GLN A 73 6.686 -25.585 -9.842 1.00 0.00 H new ATOM 984 N MET A 74 7.323 -20.117 -6.207 1.00 0.00 N ATOM 985 CA MET A 74 7.237 -18.730 -6.660 1.00 0.00 C ATOM 986 C MET A 74 7.774 -17.747 -5.618 1.00 0.00 C ATOM 987 O MET A 74 8.160 -18.134 -4.523 1.00 0.00 O ATOM 988 CB MET A 74 5.790 -18.367 -7.072 1.00 0.00 C ATOM 989 CG MET A 74 4.710 -18.648 -6.022 1.00 0.00 C ATOM 990 SD MET A 74 4.819 -17.591 -4.559 1.00 0.00 S ATOM 991 CE MET A 74 5.293 -18.791 -3.320 1.00 0.00 C ATOM 0 H MET A 74 6.441 -20.511 -5.879 1.00 0.00 H new ATOM 0 HA MET A 74 7.874 -18.643 -7.540 1.00 0.00 H new ATOM 0 HB2 MET A 74 5.759 -17.307 -7.324 1.00 0.00 H new ATOM 0 HB3 MET A 74 5.541 -18.918 -7.979 1.00 0.00 H new ATOM 0 HG2 MET A 74 3.729 -18.518 -6.480 1.00 0.00 H new ATOM 0 HG3 MET A 74 4.781 -19.690 -5.711 1.00 0.00 H new ATOM 0 HE1 MET A 74 5.144 -18.367 -2.327 1.00 0.00 H new ATOM 0 HE2 MET A 74 4.681 -19.686 -3.427 1.00 0.00 H new ATOM 0 HE3 MET A 74 6.343 -19.052 -3.450 1.00 0.00 H new ATOM 1001 N LEU A 75 7.811 -16.474 -5.991 1.00 0.00 N ATOM 1002 CA LEU A 75 8.252 -15.403 -5.107 1.00 0.00 C ATOM 1003 C LEU A 75 7.128 -14.387 -4.990 1.00 0.00 C ATOM 1004 O LEU A 75 6.156 -14.459 -5.745 1.00 0.00 O ATOM 1005 CB LEU A 75 9.519 -14.712 -5.656 1.00 0.00 C ATOM 1006 CG LEU A 75 10.809 -15.556 -5.702 1.00 0.00 C ATOM 1007 CD1 LEU A 75 10.775 -16.569 -6.840 1.00 0.00 C ATOM 1008 CD2 LEU A 75 12.023 -14.655 -5.831 1.00 0.00 C ATOM 0 H LEU A 75 7.535 -16.154 -6.919 1.00 0.00 H new ATOM 0 HA LEU A 75 8.496 -15.823 -4.131 1.00 0.00 H new ATOM 0 HB2 LEU A 75 9.305 -14.364 -6.667 1.00 0.00 H new ATOM 0 HB3 LEU A 75 9.713 -13.828 -5.049 1.00 0.00 H new ATOM 0 HG LEU A 75 10.877 -16.112 -4.767 1.00 0.00 H new ATOM 0 HD11 LEU A 75 11.700 -17.146 -6.842 1.00 0.00 H new ATOM 0 HD12 LEU A 75 9.928 -17.242 -6.703 1.00 0.00 H new ATOM 0 HD13 LEU A 75 10.672 -16.045 -7.790 1.00 0.00 H new ATOM 0 HD21 LEU A 75 12.926 -15.264 -5.862 1.00 0.00 H new ATOM 0 HD22 LEU A 75 11.947 -14.071 -6.748 1.00 0.00 H new ATOM 0 HD23 LEU A 75 12.069 -13.982 -4.975 1.00 0.00 H new ATOM 1020 N LEU A 76 7.254 -13.438 -4.072 1.00 0.00 N ATOM 1021 CA LEU A 76 6.218 -12.419 -3.874 1.00 0.00 C ATOM 1022 C LEU A 76 5.939 -11.654 -5.173 1.00 0.00 C ATOM 1023 O LEU A 76 4.787 -11.360 -5.496 1.00 0.00 O ATOM 1024 CB LEU A 76 6.635 -11.441 -2.773 1.00 0.00 C ATOM 1025 CG LEU A 76 5.578 -10.421 -2.351 1.00 0.00 C ATOM 1026 CD1 LEU A 76 4.365 -11.124 -1.762 1.00 0.00 C ATOM 1027 CD2 LEU A 76 6.160 -9.434 -1.351 1.00 0.00 C ATOM 0 H LEU A 76 8.059 -13.348 -3.452 1.00 0.00 H new ATOM 0 HA LEU A 76 5.303 -12.928 -3.572 1.00 0.00 H new ATOM 0 HB2 LEU A 76 6.928 -12.016 -1.895 1.00 0.00 H new ATOM 0 HB3 LEU A 76 7.520 -10.901 -3.110 1.00 0.00 H new ATOM 0 HG LEU A 76 5.260 -9.868 -3.235 1.00 0.00 H new ATOM 0 HD11 LEU A 76 3.622 -10.383 -1.467 1.00 0.00 H new ATOM 0 HD12 LEU A 76 3.934 -11.792 -2.508 1.00 0.00 H new ATOM 0 HD13 LEU A 76 4.668 -11.702 -0.889 1.00 0.00 H new ATOM 0 HD21 LEU A 76 5.394 -8.715 -1.061 1.00 0.00 H new ATOM 0 HD22 LEU A 76 6.505 -9.972 -0.468 1.00 0.00 H new ATOM 0 HD23 LEU A 76 6.999 -8.907 -1.806 1.00 0.00 H new ATOM 1039 N ILE A 77 7.002 -11.360 -5.911 1.00 0.00 N ATOM 1040 CA ILE A 77 6.901 -10.619 -7.162 1.00 0.00 C ATOM 1041 C ILE A 77 6.032 -11.345 -8.188 1.00 0.00 C ATOM 1042 O ILE A 77 5.126 -10.753 -8.765 1.00 0.00 O ATOM 1043 CB ILE A 77 8.302 -10.348 -7.771 1.00 0.00 C ATOM 1044 CG1 ILE A 77 9.134 -9.474 -6.825 1.00 0.00 C ATOM 1045 CG2 ILE A 77 8.187 -9.690 -9.148 1.00 0.00 C ATOM 1046 CD1 ILE A 77 8.514 -8.117 -6.538 1.00 0.00 C ATOM 0 H ILE A 77 7.954 -11.627 -5.661 1.00 0.00 H new ATOM 0 HA ILE A 77 6.426 -9.668 -6.920 1.00 0.00 H new ATOM 0 HB ILE A 77 8.807 -11.305 -7.898 1.00 0.00 H new ATOM 0 HG12 ILE A 77 9.274 -10.005 -5.884 1.00 0.00 H new ATOM 0 HG13 ILE A 77 10.123 -9.327 -7.258 1.00 0.00 H new ATOM 0 HG21 ILE A 77 9.184 -9.512 -9.551 1.00 0.00 H new ATOM 0 HG22 ILE A 77 7.636 -10.348 -9.821 1.00 0.00 H new ATOM 0 HG23 ILE A 77 7.658 -8.741 -9.055 1.00 0.00 H new ATOM 0 HD11 ILE A 77 9.160 -7.557 -5.862 1.00 0.00 H new ATOM 0 HD12 ILE A 77 8.399 -7.565 -7.471 1.00 0.00 H new ATOM 0 HD13 ILE A 77 7.537 -8.254 -6.075 1.00 0.00 H new ATOM 1058 N THR A 78 6.289 -12.628 -8.387 1.00 0.00 N ATOM 1059 CA THR A 78 5.551 -13.391 -9.377 1.00 0.00 C ATOM 1060 C THR A 78 4.141 -13.696 -8.885 1.00 0.00 C ATOM 1061 O THR A 78 3.185 -13.648 -9.654 1.00 0.00 O ATOM 1062 CB THR A 78 6.279 -14.700 -9.756 1.00 0.00 C ATOM 1063 OG1 THR A 78 6.601 -15.451 -8.578 1.00 0.00 O ATOM 1064 CG2 THR A 78 7.553 -14.402 -10.531 1.00 0.00 C ATOM 0 H THR A 78 6.998 -13.158 -7.880 1.00 0.00 H new ATOM 0 HA THR A 78 5.487 -12.775 -10.274 1.00 0.00 H new ATOM 0 HB THR A 78 5.611 -15.287 -10.386 1.00 0.00 H new ATOM 0 HG1 THR A 78 6.371 -14.927 -7.783 1.00 0.00 H new ATOM 0 HG21 THR A 78 8.050 -15.338 -10.788 1.00 0.00 H new ATOM 0 HG22 THR A 78 7.305 -13.860 -11.444 1.00 0.00 H new ATOM 0 HG23 THR A 78 8.218 -13.794 -9.918 1.00 0.00 H new ATOM 1072 N ALA A 79 4.033 -14.022 -7.602 1.00 0.00 N ATOM 1073 CA ALA A 79 2.748 -14.286 -6.962 1.00 0.00 C ATOM 1074 C ALA A 79 1.740 -13.143 -7.201 1.00 0.00 C ATOM 1075 O ALA A 79 0.677 -13.360 -7.793 1.00 0.00 O ATOM 1076 CB ALA A 79 2.951 -14.537 -5.476 1.00 0.00 C ATOM 0 H ALA A 79 4.833 -14.111 -6.976 1.00 0.00 H new ATOM 0 HA ALA A 79 2.322 -15.181 -7.416 1.00 0.00 H new ATOM 0 HB1 ALA A 79 1.988 -14.733 -5.005 1.00 0.00 H new ATOM 0 HB2 ALA A 79 3.604 -15.399 -5.338 1.00 0.00 H new ATOM 0 HB3 ALA A 79 3.407 -13.659 -5.018 1.00 0.00 H new ATOM 1082 N ILE A 80 2.069 -11.929 -6.735 1.00 0.00 N ATOM 1083 CA ILE A 80 1.207 -10.769 -6.946 1.00 0.00 C ATOM 1084 C ILE A 80 0.993 -10.523 -8.445 1.00 0.00 C ATOM 1085 O ILE A 80 -0.109 -10.178 -8.883 1.00 0.00 O ATOM 1086 CB ILE A 80 1.805 -9.498 -6.298 1.00 0.00 C ATOM 1087 CG1 ILE A 80 2.039 -9.725 -4.801 1.00 0.00 C ATOM 1088 CG2 ILE A 80 0.889 -8.301 -6.516 1.00 0.00 C ATOM 1089 CD1 ILE A 80 2.683 -8.550 -4.096 1.00 0.00 C ATOM 0 H ILE A 80 2.923 -11.731 -6.213 1.00 0.00 H new ATOM 0 HA ILE A 80 0.249 -10.984 -6.473 1.00 0.00 H new ATOM 0 HB ILE A 80 2.763 -9.287 -6.774 1.00 0.00 H new ATOM 0 HG12 ILE A 80 1.084 -9.944 -4.323 1.00 0.00 H new ATOM 0 HG13 ILE A 80 2.670 -10.604 -4.671 1.00 0.00 H new ATOM 0 HG21 ILE A 80 1.328 -7.418 -6.052 1.00 0.00 H new ATOM 0 HG22 ILE A 80 0.766 -8.127 -7.585 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -0.084 -8.501 -6.067 1.00 0.00 H new ATOM 0 HD11 ILE A 80 2.816 -8.787 -3.040 1.00 0.00 H new ATOM 0 HD12 ILE A 80 3.654 -8.343 -4.546 1.00 0.00 H new ATOM 0 HD13 ILE A 80 2.044 -7.673 -4.193 1.00 0.00 H new ATOM 1101 N ASP A 81 2.050 -10.736 -9.223 1.00 0.00 N ATOM 1102 CA ASP A 81 2.007 -10.564 -10.679 1.00 0.00 C ATOM 1103 C ASP A 81 0.978 -11.516 -11.311 1.00 0.00 C ATOM 1104 O ASP A 81 0.358 -11.202 -12.320 1.00 0.00 O ATOM 1105 CB ASP A 81 3.398 -10.817 -11.267 1.00 0.00 C ATOM 1106 CG ASP A 81 3.489 -10.545 -12.754 1.00 0.00 C ATOM 1107 OD1 ASP A 81 3.750 -9.382 -13.136 1.00 0.00 O ATOM 1108 OD2 ASP A 81 3.344 -11.498 -13.545 1.00 0.00 O ATOM 0 H ASP A 81 2.959 -11.032 -8.868 1.00 0.00 H new ATOM 0 HA ASP A 81 1.702 -9.542 -10.903 1.00 0.00 H new ATOM 0 HB2 ASP A 81 4.122 -10.190 -10.747 1.00 0.00 H new ATOM 0 HB3 ASP A 81 3.680 -11.853 -11.078 1.00 0.00 H new ATOM 1113 N ASP A 82 0.798 -12.667 -10.695 1.00 0.00 N ATOM 1114 CA ASP A 82 -0.171 -13.652 -11.166 1.00 0.00 C ATOM 1115 C ASP A 82 -1.569 -13.323 -10.645 1.00 0.00 C ATOM 1116 O ASP A 82 -2.576 -13.613 -11.293 1.00 0.00 O ATOM 1117 CB ASP A 82 0.244 -15.063 -10.742 1.00 0.00 C ATOM 1118 CG ASP A 82 -0.645 -16.133 -11.343 1.00 0.00 C ATOM 1119 OD1 ASP A 82 -0.679 -16.253 -12.582 1.00 0.00 O ATOM 1120 OD2 ASP A 82 -1.311 -16.860 -10.580 1.00 0.00 O ATOM 0 H ASP A 82 1.311 -12.950 -9.860 1.00 0.00 H new ATOM 0 HA ASP A 82 -0.194 -13.615 -12.255 1.00 0.00 H new ATOM 0 HB2 ASP A 82 1.276 -15.241 -11.043 1.00 0.00 H new ATOM 0 HB3 ASP A 82 0.212 -15.137 -9.655 1.00 0.00 H new ATOM 1125 N THR A 83 -1.626 -12.688 -9.481 1.00 0.00 N ATOM 1126 CA THR A 83 -2.888 -12.298 -8.886 1.00 0.00 C ATOM 1127 C THR A 83 -3.519 -11.169 -9.696 1.00 0.00 C ATOM 1128 O THR A 83 -4.727 -11.155 -9.932 1.00 0.00 O ATOM 1129 CB THR A 83 -2.693 -11.858 -7.424 1.00 0.00 C ATOM 1130 OG1 THR A 83 -2.044 -12.906 -6.700 1.00 0.00 O ATOM 1131 CG2 THR A 83 -4.033 -11.542 -6.765 1.00 0.00 C ATOM 0 H THR A 83 -0.805 -12.433 -8.931 1.00 0.00 H new ATOM 0 HA THR A 83 -3.554 -13.161 -8.896 1.00 0.00 H new ATOM 0 HB THR A 83 -2.081 -10.956 -7.411 1.00 0.00 H new ATOM 0 HG1 THR A 83 -1.125 -13.008 -7.025 1.00 0.00 H new ATOM 0 HG21 THR A 83 -3.867 -11.234 -5.733 1.00 0.00 H new ATOM 0 HG22 THR A 83 -4.525 -10.736 -7.310 1.00 0.00 H new ATOM 0 HG23 THR A 83 -4.665 -12.430 -6.781 1.00 0.00 H new ATOM 1139 N MET A 84 -2.685 -10.241 -10.157 1.00 0.00 N ATOM 1140 CA MET A 84 -3.160 -9.147 -10.989 1.00 0.00 C ATOM 1141 C MET A 84 -3.616 -9.678 -12.339 1.00 0.00 C ATOM 1142 O MET A 84 -4.496 -9.102 -12.983 1.00 0.00 O ATOM 1143 CB MET A 84 -2.093 -8.066 -11.174 1.00 0.00 C ATOM 1144 CG MET A 84 -0.738 -8.589 -11.566 1.00 0.00 C ATOM 1145 SD MET A 84 0.263 -7.360 -12.391 1.00 0.00 S ATOM 1146 CE MET A 84 -0.654 -7.192 -13.914 1.00 0.00 C ATOM 0 H MET A 84 -1.683 -10.227 -9.968 1.00 0.00 H new ATOM 0 HA MET A 84 -4.006 -8.686 -10.479 1.00 0.00 H new ATOM 0 HB2 MET A 84 -2.432 -7.365 -11.936 1.00 0.00 H new ATOM 0 HB3 MET A 84 -1.997 -7.505 -10.245 1.00 0.00 H new ATOM 0 HG2 MET A 84 -0.216 -8.938 -10.675 1.00 0.00 H new ATOM 0 HG3 MET A 84 -0.861 -9.451 -12.222 1.00 0.00 H new ATOM 0 HE1 MET A 84 0.025 -6.907 -14.718 1.00 0.00 H new ATOM 0 HE2 MET A 84 -1.128 -8.142 -14.160 1.00 0.00 H new ATOM 0 HE3 MET A 84 -1.419 -6.425 -13.795 1.00 0.00 H new ATOM 1156 N ARG A 85 -3.014 -10.785 -12.763 1.00 0.00 N ATOM 1157 CA ARG A 85 -3.408 -11.446 -13.995 1.00 0.00 C ATOM 1158 C ARG A 85 -4.796 -12.031 -13.831 1.00 0.00 C ATOM 1159 O ARG A 85 -5.650 -11.858 -14.686 1.00 0.00 O ATOM 1160 CB ARG A 85 -2.413 -12.542 -14.374 1.00 0.00 C ATOM 1161 CG ARG A 85 -1.113 -12.024 -14.963 1.00 0.00 C ATOM 1162 CD ARG A 85 -0.099 -13.145 -15.135 1.00 0.00 C ATOM 1163 NE ARG A 85 -0.632 -14.268 -15.904 1.00 0.00 N ATOM 1164 CZ ARG A 85 -0.122 -15.502 -15.881 1.00 0.00 C ATOM 1165 NH1 ARG A 85 0.956 -15.773 -15.146 1.00 0.00 N ATOM 1166 NH2 ARG A 85 -0.687 -16.462 -16.595 1.00 0.00 N ATOM 0 H ARG A 85 -2.249 -11.242 -12.267 1.00 0.00 H new ATOM 0 HA ARG A 85 -3.415 -10.710 -14.799 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -2.187 -13.135 -13.488 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -2.884 -13.212 -15.094 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -1.309 -11.557 -15.928 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -0.699 -11.253 -14.314 1.00 0.00 H new ATOM 0 HD2 ARG A 85 0.788 -12.755 -15.635 1.00 0.00 H new ATOM 0 HD3 ARG A 85 0.217 -13.498 -14.154 1.00 0.00 H new ATOM 0 HE ARG A 85 -1.445 -14.098 -16.496 1.00 0.00 H new ATOM 0 HH11 ARG A 85 1.397 -15.036 -14.596 1.00 0.00 H new ATOM 0 HH12 ARG A 85 1.340 -16.718 -15.133 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -1.510 -16.259 -17.162 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -0.299 -17.405 -16.579 1.00 0.00 H new ATOM 1180 N ALA A 86 -5.014 -12.701 -12.702 1.00 0.00 N ATOM 1181 CA ALA A 86 -6.309 -13.292 -12.393 1.00 0.00 C ATOM 1182 C ALA A 86 -7.393 -12.221 -12.332 1.00 0.00 C ATOM 1183 O ALA A 86 -8.532 -12.450 -12.743 1.00 0.00 O ATOM 1184 CB ALA A 86 -6.241 -14.058 -11.079 1.00 0.00 C ATOM 0 H ALA A 86 -4.305 -12.847 -11.984 1.00 0.00 H new ATOM 0 HA ALA A 86 -6.566 -13.990 -13.190 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -7.216 -14.494 -10.861 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -5.498 -14.852 -11.159 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -5.960 -13.377 -10.275 1.00 0.00 H new ATOM 1190 N ILE A 87 -7.032 -11.047 -11.817 1.00 0.00 N ATOM 1191 CA ILE A 87 -7.963 -9.923 -11.752 1.00 0.00 C ATOM 1192 C ILE A 87 -8.279 -9.412 -13.160 1.00 0.00 C ATOM 1193 O ILE A 87 -9.423 -9.096 -13.475 1.00 0.00 O ATOM 1194 CB ILE A 87 -7.402 -8.758 -10.892 1.00 0.00 C ATOM 1195 CG1 ILE A 87 -7.180 -9.220 -9.447 1.00 0.00 C ATOM 1196 CG2 ILE A 87 -8.345 -7.555 -10.928 1.00 0.00 C ATOM 1197 CD1 ILE A 87 -6.603 -8.145 -8.548 1.00 0.00 C ATOM 0 H ILE A 87 -6.105 -10.850 -11.440 1.00 0.00 H new ATOM 0 HA ILE A 87 -8.876 -10.286 -11.279 1.00 0.00 H new ATOM 0 HB ILE A 87 -6.443 -8.453 -11.312 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -8.130 -9.557 -9.032 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -6.510 -10.079 -9.448 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -7.932 -6.751 -10.319 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -8.457 -7.211 -11.956 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -9.319 -7.845 -10.535 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -6.473 -8.543 -7.542 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -5.637 -7.824 -8.939 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -7.283 -7.294 -8.516 1.00 0.00 H new ATOM 1282 N LEU B 9 -17.172 12.251 -0.181 1.00 0.00 N ATOM 1283 CA LEU B 9 -16.390 11.091 -0.557 1.00 0.00 C ATOM 1284 C LEU B 9 -16.555 9.977 0.477 1.00 0.00 C ATOM 1285 O LEU B 9 -17.003 10.232 1.598 1.00 0.00 O ATOM 1286 CB LEU B 9 -14.912 11.492 -0.656 1.00 0.00 C ATOM 1287 CG LEU B 9 -14.582 12.563 -1.698 1.00 0.00 C ATOM 1288 CD1 LEU B 9 -13.187 13.123 -1.466 1.00 0.00 C ATOM 1289 CD2 LEU B 9 -14.697 11.990 -3.104 1.00 0.00 C ATOM 0 HA LEU B 9 -16.739 10.722 -1.521 1.00 0.00 H new ATOM 0 HB2 LEU B 9 -14.586 11.849 0.321 1.00 0.00 H new ATOM 0 HB3 LEU B 9 -14.327 10.600 -0.881 1.00 0.00 H new ATOM 0 HG LEU B 9 -15.301 13.376 -1.595 1.00 0.00 H new ATOM 0 HD11 LEU B 9 -12.971 13.883 -2.217 1.00 0.00 H new ATOM 0 HD12 LEU B 9 -13.134 13.569 -0.473 1.00 0.00 H new ATOM 0 HD13 LEU B 9 -12.455 12.319 -1.542 1.00 0.00 H new ATOM 0 HD21 LEU B 9 -14.459 12.765 -3.833 1.00 0.00 H new ATOM 0 HD22 LEU B 9 -14.000 11.159 -3.217 1.00 0.00 H new ATOM 0 HD23 LEU B 9 -15.714 11.635 -3.270 1.00 0.00 H new ATOM 1301 N PRO B 10 -16.223 8.715 0.103 1.00 0.00 N ATOM 1302 CA PRO B 10 -16.255 7.578 1.037 1.00 0.00 C ATOM 1303 C PRO B 10 -15.423 7.871 2.285 1.00 0.00 C ATOM 1304 O PRO B 10 -14.443 8.597 2.204 1.00 0.00 O ATOM 1305 CB PRO B 10 -15.610 6.445 0.232 1.00 0.00 C ATOM 1306 CG PRO B 10 -15.865 6.802 -1.190 1.00 0.00 C ATOM 1307 CD PRO B 10 -15.819 8.302 -1.257 1.00 0.00 C ATOM 0 HA PRO B 10 -17.261 7.349 1.387 1.00 0.00 H new ATOM 0 HB2 PRO B 10 -14.542 6.372 0.437 1.00 0.00 H new ATOM 0 HB3 PRO B 10 -16.050 5.480 0.483 1.00 0.00 H new ATOM 0 HG2 PRO B 10 -15.114 6.359 -1.844 1.00 0.00 H new ATOM 0 HG3 PRO B 10 -16.834 6.427 -1.518 1.00 0.00 H new ATOM 0 HD2 PRO B 10 -14.822 8.663 -1.508 1.00 0.00 H new ATOM 0 HD3 PRO B 10 -16.499 8.692 -2.015 1.00 0.00 H new ATOM 1315 N SER B 11 -15.814 7.287 3.419 1.00 0.00 N ATOM 1316 CA SER B 11 -15.151 7.521 4.717 1.00 0.00 C ATOM 1317 C SER B 11 -13.615 7.526 4.608 1.00 0.00 C ATOM 1318 O SER B 11 -12.958 8.460 5.066 1.00 0.00 O ATOM 1319 CB SER B 11 -15.607 6.466 5.723 1.00 0.00 C ATOM 1320 OG SER B 11 -15.538 5.168 5.155 1.00 0.00 O ATOM 0 H SER B 11 -16.599 6.637 3.471 1.00 0.00 H new ATOM 0 HA SER B 11 -15.444 8.514 5.059 1.00 0.00 H new ATOM 0 HB2 SER B 11 -14.981 6.512 6.614 1.00 0.00 H new ATOM 0 HB3 SER B 11 -16.629 6.676 6.040 1.00 0.00 H new ATOM 0 HG SER B 11 -15.832 4.506 5.815 1.00 0.00 H new ATOM 1326 N GLU B 12 -13.074 6.489 3.988 1.00 0.00 N ATOM 1327 CA GLU B 12 -11.628 6.343 3.790 1.00 0.00 C ATOM 1328 C GLU B 12 -11.009 7.576 3.091 1.00 0.00 C ATOM 1329 O GLU B 12 -9.956 8.065 3.483 1.00 0.00 O ATOM 1330 CB GLU B 12 -11.361 5.071 2.969 1.00 0.00 C ATOM 1331 CG GLU B 12 -12.172 4.997 1.674 1.00 0.00 C ATOM 1332 CD GLU B 12 -11.963 3.710 0.910 1.00 0.00 C ATOM 1333 OE1 GLU B 12 -10.901 3.550 0.290 1.00 0.00 O ATOM 1334 OE2 GLU B 12 -12.879 2.861 0.912 1.00 0.00 O ATOM 0 H GLU B 12 -13.621 5.719 3.604 1.00 0.00 H new ATOM 0 HA GLU B 12 -11.154 6.263 4.768 1.00 0.00 H new ATOM 0 HB2 GLU B 12 -10.299 5.021 2.727 1.00 0.00 H new ATOM 0 HB3 GLU B 12 -11.589 4.199 3.581 1.00 0.00 H new ATOM 0 HG2 GLU B 12 -13.231 5.103 1.910 1.00 0.00 H new ATOM 0 HG3 GLU B 12 -11.902 5.838 1.036 1.00 0.00 H new ATOM 1341 N THR B 13 -11.687 8.061 2.071 1.00 0.00 N ATOM 1342 CA THR B 13 -11.225 9.194 1.279 1.00 0.00 C ATOM 1343 C THR B 13 -11.651 10.540 1.905 1.00 0.00 C ATOM 1344 O THR B 13 -11.143 11.601 1.545 1.00 0.00 O ATOM 1345 CB THR B 13 -11.833 9.090 -0.133 1.00 0.00 C ATOM 1346 OG1 THR B 13 -11.776 7.726 -0.576 1.00 0.00 O ATOM 1347 CG2 THR B 13 -11.088 9.962 -1.121 1.00 0.00 C ATOM 0 H THR B 13 -12.582 7.681 1.762 1.00 0.00 H new ATOM 0 HA THR B 13 -10.136 9.165 1.243 1.00 0.00 H new ATOM 0 HB THR B 13 -12.867 9.432 -0.083 1.00 0.00 H new ATOM 0 HG1 THR B 13 -12.164 7.657 -1.473 1.00 0.00 H new ATOM 0 HG21 THR B 13 -11.543 9.865 -2.107 1.00 0.00 H new ATOM 0 HG22 THR B 13 -11.139 11.002 -0.799 1.00 0.00 H new ATOM 0 HG23 THR B 13 -10.045 9.648 -1.170 1.00 0.00 H new ATOM 1355 N TYR B 14 -12.555 10.465 2.852 1.00 0.00 N ATOM 1356 CA TYR B 14 -13.164 11.645 3.459 1.00 0.00 C ATOM 1357 C TYR B 14 -12.466 12.087 4.754 1.00 0.00 C ATOM 1358 O TYR B 14 -12.600 13.238 5.173 1.00 0.00 O ATOM 1359 CB TYR B 14 -14.658 11.363 3.719 1.00 0.00 C ATOM 1360 CG TYR B 14 -15.336 12.340 4.649 1.00 0.00 C ATOM 1361 CD1 TYR B 14 -15.880 13.525 4.176 1.00 0.00 C ATOM 1362 CD2 TYR B 14 -15.428 12.072 6.010 1.00 0.00 C ATOM 1363 CE1 TYR B 14 -16.493 14.416 5.035 1.00 0.00 C ATOM 1364 CE2 TYR B 14 -16.036 12.951 6.870 1.00 0.00 C ATOM 1365 CZ TYR B 14 -16.568 14.123 6.382 1.00 0.00 C ATOM 1366 OH TYR B 14 -17.178 15.006 7.244 1.00 0.00 O ATOM 0 H TYR B 14 -12.897 9.582 3.232 1.00 0.00 H new ATOM 0 HA TYR B 14 -13.050 12.472 2.758 1.00 0.00 H new ATOM 0 HB2 TYR B 14 -15.185 11.366 2.765 1.00 0.00 H new ATOM 0 HB3 TYR B 14 -14.757 10.360 4.134 1.00 0.00 H new ATOM 0 HD1 TYR B 14 -15.823 13.754 3.122 1.00 0.00 H new ATOM 0 HD2 TYR B 14 -15.013 11.154 6.398 1.00 0.00 H new ATOM 0 HE1 TYR B 14 -16.911 15.336 4.655 1.00 0.00 H new ATOM 0 HE2 TYR B 14 -16.097 12.725 7.924 1.00 0.00 H new ATOM 0 HH TYR B 14 -17.146 14.648 8.156 1.00 0.00 H new ATOM 1376 N ILE B 15 -11.710 11.209 5.373 1.00 0.00 N ATOM 1377 CA ILE B 15 -11.106 11.543 6.653 1.00 0.00 C ATOM 1378 C ILE B 15 -9.767 12.253 6.486 1.00 0.00 C ATOM 1379 O ILE B 15 -9.247 12.371 5.377 1.00 0.00 O ATOM 1380 CB ILE B 15 -10.964 10.300 7.588 1.00 0.00 C ATOM 1381 CG1 ILE B 15 -10.329 9.097 6.865 1.00 0.00 C ATOM 1382 CG2 ILE B 15 -12.318 9.916 8.164 1.00 0.00 C ATOM 1383 CD1 ILE B 15 -8.829 9.192 6.679 1.00 0.00 C ATOM 0 H ILE B 15 -11.498 10.274 5.024 1.00 0.00 H new ATOM 0 HA ILE B 15 -11.792 12.237 7.138 1.00 0.00 H new ATOM 0 HB ILE B 15 -10.293 10.580 8.400 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -10.555 8.191 7.428 1.00 0.00 H new ATOM 0 HG13 ILE B 15 -10.797 8.990 5.886 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -12.204 9.048 8.814 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -12.718 10.750 8.740 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -13.003 9.674 7.352 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -8.469 8.302 6.162 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -8.591 10.077 6.088 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -8.346 9.265 7.653 1.00 0.00 H new ATOM 1395 N THR B 16 -9.224 12.738 7.586 1.00 0.00 N ATOM 1396 CA THR B 16 -7.949 13.420 7.566 1.00 0.00 C ATOM 1397 C THR B 16 -6.870 12.509 8.145 1.00 0.00 C ATOM 1398 O THR B 16 -7.180 11.547 8.853 1.00 0.00 O ATOM 1399 CB THR B 16 -8.005 14.762 8.351 1.00 0.00 C ATOM 1400 OG1 THR B 16 -6.708 15.368 8.396 1.00 0.00 O ATOM 1401 CG2 THR B 16 -8.517 14.553 9.766 1.00 0.00 C ATOM 0 H THR B 16 -9.651 12.670 8.510 1.00 0.00 H new ATOM 0 HA THR B 16 -7.706 13.658 6.530 1.00 0.00 H new ATOM 0 HB THR B 16 -8.696 15.422 7.827 1.00 0.00 H new ATOM 0 HG1 THR B 16 -6.538 15.840 7.554 1.00 0.00 H new ATOM 0 HG21 THR B 16 -8.544 15.509 10.288 1.00 0.00 H new ATOM 0 HG22 THR B 16 -9.521 14.130 9.731 1.00 0.00 H new ATOM 0 HG23 THR B 16 -7.854 13.869 10.296 1.00 0.00 H new ATOM 1409 N CYS B 17 -5.610 12.814 7.863 1.00 0.00 N ATOM 1410 CA CYS B 17 -4.520 11.969 8.314 1.00 0.00 C ATOM 1411 C CYS B 17 -4.355 12.052 9.824 1.00 0.00 C ATOM 1412 O CYS B 17 -3.815 11.142 10.449 1.00 0.00 O ATOM 1413 CB CYS B 17 -3.215 12.334 7.617 1.00 0.00 C ATOM 1414 SG CYS B 17 -2.295 13.701 8.386 1.00 0.00 S ATOM 0 H CYS B 17 -5.322 13.634 7.329 1.00 0.00 H new ATOM 0 HA CYS B 17 -4.771 10.941 8.051 1.00 0.00 H new ATOM 0 HB2 CYS B 17 -2.574 11.453 7.592 1.00 0.00 H new ATOM 0 HB3 CYS B 17 -3.434 12.599 6.583 1.00 0.00 H new ATOM 1419 N ALA B 18 -4.840 13.145 10.409 1.00 0.00 N ATOM 1420 CA ALA B 18 -4.784 13.319 11.848 1.00 0.00 C ATOM 1421 C ALA B 18 -5.585 12.219 12.529 1.00 0.00 C ATOM 1422 O ALA B 18 -5.117 11.575 13.471 1.00 0.00 O ATOM 1423 CB ALA B 18 -5.314 14.692 12.239 1.00 0.00 C ATOM 0 H ALA B 18 -5.274 13.918 9.905 1.00 0.00 H new ATOM 0 HA ALA B 18 -3.746 13.252 12.175 1.00 0.00 H new ATOM 0 HB1 ALA B 18 -5.265 14.806 13.322 1.00 0.00 H new ATOM 0 HB2 ALA B 18 -4.708 15.464 11.765 1.00 0.00 H new ATOM 0 HB3 ALA B 18 -6.349 14.790 11.910 1.00 0.00 H new ATOM 1429 N GLU B 19 -6.798 12.003 12.042 1.00 0.00 N ATOM 1430 CA GLU B 19 -7.657 10.960 12.561 1.00 0.00 C ATOM 1431 C GLU B 19 -7.186 9.584 12.078 1.00 0.00 C ATOM 1432 O GLU B 19 -7.486 8.562 12.700 1.00 0.00 O ATOM 1433 CB GLU B 19 -9.106 11.222 12.142 1.00 0.00 C ATOM 1434 CG GLU B 19 -10.123 10.309 12.801 1.00 0.00 C ATOM 1435 CD GLU B 19 -11.542 10.760 12.556 1.00 0.00 C ATOM 1436 OE1 GLU B 19 -12.029 11.624 13.312 1.00 0.00 O ATOM 1437 OE2 GLU B 19 -12.181 10.260 11.617 1.00 0.00 O ATOM 0 H GLU B 19 -7.208 12.544 11.281 1.00 0.00 H new ATOM 0 HA GLU B 19 -7.605 10.967 13.650 1.00 0.00 H new ATOM 0 HB2 GLU B 19 -9.358 12.256 12.377 1.00 0.00 H new ATOM 0 HB3 GLU B 19 -9.184 11.112 11.060 1.00 0.00 H new ATOM 0 HG2 GLU B 19 -9.996 9.295 12.423 1.00 0.00 H new ATOM 0 HG3 GLU B 19 -9.935 10.275 13.874 1.00 0.00 H new ATOM 1444 N ALA B 20 -6.424 9.565 10.977 1.00 0.00 N ATOM 1445 CA ALA B 20 -5.896 8.328 10.444 1.00 0.00 C ATOM 1446 C ALA B 20 -4.924 7.696 11.433 1.00 0.00 C ATOM 1447 O ALA B 20 -4.783 6.486 11.486 1.00 0.00 O ATOM 1448 CB ALA B 20 -5.219 8.565 9.104 1.00 0.00 C ATOM 0 H ALA B 20 -6.166 10.398 10.447 1.00 0.00 H new ATOM 0 HA ALA B 20 -6.726 7.639 10.287 1.00 0.00 H new ATOM 0 HB1 ALA B 20 -4.829 7.622 8.721 1.00 0.00 H new ATOM 0 HB2 ALA B 20 -5.943 8.972 8.398 1.00 0.00 H new ATOM 0 HB3 ALA B 20 -4.399 9.272 9.231 1.00 0.00 H new ATOM 1454 N ASN B 21 -4.281 8.539 12.235 1.00 0.00 N ATOM 1455 CA ASN B 21 -3.353 8.064 13.259 1.00 0.00 C ATOM 1456 C ASN B 21 -4.125 7.454 14.412 1.00 0.00 C ATOM 1457 O ASN B 21 -3.731 6.433 14.969 1.00 0.00 O ATOM 1458 CB ASN B 21 -2.465 9.204 13.769 1.00 0.00 C ATOM 1459 CG ASN B 21 -1.378 9.606 12.785 1.00 0.00 C ATOM 1460 OD1 ASN B 21 -0.816 8.636 12.082 1.00 0.00 O flip ATOM 1461 ND2 ASN B 21 -1.020 10.778 12.688 1.00 0.00 N flip ATOM 0 H ASN B 21 -4.384 9.553 12.197 1.00 0.00 H new ATOM 0 HA ASN B 21 -2.710 7.306 12.812 1.00 0.00 H new ATOM 0 HB2 ASN B 21 -3.088 10.072 13.986 1.00 0.00 H new ATOM 0 HB3 ASN B 21 -2.002 8.902 14.708 1.00 0.00 H new ATOM 0 HD21 ASN B 21 -1.477 11.499 13.246 1.00 0.00 H new ATOM 0 HD22 ASN B 21 -0.266 11.030 12.049 1.00 0.00 H new ATOM 1468 N GLU B 22 -5.222 8.103 14.770 1.00 0.00 N ATOM 1469 CA GLU B 22 -6.102 7.616 15.826 1.00 0.00 C ATOM 1470 C GLU B 22 -6.608 6.211 15.498 1.00 0.00 C ATOM 1471 O GLU B 22 -6.475 5.294 16.303 1.00 0.00 O ATOM 1472 CB GLU B 22 -7.280 8.572 16.023 1.00 0.00 C ATOM 1473 CG GLU B 22 -6.863 9.985 16.407 1.00 0.00 C ATOM 1474 CD GLU B 22 -6.088 10.034 17.706 1.00 0.00 C ATOM 1475 OE1 GLU B 22 -6.720 10.034 18.779 1.00 0.00 O ATOM 1476 OE2 GLU B 22 -4.839 10.076 17.662 1.00 0.00 O ATOM 0 H GLU B 22 -5.528 8.977 14.341 1.00 0.00 H new ATOM 0 HA GLU B 22 -5.532 7.570 16.754 1.00 0.00 H new ATOM 0 HB2 GLU B 22 -7.862 8.612 15.102 1.00 0.00 H new ATOM 0 HB3 GLU B 22 -7.935 8.173 16.797 1.00 0.00 H new ATOM 0 HG2 GLU B 22 -6.253 10.409 15.609 1.00 0.00 H new ATOM 0 HG3 GLU B 22 -7.752 10.610 16.495 1.00 0.00 H new ATOM 1483 N MET B 23 -7.169 6.050 14.308 1.00 0.00 N ATOM 1484 CA MET B 23 -7.673 4.748 13.872 1.00 0.00 C ATOM 1485 C MET B 23 -6.526 3.750 13.657 1.00 0.00 C ATOM 1486 O MET B 23 -6.680 2.562 13.913 1.00 0.00 O ATOM 1487 CB MET B 23 -8.532 4.891 12.602 1.00 0.00 C ATOM 1488 CG MET B 23 -7.836 5.598 11.456 1.00 0.00 C ATOM 1489 SD MET B 23 -8.931 5.947 10.066 1.00 0.00 S ATOM 1490 CE MET B 23 -9.374 4.292 9.555 1.00 0.00 C ATOM 0 H MET B 23 -7.288 6.800 13.627 1.00 0.00 H new ATOM 0 HA MET B 23 -8.308 4.352 14.665 1.00 0.00 H new ATOM 0 HB2 MET B 23 -8.837 3.899 12.270 1.00 0.00 H new ATOM 0 HB3 MET B 23 -9.442 5.437 12.852 1.00 0.00 H new ATOM 0 HG2 MET B 23 -7.411 6.534 11.819 1.00 0.00 H new ATOM 0 HG3 MET B 23 -7.005 4.984 11.110 1.00 0.00 H new ATOM 0 HE1 MET B 23 -9.854 4.329 8.577 1.00 0.00 H new ATOM 0 HE2 MET B 23 -8.476 3.677 9.495 1.00 0.00 H new ATOM 0 HE3 MET B 23 -10.063 3.859 10.281 1.00 0.00 H new ATOM 1500 N ALA B 24 -5.385 4.249 13.173 1.00 0.00 N ATOM 1501 CA ALA B 24 -4.171 3.430 12.986 1.00 0.00 C ATOM 1502 C ALA B 24 -3.786 2.685 14.266 1.00 0.00 C ATOM 1503 O ALA B 24 -3.148 1.641 14.216 1.00 0.00 O ATOM 1504 CB ALA B 24 -3.005 4.282 12.513 1.00 0.00 C ATOM 0 H ALA B 24 -5.271 5.225 12.900 1.00 0.00 H new ATOM 0 HA ALA B 24 -4.402 2.691 12.219 1.00 0.00 H new ATOM 0 HB1 ALA B 24 -2.124 3.653 12.383 1.00 0.00 H new ATOM 0 HB2 ALA B 24 -3.259 4.751 11.562 1.00 0.00 H new ATOM 0 HB3 ALA B 24 -2.794 5.054 13.253 1.00 0.00 H new ATOM 1510 N LYS B 25 -4.160 3.238 15.406 1.00 0.00 N ATOM 1511 CA LYS B 25 -3.891 2.604 16.697 1.00 0.00 C ATOM 1512 C LYS B 25 -4.662 1.288 16.830 1.00 0.00 C ATOM 1513 O LYS B 25 -4.306 0.427 17.628 1.00 0.00 O ATOM 1514 CB LYS B 25 -4.254 3.553 17.838 1.00 0.00 C ATOM 1515 CG LYS B 25 -3.516 4.881 17.783 1.00 0.00 C ATOM 1516 CD LYS B 25 -4.059 5.857 18.811 1.00 0.00 C ATOM 1517 CE LYS B 25 -3.441 7.239 18.646 1.00 0.00 C ATOM 1518 NZ LYS B 25 -1.984 7.241 18.911 1.00 0.00 N ATOM 0 H LYS B 25 -4.653 4.128 15.470 1.00 0.00 H new ATOM 0 HA LYS B 25 -2.826 2.380 16.753 1.00 0.00 H new ATOM 0 HB2 LYS B 25 -5.327 3.742 17.815 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -4.037 3.065 18.788 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -2.453 4.716 17.961 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -3.610 5.311 16.786 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -5.142 5.927 18.712 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -3.854 5.483 19.814 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -3.624 7.597 17.633 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -3.932 7.937 19.324 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -1.622 8.214 18.852 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -1.804 6.861 19.862 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -1.502 6.649 18.205 1.00 0.00 H new ATOM 1532 N THR B 26 -5.713 1.145 16.038 1.00 0.00 N ATOM 1533 CA THR B 26 -6.517 -0.063 16.037 1.00 0.00 C ATOM 1534 C THR B 26 -6.319 -0.826 14.724 1.00 0.00 C ATOM 1535 O THR B 26 -6.237 -2.058 14.707 1.00 0.00 O ATOM 1536 CB THR B 26 -8.016 0.271 16.190 1.00 0.00 C ATOM 1537 OG1 THR B 26 -8.186 1.303 17.170 1.00 0.00 O ATOM 1538 CG2 THR B 26 -8.800 -0.960 16.622 1.00 0.00 C ATOM 0 H THR B 26 -6.030 1.859 15.382 1.00 0.00 H new ATOM 0 HA THR B 26 -6.197 -0.676 16.880 1.00 0.00 H new ATOM 0 HB THR B 26 -8.391 0.610 15.225 1.00 0.00 H new ATOM 0 HG1 THR B 26 -9.139 1.513 17.262 1.00 0.00 H new ATOM 0 HG21 THR B 26 -9.854 -0.703 16.724 1.00 0.00 H new ATOM 0 HG22 THR B 26 -8.689 -1.744 15.873 1.00 0.00 H new ATOM 0 HG23 THR B 26 -8.419 -1.316 17.579 1.00 0.00 H new ATOM 1546 N ASP B 27 -6.228 -0.081 13.632 1.00 0.00 N ATOM 1547 CA ASP B 27 -6.095 -0.663 12.310 1.00 0.00 C ATOM 1548 C ASP B 27 -5.014 0.044 11.516 1.00 0.00 C ATOM 1549 O ASP B 27 -5.296 0.731 10.534 1.00 0.00 O ATOM 1550 CB ASP B 27 -7.418 -0.585 11.554 1.00 0.00 C ATOM 1551 CG ASP B 27 -8.496 -1.466 12.146 1.00 0.00 C ATOM 1552 OD1 ASP B 27 -8.402 -2.705 12.014 1.00 0.00 O ATOM 1553 OD2 ASP B 27 -9.452 -0.924 12.739 1.00 0.00 O ATOM 0 H ASP B 27 -6.244 0.939 13.640 1.00 0.00 H new ATOM 0 HA ASP B 27 -5.815 -1.709 12.433 1.00 0.00 H new ATOM 0 HB2 ASP B 27 -7.765 0.448 11.548 1.00 0.00 H new ATOM 0 HB3 ASP B 27 -7.253 -0.872 10.515 1.00 0.00 H new ATOM 1558 N SER B 28 -3.779 -0.113 11.955 1.00 0.00 N ATOM 1559 CA SER B 28 -2.633 0.491 11.290 1.00 0.00 C ATOM 1560 C SER B 28 -2.521 0.002 9.852 1.00 0.00 C ATOM 1561 O SER B 28 -2.061 0.733 8.979 1.00 0.00 O ATOM 1562 CB SER B 28 -1.345 0.168 12.062 1.00 0.00 C ATOM 1563 OG SER B 28 -0.214 0.795 11.476 1.00 0.00 O ATOM 0 H SER B 28 -3.539 -0.661 12.781 1.00 0.00 H new ATOM 0 HA SER B 28 -2.776 1.571 11.273 1.00 0.00 H new ATOM 0 HB2 SER B 28 -1.448 0.496 13.096 1.00 0.00 H new ATOM 0 HB3 SER B 28 -1.193 -0.911 12.083 1.00 0.00 H new ATOM 0 HG SER B 28 0.588 0.571 11.992 1.00 0.00 H new ATOM 1569 N ALA B 29 -2.958 -1.231 9.620 1.00 0.00 N ATOM 1570 CA ALA B 29 -2.899 -1.823 8.297 1.00 0.00 C ATOM 1571 C ALA B 29 -3.755 -1.034 7.308 1.00 0.00 C ATOM 1572 O ALA B 29 -3.237 -0.445 6.383 1.00 0.00 O ATOM 1573 CB ALA B 29 -3.342 -3.278 8.349 1.00 0.00 C ATOM 0 H ALA B 29 -3.357 -1.838 10.336 1.00 0.00 H new ATOM 0 HA ALA B 29 -1.866 -1.787 7.951 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -3.293 -3.709 7.349 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -2.685 -3.835 9.017 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -4.366 -3.334 8.718 1.00 0.00 H new ATOM 1579 N GLN B 30 -5.064 -0.987 7.560 1.00 0.00 N ATOM 1580 CA GLN B 30 -6.013 -0.295 6.682 1.00 0.00 C ATOM 1581 C GLN B 30 -5.597 1.144 6.384 1.00 0.00 C ATOM 1582 O GLN B 30 -5.833 1.646 5.293 1.00 0.00 O ATOM 1583 CB GLN B 30 -7.411 -0.296 7.294 1.00 0.00 C ATOM 1584 CG GLN B 30 -7.984 -1.678 7.535 1.00 0.00 C ATOM 1585 CD GLN B 30 -9.443 -1.625 7.923 1.00 0.00 C ATOM 1586 OE1 GLN B 30 -9.784 -1.550 9.102 1.00 0.00 O ATOM 1587 NE2 GLN B 30 -10.314 -1.665 6.936 1.00 0.00 N ATOM 0 H GLN B 30 -5.496 -1.425 8.374 1.00 0.00 H new ATOM 0 HA GLN B 30 -6.017 -0.844 5.741 1.00 0.00 H new ATOM 0 HB2 GLN B 30 -7.381 0.243 8.241 1.00 0.00 H new ATOM 0 HB3 GLN B 30 -8.084 0.254 6.636 1.00 0.00 H new ATOM 0 HG2 GLN B 30 -7.870 -2.280 6.634 1.00 0.00 H new ATOM 0 HG3 GLN B 30 -7.417 -2.173 8.323 1.00 0.00 H new ATOM 0 HE21 GLN B 30 -9.989 -1.727 5.971 1.00 0.00 H new ATOM 0 HE22 GLN B 30 -11.314 -1.634 7.136 1.00 0.00 H new ATOM 1596 N VAL B 31 -4.970 1.794 7.348 1.00 0.00 N ATOM 1597 CA VAL B 31 -4.555 3.177 7.186 1.00 0.00 C ATOM 1598 C VAL B 31 -3.359 3.270 6.252 1.00 0.00 C ATOM 1599 O VAL B 31 -3.306 4.126 5.375 1.00 0.00 O ATOM 1600 CB VAL B 31 -4.198 3.820 8.546 1.00 0.00 C ATOM 1601 CG1 VAL B 31 -3.712 5.248 8.358 1.00 0.00 C ATOM 1602 CG2 VAL B 31 -5.396 3.782 9.477 1.00 0.00 C ATOM 0 H VAL B 31 -4.736 1.386 8.253 1.00 0.00 H new ATOM 0 HA VAL B 31 -5.395 3.722 6.754 1.00 0.00 H new ATOM 0 HB VAL B 31 -3.389 3.244 8.996 1.00 0.00 H new ATOM 0 HG11 VAL B 31 -3.467 5.680 9.328 1.00 0.00 H new ATOM 0 HG12 VAL B 31 -2.824 5.250 7.725 1.00 0.00 H new ATOM 0 HG13 VAL B 31 -4.496 5.840 7.885 1.00 0.00 H new ATOM 0 HG21 VAL B 31 -5.130 4.238 10.431 1.00 0.00 H new ATOM 0 HG22 VAL B 31 -6.223 4.333 9.029 1.00 0.00 H new ATOM 0 HG23 VAL B 31 -5.697 2.747 9.641 1.00 0.00 H new ATOM 1612 N ALA B 32 -2.432 2.359 6.414 1.00 0.00 N ATOM 1613 CA ALA B 32 -1.229 2.354 5.620 1.00 0.00 C ATOM 1614 C ALA B 32 -1.502 1.780 4.234 1.00 0.00 C ATOM 1615 O ALA B 32 -0.957 2.254 3.242 1.00 0.00 O ATOM 1616 CB ALA B 32 -0.141 1.566 6.330 1.00 0.00 C ATOM 0 H ALA B 32 -2.489 1.603 7.097 1.00 0.00 H new ATOM 0 HA ALA B 32 -0.886 3.381 5.494 1.00 0.00 H new ATOM 0 HB1 ALA B 32 0.764 1.567 5.723 1.00 0.00 H new ATOM 0 HB2 ALA B 32 0.069 2.025 7.296 1.00 0.00 H new ATOM 0 HB3 ALA B 32 -0.475 0.539 6.481 1.00 0.00 H new ATOM 1622 N GLU B 33 -2.413 0.809 4.172 1.00 0.00 N ATOM 1623 CA GLU B 33 -2.747 0.135 2.925 1.00 0.00 C ATOM 1624 C GLU B 33 -3.302 1.115 1.919 1.00 0.00 C ATOM 1625 O GLU B 33 -3.018 1.027 0.739 1.00 0.00 O ATOM 1626 CB GLU B 33 -3.761 -0.996 3.163 1.00 0.00 C ATOM 1627 CG GLU B 33 -3.191 -2.201 3.900 1.00 0.00 C ATOM 1628 CD GLU B 33 -4.233 -3.271 4.168 1.00 0.00 C ATOM 1629 OE1 GLU B 33 -4.479 -4.106 3.268 1.00 0.00 O ATOM 1630 OE2 GLU B 33 -4.800 -3.294 5.284 1.00 0.00 O ATOM 0 H GLU B 33 -2.935 0.472 4.981 1.00 0.00 H new ATOM 0 HA GLU B 33 -1.829 -0.298 2.528 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -4.602 -0.601 3.732 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -4.154 -1.325 2.201 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -2.379 -2.630 3.313 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -2.762 -1.873 4.847 1.00 0.00 H new ATOM 1637 N ILE B 34 -4.073 2.070 2.390 1.00 0.00 N ATOM 1638 CA ILE B 34 -4.660 3.037 1.499 1.00 0.00 C ATOM 1639 C ILE B 34 -3.701 4.201 1.228 1.00 0.00 C ATOM 1640 O ILE B 34 -3.664 4.737 0.114 1.00 0.00 O ATOM 1641 CB ILE B 34 -6.031 3.556 2.005 1.00 0.00 C ATOM 1642 CG1 ILE B 34 -6.578 4.603 1.045 1.00 0.00 C ATOM 1643 CG2 ILE B 34 -5.922 4.123 3.416 1.00 0.00 C ATOM 1644 CD1 ILE B 34 -7.955 5.118 1.409 1.00 0.00 C ATOM 0 H ILE B 34 -4.305 2.195 3.375 1.00 0.00 H new ATOM 0 HA ILE B 34 -4.843 2.519 0.558 1.00 0.00 H new ATOM 0 HB ILE B 34 -6.723 2.715 2.041 1.00 0.00 H new ATOM 0 HG12 ILE B 34 -5.885 5.444 1.009 1.00 0.00 H new ATOM 0 HG13 ILE B 34 -6.615 4.177 0.042 1.00 0.00 H new ATOM 0 HG21 ILE B 34 -6.900 4.478 3.742 1.00 0.00 H new ATOM 0 HG22 ILE B 34 -5.574 3.345 4.095 1.00 0.00 H new ATOM 0 HG23 ILE B 34 -5.214 4.952 3.421 1.00 0.00 H new ATOM 0 HD11 ILE B 34 -8.272 5.860 0.676 1.00 0.00 H new ATOM 0 HD12 ILE B 34 -8.663 4.289 1.416 1.00 0.00 H new ATOM 0 HD13 ILE B 34 -7.923 5.576 2.398 1.00 0.00 H new ATOM 1656 N VAL B 35 -2.894 4.569 2.226 1.00 0.00 N ATOM 1657 CA VAL B 35 -1.954 5.665 2.060 1.00 0.00 C ATOM 1658 C VAL B 35 -0.822 5.259 1.122 1.00 0.00 C ATOM 1659 O VAL B 35 -0.489 5.987 0.187 1.00 0.00 O ATOM 1660 CB VAL B 35 -1.378 6.136 3.422 1.00 0.00 C ATOM 1661 CG1 VAL B 35 -0.214 7.090 3.225 1.00 0.00 C ATOM 1662 CG2 VAL B 35 -2.463 6.802 4.252 1.00 0.00 C ATOM 0 H VAL B 35 -2.876 4.126 3.145 1.00 0.00 H new ATOM 0 HA VAL B 35 -2.498 6.501 1.621 1.00 0.00 H new ATOM 0 HB VAL B 35 -1.012 5.257 3.953 1.00 0.00 H new ATOM 0 HG11 VAL B 35 0.169 7.403 4.197 1.00 0.00 H new ATOM 0 HG12 VAL B 35 0.577 6.588 2.668 1.00 0.00 H new ATOM 0 HG13 VAL B 35 -0.551 7.965 2.669 1.00 0.00 H new ATOM 0 HG21 VAL B 35 -2.044 7.127 5.204 1.00 0.00 H new ATOM 0 HG22 VAL B 35 -2.854 7.665 3.714 1.00 0.00 H new ATOM 0 HG23 VAL B 35 -3.270 6.092 4.434 1.00 0.00 H new ATOM 1672 N ALA B 36 -0.258 4.087 1.360 1.00 0.00 N ATOM 1673 CA ALA B 36 0.819 3.570 0.537 1.00 0.00 C ATOM 1674 C ALA B 36 0.331 3.293 -0.872 1.00 0.00 C ATOM 1675 O ALA B 36 0.990 3.655 -1.853 1.00 0.00 O ATOM 1676 CB ALA B 36 1.388 2.304 1.151 1.00 0.00 C ATOM 0 H ALA B 36 -0.533 3.471 2.125 1.00 0.00 H new ATOM 0 HA ALA B 36 1.605 4.323 0.488 1.00 0.00 H new ATOM 0 HB1 ALA B 36 2.195 1.926 0.524 1.00 0.00 H new ATOM 0 HB2 ALA B 36 1.774 2.524 2.146 1.00 0.00 H new ATOM 0 HB3 ALA B 36 0.603 1.551 1.225 1.00 0.00 H new ATOM 1682 N VAL B 37 -0.828 2.647 -0.975 1.00 0.00 N ATOM 1683 CA VAL B 37 -1.415 2.341 -2.265 1.00 0.00 C ATOM 1684 C VAL B 37 -1.632 3.600 -3.100 1.00 0.00 C ATOM 1685 O VAL B 37 -1.050 3.725 -4.175 1.00 0.00 O ATOM 1686 CB VAL B 37 -2.723 1.509 -2.136 1.00 0.00 C ATOM 1687 CG1 VAL B 37 -3.632 1.697 -3.335 1.00 0.00 C ATOM 1688 CG2 VAL B 37 -2.377 0.036 -1.984 1.00 0.00 C ATOM 0 H VAL B 37 -1.375 2.327 -0.176 1.00 0.00 H new ATOM 0 HA VAL B 37 -0.695 1.717 -2.795 1.00 0.00 H new ATOM 0 HB VAL B 37 -3.257 1.862 -1.254 1.00 0.00 H new ATOM 0 HG11 VAL B 37 -4.534 1.099 -3.205 1.00 0.00 H new ATOM 0 HG12 VAL B 37 -3.904 2.749 -3.424 1.00 0.00 H new ATOM 0 HG13 VAL B 37 -3.113 1.379 -4.239 1.00 0.00 H new ATOM 0 HG21 VAL B 37 -3.294 -0.546 -1.894 1.00 0.00 H new ATOM 0 HG22 VAL B 37 -1.819 -0.299 -2.859 1.00 0.00 H new ATOM 0 HG23 VAL B 37 -1.769 -0.105 -1.090 1.00 0.00 H new ATOM 1698 N MET B 38 -2.445 4.548 -2.614 1.00 0.00 N ATOM 1699 CA MET B 38 -2.699 5.774 -3.358 1.00 0.00 C ATOM 1700 C MET B 38 -1.440 6.585 -3.527 1.00 0.00 C ATOM 1701 O MET B 38 -1.163 7.079 -4.607 1.00 0.00 O ATOM 1702 CB MET B 38 -3.741 6.631 -2.652 1.00 0.00 C ATOM 1703 CG MET B 38 -5.102 5.976 -2.519 1.00 0.00 C ATOM 1704 SD MET B 38 -6.424 7.150 -2.158 1.00 0.00 S ATOM 1705 CE MET B 38 -5.762 7.996 -0.735 1.00 0.00 C ATOM 0 H MET B 38 -2.930 4.485 -1.719 1.00 0.00 H new ATOM 0 HA MET B 38 -3.070 5.479 -4.340 1.00 0.00 H new ATOM 0 HB2 MET B 38 -3.373 6.883 -1.657 1.00 0.00 H new ATOM 0 HB3 MET B 38 -3.854 7.568 -3.197 1.00 0.00 H new ATOM 0 HG2 MET B 38 -5.336 5.448 -3.444 1.00 0.00 H new ATOM 0 HG3 MET B 38 -5.062 5.228 -1.727 1.00 0.00 H new ATOM 0 HE1 MET B 38 -6.577 8.282 -0.070 1.00 0.00 H new ATOM 0 HE2 MET B 38 -5.077 7.335 -0.205 1.00 0.00 H new ATOM 0 HE3 MET B 38 -5.227 8.889 -1.059 1.00 0.00 H new ATOM 1715 N GLY B 39 -0.685 6.723 -2.448 1.00 0.00 N ATOM 1716 CA GLY B 39 0.525 7.508 -2.480 1.00 0.00 C ATOM 1717 C GLY B 39 1.469 7.078 -3.572 1.00 0.00 C ATOM 1718 O GLY B 39 1.798 7.860 -4.453 1.00 0.00 O ATOM 0 H GLY B 39 -0.894 6.300 -1.544 1.00 0.00 H new ATOM 0 HA2 GLY B 39 0.268 8.558 -2.620 1.00 0.00 H new ATOM 0 HA3 GLY B 39 1.030 7.429 -1.517 1.00 0.00 H new ATOM 1722 N ASN B 40 1.869 5.828 -3.542 1.00 0.00 N ATOM 1723 CA ASN B 40 2.822 5.322 -4.514 1.00 0.00 C ATOM 1724 C ASN B 40 2.239 5.344 -5.938 1.00 0.00 C ATOM 1725 O ASN B 40 2.929 5.701 -6.889 1.00 0.00 O ATOM 1726 CB ASN B 40 3.301 3.915 -4.116 1.00 0.00 C ATOM 1727 CG ASN B 40 2.672 2.792 -4.919 1.00 0.00 C ATOM 1728 OD1 ASN B 40 3.169 2.414 -5.971 1.00 0.00 O ATOM 1729 ND2 ASN B 40 1.591 2.241 -4.414 1.00 0.00 N ATOM 0 H ASN B 40 1.553 5.141 -2.858 1.00 0.00 H new ATOM 0 HA ASN B 40 3.689 5.983 -4.517 1.00 0.00 H new ATOM 0 HB2 ASN B 40 4.384 3.866 -4.231 1.00 0.00 H new ATOM 0 HB3 ASN B 40 3.085 3.756 -3.059 1.00 0.00 H new ATOM 0 HD21 ASN B 40 1.136 1.470 -4.902 1.00 0.00 H new ATOM 0 HD22 ASN B 40 1.207 2.585 -3.534 1.00 0.00 H new ATOM 1736 N ALA B 41 0.962 4.998 -6.069 1.00 0.00 N ATOM 1737 CA ALA B 41 0.310 4.961 -7.374 1.00 0.00 C ATOM 1738 C ALA B 41 0.097 6.355 -7.955 1.00 0.00 C ATOM 1739 O ALA B 41 0.151 6.543 -9.169 1.00 0.00 O ATOM 1740 CB ALA B 41 -1.015 4.221 -7.287 1.00 0.00 C ATOM 0 H ALA B 41 0.359 4.739 -5.288 1.00 0.00 H new ATOM 0 HA ALA B 41 0.978 4.426 -8.049 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -1.487 4.203 -8.269 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -0.840 3.199 -6.950 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -1.670 4.729 -6.579 1.00 0.00 H new ATOM 1746 N SER B 42 -0.121 7.335 -7.094 1.00 0.00 N ATOM 1747 CA SER B 42 -0.392 8.678 -7.553 1.00 0.00 C ATOM 1748 C SER B 42 0.909 9.417 -7.849 1.00 0.00 C ATOM 1749 O SER B 42 0.949 10.302 -8.701 1.00 0.00 O ATOM 1750 CB SER B 42 -1.241 9.444 -6.528 1.00 0.00 C ATOM 1751 OG SER B 42 -1.684 10.690 -7.047 1.00 0.00 O ATOM 0 H SER B 42 -0.115 7.223 -6.080 1.00 0.00 H new ATOM 0 HA SER B 42 -0.963 8.615 -8.479 1.00 0.00 H new ATOM 0 HB2 SER B 42 -2.103 8.840 -6.243 1.00 0.00 H new ATOM 0 HB3 SER B 42 -0.657 9.612 -5.623 1.00 0.00 H new ATOM 0 HG SER B 42 -2.223 11.153 -6.372 1.00 0.00 H new ATOM 1757 N VAL B 43 1.982 9.054 -7.157 1.00 0.00 N ATOM 1758 CA VAL B 43 3.263 9.671 -7.428 1.00 0.00 C ATOM 1759 C VAL B 43 3.906 9.016 -8.639 1.00 0.00 C ATOM 1760 O VAL B 43 4.602 9.674 -9.414 1.00 0.00 O ATOM 1761 CB VAL B 43 4.221 9.658 -6.207 1.00 0.00 C ATOM 1762 CG1 VAL B 43 4.539 8.258 -5.760 1.00 0.00 C ATOM 1763 CG2 VAL B 43 5.499 10.440 -6.502 1.00 0.00 C ATOM 0 H VAL B 43 1.987 8.349 -6.419 1.00 0.00 H new ATOM 0 HA VAL B 43 3.074 10.723 -7.643 1.00 0.00 H new ATOM 0 HB VAL B 43 3.702 10.152 -5.386 1.00 0.00 H new ATOM 0 HG11 VAL B 43 5.212 8.294 -4.903 1.00 0.00 H new ATOM 0 HG12 VAL B 43 3.618 7.748 -5.477 1.00 0.00 H new ATOM 0 HG13 VAL B 43 5.018 7.716 -6.575 1.00 0.00 H new ATOM 0 HG21 VAL B 43 6.151 10.414 -5.629 1.00 0.00 H new ATOM 0 HG22 VAL B 43 6.012 9.991 -7.352 1.00 0.00 H new ATOM 0 HG23 VAL B 43 5.247 11.474 -6.736 1.00 0.00 H new ATOM 1773 N ALA B 44 3.636 7.722 -8.847 1.00 0.00 N ATOM 1774 CA ALA B 44 4.134 7.026 -10.015 1.00 0.00 C ATOM 1775 C ALA B 44 3.360 7.467 -11.239 1.00 0.00 C ATOM 1776 O ALA B 44 3.726 7.172 -12.364 1.00 0.00 O ATOM 1777 CB ALA B 44 4.005 5.525 -9.834 1.00 0.00 C ATOM 0 H ALA B 44 3.076 7.147 -8.218 1.00 0.00 H new ATOM 0 HA ALA B 44 5.188 7.270 -10.147 1.00 0.00 H new ATOM 0 HB1 ALA B 44 4.384 5.018 -10.721 1.00 0.00 H new ATOM 0 HB2 ALA B 44 4.582 5.213 -8.963 1.00 0.00 H new ATOM 0 HB3 ALA B 44 2.957 5.265 -9.687 1.00 0.00 H new ATOM 1783 N SER B 45 2.293 8.183 -11.006 1.00 0.00 N ATOM 1784 CA SER B 45 1.472 8.675 -12.074 1.00 0.00 C ATOM 1785 C SER B 45 2.175 9.863 -12.725 1.00 0.00 C ATOM 1786 O SER B 45 1.879 10.241 -13.858 1.00 0.00 O ATOM 1787 CB SER B 45 0.099 9.098 -11.526 1.00 0.00 C ATOM 1788 OG SER B 45 0.091 10.462 -11.137 1.00 0.00 O ATOM 0 H SER B 45 1.971 8.440 -10.073 1.00 0.00 H new ATOM 0 HA SER B 45 1.318 7.893 -12.817 1.00 0.00 H new ATOM 0 HB2 SER B 45 -0.664 8.931 -12.286 1.00 0.00 H new ATOM 0 HB3 SER B 45 -0.161 8.473 -10.671 1.00 0.00 H new ATOM 0 HG SER B 45 0.037 10.523 -10.160 1.00 0.00 H new ATOM 1794 N ARG B 46 3.136 10.433 -11.989 1.00 0.00 N ATOM 1795 CA ARG B 46 3.849 11.613 -12.442 1.00 0.00 C ATOM 1796 C ARG B 46 5.350 11.337 -12.593 1.00 0.00 C ATOM 1797 O ARG B 46 6.069 12.108 -13.228 1.00 0.00 O ATOM 1798 CB ARG B 46 3.609 12.768 -11.459 1.00 0.00 C ATOM 1799 CG ARG B 46 2.129 13.061 -11.230 1.00 0.00 C ATOM 1800 CD ARG B 46 1.904 14.049 -10.097 1.00 0.00 C ATOM 1801 NE ARG B 46 0.478 14.170 -9.762 1.00 0.00 N ATOM 1802 CZ ARG B 46 -0.001 14.723 -8.641 1.00 0.00 C ATOM 1803 NH1 ARG B 46 0.822 15.289 -7.766 1.00 0.00 N ATOM 1804 NH2 ARG B 46 -1.309 14.728 -8.414 1.00 0.00 N ATOM 0 H ARG B 46 3.432 10.088 -11.076 1.00 0.00 H new ATOM 0 HA ARG B 46 3.468 11.890 -13.425 1.00 0.00 H new ATOM 0 HB2 ARG B 46 4.078 12.528 -10.505 1.00 0.00 H new ATOM 0 HB3 ARG B 46 4.097 13.666 -11.837 1.00 0.00 H new ATOM 0 HG2 ARG B 46 1.694 13.458 -12.147 1.00 0.00 H new ATOM 0 HG3 ARG B 46 1.607 12.130 -11.006 1.00 0.00 H new ATOM 0 HD2 ARG B 46 2.459 13.727 -9.216 1.00 0.00 H new ATOM 0 HD3 ARG B 46 2.296 15.026 -10.381 1.00 0.00 H new ATOM 0 HE ARG B 46 -0.197 13.805 -10.434 1.00 0.00 H new ATOM 0 HH11 ARG B 46 1.826 15.304 -7.946 1.00 0.00 H new ATOM 0 HH12 ARG B 46 0.450 15.709 -6.914 1.00 0.00 H new ATOM 0 HH21 ARG B 46 -1.946 14.311 -9.093 1.00 0.00 H new ATOM 0 HH22 ARG B 46 -1.677 15.149 -7.561 1.00 0.00 H new ATOM 1818 N ASP B 47 5.819 10.248 -11.995 1.00 0.00 N ATOM 1819 CA ASP B 47 7.235 9.888 -12.075 1.00 0.00 C ATOM 1820 C ASP B 47 7.415 8.465 -12.584 1.00 0.00 C ATOM 1821 O ASP B 47 8.368 8.168 -13.303 1.00 0.00 O ATOM 1822 CB ASP B 47 7.893 10.028 -10.713 1.00 0.00 C ATOM 1823 CG ASP B 47 9.397 9.869 -10.794 1.00 0.00 C ATOM 1824 OD1 ASP B 47 10.079 10.842 -11.182 1.00 0.00 O ATOM 1825 OD2 ASP B 47 9.895 8.774 -10.484 1.00 0.00 O ATOM 0 H ASP B 47 5.247 9.601 -11.452 1.00 0.00 H new ATOM 0 HA ASP B 47 7.711 10.570 -12.780 1.00 0.00 H new ATOM 0 HB2 ASP B 47 7.653 11.005 -10.293 1.00 0.00 H new ATOM 0 HB3 ASP B 47 7.485 9.280 -10.034 1.00 0.00 H new ATOM 1830 N LEU B 48 6.497 7.592 -12.181 1.00 0.00 N ATOM 1831 CA LEU B 48 6.468 6.167 -12.575 1.00 0.00 C ATOM 1832 C LEU B 48 7.526 5.335 -11.851 1.00 0.00 C ATOM 1833 O LEU B 48 7.276 4.190 -11.484 1.00 0.00 O ATOM 1834 CB LEU B 48 6.587 5.997 -14.099 1.00 0.00 C ATOM 1835 CG LEU B 48 6.376 4.576 -14.629 1.00 0.00 C ATOM 1836 CD1 LEU B 48 4.960 4.093 -14.338 1.00 0.00 C ATOM 1837 CD2 LEU B 48 6.668 4.519 -16.118 1.00 0.00 C ATOM 0 H LEU B 48 5.732 7.850 -11.558 1.00 0.00 H new ATOM 0 HA LEU B 48 5.495 5.786 -12.266 1.00 0.00 H new ATOM 0 HB2 LEU B 48 5.861 6.654 -14.577 1.00 0.00 H new ATOM 0 HB3 LEU B 48 7.576 6.337 -14.408 1.00 0.00 H new ATOM 0 HG LEU B 48 7.070 3.911 -14.115 1.00 0.00 H new ATOM 0 HD11 LEU B 48 4.834 3.081 -14.724 1.00 0.00 H new ATOM 0 HD12 LEU B 48 4.789 4.095 -13.261 1.00 0.00 H new ATOM 0 HD13 LEU B 48 4.243 4.757 -14.820 1.00 0.00 H new ATOM 0 HD21 LEU B 48 6.514 3.503 -16.480 1.00 0.00 H new ATOM 0 HD22 LEU B 48 5.999 5.198 -16.646 1.00 0.00 H new ATOM 0 HD23 LEU B 48 7.701 4.815 -16.298 1.00 0.00 H new ATOM 1849 N LYS B 49 8.681 5.916 -11.616 1.00 0.00 N ATOM 1850 CA LYS B 49 9.778 5.210 -10.979 1.00 0.00 C ATOM 1851 C LYS B 49 9.694 5.302 -9.460 1.00 0.00 C ATOM 1852 O LYS B 49 10.649 5.713 -8.793 1.00 0.00 O ATOM 1853 CB LYS B 49 11.104 5.770 -11.470 1.00 0.00 C ATOM 1854 CG LYS B 49 11.298 5.631 -12.969 1.00 0.00 C ATOM 1855 CD LYS B 49 12.463 6.469 -13.459 1.00 0.00 C ATOM 1856 CE LYS B 49 12.209 7.953 -13.234 1.00 0.00 C ATOM 1857 NZ LYS B 49 13.279 8.788 -13.820 1.00 0.00 N ATOM 0 H LYS B 49 8.889 6.885 -11.858 1.00 0.00 H new ATOM 0 HA LYS B 49 9.708 4.156 -11.250 1.00 0.00 H new ATOM 0 HB2 LYS B 49 11.168 6.824 -11.199 1.00 0.00 H new ATOM 0 HB3 LYS B 49 11.918 5.259 -10.957 1.00 0.00 H new ATOM 0 HG2 LYS B 49 11.471 4.584 -13.219 1.00 0.00 H new ATOM 0 HG3 LYS B 49 10.387 5.936 -13.485 1.00 0.00 H new ATOM 0 HD2 LYS B 49 13.373 6.170 -12.939 1.00 0.00 H new ATOM 0 HD3 LYS B 49 12.627 6.283 -14.520 1.00 0.00 H new ATOM 0 HE2 LYS B 49 11.251 8.229 -13.674 1.00 0.00 H new ATOM 0 HE3 LYS B 49 12.137 8.152 -12.165 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 13.070 9.792 -13.646 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 14.190 8.543 -13.382 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 13.331 8.618 -14.845 1.00 0.00 H new ATOM 1871 N ILE B 50 8.556 4.922 -8.918 1.00 0.00 N ATOM 1872 CA ILE B 50 8.369 4.928 -7.487 1.00 0.00 C ATOM 1873 C ILE B 50 8.927 3.628 -6.891 1.00 0.00 C ATOM 1874 O ILE B 50 8.869 2.570 -7.526 1.00 0.00 O ATOM 1875 CB ILE B 50 6.869 5.106 -7.099 1.00 0.00 C ATOM 1876 CG1 ILE B 50 6.721 5.341 -5.589 1.00 0.00 C ATOM 1877 CG2 ILE B 50 6.053 3.892 -7.527 1.00 0.00 C ATOM 1878 CD1 ILE B 50 7.488 6.545 -5.077 1.00 0.00 C ATOM 0 H ILE B 50 7.746 4.605 -9.451 1.00 0.00 H new ATOM 0 HA ILE B 50 8.911 5.780 -7.077 1.00 0.00 H new ATOM 0 HB ILE B 50 6.487 5.982 -7.624 1.00 0.00 H new ATOM 0 HG12 ILE B 50 5.665 5.468 -5.353 1.00 0.00 H new ATOM 0 HG13 ILE B 50 7.062 4.452 -5.058 1.00 0.00 H new ATOM 0 HG21 ILE B 50 5.010 4.038 -7.247 1.00 0.00 H new ATOM 0 HG22 ILE B 50 6.124 3.768 -8.608 1.00 0.00 H new ATOM 0 HG23 ILE B 50 6.440 3.001 -7.033 1.00 0.00 H new ATOM 0 HD11 ILE B 50 7.334 6.645 -4.003 1.00 0.00 H new ATOM 0 HD12 ILE B 50 8.551 6.413 -5.280 1.00 0.00 H new ATOM 0 HD13 ILE B 50 7.132 7.444 -5.580 1.00 0.00 H new ATOM 1890 N GLU B 51 9.495 3.714 -5.705 1.00 0.00 N ATOM 1891 CA GLU B 51 10.078 2.563 -5.064 1.00 0.00 C ATOM 1892 C GLU B 51 9.103 1.925 -4.092 1.00 0.00 C ATOM 1893 O GLU B 51 8.527 2.593 -3.231 1.00 0.00 O ATOM 1894 CB GLU B 51 11.366 2.958 -4.357 1.00 0.00 C ATOM 1895 CG GLU B 51 12.404 3.543 -5.297 1.00 0.00 C ATOM 1896 CD GLU B 51 13.643 4.002 -4.583 1.00 0.00 C ATOM 1897 OE1 GLU B 51 13.683 5.171 -4.148 1.00 0.00 O ATOM 1898 OE2 GLU B 51 14.591 3.206 -4.455 1.00 0.00 O ATOM 0 H GLU B 51 9.563 4.577 -5.166 1.00 0.00 H new ATOM 0 HA GLU B 51 10.311 1.823 -5.830 1.00 0.00 H new ATOM 0 HB2 GLU B 51 11.138 3.686 -3.578 1.00 0.00 H new ATOM 0 HB3 GLU B 51 11.785 2.082 -3.862 1.00 0.00 H new ATOM 0 HG2 GLU B 51 12.676 2.795 -6.042 1.00 0.00 H new ATOM 0 HG3 GLU B 51 11.967 4.385 -5.835 1.00 0.00 H new ATOM 1905 N GLN B 52 8.929 0.638 -4.239 1.00 0.00 N ATOM 1906 CA GLN B 52 8.028 -0.139 -3.407 1.00 0.00 C ATOM 1907 C GLN B 52 8.684 -0.504 -2.075 1.00 0.00 C ATOM 1908 O GLN B 52 9.077 -1.650 -1.851 1.00 0.00 O ATOM 1909 CB GLN B 52 7.586 -1.403 -4.151 1.00 0.00 C ATOM 1910 CG GLN B 52 8.704 -2.061 -4.961 1.00 0.00 C ATOM 1911 CD GLN B 52 8.831 -1.492 -6.367 1.00 0.00 C ATOM 1912 OE1 GLN B 52 7.845 -1.092 -6.978 1.00 0.00 O ATOM 1913 NE2 GLN B 52 10.048 -1.430 -6.870 1.00 0.00 N ATOM 0 H GLN B 52 9.412 0.086 -4.948 1.00 0.00 H new ATOM 0 HA GLN B 52 7.151 0.470 -3.191 1.00 0.00 H new ATOM 0 HB2 GLN B 52 7.200 -2.123 -3.429 1.00 0.00 H new ATOM 0 HB3 GLN B 52 6.764 -1.151 -4.821 1.00 0.00 H new ATOM 0 HG2 GLN B 52 9.650 -1.932 -4.436 1.00 0.00 H new ATOM 0 HG3 GLN B 52 8.518 -3.133 -5.024 1.00 0.00 H new ATOM 0 HE21 GLN B 52 10.842 -1.774 -6.329 1.00 0.00 H new ATOM 0 HE22 GLN B 52 10.196 -1.038 -7.800 1.00 0.00 H new ATOM 1922 N SER B 53 8.838 0.480 -1.216 1.00 0.00 N ATOM 1923 CA SER B 53 9.444 0.261 0.080 1.00 0.00 C ATOM 1924 C SER B 53 8.467 0.549 1.226 1.00 0.00 C ATOM 1925 O SER B 53 7.763 1.565 1.212 1.00 0.00 O ATOM 1926 CB SER B 53 10.689 1.144 0.220 1.00 0.00 C ATOM 1927 OG SER B 53 11.202 1.109 1.540 1.00 0.00 O ATOM 0 H SER B 53 8.551 1.443 -1.392 1.00 0.00 H new ATOM 0 HA SER B 53 9.724 -0.790 0.145 1.00 0.00 H new ATOM 0 HB2 SER B 53 11.455 0.808 -0.479 1.00 0.00 H new ATOM 0 HB3 SER B 53 10.441 2.171 -0.048 1.00 0.00 H new ATOM 0 HG SER B 53 12.079 1.546 1.562 1.00 0.00 H new ATOM 1933 N PRO B 54 8.410 -0.361 2.232 1.00 0.00 N ATOM 1934 CA PRO B 54 7.609 -0.160 3.457 1.00 0.00 C ATOM 1935 C PRO B 54 8.032 1.125 4.167 1.00 0.00 C ATOM 1936 O PRO B 54 7.214 1.844 4.740 1.00 0.00 O ATOM 1937 CB PRO B 54 7.989 -1.373 4.319 1.00 0.00 C ATOM 1938 CG PRO B 54 8.425 -2.408 3.348 1.00 0.00 C ATOM 1939 CD PRO B 54 9.108 -1.664 2.241 1.00 0.00 C ATOM 0 HA PRO B 54 6.540 -0.075 3.260 1.00 0.00 H new ATOM 0 HB2 PRO B 54 8.787 -1.126 5.019 1.00 0.00 H new ATOM 0 HB3 PRO B 54 7.142 -1.718 4.911 1.00 0.00 H new ATOM 0 HG2 PRO B 54 9.102 -3.123 3.815 1.00 0.00 H new ATOM 0 HG3 PRO B 54 7.574 -2.975 2.972 1.00 0.00 H new ATOM 0 HD2 PRO B 54 10.175 -1.548 2.431 1.00 0.00 H new ATOM 0 HD3 PRO B 54 9.009 -2.181 1.287 1.00 0.00 H new ATOM 1947 N GLU B 55 9.329 1.407 4.091 1.00 0.00 N ATOM 1948 CA GLU B 55 9.916 2.580 4.711 1.00 0.00 C ATOM 1949 C GLU B 55 9.467 3.850 4.008 1.00 0.00 C ATOM 1950 O GLU B 55 9.167 4.855 4.652 1.00 0.00 O ATOM 1951 CB GLU B 55 11.440 2.475 4.668 1.00 0.00 C ATOM 1952 CG GLU B 55 11.996 1.340 5.508 1.00 0.00 C ATOM 1953 CD GLU B 55 11.826 1.585 6.986 1.00 0.00 C ATOM 1954 OE1 GLU B 55 10.756 1.252 7.535 1.00 0.00 O ATOM 1955 OE2 GLU B 55 12.763 2.126 7.605 1.00 0.00 O ATOM 0 H GLU B 55 10.002 0.823 3.594 1.00 0.00 H new ATOM 0 HA GLU B 55 9.581 2.627 5.747 1.00 0.00 H new ATOM 0 HB2 GLU B 55 11.757 2.339 3.634 1.00 0.00 H new ATOM 0 HB3 GLU B 55 11.870 3.415 5.013 1.00 0.00 H new ATOM 0 HG2 GLU B 55 11.495 0.411 5.236 1.00 0.00 H new ATOM 0 HG3 GLU B 55 13.055 1.209 5.283 1.00 0.00 H new ATOM 1962 N LEU B 56 9.434 3.803 2.682 1.00 0.00 N ATOM 1963 CA LEU B 56 9.013 4.951 1.892 1.00 0.00 C ATOM 1964 C LEU B 56 7.572 5.344 2.217 1.00 0.00 C ATOM 1965 O LEU B 56 7.228 6.526 2.200 1.00 0.00 O ATOM 1966 CB LEU B 56 9.177 4.679 0.393 1.00 0.00 C ATOM 1967 CG LEU B 56 8.968 5.888 -0.526 1.00 0.00 C ATOM 1968 CD1 LEU B 56 9.942 7.006 -0.179 1.00 0.00 C ATOM 1969 CD2 LEU B 56 9.128 5.481 -1.979 1.00 0.00 C ATOM 0 H LEU B 56 9.693 2.984 2.133 1.00 0.00 H new ATOM 0 HA LEU B 56 9.659 5.789 2.155 1.00 0.00 H new ATOM 0 HB2 LEU B 56 10.178 4.283 0.221 1.00 0.00 H new ATOM 0 HB3 LEU B 56 8.472 3.899 0.104 1.00 0.00 H new ATOM 0 HG LEU B 56 7.954 6.259 -0.376 1.00 0.00 H new ATOM 0 HD11 LEU B 56 9.775 7.853 -0.844 1.00 0.00 H new ATOM 0 HD12 LEU B 56 9.785 7.318 0.853 1.00 0.00 H new ATOM 0 HD13 LEU B 56 10.965 6.648 -0.298 1.00 0.00 H new ATOM 0 HD21 LEU B 56 8.977 6.350 -2.619 1.00 0.00 H new ATOM 0 HD22 LEU B 56 10.131 5.084 -2.137 1.00 0.00 H new ATOM 0 HD23 LEU B 56 8.392 4.716 -2.226 1.00 0.00 H new ATOM 1981 N SER B 57 6.735 4.352 2.516 1.00 0.00 N ATOM 1982 CA SER B 57 5.361 4.624 2.907 1.00 0.00 C ATOM 1983 C SER B 57 5.349 5.406 4.217 1.00 0.00 C ATOM 1984 O SER B 57 4.725 6.461 4.321 1.00 0.00 O ATOM 1985 CB SER B 57 4.571 3.328 3.055 1.00 0.00 C ATOM 1986 OG SER B 57 3.221 3.600 3.368 1.00 0.00 O ATOM 0 H SER B 57 6.985 3.363 2.494 1.00 0.00 H new ATOM 0 HA SER B 57 4.885 5.219 2.127 1.00 0.00 H new ATOM 0 HB2 SER B 57 4.627 2.755 2.130 1.00 0.00 H new ATOM 0 HB3 SER B 57 5.014 2.713 3.838 1.00 0.00 H new ATOM 0 HG SER B 57 2.889 2.926 3.998 1.00 0.00 H new ATOM 1992 N ALA B 58 6.031 4.868 5.223 1.00 0.00 N ATOM 1993 CA ALA B 58 6.212 5.563 6.497 1.00 0.00 C ATOM 1994 C ALA B 58 6.625 7.028 6.283 1.00 0.00 C ATOM 1995 O ALA B 58 6.267 7.898 7.060 1.00 0.00 O ATOM 1996 CB ALA B 58 7.243 4.842 7.350 1.00 0.00 C ATOM 0 H ALA B 58 6.470 3.948 5.182 1.00 0.00 H new ATOM 0 HA ALA B 58 5.255 5.559 7.019 1.00 0.00 H new ATOM 0 HB1 ALA B 58 7.367 5.371 8.295 1.00 0.00 H new ATOM 0 HB2 ALA B 58 6.906 3.824 7.545 1.00 0.00 H new ATOM 0 HB3 ALA B 58 8.196 4.814 6.822 1.00 0.00 H new ATOM 2002 N LYS B 59 7.363 7.283 5.204 1.00 0.00 N ATOM 2003 CA LYS B 59 7.816 8.629 4.864 1.00 0.00 C ATOM 2004 C LYS B 59 6.677 9.476 4.245 1.00 0.00 C ATOM 2005 O LYS B 59 6.500 10.645 4.607 1.00 0.00 O ATOM 2006 CB LYS B 59 9.010 8.543 3.904 1.00 0.00 C ATOM 2007 CG LYS B 59 9.602 9.886 3.506 1.00 0.00 C ATOM 2008 CD LYS B 59 10.829 9.698 2.631 1.00 0.00 C ATOM 2009 CE LYS B 59 11.419 11.029 2.198 1.00 0.00 C ATOM 2010 NZ LYS B 59 12.663 10.852 1.411 1.00 0.00 N ATOM 0 H LYS B 59 7.662 6.565 4.544 1.00 0.00 H new ATOM 0 HA LYS B 59 8.126 9.128 5.782 1.00 0.00 H new ATOM 0 HB2 LYS B 59 9.790 7.941 4.369 1.00 0.00 H new ATOM 0 HB3 LYS B 59 8.697 8.017 3.002 1.00 0.00 H new ATOM 0 HG2 LYS B 59 8.855 10.473 2.971 1.00 0.00 H new ATOM 0 HG3 LYS B 59 9.870 10.449 4.400 1.00 0.00 H new ATOM 0 HD2 LYS B 59 11.581 9.127 3.176 1.00 0.00 H new ATOM 0 HD3 LYS B 59 10.562 9.114 1.750 1.00 0.00 H new ATOM 0 HE2 LYS B 59 10.687 11.574 1.602 1.00 0.00 H new ATOM 0 HE3 LYS B 59 11.630 11.636 3.078 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 13.034 11.783 1.135 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 13.371 10.354 1.988 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 12.458 10.294 0.558 1.00 0.00 H new ATOM 2024 N VAL B 60 5.913 8.880 3.318 1.00 0.00 N ATOM 2025 CA VAL B 60 4.796 9.589 2.654 1.00 0.00 C ATOM 2026 C VAL B 60 3.697 9.988 3.659 1.00 0.00 C ATOM 2027 O VAL B 60 2.947 10.927 3.430 1.00 0.00 O ATOM 2028 CB VAL B 60 4.174 8.758 1.473 1.00 0.00 C ATOM 2029 CG1 VAL B 60 3.370 7.575 1.976 1.00 0.00 C ATOM 2030 CG2 VAL B 60 3.311 9.639 0.578 1.00 0.00 C ATOM 0 H VAL B 60 6.042 7.917 3.009 1.00 0.00 H new ATOM 0 HA VAL B 60 5.225 10.497 2.230 1.00 0.00 H new ATOM 0 HB VAL B 60 5.006 8.371 0.885 1.00 0.00 H new ATOM 0 HG11 VAL B 60 2.958 7.028 1.128 1.00 0.00 H new ATOM 0 HG12 VAL B 60 4.017 6.915 2.554 1.00 0.00 H new ATOM 0 HG13 VAL B 60 2.556 7.930 2.608 1.00 0.00 H new ATOM 0 HG21 VAL B 60 2.894 9.038 -0.230 1.00 0.00 H new ATOM 0 HG22 VAL B 60 2.500 10.071 1.165 1.00 0.00 H new ATOM 0 HG23 VAL B 60 3.921 10.439 0.158 1.00 0.00 H new ATOM 2040 N VAL B 61 3.639 9.284 4.780 1.00 0.00 N ATOM 2041 CA VAL B 61 2.652 9.595 5.811 1.00 0.00 C ATOM 2042 C VAL B 61 3.314 10.367 6.964 1.00 0.00 C ATOM 2043 O VAL B 61 2.639 10.947 7.813 1.00 0.00 O ATOM 2044 CB VAL B 61 1.904 8.322 6.333 1.00 0.00 C ATOM 2045 CG1 VAL B 61 2.836 7.384 7.077 1.00 0.00 C ATOM 2046 CG2 VAL B 61 0.688 8.699 7.194 1.00 0.00 C ATOM 0 H VAL B 61 4.255 8.501 5.000 1.00 0.00 H new ATOM 0 HA VAL B 61 1.892 10.228 5.354 1.00 0.00 H new ATOM 0 HB VAL B 61 1.537 7.785 5.458 1.00 0.00 H new ATOM 0 HG11 VAL B 61 2.277 6.514 7.422 1.00 0.00 H new ATOM 0 HG12 VAL B 61 3.635 7.061 6.410 1.00 0.00 H new ATOM 0 HG13 VAL B 61 3.266 7.902 7.934 1.00 0.00 H new ATOM 0 HG21 VAL B 61 0.192 7.792 7.540 1.00 0.00 H new ATOM 0 HG22 VAL B 61 1.018 9.283 8.054 1.00 0.00 H new ATOM 0 HG23 VAL B 61 -0.009 9.290 6.600 1.00 0.00 H new ATOM 2056 N GLU B 62 4.649 10.395 6.946 1.00 0.00 N ATOM 2057 CA GLU B 62 5.436 11.079 7.979 1.00 0.00 C ATOM 2058 C GLU B 62 5.309 12.589 7.835 1.00 0.00 C ATOM 2059 O GLU B 62 4.927 13.288 8.773 1.00 0.00 O ATOM 2060 CB GLU B 62 6.912 10.677 7.904 1.00 0.00 C ATOM 2061 CG GLU B 62 7.771 11.274 9.011 1.00 0.00 C ATOM 2062 CD GLU B 62 7.442 10.714 10.381 1.00 0.00 C ATOM 2063 OE1 GLU B 62 6.264 10.769 10.792 1.00 0.00 O ATOM 2064 OE2 GLU B 62 8.366 10.210 11.056 1.00 0.00 O ATOM 0 H GLU B 62 5.212 9.949 6.222 1.00 0.00 H new ATOM 0 HA GLU B 62 5.042 10.777 8.949 1.00 0.00 H new ATOM 0 HB2 GLU B 62 6.985 9.590 7.947 1.00 0.00 H new ATOM 0 HB3 GLU B 62 7.314 10.986 6.939 1.00 0.00 H new ATOM 0 HG2 GLU B 62 8.822 11.086 8.790 1.00 0.00 H new ATOM 0 HG3 GLU B 62 7.637 12.356 9.025 1.00 0.00 H new ATOM 2071 N LYS B 63 5.630 13.091 6.658 1.00 0.00 N ATOM 2072 CA LYS B 63 5.517 14.513 6.409 1.00 0.00 C ATOM 2073 C LYS B 63 4.061 14.904 6.266 1.00 0.00 C ATOM 2074 O LYS B 63 3.705 16.067 6.430 1.00 0.00 O ATOM 2075 CB LYS B 63 6.312 14.944 5.173 1.00 0.00 C ATOM 2076 CG LYS B 63 7.819 14.791 5.322 1.00 0.00 C ATOM 2077 CD LYS B 63 8.578 15.655 4.319 1.00 0.00 C ATOM 2078 CE LYS B 63 8.300 15.251 2.879 1.00 0.00 C ATOM 2079 NZ LYS B 63 9.105 16.054 1.920 1.00 0.00 N ATOM 0 H LYS B 63 5.967 12.541 5.868 1.00 0.00 H new ATOM 0 HA LYS B 63 5.945 15.033 7.266 1.00 0.00 H new ATOM 0 HB2 LYS B 63 5.980 14.356 4.317 1.00 0.00 H new ATOM 0 HB3 LYS B 63 6.083 15.986 4.952 1.00 0.00 H new ATOM 0 HG2 LYS B 63 8.114 15.066 6.335 1.00 0.00 H new ATOM 0 HG3 LYS B 63 8.094 13.745 5.182 1.00 0.00 H new ATOM 0 HD2 LYS B 63 8.301 16.700 4.460 1.00 0.00 H new ATOM 0 HD3 LYS B 63 9.648 15.580 4.515 1.00 0.00 H new ATOM 0 HE2 LYS B 63 8.525 14.193 2.747 1.00 0.00 H new ATOM 0 HE3 LYS B 63 7.240 15.380 2.662 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 8.728 15.927 0.959 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 9.055 17.059 2.182 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 10.095 15.738 1.948 1.00 0.00 H new ATOM 2093 N LEU B 64 3.222 13.923 5.977 1.00 0.00 N ATOM 2094 CA LEU B 64 1.812 14.149 5.779 1.00 0.00 C ATOM 2095 C LEU B 64 1.119 14.455 7.119 1.00 0.00 C ATOM 2096 O LEU B 64 0.460 15.481 7.251 1.00 0.00 O ATOM 2097 CB LEU B 64 1.207 12.911 5.110 1.00 0.00 C ATOM 2098 CG LEU B 64 -0.074 13.112 4.302 1.00 0.00 C ATOM 2099 CD1 LEU B 64 -0.374 11.871 3.497 1.00 0.00 C ATOM 2100 CD2 LEU B 64 -1.235 13.430 5.203 1.00 0.00 C ATOM 0 H LEU B 64 3.506 12.949 5.874 1.00 0.00 H new ATOM 0 HA LEU B 64 1.662 15.015 5.134 1.00 0.00 H new ATOM 0 HB2 LEU B 64 1.960 12.482 4.449 1.00 0.00 H new ATOM 0 HB3 LEU B 64 1.005 12.172 5.886 1.00 0.00 H new ATOM 0 HG LEU B 64 0.076 13.955 3.627 1.00 0.00 H new ATOM 0 HD11 LEU B 64 -1.289 12.022 2.924 1.00 0.00 H new ATOM 0 HD12 LEU B 64 0.453 11.671 2.816 1.00 0.00 H new ATOM 0 HD13 LEU B 64 -0.503 11.023 4.170 1.00 0.00 H new ATOM 0 HD21 LEU B 64 -2.134 13.568 4.603 1.00 0.00 H new ATOM 0 HD22 LEU B 64 -1.389 12.608 5.902 1.00 0.00 H new ATOM 0 HD23 LEU B 64 -1.025 14.344 5.758 1.00 0.00 H new ATOM 2112 N ASN B 65 1.251 13.541 8.108 1.00 0.00 N ATOM 2113 CA ASN B 65 0.664 13.766 9.451 1.00 0.00 C ATOM 2114 C ASN B 65 1.132 15.084 10.053 1.00 0.00 C ATOM 2115 O ASN B 65 0.446 15.675 10.890 1.00 0.00 O ATOM 2116 CB ASN B 65 0.945 12.591 10.426 1.00 0.00 C ATOM 2117 CG ASN B 65 2.378 12.536 10.957 1.00 0.00 C ATOM 2118 OD1 ASN B 65 2.714 13.197 11.939 1.00 0.00 O ATOM 2119 ND2 ASN B 65 3.210 11.723 10.341 1.00 0.00 N ATOM 0 H ASN B 65 1.749 12.657 8.006 1.00 0.00 H new ATOM 0 HA ASN B 65 -0.415 13.818 9.307 1.00 0.00 H new ATOM 0 HB2 ASN B 65 0.261 12.665 11.271 1.00 0.00 H new ATOM 0 HB3 ASN B 65 0.723 11.653 9.918 1.00 0.00 H new ATOM 0 HD21 ASN B 65 4.169 11.625 10.675 1.00 0.00 H new ATOM 0 HD22 ASN B 65 2.896 11.191 9.530 1.00 0.00 H new ATOM 2126 N GLN B 66 2.279 15.554 9.596 1.00 0.00 N ATOM 2127 CA GLN B 66 2.821 16.816 10.051 1.00 0.00 C ATOM 2128 C GLN B 66 1.939 17.955 9.533 1.00 0.00 C ATOM 2129 O GLN B 66 1.650 18.915 10.248 1.00 0.00 O ATOM 2130 CB GLN B 66 4.254 16.986 9.546 1.00 0.00 C ATOM 2131 CG GLN B 66 5.244 17.390 10.624 1.00 0.00 C ATOM 2132 CD GLN B 66 5.438 16.321 11.689 1.00 0.00 C ATOM 2133 OE1 GLN B 66 5.330 15.059 11.302 1.00 0.00 O flip ATOM 2134 NE2 GLN B 66 5.698 16.628 12.849 1.00 0.00 N flip ATOM 0 H GLN B 66 2.855 15.074 8.904 1.00 0.00 H new ATOM 0 HA GLN B 66 2.836 16.835 11.141 1.00 0.00 H new ATOM 0 HB2 GLN B 66 4.584 16.049 9.097 1.00 0.00 H new ATOM 0 HB3 GLN B 66 4.264 17.738 8.757 1.00 0.00 H new ATOM 0 HG2 GLN B 66 6.206 17.611 10.161 1.00 0.00 H new ATOM 0 HG3 GLN B 66 4.900 18.309 11.099 1.00 0.00 H new ATOM 0 HE21 GLN B 66 5.774 17.611 13.112 1.00 0.00 H new ATOM 0 HE22 GLN B 66 5.838 15.900 13.550 1.00 0.00 H new ATOM 2143 N VAL B 67 1.523 17.826 8.277 1.00 0.00 N ATOM 2144 CA VAL B 67 0.636 18.789 7.637 1.00 0.00 C ATOM 2145 C VAL B 67 -0.702 18.895 8.380 1.00 0.00 C ATOM 2146 O VAL B 67 -1.109 19.987 8.760 1.00 0.00 O ATOM 2147 CB VAL B 67 0.373 18.429 6.151 1.00 0.00 C ATOM 2148 CG1 VAL B 67 -0.570 19.437 5.507 1.00 0.00 C ATOM 2149 CG2 VAL B 67 1.680 18.357 5.378 1.00 0.00 C ATOM 0 H VAL B 67 1.793 17.049 7.674 1.00 0.00 H new ATOM 0 HA VAL B 67 1.143 19.753 7.677 1.00 0.00 H new ATOM 0 HB VAL B 67 -0.102 17.448 6.120 1.00 0.00 H new ATOM 0 HG11 VAL B 67 -0.739 19.163 4.466 1.00 0.00 H new ATOM 0 HG12 VAL B 67 -1.520 19.439 6.041 1.00 0.00 H new ATOM 0 HG13 VAL B 67 -0.126 20.432 5.553 1.00 0.00 H new ATOM 0 HG21 VAL B 67 1.474 18.103 4.338 1.00 0.00 H new ATOM 0 HG22 VAL B 67 2.183 19.323 5.423 1.00 0.00 H new ATOM 0 HG23 VAL B 67 2.321 17.593 5.818 1.00 0.00 H new ATOM 2159 N CYS B 68 -1.376 17.756 8.592 1.00 0.00 N ATOM 2160 CA CYS B 68 -2.675 17.755 9.292 1.00 0.00 C ATOM 2161 C CYS B 68 -2.538 18.349 10.690 1.00 0.00 C ATOM 2162 O CYS B 68 -3.436 19.035 11.173 1.00 0.00 O ATOM 2163 CB CYS B 68 -3.246 16.342 9.413 1.00 0.00 C ATOM 2164 SG CYS B 68 -3.294 15.381 7.870 1.00 0.00 S ATOM 0 H CYS B 68 -1.053 16.835 8.295 1.00 0.00 H new ATOM 0 HA CYS B 68 -3.356 18.364 8.697 1.00 0.00 H new ATOM 0 HB2 CYS B 68 -2.655 15.792 10.145 1.00 0.00 H new ATOM 0 HB3 CYS B 68 -4.259 16.411 9.809 1.00 0.00 H new ATOM 2169 N ALA B 69 -1.415 18.058 11.340 1.00 0.00 N ATOM 2170 CA ALA B 69 -1.140 18.586 12.673 1.00 0.00 C ATOM 2171 C ALA B 69 -1.145 20.116 12.676 1.00 0.00 C ATOM 2172 O ALA B 69 -1.553 20.743 13.653 1.00 0.00 O ATOM 2173 CB ALA B 69 0.189 18.058 13.194 1.00 0.00 C ATOM 0 H ALA B 69 -0.680 17.459 10.965 1.00 0.00 H new ATOM 0 HA ALA B 69 -1.935 18.246 13.337 1.00 0.00 H new ATOM 0 HB1 ALA B 69 0.377 18.463 14.189 1.00 0.00 H new ATOM 0 HB2 ALA B 69 0.153 16.970 13.246 1.00 0.00 H new ATOM 0 HB3 ALA B 69 0.991 18.363 12.521 1.00 0.00 H new ATOM 2179 N LYS B 70 -0.708 20.705 11.573 1.00 0.00 N ATOM 2180 CA LYS B 70 -0.638 22.158 11.453 1.00 0.00 C ATOM 2181 C LYS B 70 -1.909 22.733 10.847 1.00 0.00 C ATOM 2182 O LYS B 70 -2.213 23.910 11.030 1.00 0.00 O ATOM 2183 CB LYS B 70 0.558 22.562 10.607 1.00 0.00 C ATOM 2184 CG LYS B 70 1.877 22.101 11.176 1.00 0.00 C ATOM 2185 CD LYS B 70 3.035 22.530 10.307 1.00 0.00 C ATOM 2186 CE LYS B 70 4.342 22.092 10.918 1.00 0.00 C ATOM 2187 NZ LYS B 70 5.515 22.600 10.163 1.00 0.00 N ATOM 0 H LYS B 70 -0.395 20.199 10.744 1.00 0.00 H new ATOM 0 HA LYS B 70 -0.527 22.563 12.459 1.00 0.00 H new ATOM 0 HB2 LYS B 70 0.440 22.151 9.604 1.00 0.00 H new ATOM 0 HB3 LYS B 70 0.573 23.647 10.507 1.00 0.00 H new ATOM 0 HG2 LYS B 70 2.004 22.508 12.179 1.00 0.00 H new ATOM 0 HG3 LYS B 70 1.874 21.015 11.270 1.00 0.00 H new ATOM 0 HD2 LYS B 70 2.930 22.099 9.311 1.00 0.00 H new ATOM 0 HD3 LYS B 70 3.027 23.613 10.188 1.00 0.00 H new ATOM 0 HE2 LYS B 70 4.395 22.445 11.948 1.00 0.00 H new ATOM 0 HE3 LYS B 70 4.378 21.003 10.952 1.00 0.00 H new ATOM 0 HZ1 LYS B 70 6.390 22.273 10.620 1.00 0.00 H new ATOM 0 HZ2 LYS B 70 5.481 22.243 9.187 1.00 0.00 H new ATOM 0 HZ3 LYS B 70 5.497 23.640 10.152 1.00 0.00 H new ATOM 2201 N ASP B 71 -2.646 21.906 10.132 1.00 0.00 N ATOM 2202 CA ASP B 71 -3.879 22.339 9.479 1.00 0.00 C ATOM 2203 C ASP B 71 -4.857 21.169 9.392 1.00 0.00 C ATOM 2204 O ASP B 71 -4.728 20.303 8.526 1.00 0.00 O ATOM 2205 CB ASP B 71 -3.591 22.887 8.075 1.00 0.00 C ATOM 2206 CG ASP B 71 -4.823 23.481 7.409 1.00 0.00 C ATOM 2207 OD1 ASP B 71 -5.602 22.731 6.805 1.00 0.00 O ATOM 2208 OD2 ASP B 71 -5.000 24.717 7.471 1.00 0.00 O ATOM 0 H ASP B 71 -2.416 20.923 9.984 1.00 0.00 H new ATOM 0 HA ASP B 71 -4.322 23.138 10.074 1.00 0.00 H new ATOM 0 HB2 ASP B 71 -2.815 23.650 8.140 1.00 0.00 H new ATOM 0 HB3 ASP B 71 -3.197 22.085 7.451 1.00 0.00 H new ATOM 2213 N PRO B 72 -5.835 21.114 10.310 1.00 0.00 N ATOM 2214 CA PRO B 72 -6.827 20.027 10.363 1.00 0.00 C ATOM 2215 C PRO B 72 -7.781 20.024 9.169 1.00 0.00 C ATOM 2216 O PRO B 72 -8.506 19.053 8.941 1.00 0.00 O ATOM 2217 CB PRO B 72 -7.608 20.312 11.656 1.00 0.00 C ATOM 2218 CG PRO B 72 -6.769 21.285 12.415 1.00 0.00 C ATOM 2219 CD PRO B 72 -6.042 22.090 11.384 1.00 0.00 C ATOM 0 HA PRO B 72 -6.342 19.051 10.338 1.00 0.00 H new ATOM 0 HB2 PRO B 72 -8.592 20.727 11.438 1.00 0.00 H new ATOM 0 HB3 PRO B 72 -7.767 19.399 12.229 1.00 0.00 H new ATOM 0 HG2 PRO B 72 -7.386 21.924 13.046 1.00 0.00 H new ATOM 0 HG3 PRO B 72 -6.069 20.768 13.072 1.00 0.00 H new ATOM 0 HD2 PRO B 72 -6.629 22.945 11.048 1.00 0.00 H new ATOM 0 HD3 PRO B 72 -5.099 22.481 11.765 1.00 0.00 H new ATOM 2227 N GLN B 73 -7.784 21.112 8.417 1.00 0.00 N ATOM 2228 CA GLN B 73 -8.656 21.254 7.255 1.00 0.00 C ATOM 2229 C GLN B 73 -8.126 20.464 6.060 1.00 0.00 C ATOM 2230 O GLN B 73 -8.738 20.446 4.992 1.00 0.00 O ATOM 2231 CB GLN B 73 -8.797 22.732 6.889 1.00 0.00 C ATOM 2232 CG GLN B 73 -9.237 23.596 8.056 1.00 0.00 C ATOM 2233 CD GLN B 73 -10.606 23.215 8.568 1.00 0.00 C ATOM 2234 OE1 GLN B 73 -11.480 22.809 7.800 1.00 0.00 O ATOM 2235 NE2 GLN B 73 -10.793 23.315 9.861 1.00 0.00 N ATOM 0 H GLN B 73 -7.186 21.920 8.591 1.00 0.00 H new ATOM 0 HA GLN B 73 -9.635 20.850 7.514 1.00 0.00 H new ATOM 0 HB2 GLN B 73 -7.842 23.099 6.513 1.00 0.00 H new ATOM 0 HB3 GLN B 73 -9.519 22.832 6.078 1.00 0.00 H new ATOM 0 HG2 GLN B 73 -8.512 23.507 8.865 1.00 0.00 H new ATOM 0 HG3 GLN B 73 -9.245 24.642 7.748 1.00 0.00 H new ATOM 0 HE21 GLN B 73 -10.041 23.656 10.460 1.00 0.00 H new ATOM 0 HE22 GLN B 73 -11.690 23.052 10.268 1.00 0.00 H new ATOM 2244 N MET B 74 -6.995 19.819 6.244 1.00 0.00 N ATOM 2245 CA MET B 74 -6.395 19.025 5.191 1.00 0.00 C ATOM 2246 C MET B 74 -6.892 17.586 5.236 1.00 0.00 C ATOM 2247 O MET B 74 -6.497 16.807 6.110 1.00 0.00 O ATOM 2248 CB MET B 74 -4.867 19.053 5.292 1.00 0.00 C ATOM 2249 CG MET B 74 -4.253 20.411 4.993 1.00 0.00 C ATOM 2250 SD MET B 74 -4.587 20.976 3.308 1.00 0.00 S ATOM 2251 CE MET B 74 -3.786 19.691 2.350 1.00 0.00 C ATOM 0 H MET B 74 -6.469 19.828 7.118 1.00 0.00 H new ATOM 0 HA MET B 74 -6.693 19.463 4.239 1.00 0.00 H new ATOM 0 HB2 MET B 74 -4.574 18.746 6.296 1.00 0.00 H new ATOM 0 HB3 MET B 74 -4.454 18.319 4.601 1.00 0.00 H new ATOM 0 HG2 MET B 74 -4.641 21.144 5.701 1.00 0.00 H new ATOM 0 HG3 MET B 74 -3.175 20.359 5.147 1.00 0.00 H new ATOM 0 HE1 MET B 74 -3.191 20.145 1.558 1.00 0.00 H new ATOM 0 HE2 MET B 74 -3.137 19.104 3.000 1.00 0.00 H new ATOM 0 HE3 MET B 74 -4.542 19.041 1.909 1.00 0.00 H new ATOM 2261 N LEU B 75 -7.784 17.244 4.312 1.00 0.00 N ATOM 2262 CA LEU B 75 -8.279 15.878 4.198 1.00 0.00 C ATOM 2263 C LEU B 75 -7.160 14.970 3.695 1.00 0.00 C ATOM 2264 O LEU B 75 -6.270 15.423 2.967 1.00 0.00 O ATOM 2265 CB LEU B 75 -9.493 15.793 3.251 1.00 0.00 C ATOM 2266 CG LEU B 75 -10.781 16.517 3.701 1.00 0.00 C ATOM 2267 CD1 LEU B 75 -11.127 16.178 5.143 1.00 0.00 C ATOM 2268 CD2 LEU B 75 -10.671 18.025 3.508 1.00 0.00 C ATOM 0 H LEU B 75 -8.178 17.894 3.632 1.00 0.00 H new ATOM 0 HA LEU B 75 -8.605 15.550 5.185 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -9.197 16.197 2.283 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -9.731 14.740 3.098 1.00 0.00 H new ATOM 0 HG LEU B 75 -11.593 16.161 3.067 1.00 0.00 H new ATOM 0 HD11 LEU B 75 -12.038 16.702 5.431 1.00 0.00 H new ATOM 0 HD12 LEU B 75 -11.282 15.103 5.237 1.00 0.00 H new ATOM 0 HD13 LEU B 75 -10.310 16.485 5.795 1.00 0.00 H new ATOM 0 HD21 LEU B 75 -11.595 18.502 3.835 1.00 0.00 H new ATOM 0 HD22 LEU B 75 -9.837 18.407 4.097 1.00 0.00 H new ATOM 0 HD23 LEU B 75 -10.502 18.246 2.454 1.00 0.00 H new ATOM 2280 N LEU B 76 -7.214 13.696 4.068 1.00 0.00 N ATOM 2281 CA LEU B 76 -6.168 12.735 3.713 1.00 0.00 C ATOM 2282 C LEU B 76 -5.958 12.654 2.207 1.00 0.00 C ATOM 2283 O LEU B 76 -4.825 12.679 1.734 1.00 0.00 O ATOM 2284 CB LEU B 76 -6.502 11.345 4.267 1.00 0.00 C ATOM 2285 CG LEU B 76 -5.480 10.241 3.960 1.00 0.00 C ATOM 2286 CD1 LEU B 76 -4.150 10.529 4.637 1.00 0.00 C ATOM 2287 CD2 LEU B 76 -6.012 8.882 4.382 1.00 0.00 C ATOM 0 H LEU B 76 -7.975 13.300 4.620 1.00 0.00 H new ATOM 0 HA LEU B 76 -5.240 13.089 4.163 1.00 0.00 H new ATOM 0 HB2 LEU B 76 -6.611 11.422 5.349 1.00 0.00 H new ATOM 0 HB3 LEU B 76 -7.470 11.039 3.870 1.00 0.00 H new ATOM 0 HG LEU B 76 -5.316 10.225 2.883 1.00 0.00 H new ATOM 0 HD11 LEU B 76 -3.443 9.733 4.404 1.00 0.00 H new ATOM 0 HD12 LEU B 76 -3.757 11.480 4.277 1.00 0.00 H new ATOM 0 HD13 LEU B 76 -4.295 10.582 5.716 1.00 0.00 H new ATOM 0 HD21 LEU B 76 -5.272 8.115 4.155 1.00 0.00 H new ATOM 0 HD22 LEU B 76 -6.213 8.887 5.453 1.00 0.00 H new ATOM 0 HD23 LEU B 76 -6.934 8.668 3.841 1.00 0.00 H new ATOM 2299 N ILE B 77 -7.053 12.575 1.460 1.00 0.00 N ATOM 2300 CA ILE B 77 -6.977 12.438 0.011 1.00 0.00 C ATOM 2301 C ILE B 77 -6.211 13.608 -0.633 1.00 0.00 C ATOM 2302 O ILE B 77 -5.388 13.406 -1.526 1.00 0.00 O ATOM 2303 CB ILE B 77 -8.389 12.290 -0.630 1.00 0.00 C ATOM 2304 CG1 ILE B 77 -8.276 11.921 -2.112 1.00 0.00 C ATOM 2305 CG2 ILE B 77 -9.228 13.551 -0.447 1.00 0.00 C ATOM 2306 CD1 ILE B 77 -7.683 10.543 -2.342 1.00 0.00 C ATOM 0 H ILE B 77 -8.002 12.603 1.833 1.00 0.00 H new ATOM 0 HA ILE B 77 -6.421 11.522 -0.187 1.00 0.00 H new ATOM 0 HB ILE B 77 -8.901 11.480 -0.111 1.00 0.00 H new ATOM 0 HG12 ILE B 77 -9.266 11.964 -2.567 1.00 0.00 H new ATOM 0 HG13 ILE B 77 -7.660 12.664 -2.619 1.00 0.00 H new ATOM 0 HG21 ILE B 77 -10.205 13.408 -0.908 1.00 0.00 H new ATOM 0 HG22 ILE B 77 -9.354 13.753 0.617 1.00 0.00 H new ATOM 0 HG23 ILE B 77 -8.725 14.395 -0.919 1.00 0.00 H new ATOM 0 HD11 ILE B 77 -7.631 10.343 -3.412 1.00 0.00 H new ATOM 0 HD12 ILE B 77 -6.681 10.503 -1.916 1.00 0.00 H new ATOM 0 HD13 ILE B 77 -8.311 9.792 -1.863 1.00 0.00 H new ATOM 2318 N THR B 78 -6.468 14.818 -0.157 1.00 0.00 N ATOM 2319 CA THR B 78 -5.800 15.993 -0.678 1.00 0.00 C ATOM 2320 C THR B 78 -4.360 16.051 -0.174 1.00 0.00 C ATOM 2321 O THR B 78 -3.433 16.304 -0.938 1.00 0.00 O ATOM 2322 CB THR B 78 -6.546 17.274 -0.258 1.00 0.00 C ATOM 2323 OG1 THR B 78 -7.946 17.115 -0.527 1.00 0.00 O ATOM 2324 CG2 THR B 78 -6.019 18.485 -1.020 1.00 0.00 C ATOM 0 H THR B 78 -7.136 15.008 0.590 1.00 0.00 H new ATOM 0 HA THR B 78 -5.798 15.927 -1.766 1.00 0.00 H new ATOM 0 HB THR B 78 -6.384 17.438 0.807 1.00 0.00 H new ATOM 0 HG1 THR B 78 -8.425 17.927 -0.260 1.00 0.00 H new ATOM 0 HG21 THR B 78 -6.561 19.377 -0.706 1.00 0.00 H new ATOM 0 HG22 THR B 78 -4.957 18.613 -0.810 1.00 0.00 H new ATOM 0 HG23 THR B 78 -6.161 18.332 -2.090 1.00 0.00 H new ATOM 2332 N ALA B 79 -4.188 15.796 1.116 1.00 0.00 N ATOM 2333 CA ALA B 79 -2.875 15.810 1.741 1.00 0.00 C ATOM 2334 C ALA B 79 -1.894 14.860 1.041 1.00 0.00 C ATOM 2335 O ALA B 79 -0.740 15.217 0.819 1.00 0.00 O ATOM 2336 CB ALA B 79 -2.996 15.475 3.213 1.00 0.00 C ATOM 0 H ALA B 79 -4.952 15.575 1.755 1.00 0.00 H new ATOM 0 HA ALA B 79 -2.468 16.816 1.639 1.00 0.00 H new ATOM 0 HB1 ALA B 79 -2.007 15.488 3.672 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -3.633 16.212 3.703 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -3.435 14.484 3.326 1.00 0.00 H new ATOM 2342 N ILE B 80 -2.355 13.655 0.690 1.00 0.00 N ATOM 2343 CA ILE B 80 -1.505 12.700 -0.024 1.00 0.00 C ATOM 2344 C ILE B 80 -1.088 13.278 -1.376 1.00 0.00 C ATOM 2345 O ILE B 80 0.061 13.137 -1.799 1.00 0.00 O ATOM 2346 CB ILE B 80 -2.206 11.322 -0.225 1.00 0.00 C ATOM 2347 CG1 ILE B 80 -2.491 10.677 1.134 1.00 0.00 C ATOM 2348 CG2 ILE B 80 -1.344 10.391 -1.080 1.00 0.00 C ATOM 2349 CD1 ILE B 80 -3.187 9.341 1.050 1.00 0.00 C ATOM 0 H ILE B 80 -3.299 13.322 0.886 1.00 0.00 H new ATOM 0 HA ILE B 80 -0.621 12.529 0.590 1.00 0.00 H new ATOM 0 HB ILE B 80 -3.148 11.488 -0.747 1.00 0.00 H new ATOM 0 HG12 ILE B 80 -1.549 10.551 1.668 1.00 0.00 H new ATOM 0 HG13 ILE B 80 -3.104 11.357 1.725 1.00 0.00 H new ATOM 0 HG21 ILE B 80 -1.854 9.436 -1.206 1.00 0.00 H new ATOM 0 HG22 ILE B 80 -1.177 10.845 -2.057 1.00 0.00 H new ATOM 0 HG23 ILE B 80 -0.386 10.228 -0.587 1.00 0.00 H new ATOM 0 HD11 ILE B 80 -3.352 8.953 2.055 1.00 0.00 H new ATOM 0 HD12 ILE B 80 -4.146 9.461 0.546 1.00 0.00 H new ATOM 0 HD13 ILE B 80 -2.567 8.642 0.488 1.00 0.00 H new ATOM 2361 N ASP B 81 -2.021 13.959 -2.028 1.00 0.00 N ATOM 2362 CA ASP B 81 -1.750 14.609 -3.308 1.00 0.00 C ATOM 2363 C ASP B 81 -0.694 15.699 -3.143 1.00 0.00 C ATOM 2364 O ASP B 81 0.210 15.837 -3.972 1.00 0.00 O ATOM 2365 CB ASP B 81 -3.032 15.195 -3.893 1.00 0.00 C ATOM 2366 CG ASP B 81 -2.768 16.119 -5.069 1.00 0.00 C ATOM 2367 OD1 ASP B 81 -2.462 15.621 -6.174 1.00 0.00 O ATOM 2368 OD2 ASP B 81 -2.873 17.352 -4.897 1.00 0.00 O ATOM 0 H ASP B 81 -2.977 14.077 -1.692 1.00 0.00 H new ATOM 0 HA ASP B 81 -1.366 13.858 -3.999 1.00 0.00 H new ATOM 0 HB2 ASP B 81 -3.685 14.383 -4.213 1.00 0.00 H new ATOM 0 HB3 ASP B 81 -3.564 15.744 -3.116 1.00 0.00 H new ATOM 2373 N ASP B 82 -0.804 16.461 -2.062 1.00 0.00 N ATOM 2374 CA ASP B 82 0.181 17.495 -1.752 1.00 0.00 C ATOM 2375 C ASP B 82 1.520 16.870 -1.422 1.00 0.00 C ATOM 2376 O ASP B 82 2.574 17.458 -1.658 1.00 0.00 O ATOM 2377 CB ASP B 82 -0.282 18.371 -0.585 1.00 0.00 C ATOM 2378 CG ASP B 82 -1.318 19.385 -0.995 1.00 0.00 C ATOM 2379 OD1 ASP B 82 -0.973 20.304 -1.770 1.00 0.00 O ATOM 2380 OD2 ASP B 82 -2.470 19.285 -0.549 1.00 0.00 O ATOM 0 H ASP B 82 -1.563 16.384 -1.385 1.00 0.00 H new ATOM 0 HA ASP B 82 0.287 18.125 -2.635 1.00 0.00 H new ATOM 0 HB2 ASP B 82 -0.692 17.736 0.200 1.00 0.00 H new ATOM 0 HB3 ASP B 82 0.578 18.888 -0.160 1.00 0.00 H new ATOM 2385 N THR B 83 1.473 15.665 -0.905 1.00 0.00 N ATOM 2386 CA THR B 83 2.673 14.949 -0.546 1.00 0.00 C ATOM 2387 C THR B 83 3.418 14.505 -1.803 1.00 0.00 C ATOM 2388 O THR B 83 4.636 14.503 -1.827 1.00 0.00 O ATOM 2389 CB THR B 83 2.370 13.736 0.361 1.00 0.00 C ATOM 2390 OG1 THR B 83 1.612 14.168 1.497 1.00 0.00 O ATOM 2391 CG2 THR B 83 3.661 13.096 0.847 1.00 0.00 C ATOM 0 H THR B 83 0.608 15.157 -0.722 1.00 0.00 H new ATOM 0 HA THR B 83 3.307 15.629 0.023 1.00 0.00 H new ATOM 0 HB THR B 83 1.804 13.005 -0.216 1.00 0.00 H new ATOM 0 HG1 THR B 83 0.685 14.336 1.227 1.00 0.00 H new ATOM 0 HG21 THR B 83 3.427 12.243 1.484 1.00 0.00 H new ATOM 0 HG22 THR B 83 4.245 12.759 -0.009 1.00 0.00 H new ATOM 0 HG23 THR B 83 4.238 13.826 1.415 1.00 0.00 H new ATOM 2399 N MET B 84 2.664 14.159 -2.861 1.00 0.00 N ATOM 2400 CA MET B 84 3.253 13.792 -4.170 1.00 0.00 C ATOM 2401 C MET B 84 4.163 14.909 -4.653 1.00 0.00 C ATOM 2402 O MET B 84 5.116 14.690 -5.396 1.00 0.00 O ATOM 2403 CB MET B 84 2.151 13.592 -5.225 1.00 0.00 C ATOM 2404 CG MET B 84 0.931 12.797 -4.772 1.00 0.00 C ATOM 2405 SD MET B 84 1.142 11.015 -4.859 1.00 0.00 S ATOM 2406 CE MET B 84 2.340 10.717 -3.574 1.00 0.00 C ATOM 0 H MET B 84 1.645 14.124 -2.840 1.00 0.00 H new ATOM 0 HA MET B 84 3.812 12.866 -4.040 1.00 0.00 H new ATOM 0 HB2 MET B 84 1.816 14.573 -5.563 1.00 0.00 H new ATOM 0 HB3 MET B 84 2.588 13.089 -6.088 1.00 0.00 H new ATOM 0 HG2 MET B 84 0.691 13.074 -3.745 1.00 0.00 H new ATOM 0 HG3 MET B 84 0.077 13.081 -5.387 1.00 0.00 H new ATOM 0 HE1 MET B 84 2.206 9.711 -3.178 1.00 0.00 H new ATOM 0 HE2 MET B 84 3.345 10.814 -3.984 1.00 0.00 H new ATOM 0 HE3 MET B 84 2.203 11.444 -2.773 1.00 0.00 H new ATOM 2416 N ARG B 85 3.855 16.100 -4.204 1.00 0.00 N ATOM 2417 CA ARG B 85 4.583 17.277 -4.583 1.00 0.00 C ATOM 2418 C ARG B 85 5.790 17.445 -3.668 1.00 0.00 C ATOM 2419 O ARG B 85 6.869 17.794 -4.109 1.00 0.00 O ATOM 2420 CB ARG B 85 3.660 18.496 -4.520 1.00 0.00 C ATOM 2421 CG ARG B 85 2.294 18.228 -5.147 1.00 0.00 C ATOM 2422 CD ARG B 85 1.426 19.471 -5.235 1.00 0.00 C ATOM 2423 NE ARG B 85 1.143 20.076 -3.932 1.00 0.00 N ATOM 2424 CZ ARG B 85 1.658 21.225 -3.498 1.00 0.00 C ATOM 2425 NH1 ARG B 85 2.566 21.876 -4.221 1.00 0.00 N ATOM 2426 NH2 ARG B 85 1.246 21.723 -2.344 1.00 0.00 N ATOM 0 H ARG B 85 3.085 16.278 -3.560 1.00 0.00 H new ATOM 0 HA ARG B 85 4.943 17.179 -5.607 1.00 0.00 H new ATOM 0 HB2 ARG B 85 3.527 18.793 -3.480 1.00 0.00 H new ATOM 0 HB3 ARG B 85 4.134 19.333 -5.033 1.00 0.00 H new ATOM 0 HG2 ARG B 85 2.434 17.818 -6.147 1.00 0.00 H new ATOM 0 HG3 ARG B 85 1.774 17.470 -4.561 1.00 0.00 H new ATOM 0 HD2 ARG B 85 1.921 20.207 -5.869 1.00 0.00 H new ATOM 0 HD3 ARG B 85 0.484 19.214 -5.720 1.00 0.00 H new ATOM 0 HE ARG B 85 0.504 19.581 -3.310 1.00 0.00 H new ATOM 0 HH11 ARG B 85 2.873 21.496 -5.116 1.00 0.00 H new ATOM 0 HH12 ARG B 85 2.954 22.755 -3.880 1.00 0.00 H new ATOM 0 HH21 ARG B 85 0.542 21.228 -1.797 1.00 0.00 H new ATOM 0 HH22 ARG B 85 1.633 22.602 -2.001 1.00 0.00 H new ATOM 2440 N ALA B 86 5.587 17.172 -2.392 1.00 0.00 N ATOM 2441 CA ALA B 86 6.644 17.286 -1.393 1.00 0.00 C ATOM 2442 C ALA B 86 7.682 16.145 -1.476 1.00 0.00 C ATOM 2443 O ALA B 86 8.822 16.308 -1.028 1.00 0.00 O ATOM 2444 CB ALA B 86 6.038 17.341 0.001 1.00 0.00 C ATOM 0 H ALA B 86 4.690 16.866 -2.016 1.00 0.00 H new ATOM 0 HA ALA B 86 7.179 18.212 -1.604 1.00 0.00 H new ATOM 0 HB1 ALA B 86 6.834 17.426 0.741 1.00 0.00 H new ATOM 0 HB2 ALA B 86 5.378 18.205 0.077 1.00 0.00 H new ATOM 0 HB3 ALA B 86 5.467 16.431 0.186 1.00 0.00 H new ATOM 2450 N ILE B 87 7.292 14.989 -2.012 1.00 0.00 N ATOM 2451 CA ILE B 87 8.223 13.852 -2.105 1.00 0.00 C ATOM 2452 C ILE B 87 8.637 13.546 -3.524 1.00 0.00 C ATOM 2453 O ILE B 87 9.403 12.617 -3.759 1.00 0.00 O ATOM 2454 CB ILE B 87 7.647 12.558 -1.521 1.00 0.00 C ATOM 2455 CG1 ILE B 87 6.361 12.145 -2.249 1.00 0.00 C ATOM 2456 CG2 ILE B 87 7.417 12.684 -0.020 1.00 0.00 C ATOM 2457 CD1 ILE B 87 5.878 10.754 -1.896 1.00 0.00 C ATOM 0 H ILE B 87 6.359 14.811 -2.383 1.00 0.00 H new ATOM 0 HA ILE B 87 9.086 14.175 -1.522 1.00 0.00 H new ATOM 0 HB ILE B 87 8.382 11.769 -1.676 1.00 0.00 H new ATOM 0 HG12 ILE B 87 5.575 12.863 -2.014 1.00 0.00 H new ATOM 0 HG13 ILE B 87 6.530 12.199 -3.324 1.00 0.00 H new ATOM 0 HG21 ILE B 87 7.008 11.750 0.365 1.00 0.00 H new ATOM 0 HG22 ILE B 87 8.364 12.898 0.476 1.00 0.00 H new ATOM 0 HG23 ILE B 87 6.715 13.495 0.174 1.00 0.00 H new ATOM 0 HD11 ILE B 87 4.965 10.534 -2.450 1.00 0.00 H new ATOM 0 HD12 ILE B 87 6.645 10.025 -2.157 1.00 0.00 H new ATOM 0 HD13 ILE B 87 5.675 10.700 -0.826 1.00 0.00 H new