USER MOD reduce.3.24.130724 H: found=0, std=0, add=1097, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1095 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 NoAdj : A 60 ASNHD21 : A 60 ASN OD1 : A 250 CACA :(metal ligand) USER MOD NoAdj : A 60 ASNHD22 : A 60 ASN OD1 : A 250 CACA :(metal ligand) USER MOD Set 1.1: A 124 MET CE :methyl 135:sc= -2.75! (180deg=-3.78!) USER MOD Set 1.2: A 144 MET CE :methyl -146:sc= -0.361 (180deg=0) USER MOD Set 2.1: A 72 MET CE :methyl 176:sc= -0.438 (180deg=-0.511) USER MOD Set 2.2: A 76 MET CE :methyl 138:sc= -1.08 (180deg=-2.19!) USER MOD Set 3.1: A 36 MET CE :methyl 157:sc= -0.521 (180deg=-1.96!) USER MOD Set 3.2: A 51 MET CE :methyl -141:sc= -1.61 (180deg=-3.48!) USER MOD Single : A 1 ALA N :NH3+ 166:sc= -0.0387 (180deg=-0.244) USER MOD Single : A 3 GLN : amide:sc= -0.0503 X(o=-0.05,f=-0.05) USER MOD Single : A 5 THR OG1 : rot 180:sc= -0.491 USER MOD Single : A 8 GLN : amide:sc= -0.682 K(o=-0.68,f=-3.7!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot -92:sc= 0.712 USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.122 USER MOD Single : A 29 THR OG1 : rot 180:sc= -0.0198 USER MOD Single : A 30 LYS NZ :NH3+ -128:sc= 0.117 (180deg=-0.0132) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= -0.0634 USER MOD Single : A 41 GLN : amide:sc= -0.25 X(o=-0.25,f=-0.63) USER MOD Single : A 42 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= -0.0514 X(o=-0.051,f=-0.051) USER MOD Single : A 53 ASN : amide:sc= 0.653 K(o=0.65,f=-0.025) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 MET CE :methyl -143:sc=-0.00182 (180deg=-1.69) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ -156:sc= -0.0623 (180deg=-0.399) USER MOD Single : A 79 THR OG1 : rot 28:sc= 0.836 USER MOD Single : A 81 SER OG : rot 89:sc= 0.575 USER MOD Single : A 94 LYS NZ :NH3+ -174:sc= -0.0212 (180deg=-0.0847) USER MOD Single : A 97 ASN : amide:sc= -0.436! C(o=-0.44!,f=-4.7!) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0.0755 USER MOD Single : A 107 HIS : no HD1:sc= -2.03! K(o=-2!,f=-0.64) USER MOD Single : A 109 MET CE :methyl -178:sc= -1.74 (180deg=-1.76) USER MOD Single : A 110 THR OG1 : rot 75:sc= 0.322 USER MOD Single : A 111 ASN : amide:sc= -0.0591 X(o=-0.059,f=-0.46) USER MOD Single : A 115 LYS NZ :NH3+ -165:sc= -0.0115 (180deg=-0.169) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 GLN : amide:sc=-0.00122 X(o=-0.0012,f=-0.11) USER MOD Single : A 137 ASN : amide:sc= -6.7 K(o=-6.7,f=-11!) USER MOD Single : A 138 TYR OH : rot 180:sc= 0.96 USER MOD Single : A 143 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 145 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 146 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 137:sc= -0.0075! (180deg=-1.11!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 16.754 -4.176 10.897 1.00 0.00 N ATOM 2 CA ALA A 1 17.615 -4.158 9.721 1.00 0.00 C ATOM 3 C ALA A 1 17.787 -5.560 9.146 1.00 0.00 C ATOM 4 O ALA A 1 18.802 -5.864 8.519 1.00 0.00 O ATOM 5 CB ALA A 1 18.970 -3.559 10.069 1.00 0.00 C ATOM 0 H1 ALA A 1 16.840 -3.272 11.404 1.00 0.00 H new ATOM 0 H2 ALA A 1 15.766 -4.315 10.602 1.00 0.00 H new ATOM 0 H3 ALA A 1 17.040 -4.954 11.525 1.00 0.00 H new ATOM 0 HA ALA A 1 17.139 -3.537 8.962 1.00 0.00 H new ATOM 0 HB1 ALA A 1 19.603 -3.552 9.182 1.00 0.00 H new ATOM 0 HB2 ALA A 1 18.835 -2.538 10.427 1.00 0.00 H new ATOM 0 HB3 ALA A 1 19.443 -4.157 10.847 1.00 0.00 H new ATOM 11 N ASP A 2 16.790 -6.410 9.363 1.00 0.00 N ATOM 12 CA ASP A 2 16.830 -7.780 8.866 1.00 0.00 C ATOM 13 C ASP A 2 16.293 -7.856 7.440 1.00 0.00 C ATOM 14 O ASP A 2 16.575 -8.807 6.711 1.00 0.00 O ATOM 15 CB ASP A 2 16.020 -8.701 9.779 1.00 0.00 C ATOM 16 CG ASP A 2 14.909 -7.967 10.503 1.00 0.00 C ATOM 17 OD1 ASP A 2 13.988 -7.468 9.824 1.00 0.00 O ATOM 18 OD2 ASP A 2 14.961 -7.891 11.749 1.00 0.00 O ATOM 0 H ASP A 2 15.943 -6.174 9.880 1.00 0.00 H new ATOM 0 HA ASP A 2 17.869 -8.109 8.862 1.00 0.00 H new ATOM 0 HB2 ASP A 2 15.592 -9.510 9.187 1.00 0.00 H new ATOM 0 HB3 ASP A 2 16.685 -9.160 10.510 1.00 0.00 H new ATOM 23 N GLN A 3 15.518 -6.849 7.050 1.00 0.00 N ATOM 24 CA GLN A 3 14.940 -6.804 5.712 1.00 0.00 C ATOM 25 C GLN A 3 15.829 -6.009 4.762 1.00 0.00 C ATOM 26 O GLN A 3 15.343 -5.377 3.823 1.00 0.00 O ATOM 27 CB GLN A 3 13.541 -6.186 5.759 1.00 0.00 C ATOM 28 CG GLN A 3 12.448 -7.181 6.117 1.00 0.00 C ATOM 29 CD GLN A 3 12.149 -8.150 4.990 1.00 0.00 C ATOM 30 OE1 GLN A 3 11.561 -7.776 3.975 1.00 0.00 O ATOM 31 NE2 GLN A 3 12.554 -9.403 5.163 1.00 0.00 N ATOM 0 H GLN A 3 15.276 -6.054 7.641 1.00 0.00 H new ATOM 0 HA GLN A 3 14.866 -7.826 5.340 1.00 0.00 H new ATOM 0 HB2 GLN A 3 13.535 -5.375 6.487 1.00 0.00 H new ATOM 0 HB3 GLN A 3 13.315 -5.744 4.788 1.00 0.00 H new ATOM 0 HG2 GLN A 3 12.748 -7.741 7.003 1.00 0.00 H new ATOM 0 HG3 GLN A 3 11.539 -6.639 6.376 1.00 0.00 H new ATOM 0 HE21 GLN A 3 13.038 -9.669 6.021 1.00 0.00 H new ATOM 0 HE22 GLN A 3 12.381 -10.100 4.438 1.00 0.00 H new ATOM 40 N LEU A 4 17.133 -6.044 5.011 1.00 0.00 N ATOM 41 CA LEU A 4 18.091 -5.326 4.178 1.00 0.00 C ATOM 42 C LEU A 4 19.280 -6.214 3.827 1.00 0.00 C ATOM 43 O LEU A 4 20.413 -5.941 4.226 1.00 0.00 O ATOM 44 CB LEU A 4 18.575 -4.064 4.894 1.00 0.00 C ATOM 45 CG LEU A 4 17.487 -3.100 5.366 1.00 0.00 C ATOM 46 CD1 LEU A 4 17.950 -2.331 6.593 1.00 0.00 C ATOM 47 CD2 LEU A 4 17.102 -2.142 4.248 1.00 0.00 C ATOM 0 H LEU A 4 17.552 -6.562 5.783 1.00 0.00 H new ATOM 0 HA LEU A 4 17.589 -5.041 3.253 1.00 0.00 H new ATOM 0 HB2 LEU A 4 19.165 -4.365 5.759 1.00 0.00 H new ATOM 0 HB3 LEU A 4 19.244 -3.525 4.224 1.00 0.00 H new ATOM 0 HG LEU A 4 16.607 -3.682 5.639 1.00 0.00 H new ATOM 0 HD11 LEU A 4 17.162 -1.650 6.914 1.00 0.00 H new ATOM 0 HD12 LEU A 4 18.175 -3.031 7.398 1.00 0.00 H new ATOM 0 HD13 LEU A 4 18.846 -1.760 6.348 1.00 0.00 H new ATOM 0 HD21 LEU A 4 16.326 -1.463 4.602 1.00 0.00 H new ATOM 0 HD22 LEU A 4 17.977 -1.567 3.944 1.00 0.00 H new ATOM 0 HD23 LEU A 4 16.727 -2.709 3.396 1.00 0.00 H new ATOM 59 N THR A 5 19.017 -7.278 3.075 1.00 0.00 N ATOM 60 CA THR A 5 20.065 -8.206 2.669 1.00 0.00 C ATOM 61 C THR A 5 20.678 -7.793 1.336 1.00 0.00 C ATOM 62 O THR A 5 20.372 -6.726 0.806 1.00 0.00 O ATOM 63 CB THR A 5 19.527 -9.644 2.550 1.00 0.00 C ATOM 64 OG1 THR A 5 18.155 -9.622 2.141 1.00 0.00 O ATOM 65 CG2 THR A 5 19.654 -10.380 3.876 1.00 0.00 C ATOM 0 H THR A 5 18.086 -7.519 2.734 1.00 0.00 H new ATOM 0 HA THR A 5 20.831 -8.176 3.443 1.00 0.00 H new ATOM 0 HB THR A 5 20.120 -10.170 1.802 1.00 0.00 H new ATOM 0 HG1 THR A 5 17.821 -10.540 2.066 1.00 0.00 H new ATOM 0 HG21 THR A 5 19.268 -11.394 3.768 1.00 0.00 H new ATOM 0 HG22 THR A 5 20.703 -10.421 4.171 1.00 0.00 H new ATOM 0 HG23 THR A 5 19.083 -9.854 4.641 1.00 0.00 H new ATOM 73 N GLU A 6 21.544 -8.647 0.799 1.00 0.00 N ATOM 74 CA GLU A 6 22.200 -8.369 -0.474 1.00 0.00 C ATOM 75 C GLU A 6 21.261 -7.626 -1.419 1.00 0.00 C ATOM 76 O GLU A 6 21.703 -6.862 -2.276 1.00 0.00 O ATOM 77 CB GLU A 6 22.672 -9.671 -1.125 1.00 0.00 C ATOM 78 CG GLU A 6 23.771 -10.376 -0.348 1.00 0.00 C ATOM 79 CD GLU A 6 25.004 -9.513 -0.169 1.00 0.00 C ATOM 80 OE1 GLU A 6 25.194 -8.573 -0.969 1.00 0.00 O ATOM 81 OE2 GLU A 6 25.781 -9.777 0.773 1.00 0.00 O ATOM 0 H GLU A 6 21.807 -9.536 1.225 1.00 0.00 H new ATOM 0 HA GLU A 6 23.065 -7.736 -0.277 1.00 0.00 H new ATOM 0 HB2 GLU A 6 21.822 -10.345 -1.228 1.00 0.00 H new ATOM 0 HB3 GLU A 6 23.031 -9.455 -2.131 1.00 0.00 H new ATOM 0 HG2 GLU A 6 23.390 -10.666 0.631 1.00 0.00 H new ATOM 0 HG3 GLU A 6 24.047 -11.294 -0.867 1.00 0.00 H new ATOM 88 N GLU A 7 19.962 -7.857 -1.256 1.00 0.00 N ATOM 89 CA GLU A 7 18.960 -7.211 -2.096 1.00 0.00 C ATOM 90 C GLU A 7 19.048 -5.692 -1.977 1.00 0.00 C ATOM 91 O GLU A 7 19.231 -4.992 -2.973 1.00 0.00 O ATOM 92 CB GLU A 7 17.557 -7.683 -1.710 1.00 0.00 C ATOM 93 CG GLU A 7 17.245 -7.518 -0.232 1.00 0.00 C ATOM 94 CD GLU A 7 16.253 -8.548 0.273 1.00 0.00 C ATOM 95 OE1 GLU A 7 16.170 -9.638 -0.329 1.00 0.00 O ATOM 96 OE2 GLU A 7 15.559 -8.262 1.272 1.00 0.00 O ATOM 0 H GLU A 7 19.579 -8.486 -0.550 1.00 0.00 H new ATOM 0 HA GLU A 7 19.157 -7.489 -3.131 1.00 0.00 H new ATOM 0 HB2 GLU A 7 16.823 -7.126 -2.292 1.00 0.00 H new ATOM 0 HB3 GLU A 7 17.449 -8.733 -1.981 1.00 0.00 H new ATOM 0 HG2 GLU A 7 18.169 -7.597 0.342 1.00 0.00 H new ATOM 0 HG3 GLU A 7 16.846 -6.519 -0.058 1.00 0.00 H new ATOM 103 N GLN A 8 18.916 -5.192 -0.753 1.00 0.00 N ATOM 104 CA GLN A 8 18.980 -3.756 -0.504 1.00 0.00 C ATOM 105 C GLN A 8 20.407 -3.240 -0.655 1.00 0.00 C ATOM 106 O GLN A 8 20.635 -2.180 -1.238 1.00 0.00 O ATOM 107 CB GLN A 8 18.454 -3.436 0.896 1.00 0.00 C ATOM 108 CG GLN A 8 16.939 -3.497 1.006 1.00 0.00 C ATOM 109 CD GLN A 8 16.274 -2.185 0.638 1.00 0.00 C ATOM 110 OE1 GLN A 8 15.833 -1.434 1.508 1.00 0.00 O ATOM 111 NE2 GLN A 8 16.199 -1.902 -0.657 1.00 0.00 N ATOM 0 H GLN A 8 18.764 -5.759 0.081 1.00 0.00 H new ATOM 0 HA GLN A 8 18.353 -3.256 -1.243 1.00 0.00 H new ATOM 0 HB2 GLN A 8 18.890 -4.137 1.608 1.00 0.00 H new ATOM 0 HB3 GLN A 8 18.791 -2.440 1.183 1.00 0.00 H new ATOM 0 HG2 GLN A 8 16.563 -4.286 0.355 1.00 0.00 H new ATOM 0 HG3 GLN A 8 16.663 -3.766 2.025 1.00 0.00 H new ATOM 0 HE21 GLN A 8 16.578 -2.554 -1.344 1.00 0.00 H new ATOM 0 HE22 GLN A 8 15.763 -1.033 -0.965 1.00 0.00 H new ATOM 120 N ILE A 9 21.363 -3.996 -0.126 1.00 0.00 N ATOM 121 CA ILE A 9 22.768 -3.615 -0.202 1.00 0.00 C ATOM 122 C ILE A 9 23.199 -3.394 -1.648 1.00 0.00 C ATOM 123 O ILE A 9 23.856 -2.403 -1.965 1.00 0.00 O ATOM 124 CB ILE A 9 23.676 -4.683 0.436 1.00 0.00 C ATOM 125 CG1 ILE A 9 23.619 -4.587 1.962 1.00 0.00 C ATOM 126 CG2 ILE A 9 25.107 -4.524 -0.057 1.00 0.00 C ATOM 127 CD1 ILE A 9 22.552 -5.463 2.582 1.00 0.00 C ATOM 0 H ILE A 9 21.190 -4.876 0.360 1.00 0.00 H new ATOM 0 HA ILE A 9 22.874 -2.683 0.353 1.00 0.00 H new ATOM 0 HB ILE A 9 23.317 -5.668 0.139 1.00 0.00 H new ATOM 0 HG12 ILE A 9 24.590 -4.865 2.372 1.00 0.00 H new ATOM 0 HG13 ILE A 9 23.438 -3.551 2.247 1.00 0.00 H new ATOM 0 HG21 ILE A 9 25.737 -5.286 0.403 1.00 0.00 H new ATOM 0 HG22 ILE A 9 25.133 -4.637 -1.141 1.00 0.00 H new ATOM 0 HG23 ILE A 9 25.477 -3.535 0.214 1.00 0.00 H new ATOM 0 HD11 ILE A 9 22.569 -5.345 3.665 1.00 0.00 H new ATOM 0 HD12 ILE A 9 21.574 -5.171 2.200 1.00 0.00 H new ATOM 0 HD13 ILE A 9 22.744 -6.505 2.328 1.00 0.00 H new ATOM 139 N ALA A 10 22.825 -4.324 -2.520 1.00 0.00 N ATOM 140 CA ALA A 10 23.170 -4.229 -3.933 1.00 0.00 C ATOM 141 C ALA A 10 22.594 -2.961 -4.555 1.00 0.00 C ATOM 142 O ALA A 10 23.205 -2.360 -5.437 1.00 0.00 O ATOM 143 CB ALA A 10 22.674 -5.458 -4.681 1.00 0.00 C ATOM 0 H ALA A 10 22.283 -5.152 -2.273 1.00 0.00 H new ATOM 0 HA ALA A 10 24.256 -4.181 -4.014 1.00 0.00 H new ATOM 0 HB1 ALA A 10 22.938 -5.374 -5.735 1.00 0.00 H new ATOM 0 HB2 ALA A 10 23.137 -6.351 -4.261 1.00 0.00 H new ATOM 0 HB3 ALA A 10 21.591 -5.531 -4.583 1.00 0.00 H new ATOM 149 N GLU A 11 21.415 -2.561 -4.088 1.00 0.00 N ATOM 150 CA GLU A 11 20.757 -1.365 -4.601 1.00 0.00 C ATOM 151 C GLU A 11 21.478 -0.104 -4.132 1.00 0.00 C ATOM 152 O GLU A 11 21.845 0.751 -4.938 1.00 0.00 O ATOM 153 CB GLU A 11 19.295 -1.327 -4.151 1.00 0.00 C ATOM 154 CG GLU A 11 18.381 -2.218 -4.975 1.00 0.00 C ATOM 155 CD GLU A 11 17.915 -1.551 -6.254 1.00 0.00 C ATOM 156 OE1 GLU A 11 18.745 -1.380 -7.172 1.00 0.00 O ATOM 157 OE2 GLU A 11 16.719 -1.200 -6.338 1.00 0.00 O ATOM 0 H GLU A 11 20.897 -3.047 -3.356 1.00 0.00 H new ATOM 0 HA GLU A 11 20.793 -1.400 -5.690 1.00 0.00 H new ATOM 0 HB2 GLU A 11 19.238 -1.630 -3.105 1.00 0.00 H new ATOM 0 HB3 GLU A 11 18.933 -0.300 -4.206 1.00 0.00 H new ATOM 0 HG2 GLU A 11 18.905 -3.141 -5.221 1.00 0.00 H new ATOM 0 HG3 GLU A 11 17.513 -2.494 -4.377 1.00 0.00 H new ATOM 164 N PHE A 12 21.678 0.003 -2.823 1.00 0.00 N ATOM 165 CA PHE A 12 22.354 1.159 -2.245 1.00 0.00 C ATOM 166 C PHE A 12 23.812 1.217 -2.692 1.00 0.00 C ATOM 167 O PHE A 12 24.409 2.291 -2.764 1.00 0.00 O ATOM 168 CB PHE A 12 22.278 1.110 -0.718 1.00 0.00 C ATOM 169 CG PHE A 12 20.927 1.478 -0.173 1.00 0.00 C ATOM 170 CD1 PHE A 12 20.523 2.802 -0.120 1.00 0.00 C ATOM 171 CD2 PHE A 12 20.061 0.499 0.287 1.00 0.00 C ATOM 172 CE1 PHE A 12 19.281 3.143 0.382 1.00 0.00 C ATOM 173 CE2 PHE A 12 18.818 0.833 0.789 1.00 0.00 C ATOM 174 CZ PHE A 12 18.427 2.157 0.836 1.00 0.00 C ATOM 0 H PHE A 12 21.382 -0.696 -2.142 1.00 0.00 H new ATOM 0 HA PHE A 12 21.849 2.058 -2.598 1.00 0.00 H new ATOM 0 HB2 PHE A 12 22.536 0.106 -0.381 1.00 0.00 H new ATOM 0 HB3 PHE A 12 23.025 1.787 -0.303 1.00 0.00 H new ATOM 0 HD1 PHE A 12 21.186 3.577 -0.475 1.00 0.00 H new ATOM 0 HD2 PHE A 12 20.361 -0.538 0.253 1.00 0.00 H new ATOM 0 HE1 PHE A 12 18.979 4.179 0.419 1.00 0.00 H new ATOM 0 HE2 PHE A 12 18.153 0.060 1.144 1.00 0.00 H new ATOM 0 HZ PHE A 12 17.455 2.421 1.227 1.00 0.00 H new ATOM 184 N LYS A 13 24.379 0.053 -2.989 1.00 0.00 N ATOM 185 CA LYS A 13 25.766 -0.032 -3.429 1.00 0.00 C ATOM 186 C LYS A 13 25.940 0.601 -4.806 1.00 0.00 C ATOM 187 O LYS A 13 26.702 1.554 -4.968 1.00 0.00 O ATOM 188 CB LYS A 13 26.222 -1.493 -3.467 1.00 0.00 C ATOM 189 CG LYS A 13 27.711 -1.659 -3.717 1.00 0.00 C ATOM 190 CD LYS A 13 28.205 -3.021 -3.259 1.00 0.00 C ATOM 191 CE LYS A 13 28.043 -4.068 -4.350 1.00 0.00 C ATOM 192 NZ LYS A 13 28.077 -5.452 -3.800 1.00 0.00 N ATOM 0 H LYS A 13 23.899 -0.845 -2.933 1.00 0.00 H new ATOM 0 HA LYS A 13 26.381 0.516 -2.716 1.00 0.00 H new ATOM 0 HB2 LYS A 13 25.966 -1.970 -2.521 1.00 0.00 H new ATOM 0 HB3 LYS A 13 25.670 -2.017 -4.248 1.00 0.00 H new ATOM 0 HG2 LYS A 13 27.919 -1.534 -4.780 1.00 0.00 H new ATOM 0 HG3 LYS A 13 28.259 -0.877 -3.191 1.00 0.00 H new ATOM 0 HD2 LYS A 13 29.255 -2.951 -2.973 1.00 0.00 H new ATOM 0 HD3 LYS A 13 27.653 -3.330 -2.372 1.00 0.00 H new ATOM 0 HE2 LYS A 13 27.099 -3.907 -4.870 1.00 0.00 H new ATOM 0 HE3 LYS A 13 28.837 -3.950 -5.087 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 27.963 -6.136 -4.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 28.988 -5.615 -3.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 27.303 -5.573 -3.115 1.00 0.00 H new ATOM 206 N GLU A 14 25.228 0.066 -5.793 1.00 0.00 N ATOM 207 CA GLU A 14 25.305 0.581 -7.155 1.00 0.00 C ATOM 208 C GLU A 14 24.998 2.075 -7.190 1.00 0.00 C ATOM 209 O GLU A 14 25.635 2.834 -7.919 1.00 0.00 O ATOM 210 CB GLU A 14 24.332 -0.173 -8.064 1.00 0.00 C ATOM 211 CG GLU A 14 24.630 -1.658 -8.177 1.00 0.00 C ATOM 212 CD GLU A 14 26.029 -1.935 -8.692 1.00 0.00 C ATOM 213 OE1 GLU A 14 26.584 -1.068 -9.400 1.00 0.00 O ATOM 214 OE2 GLU A 14 26.570 -3.019 -8.388 1.00 0.00 O ATOM 0 H GLU A 14 24.592 -0.723 -5.675 1.00 0.00 H new ATOM 0 HA GLU A 14 26.322 0.429 -7.517 1.00 0.00 H new ATOM 0 HB2 GLU A 14 23.319 -0.042 -7.685 1.00 0.00 H new ATOM 0 HB3 GLU A 14 24.360 0.271 -9.059 1.00 0.00 H new ATOM 0 HG2 GLU A 14 24.508 -2.125 -7.200 1.00 0.00 H new ATOM 0 HG3 GLU A 14 23.903 -2.121 -8.844 1.00 0.00 H new ATOM 221 N ALA A 15 24.016 2.490 -6.397 1.00 0.00 N ATOM 222 CA ALA A 15 23.624 3.892 -6.335 1.00 0.00 C ATOM 223 C ALA A 15 24.688 4.729 -5.634 1.00 0.00 C ATOM 224 O ALA A 15 24.657 5.959 -5.683 1.00 0.00 O ATOM 225 CB ALA A 15 22.285 4.036 -5.626 1.00 0.00 C ATOM 0 H ALA A 15 23.477 1.874 -5.788 1.00 0.00 H new ATOM 0 HA ALA A 15 23.523 4.260 -7.356 1.00 0.00 H new ATOM 0 HB1 ALA A 15 22.005 5.089 -5.587 1.00 0.00 H new ATOM 0 HB2 ALA A 15 21.523 3.478 -6.170 1.00 0.00 H new ATOM 0 HB3 ALA A 15 22.366 3.645 -4.612 1.00 0.00 H new ATOM 231 N PHE A 16 25.628 4.055 -4.980 1.00 0.00 N ATOM 232 CA PHE A 16 26.702 4.737 -4.267 1.00 0.00 C ATOM 233 C PHE A 16 28.041 4.527 -4.968 1.00 0.00 C ATOM 234 O PHE A 16 29.027 5.195 -4.659 1.00 0.00 O ATOM 235 CB PHE A 16 26.784 4.234 -2.824 1.00 0.00 C ATOM 236 CG PHE A 16 28.027 4.675 -2.105 1.00 0.00 C ATOM 237 CD1 PHE A 16 28.103 5.935 -1.534 1.00 0.00 C ATOM 238 CD2 PHE A 16 29.120 3.830 -2.001 1.00 0.00 C ATOM 239 CE1 PHE A 16 29.246 6.344 -0.873 1.00 0.00 C ATOM 240 CE2 PHE A 16 30.266 4.233 -1.341 1.00 0.00 C ATOM 241 CZ PHE A 16 30.328 5.491 -0.775 1.00 0.00 C ATOM 0 H PHE A 16 25.668 3.037 -4.929 1.00 0.00 H new ATOM 0 HA PHE A 16 26.480 5.804 -4.261 1.00 0.00 H new ATOM 0 HB2 PHE A 16 25.911 4.587 -2.274 1.00 0.00 H new ATOM 0 HB3 PHE A 16 26.741 3.145 -2.824 1.00 0.00 H new ATOM 0 HD1 PHE A 16 27.259 6.605 -1.606 1.00 0.00 H new ATOM 0 HD2 PHE A 16 29.076 2.845 -2.441 1.00 0.00 H new ATOM 0 HE1 PHE A 16 29.293 7.329 -0.434 1.00 0.00 H new ATOM 0 HE2 PHE A 16 31.111 3.565 -1.268 1.00 0.00 H new ATOM 0 HZ PHE A 16 31.221 5.807 -0.257 1.00 0.00 H new ATOM 251 N SER A 17 28.066 3.593 -5.913 1.00 0.00 N ATOM 252 CA SER A 17 29.284 3.290 -6.656 1.00 0.00 C ATOM 253 C SER A 17 29.462 4.255 -7.824 1.00 0.00 C ATOM 254 O SER A 17 30.584 4.545 -8.240 1.00 0.00 O ATOM 255 CB SER A 17 29.248 1.850 -7.170 1.00 0.00 C ATOM 256 OG SER A 17 29.821 0.958 -6.230 1.00 0.00 O ATOM 0 H SER A 17 27.257 3.033 -6.182 1.00 0.00 H new ATOM 0 HA SER A 17 30.131 3.406 -5.980 1.00 0.00 H new ATOM 0 HB2 SER A 17 28.217 1.558 -7.371 1.00 0.00 H new ATOM 0 HB3 SER A 17 29.788 1.784 -8.114 1.00 0.00 H new ATOM 0 HG SER A 17 29.784 0.044 -6.582 1.00 0.00 H new ATOM 262 N LEU A 18 28.346 4.750 -8.349 1.00 0.00 N ATOM 263 CA LEU A 18 28.377 5.683 -9.470 1.00 0.00 C ATOM 264 C LEU A 18 28.806 7.073 -9.010 1.00 0.00 C ATOM 265 O LEU A 18 29.531 7.775 -9.715 1.00 0.00 O ATOM 266 CB LEU A 18 27.002 5.756 -10.136 1.00 0.00 C ATOM 267 CG LEU A 18 26.036 6.797 -9.570 1.00 0.00 C ATOM 268 CD1 LEU A 18 25.058 7.256 -10.640 1.00 0.00 C ATOM 269 CD2 LEU A 18 25.290 6.235 -8.368 1.00 0.00 C ATOM 0 H LEU A 18 27.409 4.521 -8.017 1.00 0.00 H new ATOM 0 HA LEU A 18 29.106 5.319 -10.194 1.00 0.00 H new ATOM 0 HB2 LEU A 18 27.145 5.961 -11.197 1.00 0.00 H new ATOM 0 HB3 LEU A 18 26.532 4.775 -10.062 1.00 0.00 H new ATOM 0 HG LEU A 18 26.615 7.661 -9.242 1.00 0.00 H new ATOM 0 HD11 LEU A 18 24.379 7.997 -10.218 1.00 0.00 H new ATOM 0 HD12 LEU A 18 25.608 7.699 -11.470 1.00 0.00 H new ATOM 0 HD13 LEU A 18 24.485 6.401 -11.000 1.00 0.00 H new ATOM 0 HD21 LEU A 18 24.607 6.990 -7.978 1.00 0.00 H new ATOM 0 HD22 LEU A 18 24.723 5.354 -8.671 1.00 0.00 H new ATOM 0 HD23 LEU A 18 26.005 5.958 -7.593 1.00 0.00 H new ATOM 281 N PHE A 19 28.356 7.463 -7.823 1.00 0.00 N ATOM 282 CA PHE A 19 28.694 8.768 -7.268 1.00 0.00 C ATOM 283 C PHE A 19 30.181 8.850 -6.937 1.00 0.00 C ATOM 284 O PHE A 19 30.809 9.895 -7.105 1.00 0.00 O ATOM 285 CB PHE A 19 27.865 9.042 -6.011 1.00 0.00 C ATOM 286 CG PHE A 19 26.567 9.744 -6.290 1.00 0.00 C ATOM 287 CD1 PHE A 19 26.553 11.075 -6.676 1.00 0.00 C ATOM 288 CD2 PHE A 19 25.361 9.073 -6.166 1.00 0.00 C ATOM 289 CE1 PHE A 19 25.360 11.724 -6.934 1.00 0.00 C ATOM 290 CE2 PHE A 19 24.165 9.717 -6.424 1.00 0.00 C ATOM 291 CZ PHE A 19 24.164 11.044 -6.807 1.00 0.00 C ATOM 0 H PHE A 19 27.756 6.894 -7.226 1.00 0.00 H new ATOM 0 HA PHE A 19 28.464 9.524 -8.019 1.00 0.00 H new ATOM 0 HB2 PHE A 19 27.657 8.097 -5.509 1.00 0.00 H new ATOM 0 HB3 PHE A 19 28.455 9.646 -5.321 1.00 0.00 H new ATOM 0 HD1 PHE A 19 27.485 11.611 -6.776 1.00 0.00 H new ATOM 0 HD2 PHE A 19 25.355 8.036 -5.865 1.00 0.00 H new ATOM 0 HE1 PHE A 19 25.363 12.761 -7.234 1.00 0.00 H new ATOM 0 HE2 PHE A 19 23.232 9.182 -6.326 1.00 0.00 H new ATOM 0 HZ PHE A 19 23.230 11.549 -7.007 1.00 0.00 H new ATOM 301 N ASP A 20 30.738 7.739 -6.466 1.00 0.00 N ATOM 302 CA ASP A 20 32.151 7.684 -6.112 1.00 0.00 C ATOM 303 C ASP A 20 33.009 7.405 -7.342 1.00 0.00 C ATOM 304 O ASP A 20 33.215 6.252 -7.721 1.00 0.00 O ATOM 305 CB ASP A 20 32.392 6.607 -5.053 1.00 0.00 C ATOM 306 CG ASP A 20 33.862 6.432 -4.728 1.00 0.00 C ATOM 307 OD1 ASP A 20 34.498 7.419 -4.304 1.00 0.00 O ATOM 308 OD2 ASP A 20 34.379 5.307 -4.900 1.00 0.00 O ATOM 0 H ASP A 20 30.232 6.865 -6.321 1.00 0.00 H new ATOM 0 HA ASP A 20 32.436 8.654 -5.704 1.00 0.00 H new ATOM 0 HB2 ASP A 20 31.851 6.868 -4.144 1.00 0.00 H new ATOM 0 HB3 ASP A 20 31.985 5.659 -5.405 1.00 0.00 H new ATOM 313 N LYS A 21 33.507 8.469 -7.963 1.00 0.00 N ATOM 314 CA LYS A 21 34.343 8.341 -9.151 1.00 0.00 C ATOM 315 C LYS A 21 35.762 7.926 -8.775 1.00 0.00 C ATOM 316 O LYS A 21 36.384 7.116 -9.463 1.00 0.00 O ATOM 317 CB LYS A 21 34.374 9.663 -9.922 1.00 0.00 C ATOM 318 CG LYS A 21 32.995 10.202 -10.261 1.00 0.00 C ATOM 319 CD LYS A 21 32.305 9.349 -11.312 1.00 0.00 C ATOM 320 CE LYS A 21 31.292 10.156 -12.108 1.00 0.00 C ATOM 321 NZ LYS A 21 30.491 9.295 -13.022 1.00 0.00 N ATOM 0 H LYS A 21 33.346 9.430 -7.663 1.00 0.00 H new ATOM 0 HA LYS A 21 33.913 7.567 -9.786 1.00 0.00 H new ATOM 0 HB2 LYS A 21 34.910 10.406 -9.331 1.00 0.00 H new ATOM 0 HB3 LYS A 21 34.937 9.523 -10.845 1.00 0.00 H new ATOM 0 HG2 LYS A 21 32.384 10.234 -9.359 1.00 0.00 H new ATOM 0 HG3 LYS A 21 33.083 11.226 -10.623 1.00 0.00 H new ATOM 0 HD2 LYS A 21 33.050 8.930 -11.988 1.00 0.00 H new ATOM 0 HD3 LYS A 21 31.805 8.510 -10.829 1.00 0.00 H new ATOM 0 HE2 LYS A 21 30.624 10.678 -11.423 1.00 0.00 H new ATOM 0 HE3 LYS A 21 31.811 10.918 -12.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 29.812 9.883 -13.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 31.125 8.816 -13.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 29.975 8.584 -12.466 1.00 0.00 H new ATOM 335 N ASP A 22 36.266 8.483 -7.680 1.00 0.00 N ATOM 336 CA ASP A 22 37.611 8.168 -7.212 1.00 0.00 C ATOM 337 C ASP A 22 37.781 6.665 -7.020 1.00 0.00 C ATOM 338 O ASP A 22 38.791 6.088 -7.422 1.00 0.00 O ATOM 339 CB ASP A 22 37.901 8.898 -5.900 1.00 0.00 C ATOM 340 CG ASP A 22 37.533 10.368 -5.961 1.00 0.00 C ATOM 341 OD1 ASP A 22 37.548 10.937 -7.072 1.00 0.00 O ATOM 342 OD2 ASP A 22 37.231 10.949 -4.898 1.00 0.00 O ATOM 0 H ASP A 22 35.764 9.155 -7.100 1.00 0.00 H new ATOM 0 HA ASP A 22 38.320 8.502 -7.969 1.00 0.00 H new ATOM 0 HB2 ASP A 22 37.346 8.421 -5.092 1.00 0.00 H new ATOM 0 HB3 ASP A 22 38.960 8.801 -5.660 1.00 0.00 H new ATOM 347 N GLY A 23 36.786 6.035 -6.402 1.00 0.00 N ATOM 348 CA GLY A 23 36.846 4.604 -6.167 1.00 0.00 C ATOM 349 C GLY A 23 37.401 4.265 -4.798 1.00 0.00 C ATOM 350 O GLY A 23 38.159 3.307 -4.648 1.00 0.00 O ATOM 0 H GLY A 23 35.940 6.490 -6.060 1.00 0.00 H new ATOM 0 HA2 GLY A 23 35.847 4.180 -6.266 1.00 0.00 H new ATOM 0 HA3 GLY A 23 37.467 4.139 -6.933 1.00 0.00 H new ATOM 354 N ASP A 24 37.024 5.053 -3.797 1.00 0.00 N ATOM 355 CA ASP A 24 37.489 4.831 -2.433 1.00 0.00 C ATOM 356 C ASP A 24 36.322 4.499 -1.508 1.00 0.00 C ATOM 357 O ASP A 24 36.389 3.555 -0.722 1.00 0.00 O ATOM 358 CB ASP A 24 38.230 6.066 -1.917 1.00 0.00 C ATOM 359 CG ASP A 24 37.328 7.279 -1.809 1.00 0.00 C ATOM 360 OD1 ASP A 24 36.682 7.630 -2.818 1.00 0.00 O ATOM 361 OD2 ASP A 24 37.268 7.879 -0.715 1.00 0.00 O ATOM 0 H ASP A 24 36.398 5.851 -3.905 1.00 0.00 H new ATOM 0 HA ASP A 24 38.174 3.983 -2.442 1.00 0.00 H new ATOM 0 HB2 ASP A 24 38.658 5.847 -0.939 1.00 0.00 H new ATOM 0 HB3 ASP A 24 39.061 6.293 -2.585 1.00 0.00 H new ATOM 366 N GLY A 25 35.254 5.285 -1.606 1.00 0.00 N ATOM 367 CA GLY A 25 34.088 5.059 -0.772 1.00 0.00 C ATOM 368 C GLY A 25 33.555 6.340 -0.162 1.00 0.00 C ATOM 369 O GLY A 25 32.996 6.329 0.936 1.00 0.00 O ATOM 0 H GLY A 25 35.176 6.074 -2.248 1.00 0.00 H new ATOM 0 HA2 GLY A 25 33.305 4.590 -1.367 1.00 0.00 H new ATOM 0 HA3 GLY A 25 34.344 4.360 0.024 1.00 0.00 H new ATOM 373 N THR A 26 33.729 7.450 -0.873 1.00 0.00 N ATOM 374 CA THR A 26 33.264 8.745 -0.394 1.00 0.00 C ATOM 375 C THR A 26 32.691 9.580 -1.534 1.00 0.00 C ATOM 376 O THR A 26 32.977 9.328 -2.704 1.00 0.00 O ATOM 377 CB THR A 26 34.400 9.534 0.283 1.00 0.00 C ATOM 378 OG1 THR A 26 35.314 10.023 -0.705 1.00 0.00 O ATOM 379 CG2 THR A 26 35.145 8.661 1.282 1.00 0.00 C ATOM 0 H THR A 26 34.189 7.477 -1.783 1.00 0.00 H new ATOM 0 HA THR A 26 32.481 8.548 0.338 1.00 0.00 H new ATOM 0 HB THR A 26 33.959 10.375 0.817 1.00 0.00 H new ATOM 0 HG1 THR A 26 36.040 9.376 -0.828 1.00 0.00 H new ATOM 0 HG21 THR A 26 35.943 9.240 1.747 1.00 0.00 H new ATOM 0 HG22 THR A 26 34.453 8.315 2.050 1.00 0.00 H new ATOM 0 HG23 THR A 26 35.574 7.802 0.766 1.00 0.00 H new ATOM 387 N ILE A 27 31.881 10.573 -1.184 1.00 0.00 N ATOM 388 CA ILE A 27 31.269 11.446 -2.179 1.00 0.00 C ATOM 389 C ILE A 27 31.379 12.910 -1.768 1.00 0.00 C ATOM 390 O ILE A 27 30.536 13.427 -1.034 1.00 0.00 O ATOM 391 CB ILE A 27 29.785 11.096 -2.397 1.00 0.00 C ATOM 392 CG1 ILE A 27 29.641 9.634 -2.826 1.00 0.00 C ATOM 393 CG2 ILE A 27 29.171 12.022 -3.437 1.00 0.00 C ATOM 394 CD1 ILE A 27 28.229 9.106 -2.707 1.00 0.00 C ATOM 0 H ILE A 27 31.633 10.793 -0.219 1.00 0.00 H new ATOM 0 HA ILE A 27 31.812 11.291 -3.111 1.00 0.00 H new ATOM 0 HB ILE A 27 29.252 11.233 -1.456 1.00 0.00 H new ATOM 0 HG12 ILE A 27 29.972 9.533 -3.859 1.00 0.00 H new ATOM 0 HG13 ILE A 27 30.303 9.018 -2.217 1.00 0.00 H new ATOM 0 HG21 ILE A 27 28.122 11.763 -3.581 1.00 0.00 H new ATOM 0 HG22 ILE A 27 29.246 13.054 -3.095 1.00 0.00 H new ATOM 0 HG23 ILE A 27 29.704 11.913 -4.381 1.00 0.00 H new ATOM 0 HD11 ILE A 27 28.202 8.065 -3.028 1.00 0.00 H new ATOM 0 HD12 ILE A 27 27.901 9.175 -1.670 1.00 0.00 H new ATOM 0 HD13 ILE A 27 27.565 9.697 -3.338 1.00 0.00 H new ATOM 406 N THR A 28 32.425 13.576 -2.247 1.00 0.00 N ATOM 407 CA THR A 28 32.647 14.982 -1.931 1.00 0.00 C ATOM 408 C THR A 28 32.066 15.886 -3.011 1.00 0.00 C ATOM 409 O THR A 28 31.698 15.424 -4.092 1.00 0.00 O ATOM 410 CB THR A 28 34.147 15.292 -1.769 1.00 0.00 C ATOM 411 OG1 THR A 28 34.319 16.602 -1.219 1.00 0.00 O ATOM 412 CG2 THR A 28 34.866 15.198 -3.106 1.00 0.00 C ATOM 0 H THR A 28 33.132 13.164 -2.856 1.00 0.00 H new ATOM 0 HA THR A 28 32.140 15.177 -0.986 1.00 0.00 H new ATOM 0 HB THR A 28 34.577 14.555 -1.091 1.00 0.00 H new ATOM 0 HG1 THR A 28 35.275 16.791 -1.117 1.00 0.00 H new ATOM 0 HG21 THR A 28 35.924 15.421 -2.967 1.00 0.00 H new ATOM 0 HG22 THR A 28 34.757 14.191 -3.508 1.00 0.00 H new ATOM 0 HG23 THR A 28 34.433 15.915 -3.803 1.00 0.00 H new ATOM 420 N THR A 29 31.987 17.180 -2.715 1.00 0.00 N ATOM 421 CA THR A 29 31.450 18.150 -3.661 1.00 0.00 C ATOM 422 C THR A 29 31.929 17.858 -5.078 1.00 0.00 C ATOM 423 O THR A 29 31.172 17.990 -6.040 1.00 0.00 O ATOM 424 CB THR A 29 31.853 19.587 -3.281 1.00 0.00 C ATOM 425 OG1 THR A 29 33.268 19.753 -3.422 1.00 0.00 O ATOM 426 CG2 THR A 29 31.440 19.905 -1.852 1.00 0.00 C ATOM 0 H THR A 29 32.289 17.580 -1.827 1.00 0.00 H new ATOM 0 HA THR A 29 30.364 18.063 -3.622 1.00 0.00 H new ATOM 0 HB THR A 29 31.339 20.274 -3.953 1.00 0.00 H new ATOM 0 HG1 THR A 29 33.516 20.670 -3.180 1.00 0.00 H new ATOM 0 HG21 THR A 29 31.735 20.925 -1.606 1.00 0.00 H new ATOM 0 HG22 THR A 29 30.359 19.807 -1.755 1.00 0.00 H new ATOM 0 HG23 THR A 29 31.930 19.211 -1.169 1.00 0.00 H new ATOM 434 N LYS A 30 33.190 17.459 -5.201 1.00 0.00 N ATOM 435 CA LYS A 30 33.771 17.146 -6.502 1.00 0.00 C ATOM 436 C LYS A 30 33.039 15.979 -7.158 1.00 0.00 C ATOM 437 O LYS A 30 32.821 15.974 -8.368 1.00 0.00 O ATOM 438 CB LYS A 30 35.257 16.811 -6.353 1.00 0.00 C ATOM 439 CG LYS A 30 35.972 16.616 -7.678 1.00 0.00 C ATOM 440 CD LYS A 30 35.904 15.170 -8.141 1.00 0.00 C ATOM 441 CE LYS A 30 36.288 15.036 -9.607 1.00 0.00 C ATOM 442 NZ LYS A 30 35.189 15.472 -10.511 1.00 0.00 N ATOM 0 H LYS A 30 33.830 17.344 -4.415 1.00 0.00 H new ATOM 0 HA LYS A 30 33.665 18.023 -7.140 1.00 0.00 H new ATOM 0 HB2 LYS A 30 35.748 17.612 -5.799 1.00 0.00 H new ATOM 0 HB3 LYS A 30 35.358 15.903 -5.758 1.00 0.00 H new ATOM 0 HG2 LYS A 30 35.524 17.262 -8.433 1.00 0.00 H new ATOM 0 HG3 LYS A 30 37.014 16.918 -7.578 1.00 0.00 H new ATOM 0 HD2 LYS A 30 36.571 14.560 -7.532 1.00 0.00 H new ATOM 0 HD3 LYS A 30 34.895 14.786 -7.991 1.00 0.00 H new ATOM 0 HE2 LYS A 30 37.179 15.632 -9.805 1.00 0.00 H new ATOM 0 HE3 LYS A 30 36.545 13.999 -9.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 34.996 14.725 -11.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 34.331 15.653 -9.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 35.471 16.343 -11.005 1.00 0.00 H new ATOM 456 N GLU A 31 32.662 14.994 -6.349 1.00 0.00 N ATOM 457 CA GLU A 31 31.954 13.822 -6.852 1.00 0.00 C ATOM 458 C GLU A 31 30.456 14.094 -6.954 1.00 0.00 C ATOM 459 O GLU A 31 29.852 13.921 -8.014 1.00 0.00 O ATOM 460 CB GLU A 31 32.204 12.618 -5.943 1.00 0.00 C ATOM 461 CG GLU A 31 33.506 11.893 -6.237 1.00 0.00 C ATOM 462 CD GLU A 31 33.980 11.048 -5.070 1.00 0.00 C ATOM 463 OE1 GLU A 31 33.913 11.533 -3.922 1.00 0.00 O ATOM 464 OE2 GLU A 31 34.419 9.903 -5.306 1.00 0.00 O ATOM 0 H GLU A 31 32.835 14.984 -5.344 1.00 0.00 H new ATOM 0 HA GLU A 31 32.334 13.600 -7.849 1.00 0.00 H new ATOM 0 HB2 GLU A 31 32.210 12.952 -4.905 1.00 0.00 H new ATOM 0 HB3 GLU A 31 31.376 11.917 -6.047 1.00 0.00 H new ATOM 0 HG2 GLU A 31 33.373 11.256 -7.112 1.00 0.00 H new ATOM 0 HG3 GLU A 31 34.275 12.623 -6.488 1.00 0.00 H new ATOM 471 N LEU A 32 29.861 14.520 -5.845 1.00 0.00 N ATOM 472 CA LEU A 32 28.433 14.816 -5.808 1.00 0.00 C ATOM 473 C LEU A 32 28.072 15.887 -6.832 1.00 0.00 C ATOM 474 O LEU A 32 27.086 15.761 -7.557 1.00 0.00 O ATOM 475 CB LEU A 32 28.024 15.275 -4.407 1.00 0.00 C ATOM 476 CG LEU A 32 26.560 15.682 -4.235 1.00 0.00 C ATOM 477 CD1 LEU A 32 25.650 14.472 -4.378 1.00 0.00 C ATOM 478 CD2 LEU A 32 26.348 16.354 -2.887 1.00 0.00 C ATOM 0 H LEU A 32 30.345 14.668 -4.960 1.00 0.00 H new ATOM 0 HA LEU A 32 27.891 13.904 -6.058 1.00 0.00 H new ATOM 0 HB2 LEU A 32 28.241 14.470 -3.705 1.00 0.00 H new ATOM 0 HB3 LEU A 32 28.651 16.121 -4.126 1.00 0.00 H new ATOM 0 HG LEU A 32 26.307 16.397 -5.018 1.00 0.00 H new ATOM 0 HD11 LEU A 32 24.612 14.780 -4.253 1.00 0.00 H new ATOM 0 HD12 LEU A 32 25.781 14.033 -5.367 1.00 0.00 H new ATOM 0 HD13 LEU A 32 25.904 13.734 -3.617 1.00 0.00 H new ATOM 0 HD21 LEU A 32 25.301 16.637 -2.782 1.00 0.00 H new ATOM 0 HD22 LEU A 32 26.619 15.663 -2.089 1.00 0.00 H new ATOM 0 HD23 LEU A 32 26.973 17.245 -2.822 1.00 0.00 H new ATOM 490 N GLY A 33 28.880 16.942 -6.887 1.00 0.00 N ATOM 491 CA GLY A 33 28.630 18.019 -7.827 1.00 0.00 C ATOM 492 C GLY A 33 28.818 17.587 -9.268 1.00 0.00 C ATOM 493 O GLY A 33 28.399 18.283 -10.194 1.00 0.00 O ATOM 0 H GLY A 33 29.703 17.070 -6.298 1.00 0.00 H new ATOM 0 HA2 GLY A 33 27.613 18.387 -7.691 1.00 0.00 H new ATOM 0 HA3 GLY A 33 29.301 18.850 -7.610 1.00 0.00 H new ATOM 497 N THR A 34 29.451 16.434 -9.460 1.00 0.00 N ATOM 498 CA THR A 34 29.697 15.911 -10.798 1.00 0.00 C ATOM 499 C THR A 34 28.472 15.181 -11.337 1.00 0.00 C ATOM 500 O THR A 34 28.274 15.090 -12.548 1.00 0.00 O ATOM 501 CB THR A 34 30.901 14.950 -10.814 1.00 0.00 C ATOM 502 OG1 THR A 34 31.639 15.109 -12.030 1.00 0.00 O ATOM 503 CG2 THR A 34 30.443 13.506 -10.677 1.00 0.00 C ATOM 0 H THR A 34 29.803 15.845 -8.706 1.00 0.00 H new ATOM 0 HA THR A 34 29.917 16.767 -11.436 1.00 0.00 H new ATOM 0 HB THR A 34 31.542 15.193 -9.967 1.00 0.00 H new ATOM 0 HG1 THR A 34 32.403 14.496 -12.031 1.00 0.00 H new ATOM 0 HG21 THR A 34 31.311 12.846 -10.691 1.00 0.00 H new ATOM 0 HG22 THR A 34 29.908 13.382 -9.736 1.00 0.00 H new ATOM 0 HG23 THR A 34 29.782 13.254 -11.506 1.00 0.00 H new ATOM 511 N VAL A 35 27.651 14.662 -10.428 1.00 0.00 N ATOM 512 CA VAL A 35 26.444 13.941 -10.813 1.00 0.00 C ATOM 513 C VAL A 35 25.215 14.838 -10.717 1.00 0.00 C ATOM 514 O VAL A 35 24.344 14.810 -11.586 1.00 0.00 O ATOM 515 CB VAL A 35 26.228 12.697 -9.930 1.00 0.00 C ATOM 516 CG1 VAL A 35 24.754 12.325 -9.883 1.00 0.00 C ATOM 517 CG2 VAL A 35 27.065 11.533 -10.439 1.00 0.00 C ATOM 0 H VAL A 35 27.800 14.728 -9.421 1.00 0.00 H new ATOM 0 HA VAL A 35 26.580 13.624 -11.847 1.00 0.00 H new ATOM 0 HB VAL A 35 26.551 12.931 -8.915 1.00 0.00 H new ATOM 0 HG11 VAL A 35 24.621 11.444 -9.255 1.00 0.00 H new ATOM 0 HG12 VAL A 35 24.182 13.156 -9.469 1.00 0.00 H new ATOM 0 HG13 VAL A 35 24.401 12.108 -10.891 1.00 0.00 H new ATOM 0 HG21 VAL A 35 26.901 10.662 -9.804 1.00 0.00 H new ATOM 0 HG22 VAL A 35 26.774 11.296 -11.463 1.00 0.00 H new ATOM 0 HG23 VAL A 35 28.120 11.806 -10.415 1.00 0.00 H new ATOM 527 N MET A 36 25.150 15.632 -9.653 1.00 0.00 N ATOM 528 CA MET A 36 24.028 16.540 -9.445 1.00 0.00 C ATOM 529 C MET A 36 23.844 17.462 -10.645 1.00 0.00 C ATOM 530 O MET A 36 22.720 17.704 -11.087 1.00 0.00 O ATOM 531 CB MET A 36 24.243 17.369 -8.177 1.00 0.00 C ATOM 532 CG MET A 36 24.124 16.562 -6.895 1.00 0.00 C ATOM 533 SD MET A 36 23.683 17.579 -5.473 1.00 0.00 S ATOM 534 CE MET A 36 22.185 18.361 -6.068 1.00 0.00 C ATOM 0 H MET A 36 25.861 15.665 -8.922 1.00 0.00 H new ATOM 0 HA MET A 36 23.125 15.941 -9.329 1.00 0.00 H new ATOM 0 HB2 MET A 36 25.231 17.829 -8.217 1.00 0.00 H new ATOM 0 HB3 MET A 36 23.515 18.180 -8.155 1.00 0.00 H new ATOM 0 HG2 MET A 36 23.372 15.785 -7.028 1.00 0.00 H new ATOM 0 HG3 MET A 36 25.071 16.059 -6.698 1.00 0.00 H new ATOM 0 HE1 MET A 36 21.580 18.681 -5.220 1.00 0.00 H new ATOM 0 HE2 MET A 36 22.444 19.228 -6.676 1.00 0.00 H new ATOM 0 HE3 MET A 36 21.618 17.651 -6.670 1.00 0.00 H new ATOM 544 N ARG A 37 24.953 17.974 -11.168 1.00 0.00 N ATOM 545 CA ARG A 37 24.913 18.872 -12.316 1.00 0.00 C ATOM 546 C ARG A 37 24.442 18.134 -13.566 1.00 0.00 C ATOM 547 O ARG A 37 24.021 18.754 -14.543 1.00 0.00 O ATOM 548 CB ARG A 37 26.294 19.482 -12.562 1.00 0.00 C ATOM 549 CG ARG A 37 27.397 18.449 -12.725 1.00 0.00 C ATOM 550 CD ARG A 37 27.411 17.867 -14.130 1.00 0.00 C ATOM 551 NE ARG A 37 28.756 17.484 -14.550 1.00 0.00 N ATOM 552 CZ ARG A 37 29.100 17.280 -15.817 1.00 0.00 C ATOM 553 NH1 ARG A 37 28.203 17.423 -16.782 1.00 0.00 N ATOM 554 NH2 ARG A 37 30.345 16.934 -16.120 1.00 0.00 N ATOM 0 H ARG A 37 25.891 17.782 -10.815 1.00 0.00 H new ATOM 0 HA ARG A 37 24.204 19.671 -12.097 1.00 0.00 H new ATOM 0 HB2 ARG A 37 26.253 20.102 -13.458 1.00 0.00 H new ATOM 0 HB3 ARG A 37 26.544 20.140 -11.730 1.00 0.00 H new ATOM 0 HG2 ARG A 37 28.362 18.908 -12.510 1.00 0.00 H new ATOM 0 HG3 ARG A 37 27.257 17.648 -11.999 1.00 0.00 H new ATOM 0 HD2 ARG A 37 26.757 16.996 -14.168 1.00 0.00 H new ATOM 0 HD3 ARG A 37 27.007 18.599 -14.830 1.00 0.00 H new ATOM 0 HE ARG A 37 29.470 17.367 -13.832 1.00 0.00 H new ATOM 0 HH11 ARG A 37 27.246 17.690 -16.553 1.00 0.00 H new ATOM 0 HH12 ARG A 37 28.470 17.266 -17.754 1.00 0.00 H new ATOM 0 HH21 ARG A 37 31.038 16.825 -15.380 1.00 0.00 H new ATOM 0 HH22 ARG A 37 30.608 16.778 -17.093 1.00 0.00 H new ATOM 568 N SER A 38 24.516 16.807 -13.528 1.00 0.00 N ATOM 569 CA SER A 38 24.101 15.986 -14.658 1.00 0.00 C ATOM 570 C SER A 38 22.593 16.073 -14.869 1.00 0.00 C ATOM 571 O SER A 38 22.104 15.961 -15.994 1.00 0.00 O ATOM 572 CB SER A 38 24.513 14.529 -14.435 1.00 0.00 C ATOM 573 OG SER A 38 25.885 14.433 -14.095 1.00 0.00 O ATOM 0 H SER A 38 24.860 16.278 -12.726 1.00 0.00 H new ATOM 0 HA SER A 38 24.597 16.364 -15.552 1.00 0.00 H new ATOM 0 HB2 SER A 38 23.907 14.094 -13.640 1.00 0.00 H new ATOM 0 HB3 SER A 38 24.318 13.950 -15.338 1.00 0.00 H new ATOM 0 HG SER A 38 26.123 13.492 -13.956 1.00 0.00 H new ATOM 579 N LEU A 39 21.860 16.274 -13.779 1.00 0.00 N ATOM 580 CA LEU A 39 20.407 16.377 -13.843 1.00 0.00 C ATOM 581 C LEU A 39 19.976 17.796 -14.201 1.00 0.00 C ATOM 582 O LEU A 39 19.023 17.996 -14.952 1.00 0.00 O ATOM 583 CB LEU A 39 19.788 15.966 -12.506 1.00 0.00 C ATOM 584 CG LEU A 39 19.857 14.477 -12.164 1.00 0.00 C ATOM 585 CD1 LEU A 39 19.489 14.247 -10.706 1.00 0.00 C ATOM 586 CD2 LEU A 39 18.943 13.676 -13.079 1.00 0.00 C ATOM 0 H LEU A 39 22.249 16.369 -12.841 1.00 0.00 H new ATOM 0 HA LEU A 39 20.054 15.703 -14.623 1.00 0.00 H new ATOM 0 HB2 LEU A 39 20.284 16.524 -11.712 1.00 0.00 H new ATOM 0 HB3 LEU A 39 18.741 16.271 -12.504 1.00 0.00 H new ATOM 0 HG LEU A 39 20.881 14.136 -12.318 1.00 0.00 H new ATOM 0 HD11 LEU A 39 19.544 13.182 -10.481 1.00 0.00 H new ATOM 0 HD12 LEU A 39 20.184 14.790 -10.065 1.00 0.00 H new ATOM 0 HD13 LEU A 39 18.475 14.605 -10.526 1.00 0.00 H new ATOM 0 HD21 LEU A 39 19.005 12.619 -12.821 1.00 0.00 H new ATOM 0 HD22 LEU A 39 17.916 14.019 -12.958 1.00 0.00 H new ATOM 0 HD23 LEU A 39 19.252 13.815 -14.115 1.00 0.00 H new ATOM 598 N GLY A 40 20.688 18.779 -13.659 1.00 0.00 N ATOM 599 CA GLY A 40 20.366 20.167 -13.934 1.00 0.00 C ATOM 600 C GLY A 40 20.340 21.017 -12.679 1.00 0.00 C ATOM 601 O GLY A 40 19.595 21.992 -12.598 1.00 0.00 O ATOM 0 H GLY A 40 21.482 18.639 -13.034 1.00 0.00 H new ATOM 0 HA2 GLY A 40 21.098 20.575 -14.630 1.00 0.00 H new ATOM 0 HA3 GLY A 40 19.395 20.221 -14.425 1.00 0.00 H new ATOM 605 N GLN A 41 21.155 20.644 -11.697 1.00 0.00 N ATOM 606 CA GLN A 41 21.220 21.378 -10.439 1.00 0.00 C ATOM 607 C GLN A 41 22.354 22.398 -10.462 1.00 0.00 C ATOM 608 O GLN A 41 22.119 23.603 -10.380 1.00 0.00 O ATOM 609 CB GLN A 41 21.412 20.411 -9.269 1.00 0.00 C ATOM 610 CG GLN A 41 20.250 19.450 -9.078 1.00 0.00 C ATOM 611 CD GLN A 41 18.903 20.136 -9.180 1.00 0.00 C ATOM 612 OE1 GLN A 41 18.690 21.202 -8.601 1.00 0.00 O ATOM 613 NE2 GLN A 41 17.983 19.528 -9.919 1.00 0.00 N ATOM 0 H GLN A 41 21.779 19.839 -11.749 1.00 0.00 H new ATOM 0 HA GLN A 41 20.278 21.911 -10.310 1.00 0.00 H new ATOM 0 HB2 GLN A 41 22.325 19.837 -9.429 1.00 0.00 H new ATOM 0 HB3 GLN A 41 21.552 20.985 -8.353 1.00 0.00 H new ATOM 0 HG2 GLN A 41 20.309 18.661 -9.828 1.00 0.00 H new ATOM 0 HG3 GLN A 41 20.336 18.971 -8.103 1.00 0.00 H new ATOM 0 HE21 GLN A 41 18.202 18.646 -10.382 1.00 0.00 H new ATOM 0 HE22 GLN A 41 17.057 19.943 -10.024 1.00 0.00 H new ATOM 622 N ASN A 42 23.584 21.907 -10.574 1.00 0.00 N ATOM 623 CA ASN A 42 24.754 22.776 -10.607 1.00 0.00 C ATOM 624 C ASN A 42 24.801 23.672 -9.374 1.00 0.00 C ATOM 625 O ASN A 42 24.919 24.894 -9.468 1.00 0.00 O ATOM 626 CB ASN A 42 24.743 23.633 -11.875 1.00 0.00 C ATOM 627 CG ASN A 42 25.444 22.956 -13.037 1.00 0.00 C ATOM 628 OD1 ASN A 42 26.664 22.792 -13.030 1.00 0.00 O ATOM 629 ND2 ASN A 42 24.673 22.559 -14.043 1.00 0.00 N ATOM 0 H ASN A 42 23.796 20.912 -10.643 1.00 0.00 H new ATOM 0 HA ASN A 42 25.644 22.146 -10.610 1.00 0.00 H new ATOM 0 HB2 ASN A 42 23.712 23.851 -12.154 1.00 0.00 H new ATOM 0 HB3 ASN A 42 25.227 24.588 -11.669 1.00 0.00 H new ATOM 0 HD21 ASN A 42 25.088 22.097 -14.852 1.00 0.00 H new ATOM 0 HD22 ASN A 42 23.666 22.716 -14.006 1.00 0.00 H new ATOM 636 N PRO A 43 24.706 23.053 -8.188 1.00 0.00 N ATOM 637 CA PRO A 43 24.736 23.775 -6.913 1.00 0.00 C ATOM 638 C PRO A 43 26.112 24.358 -6.609 1.00 0.00 C ATOM 639 O PRO A 43 27.133 23.836 -7.060 1.00 0.00 O ATOM 640 CB PRO A 43 24.373 22.699 -5.887 1.00 0.00 C ATOM 641 CG PRO A 43 24.779 21.415 -6.524 1.00 0.00 C ATOM 642 CD PRO A 43 24.563 21.599 -8.001 1.00 0.00 C ATOM 0 HA PRO A 43 24.059 24.629 -6.913 1.00 0.00 H new ATOM 0 HB2 PRO A 43 24.898 22.857 -4.945 1.00 0.00 H new ATOM 0 HB3 PRO A 43 23.306 22.710 -5.663 1.00 0.00 H new ATOM 0 HG2 PRO A 43 25.822 21.185 -6.308 1.00 0.00 H new ATOM 0 HG3 PRO A 43 24.184 20.585 -6.143 1.00 0.00 H new ATOM 0 HD2 PRO A 43 25.296 21.044 -8.587 1.00 0.00 H new ATOM 0 HD3 PRO A 43 23.578 21.249 -8.310 1.00 0.00 H new ATOM 650 N THR A 44 26.134 25.443 -5.841 1.00 0.00 N ATOM 651 CA THR A 44 27.385 26.097 -5.477 1.00 0.00 C ATOM 652 C THR A 44 27.999 25.458 -4.237 1.00 0.00 C ATOM 653 O THR A 44 27.311 24.786 -3.469 1.00 0.00 O ATOM 654 CB THR A 44 27.177 27.601 -5.216 1.00 0.00 C ATOM 655 OG1 THR A 44 26.193 27.790 -4.194 1.00 0.00 O ATOM 656 CG2 THR A 44 26.741 28.315 -6.487 1.00 0.00 C ATOM 0 H THR A 44 25.299 25.887 -5.459 1.00 0.00 H new ATOM 0 HA THR A 44 28.064 25.972 -6.321 1.00 0.00 H new ATOM 0 HB THR A 44 28.126 28.025 -4.887 1.00 0.00 H new ATOM 0 HG1 THR A 44 26.068 28.749 -4.033 1.00 0.00 H new ATOM 0 HG21 THR A 44 26.600 29.376 -6.279 1.00 0.00 H new ATOM 0 HG22 THR A 44 27.507 28.194 -7.253 1.00 0.00 H new ATOM 0 HG23 THR A 44 25.803 27.887 -6.841 1.00 0.00 H new ATOM 664 N GLU A 45 29.297 25.672 -4.047 1.00 0.00 N ATOM 665 CA GLU A 45 30.003 25.116 -2.899 1.00 0.00 C ATOM 666 C GLU A 45 29.147 25.207 -1.638 1.00 0.00 C ATOM 667 O GLU A 45 28.916 24.207 -0.959 1.00 0.00 O ATOM 668 CB GLU A 45 31.328 25.850 -2.682 1.00 0.00 C ATOM 669 CG GLU A 45 32.495 25.232 -3.435 1.00 0.00 C ATOM 670 CD GLU A 45 33.840 25.672 -2.889 1.00 0.00 C ATOM 671 OE1 GLU A 45 34.046 25.560 -1.662 1.00 0.00 O ATOM 672 OE2 GLU A 45 34.684 26.128 -3.687 1.00 0.00 O ATOM 0 H GLU A 45 29.881 26.226 -4.673 1.00 0.00 H new ATOM 0 HA GLU A 45 30.207 24.065 -3.105 1.00 0.00 H new ATOM 0 HB2 GLU A 45 31.214 26.888 -2.994 1.00 0.00 H new ATOM 0 HB3 GLU A 45 31.558 25.860 -1.617 1.00 0.00 H new ATOM 0 HG2 GLU A 45 32.423 24.146 -3.381 1.00 0.00 H new ATOM 0 HG3 GLU A 45 32.428 25.504 -4.488 1.00 0.00 H new ATOM 679 N ALA A 46 28.681 26.413 -1.332 1.00 0.00 N ATOM 680 CA ALA A 46 27.851 26.635 -0.155 1.00 0.00 C ATOM 681 C ALA A 46 26.681 25.657 -0.116 1.00 0.00 C ATOM 682 O ALA A 46 26.302 25.171 0.949 1.00 0.00 O ATOM 683 CB ALA A 46 27.344 28.069 -0.129 1.00 0.00 C ATOM 0 H ALA A 46 28.864 27.251 -1.883 1.00 0.00 H new ATOM 0 HA ALA A 46 28.464 26.463 0.729 1.00 0.00 H new ATOM 0 HB1 ALA A 46 26.725 28.220 0.756 1.00 0.00 H new ATOM 0 HB2 ALA A 46 28.191 28.754 -0.101 1.00 0.00 H new ATOM 0 HB3 ALA A 46 26.751 28.262 -1.023 1.00 0.00 H new ATOM 689 N GLU A 47 26.113 25.375 -1.284 1.00 0.00 N ATOM 690 CA GLU A 47 24.985 24.456 -1.382 1.00 0.00 C ATOM 691 C GLU A 47 25.431 23.018 -1.135 1.00 0.00 C ATOM 692 O GLU A 47 24.920 22.342 -0.241 1.00 0.00 O ATOM 693 CB GLU A 47 24.325 24.568 -2.758 1.00 0.00 C ATOM 694 CG GLU A 47 23.645 25.904 -3.001 1.00 0.00 C ATOM 695 CD GLU A 47 22.323 26.028 -2.268 1.00 0.00 C ATOM 696 OE1 GLU A 47 21.577 25.027 -2.220 1.00 0.00 O ATOM 697 OE2 GLU A 47 22.035 27.123 -1.744 1.00 0.00 O ATOM 0 H GLU A 47 26.415 25.769 -2.175 1.00 0.00 H new ATOM 0 HA GLU A 47 24.260 24.729 -0.616 1.00 0.00 H new ATOM 0 HB2 GLU A 47 25.080 24.409 -3.528 1.00 0.00 H new ATOM 0 HB3 GLU A 47 23.589 23.771 -2.864 1.00 0.00 H new ATOM 0 HG2 GLU A 47 24.309 26.708 -2.684 1.00 0.00 H new ATOM 0 HG3 GLU A 47 23.477 26.033 -4.070 1.00 0.00 H new ATOM 704 N LEU A 48 26.387 22.556 -1.933 1.00 0.00 N ATOM 705 CA LEU A 48 26.904 21.198 -1.803 1.00 0.00 C ATOM 706 C LEU A 48 27.308 20.906 -0.362 1.00 0.00 C ATOM 707 O LEU A 48 26.887 19.906 0.220 1.00 0.00 O ATOM 708 CB LEU A 48 28.102 20.996 -2.732 1.00 0.00 C ATOM 709 CG LEU A 48 27.804 21.038 -4.231 1.00 0.00 C ATOM 710 CD1 LEU A 48 29.089 21.204 -5.027 1.00 0.00 C ATOM 711 CD2 LEU A 48 27.065 19.780 -4.664 1.00 0.00 C ATOM 0 H LEU A 48 26.820 23.102 -2.678 1.00 0.00 H new ATOM 0 HA LEU A 48 26.112 20.505 -2.087 1.00 0.00 H new ATOM 0 HB2 LEU A 48 28.843 21.763 -2.508 1.00 0.00 H new ATOM 0 HB3 LEU A 48 28.558 20.034 -2.500 1.00 0.00 H new ATOM 0 HG LEU A 48 27.164 21.898 -4.430 1.00 0.00 H new ATOM 0 HD11 LEU A 48 28.857 21.232 -6.092 1.00 0.00 H new ATOM 0 HD12 LEU A 48 29.578 22.134 -4.738 1.00 0.00 H new ATOM 0 HD13 LEU A 48 29.754 20.365 -4.823 1.00 0.00 H new ATOM 0 HD21 LEU A 48 26.861 19.828 -5.734 1.00 0.00 H new ATOM 0 HD22 LEU A 48 27.679 18.905 -4.450 1.00 0.00 H new ATOM 0 HD23 LEU A 48 26.124 19.705 -4.119 1.00 0.00 H new ATOM 723 N GLN A 49 28.126 21.785 0.208 1.00 0.00 N ATOM 724 CA GLN A 49 28.585 21.621 1.582 1.00 0.00 C ATOM 725 C GLN A 49 27.405 21.473 2.537 1.00 0.00 C ATOM 726 O GLN A 49 27.372 20.560 3.362 1.00 0.00 O ATOM 727 CB GLN A 49 29.448 22.813 2.000 1.00 0.00 C ATOM 728 CG GLN A 49 30.894 22.708 1.541 1.00 0.00 C ATOM 729 CD GLN A 49 31.686 21.689 2.337 1.00 0.00 C ATOM 730 OE1 GLN A 49 32.107 21.956 3.463 1.00 0.00 O ATOM 731 NE2 GLN A 49 31.893 20.514 1.755 1.00 0.00 N ATOM 0 H GLN A 49 28.484 22.617 -0.260 1.00 0.00 H new ATOM 0 HA GLN A 49 29.185 20.712 1.631 1.00 0.00 H new ATOM 0 HB2 GLN A 49 29.012 23.726 1.595 1.00 0.00 H new ATOM 0 HB3 GLN A 49 29.426 22.904 3.086 1.00 0.00 H new ATOM 0 HG2 GLN A 49 30.917 22.437 0.486 1.00 0.00 H new ATOM 0 HG3 GLN A 49 31.371 23.684 1.630 1.00 0.00 H new ATOM 0 HE21 GLN A 49 31.526 20.336 0.820 1.00 0.00 H new ATOM 0 HE22 GLN A 49 32.419 19.789 2.243 1.00 0.00 H new ATOM 740 N ASP A 50 26.439 22.377 2.419 1.00 0.00 N ATOM 741 CA ASP A 50 25.256 22.347 3.271 1.00 0.00 C ATOM 742 C ASP A 50 24.493 21.038 3.096 1.00 0.00 C ATOM 743 O ASP A 50 23.912 20.515 4.047 1.00 0.00 O ATOM 744 CB ASP A 50 24.342 23.531 2.953 1.00 0.00 C ATOM 745 CG ASP A 50 24.666 24.754 3.789 1.00 0.00 C ATOM 746 OD1 ASP A 50 25.859 24.967 4.092 1.00 0.00 O ATOM 747 OD2 ASP A 50 23.727 25.498 4.140 1.00 0.00 O ATOM 0 H ASP A 50 26.452 23.140 1.742 1.00 0.00 H new ATOM 0 HA ASP A 50 25.584 22.419 4.308 1.00 0.00 H new ATOM 0 HB2 ASP A 50 24.433 23.783 1.896 1.00 0.00 H new ATOM 0 HB3 ASP A 50 23.305 23.242 3.124 1.00 0.00 H new ATOM 752 N MET A 51 24.498 20.515 1.874 1.00 0.00 N ATOM 753 CA MET A 51 23.806 19.267 1.575 1.00 0.00 C ATOM 754 C MET A 51 24.517 18.082 2.222 1.00 0.00 C ATOM 755 O MET A 51 23.887 17.254 2.881 1.00 0.00 O ATOM 756 CB MET A 51 23.717 19.058 0.062 1.00 0.00 C ATOM 757 CG MET A 51 22.664 19.924 -0.610 1.00 0.00 C ATOM 758 SD MET A 51 22.256 19.358 -2.272 1.00 0.00 S ATOM 759 CE MET A 51 23.518 20.190 -3.233 1.00 0.00 C ATOM 0 H MET A 51 24.973 20.936 1.076 1.00 0.00 H new ATOM 0 HA MET A 51 22.799 19.332 1.986 1.00 0.00 H new ATOM 0 HB2 MET A 51 24.689 19.270 -0.384 1.00 0.00 H new ATOM 0 HB3 MET A 51 23.496 18.010 -0.139 1.00 0.00 H new ATOM 0 HG2 MET A 51 21.761 19.929 -0.000 1.00 0.00 H new ATOM 0 HG3 MET A 51 23.022 20.952 -0.658 1.00 0.00 H new ATOM 0 HE1 MET A 51 23.089 20.540 -4.172 1.00 0.00 H new ATOM 0 HE2 MET A 51 23.902 21.041 -2.670 1.00 0.00 H new ATOM 0 HE3 MET A 51 24.332 19.496 -3.443 1.00 0.00 H new ATOM 769 N ILE A 52 25.829 18.008 2.030 1.00 0.00 N ATOM 770 CA ILE A 52 26.624 16.926 2.596 1.00 0.00 C ATOM 771 C ILE A 52 26.606 16.970 4.120 1.00 0.00 C ATOM 772 O ILE A 52 26.166 16.025 4.773 1.00 0.00 O ATOM 773 CB ILE A 52 28.084 16.985 2.108 1.00 0.00 C ATOM 774 CG1 ILE A 52 28.141 16.873 0.584 1.00 0.00 C ATOM 775 CG2 ILE A 52 28.904 15.880 2.757 1.00 0.00 C ATOM 776 CD1 ILE A 52 29.400 17.456 -0.019 1.00 0.00 C ATOM 0 H ILE A 52 26.364 18.685 1.486 1.00 0.00 H new ATOM 0 HA ILE A 52 26.174 15.993 2.257 1.00 0.00 H new ATOM 0 HB ILE A 52 28.510 17.945 2.398 1.00 0.00 H new ATOM 0 HG12 ILE A 52 28.066 15.823 0.302 1.00 0.00 H new ATOM 0 HG13 ILE A 52 27.275 17.380 0.158 1.00 0.00 H new ATOM 0 HG21 ILE A 52 29.933 15.935 2.402 1.00 0.00 H new ATOM 0 HG22 ILE A 52 28.886 16.002 3.840 1.00 0.00 H new ATOM 0 HG23 ILE A 52 28.481 14.911 2.494 1.00 0.00 H new ATOM 0 HD11 ILE A 52 29.371 17.341 -1.103 1.00 0.00 H new ATOM 0 HD12 ILE A 52 29.467 18.515 0.232 1.00 0.00 H new ATOM 0 HD13 ILE A 52 30.270 16.933 0.378 1.00 0.00 H new ATOM 788 N ASN A 53 27.087 18.074 4.680 1.00 0.00 N ATOM 789 CA ASN A 53 27.126 18.243 6.128 1.00 0.00 C ATOM 790 C ASN A 53 25.906 17.602 6.783 1.00 0.00 C ATOM 791 O ASN A 53 26.008 16.994 7.847 1.00 0.00 O ATOM 792 CB ASN A 53 27.191 19.728 6.489 1.00 0.00 C ATOM 793 CG ASN A 53 28.614 20.250 6.537 1.00 0.00 C ATOM 794 OD1 ASN A 53 29.368 19.944 7.460 1.00 0.00 O ATOM 795 ND2 ASN A 53 28.988 21.042 5.538 1.00 0.00 N ATOM 0 H ASN A 53 27.456 18.866 4.153 1.00 0.00 H new ATOM 0 HA ASN A 53 28.021 17.746 6.502 1.00 0.00 H new ATOM 0 HB2 ASN A 53 26.621 20.302 5.758 1.00 0.00 H new ATOM 0 HB3 ASN A 53 26.717 19.885 7.458 1.00 0.00 H new ATOM 0 HD21 ASN A 53 29.934 21.423 5.516 1.00 0.00 H new ATOM 0 HD22 ASN A 53 28.329 21.269 4.793 1.00 0.00 H new ATOM 802 N GLU A 54 24.752 17.744 6.138 1.00 0.00 N ATOM 803 CA GLU A 54 23.512 17.179 6.658 1.00 0.00 C ATOM 804 C GLU A 54 23.596 15.657 6.731 1.00 0.00 C ATOM 805 O GLU A 54 23.218 15.050 7.733 1.00 0.00 O ATOM 806 CB GLU A 54 22.329 17.594 5.780 1.00 0.00 C ATOM 807 CG GLU A 54 21.974 19.067 5.895 1.00 0.00 C ATOM 808 CD GLU A 54 21.273 19.398 7.199 1.00 0.00 C ATOM 809 OE1 GLU A 54 20.398 18.612 7.619 1.00 0.00 O ATOM 810 OE2 GLU A 54 21.601 20.443 7.799 1.00 0.00 O ATOM 0 H GLU A 54 24.650 18.245 5.255 1.00 0.00 H new ATOM 0 HA GLU A 54 23.361 17.566 7.666 1.00 0.00 H new ATOM 0 HB2 GLU A 54 22.561 17.365 4.740 1.00 0.00 H new ATOM 0 HB3 GLU A 54 21.459 16.997 6.051 1.00 0.00 H new ATOM 0 HG2 GLU A 54 22.883 19.663 5.814 1.00 0.00 H new ATOM 0 HG3 GLU A 54 21.332 19.349 5.060 1.00 0.00 H new ATOM 817 N VAL A 55 24.095 15.046 5.661 1.00 0.00 N ATOM 818 CA VAL A 55 24.229 13.595 5.602 1.00 0.00 C ATOM 819 C VAL A 55 25.464 13.127 6.364 1.00 0.00 C ATOM 820 O VAL A 55 25.543 11.974 6.790 1.00 0.00 O ATOM 821 CB VAL A 55 24.319 13.098 4.147 1.00 0.00 C ATOM 822 CG1 VAL A 55 24.927 11.705 4.095 1.00 0.00 C ATOM 823 CG2 VAL A 55 22.945 13.114 3.494 1.00 0.00 C ATOM 0 H VAL A 55 24.413 15.533 4.823 1.00 0.00 H new ATOM 0 HA VAL A 55 23.337 13.175 6.067 1.00 0.00 H new ATOM 0 HB VAL A 55 24.969 13.773 3.590 1.00 0.00 H new ATOM 0 HG11 VAL A 55 24.982 11.371 3.059 1.00 0.00 H new ATOM 0 HG12 VAL A 55 25.929 11.729 4.523 1.00 0.00 H new ATOM 0 HG13 VAL A 55 24.306 11.015 4.666 1.00 0.00 H new ATOM 0 HG21 VAL A 55 23.026 12.760 2.466 1.00 0.00 H new ATOM 0 HG22 VAL A 55 22.270 12.463 4.050 1.00 0.00 H new ATOM 0 HG23 VAL A 55 22.552 14.131 3.497 1.00 0.00 H new ATOM 833 N ASP A 56 26.425 14.028 6.533 1.00 0.00 N ATOM 834 CA ASP A 56 27.657 13.708 7.246 1.00 0.00 C ATOM 835 C ASP A 56 27.352 13.155 8.635 1.00 0.00 C ATOM 836 O ASP A 56 26.841 13.866 9.499 1.00 0.00 O ATOM 837 CB ASP A 56 28.542 14.950 7.361 1.00 0.00 C ATOM 838 CG ASP A 56 29.987 14.604 7.662 1.00 0.00 C ATOM 839 OD1 ASP A 56 30.548 13.736 6.962 1.00 0.00 O ATOM 840 OD2 ASP A 56 30.557 15.202 8.599 1.00 0.00 O ATOM 0 H ASP A 56 26.375 14.986 6.186 1.00 0.00 H new ATOM 0 HA ASP A 56 28.189 12.944 6.679 1.00 0.00 H new ATOM 0 HB2 ASP A 56 28.493 15.515 6.430 1.00 0.00 H new ATOM 0 HB3 ASP A 56 28.155 15.597 8.148 1.00 0.00 H new ATOM 845 N ALA A 57 27.669 11.881 8.841 1.00 0.00 N ATOM 846 CA ALA A 57 27.431 11.232 10.125 1.00 0.00 C ATOM 847 C ALA A 57 28.739 11.001 10.874 1.00 0.00 C ATOM 848 O ALA A 57 29.001 11.637 11.895 1.00 0.00 O ATOM 849 CB ALA A 57 26.696 9.915 9.923 1.00 0.00 C ATOM 0 H ALA A 57 28.091 11.278 8.135 1.00 0.00 H new ATOM 0 HA ALA A 57 26.809 11.893 10.729 1.00 0.00 H new ATOM 0 HB1 ALA A 57 26.525 9.442 10.890 1.00 0.00 H new ATOM 0 HB2 ALA A 57 25.739 10.103 9.437 1.00 0.00 H new ATOM 0 HB3 ALA A 57 27.297 9.255 9.297 1.00 0.00 H new ATOM 855 N ASP A 58 29.555 10.087 10.362 1.00 0.00 N ATOM 856 CA ASP A 58 30.836 9.772 10.983 1.00 0.00 C ATOM 857 C ASP A 58 31.457 11.016 11.610 1.00 0.00 C ATOM 858 O ASP A 58 32.023 10.958 12.701 1.00 0.00 O ATOM 859 CB ASP A 58 31.794 9.174 9.951 1.00 0.00 C ATOM 860 CG ASP A 58 31.123 8.138 9.071 1.00 0.00 C ATOM 861 OD1 ASP A 58 31.023 6.969 9.500 1.00 0.00 O ATOM 862 OD2 ASP A 58 30.697 8.496 7.953 1.00 0.00 O ATOM 0 H ASP A 58 29.352 9.551 9.518 1.00 0.00 H new ATOM 0 HA ASP A 58 30.659 9.040 11.771 1.00 0.00 H new ATOM 0 HB2 ASP A 58 32.195 9.972 9.326 1.00 0.00 H new ATOM 0 HB3 ASP A 58 32.639 8.717 10.466 1.00 0.00 H new ATOM 867 N GLY A 59 31.347 12.142 10.911 1.00 0.00 N ATOM 868 CA GLY A 59 31.903 13.385 11.414 1.00 0.00 C ATOM 869 C GLY A 59 33.234 13.726 10.774 1.00 0.00 C ATOM 870 O GLY A 59 34.150 14.200 11.444 1.00 0.00 O ATOM 0 H GLY A 59 30.883 12.216 10.006 1.00 0.00 H new ATOM 0 HA2 GLY A 59 31.197 14.195 11.231 1.00 0.00 H new ATOM 0 HA3 GLY A 59 32.031 13.311 12.494 1.00 0.00 H new ATOM 874 N ASN A 60 33.342 13.483 9.471 1.00 0.00 N ATOM 875 CA ASN A 60 34.572 13.765 8.740 1.00 0.00 C ATOM 876 C ASN A 60 34.372 14.922 7.766 1.00 0.00 C ATOM 877 O ASN A 60 35.180 15.848 7.710 1.00 0.00 O ATOM 878 CB ASN A 60 35.036 12.520 7.982 1.00 0.00 C ATOM 879 CG ASN A 60 33.877 11.710 7.435 1.00 0.00 C ATOM 880 OD1 ASN A 60 32.886 12.265 6.962 1.00 0.00 O ATOM 881 ND2 ASN A 60 33.997 10.389 7.498 1.00 0.00 N ATOM 0 H ASN A 60 32.593 13.092 8.900 1.00 0.00 H new ATOM 0 HA ASN A 60 35.338 14.049 9.462 1.00 0.00 H new ATOM 0 HB2 ASN A 60 35.686 12.820 7.160 1.00 0.00 H new ATOM 0 HB3 ASN A 60 35.631 11.894 8.647 1.00 0.00 H new ATOM 0 HD21 ASN A 60 33.249 9.792 7.146 1.00 0.00 H new ATOM 0 HD22 ASN A 60 34.837 9.972 7.899 1.00 0.00 H new ATOM 888 N GLY A 61 33.287 14.863 6.999 1.00 0.00 N ATOM 889 CA GLY A 61 33.000 15.911 6.037 1.00 0.00 C ATOM 890 C GLY A 61 32.518 15.363 4.709 1.00 0.00 C ATOM 891 O GLY A 61 31.727 16.002 4.014 1.00 0.00 O ATOM 0 H GLY A 61 32.602 14.108 7.027 1.00 0.00 H new ATOM 0 HA2 GLY A 61 32.243 16.579 6.447 1.00 0.00 H new ATOM 0 HA3 GLY A 61 33.898 16.508 5.876 1.00 0.00 H new ATOM 895 N THR A 62 32.998 14.176 4.351 1.00 0.00 N ATOM 896 CA THR A 62 32.615 13.543 3.095 1.00 0.00 C ATOM 897 C THR A 62 31.631 12.403 3.332 1.00 0.00 C ATOM 898 O THR A 62 31.748 11.663 4.309 1.00 0.00 O ATOM 899 CB THR A 62 33.843 12.998 2.342 1.00 0.00 C ATOM 900 OG1 THR A 62 34.463 11.957 3.105 1.00 0.00 O ATOM 901 CG2 THR A 62 34.850 14.107 2.076 1.00 0.00 C ATOM 0 H THR A 62 33.653 13.633 4.914 1.00 0.00 H new ATOM 0 HA THR A 62 32.138 14.311 2.487 1.00 0.00 H new ATOM 0 HB THR A 62 33.507 12.596 1.386 1.00 0.00 H new ATOM 0 HG1 THR A 62 35.242 11.615 2.619 1.00 0.00 H new ATOM 0 HG21 THR A 62 35.709 13.699 1.543 1.00 0.00 H new ATOM 0 HG22 THR A 62 34.384 14.884 1.471 1.00 0.00 H new ATOM 0 HG23 THR A 62 35.180 14.534 3.023 1.00 0.00 H new ATOM 909 N ILE A 63 30.662 12.267 2.432 1.00 0.00 N ATOM 910 CA ILE A 63 29.660 11.215 2.544 1.00 0.00 C ATOM 911 C ILE A 63 30.247 9.855 2.181 1.00 0.00 C ATOM 912 O ILE A 63 30.697 9.642 1.055 1.00 0.00 O ATOM 913 CB ILE A 63 28.446 11.496 1.637 1.00 0.00 C ATOM 914 CG1 ILE A 63 27.740 12.779 2.078 1.00 0.00 C ATOM 915 CG2 ILE A 63 27.483 10.319 1.663 1.00 0.00 C ATOM 916 CD1 ILE A 63 26.824 13.358 1.021 1.00 0.00 C ATOM 0 H ILE A 63 30.550 12.872 1.618 1.00 0.00 H new ATOM 0 HA ILE A 63 29.332 11.201 3.583 1.00 0.00 H new ATOM 0 HB ILE A 63 28.797 11.630 0.614 1.00 0.00 H new ATOM 0 HG12 ILE A 63 27.160 12.574 2.978 1.00 0.00 H new ATOM 0 HG13 ILE A 63 28.490 13.524 2.345 1.00 0.00 H new ATOM 0 HG21 ILE A 63 26.631 10.532 1.018 1.00 0.00 H new ATOM 0 HG22 ILE A 63 27.993 9.424 1.307 1.00 0.00 H new ATOM 0 HG23 ILE A 63 27.134 10.157 2.683 1.00 0.00 H new ATOM 0 HD11 ILE A 63 26.357 14.266 1.402 1.00 0.00 H new ATOM 0 HD12 ILE A 63 27.403 13.595 0.128 1.00 0.00 H new ATOM 0 HD13 ILE A 63 26.052 12.631 0.771 1.00 0.00 H new ATOM 928 N ASP A 64 30.238 8.938 3.142 1.00 0.00 N ATOM 929 CA ASP A 64 30.767 7.597 2.923 1.00 0.00 C ATOM 930 C ASP A 64 29.651 6.627 2.546 1.00 0.00 C ATOM 931 O ASP A 64 28.502 7.028 2.362 1.00 0.00 O ATOM 932 CB ASP A 64 31.489 7.100 4.177 1.00 0.00 C ATOM 933 CG ASP A 64 32.691 7.953 4.529 1.00 0.00 C ATOM 934 OD1 ASP A 64 33.005 8.882 3.757 1.00 0.00 O ATOM 935 OD2 ASP A 64 33.319 7.691 5.577 1.00 0.00 O ATOM 0 H ASP A 64 29.870 9.099 4.080 1.00 0.00 H new ATOM 0 HA ASP A 64 31.478 7.644 2.098 1.00 0.00 H new ATOM 0 HB2 ASP A 64 30.793 7.095 5.016 1.00 0.00 H new ATOM 0 HB3 ASP A 64 31.811 6.070 4.023 1.00 0.00 H new ATOM 940 N PHE A 65 29.998 5.349 2.431 1.00 0.00 N ATOM 941 CA PHE A 65 29.026 4.322 2.074 1.00 0.00 C ATOM 942 C PHE A 65 27.822 4.364 3.009 1.00 0.00 C ATOM 943 O PHE A 65 26.669 4.366 2.578 1.00 0.00 O ATOM 944 CB PHE A 65 29.675 2.938 2.121 1.00 0.00 C ATOM 945 CG PHE A 65 29.075 1.961 1.151 1.00 0.00 C ATOM 946 CD1 PHE A 65 27.710 1.717 1.148 1.00 0.00 C ATOM 947 CD2 PHE A 65 29.874 1.286 0.242 1.00 0.00 C ATOM 948 CE1 PHE A 65 27.155 0.818 0.257 1.00 0.00 C ATOM 949 CE2 PHE A 65 29.324 0.386 -0.652 1.00 0.00 C ATOM 950 CZ PHE A 65 27.963 0.153 -0.645 1.00 0.00 C ATOM 0 H PHE A 65 30.945 5.000 2.580 1.00 0.00 H new ATOM 0 HA PHE A 65 28.682 4.520 1.059 1.00 0.00 H new ATOM 0 HB2 PHE A 65 30.740 3.038 1.912 1.00 0.00 H new ATOM 0 HB3 PHE A 65 29.585 2.537 3.131 1.00 0.00 H new ATOM 0 HD1 PHE A 65 27.073 2.235 1.850 1.00 0.00 H new ATOM 0 HD2 PHE A 65 30.939 1.465 0.232 1.00 0.00 H new ATOM 0 HE1 PHE A 65 26.091 0.635 0.266 1.00 0.00 H new ATOM 0 HE2 PHE A 65 29.958 -0.134 -1.355 1.00 0.00 H new ATOM 0 HZ PHE A 65 27.531 -0.548 -1.344 1.00 0.00 H new ATOM 960 N PRO A 66 28.094 4.397 4.322 1.00 0.00 N ATOM 961 CA PRO A 66 27.047 4.439 5.347 1.00 0.00 C ATOM 962 C PRO A 66 26.308 5.773 5.367 1.00 0.00 C ATOM 963 O PRO A 66 25.082 5.812 5.469 1.00 0.00 O ATOM 964 CB PRO A 66 27.820 4.237 6.653 1.00 0.00 C ATOM 965 CG PRO A 66 29.198 4.718 6.356 1.00 0.00 C ATOM 966 CD PRO A 66 29.445 4.397 4.907 1.00 0.00 C ATOM 0 HA PRO A 66 26.276 3.689 5.172 1.00 0.00 H new ATOM 0 HB2 PRO A 66 27.371 4.802 7.470 1.00 0.00 H new ATOM 0 HB3 PRO A 66 27.823 3.189 6.953 1.00 0.00 H new ATOM 0 HG2 PRO A 66 29.285 5.789 6.539 1.00 0.00 H new ATOM 0 HG3 PRO A 66 29.930 4.225 6.995 1.00 0.00 H new ATOM 0 HD2 PRO A 66 30.087 5.140 4.435 1.00 0.00 H new ATOM 0 HD3 PRO A 66 29.935 3.431 4.787 1.00 0.00 H new ATOM 974 N GLU A 67 27.062 6.863 5.268 1.00 0.00 N ATOM 975 CA GLU A 67 26.477 8.199 5.275 1.00 0.00 C ATOM 976 C GLU A 67 25.527 8.383 4.095 1.00 0.00 C ATOM 977 O GLU A 67 24.401 8.855 4.257 1.00 0.00 O ATOM 978 CB GLU A 67 27.577 9.262 5.229 1.00 0.00 C ATOM 979 CG GLU A 67 28.710 9.007 6.209 1.00 0.00 C ATOM 980 CD GLU A 67 29.806 10.051 6.117 1.00 0.00 C ATOM 981 OE1 GLU A 67 29.507 11.246 6.318 1.00 0.00 O ATOM 982 OE2 GLU A 67 30.964 9.671 5.843 1.00 0.00 O ATOM 0 H GLU A 67 28.078 6.848 5.182 1.00 0.00 H new ATOM 0 HA GLU A 67 25.909 8.314 6.198 1.00 0.00 H new ATOM 0 HB2 GLU A 67 27.985 9.308 4.219 1.00 0.00 H new ATOM 0 HB3 GLU A 67 27.138 10.237 5.440 1.00 0.00 H new ATOM 0 HG2 GLU A 67 28.312 8.992 7.223 1.00 0.00 H new ATOM 0 HG3 GLU A 67 29.135 8.021 6.019 1.00 0.00 H new ATOM 989 N PHE A 68 25.990 8.009 2.907 1.00 0.00 N ATOM 990 CA PHE A 68 25.183 8.134 1.698 1.00 0.00 C ATOM 991 C PHE A 68 23.770 7.609 1.931 1.00 0.00 C ATOM 992 O PHE A 68 22.787 8.265 1.583 1.00 0.00 O ATOM 993 CB PHE A 68 25.837 7.373 0.542 1.00 0.00 C ATOM 994 CG PHE A 68 24.861 6.920 -0.505 1.00 0.00 C ATOM 995 CD1 PHE A 68 24.477 7.772 -1.528 1.00 0.00 C ATOM 996 CD2 PHE A 68 24.327 5.642 -0.467 1.00 0.00 C ATOM 997 CE1 PHE A 68 23.580 7.358 -2.494 1.00 0.00 C ATOM 998 CE2 PHE A 68 23.429 5.223 -1.430 1.00 0.00 C ATOM 999 CZ PHE A 68 23.054 6.082 -2.445 1.00 0.00 C ATOM 0 H PHE A 68 26.919 7.617 2.755 1.00 0.00 H new ATOM 0 HA PHE A 68 25.121 9.191 1.440 1.00 0.00 H new ATOM 0 HB2 PHE A 68 26.588 8.011 0.076 1.00 0.00 H new ATOM 0 HB3 PHE A 68 26.361 6.504 0.940 1.00 0.00 H new ATOM 0 HD1 PHE A 68 24.884 8.772 -1.571 1.00 0.00 H new ATOM 0 HD2 PHE A 68 24.616 4.966 0.324 1.00 0.00 H new ATOM 0 HE1 PHE A 68 23.290 8.032 -3.287 1.00 0.00 H new ATOM 0 HE2 PHE A 68 23.020 4.224 -1.389 1.00 0.00 H new ATOM 0 HZ PHE A 68 22.352 5.757 -3.198 1.00 0.00 H new ATOM 1009 N LEU A 69 23.675 6.423 2.521 1.00 0.00 N ATOM 1010 CA LEU A 69 22.382 5.809 2.801 1.00 0.00 C ATOM 1011 C LEU A 69 21.380 6.849 3.293 1.00 0.00 C ATOM 1012 O LEU A 69 20.212 6.836 2.902 1.00 0.00 O ATOM 1013 CB LEU A 69 22.536 4.700 3.844 1.00 0.00 C ATOM 1014 CG LEU A 69 23.019 3.347 3.319 1.00 0.00 C ATOM 1015 CD1 LEU A 69 23.817 2.615 4.386 1.00 0.00 C ATOM 1016 CD2 LEU A 69 21.839 2.503 2.859 1.00 0.00 C ATOM 0 H LEU A 69 24.478 5.867 2.815 1.00 0.00 H new ATOM 0 HA LEU A 69 22.005 5.378 1.874 1.00 0.00 H new ATOM 0 HB2 LEU A 69 23.235 5.041 4.608 1.00 0.00 H new ATOM 0 HB3 LEU A 69 21.574 4.554 4.335 1.00 0.00 H new ATOM 0 HG LEU A 69 23.671 3.521 2.463 1.00 0.00 H new ATOM 0 HD11 LEU A 69 24.152 1.655 3.995 1.00 0.00 H new ATOM 0 HD12 LEU A 69 24.683 3.214 4.668 1.00 0.00 H new ATOM 0 HD13 LEU A 69 23.189 2.451 5.261 1.00 0.00 H new ATOM 0 HD21 LEU A 69 22.200 1.544 2.488 1.00 0.00 H new ATOM 0 HD22 LEU A 69 21.162 2.337 3.697 1.00 0.00 H new ATOM 0 HD23 LEU A 69 21.308 3.023 2.062 1.00 0.00 H new ATOM 1028 N THR A 70 21.845 7.751 4.151 1.00 0.00 N ATOM 1029 CA THR A 70 20.990 8.799 4.696 1.00 0.00 C ATOM 1030 C THR A 70 20.410 9.667 3.585 1.00 0.00 C ATOM 1031 O THR A 70 19.215 9.960 3.574 1.00 0.00 O ATOM 1032 CB THR A 70 21.761 9.696 5.683 1.00 0.00 C ATOM 1033 OG1 THR A 70 22.205 8.922 6.803 1.00 0.00 O ATOM 1034 CG2 THR A 70 20.888 10.843 6.167 1.00 0.00 C ATOM 0 H THR A 70 22.809 7.777 4.484 1.00 0.00 H new ATOM 0 HA THR A 70 20.178 8.301 5.227 1.00 0.00 H new ATOM 0 HB THR A 70 22.624 10.112 5.164 1.00 0.00 H new ATOM 0 HG1 THR A 70 22.696 9.499 7.425 1.00 0.00 H new ATOM 0 HG21 THR A 70 21.454 11.463 6.863 1.00 0.00 H new ATOM 0 HG22 THR A 70 20.575 11.447 5.315 1.00 0.00 H new ATOM 0 HG23 THR A 70 20.008 10.443 6.671 1.00 0.00 H new ATOM 1042 N MET A 71 21.263 10.075 2.652 1.00 0.00 N ATOM 1043 CA MET A 71 20.833 10.909 1.535 1.00 0.00 C ATOM 1044 C MET A 71 19.741 10.215 0.728 1.00 0.00 C ATOM 1045 O MET A 71 18.677 10.785 0.486 1.00 0.00 O ATOM 1046 CB MET A 71 22.021 11.238 0.629 1.00 0.00 C ATOM 1047 CG MET A 71 21.630 11.966 -0.646 1.00 0.00 C ATOM 1048 SD MET A 71 23.011 12.158 -1.789 1.00 0.00 S ATOM 1049 CE MET A 71 22.815 10.697 -2.805 1.00 0.00 C ATOM 0 H MET A 71 22.256 9.842 2.647 1.00 0.00 H new ATOM 0 HA MET A 71 20.428 11.836 1.941 1.00 0.00 H new ATOM 0 HB2 MET A 71 22.732 11.850 1.184 1.00 0.00 H new ATOM 0 HB3 MET A 71 22.534 10.313 0.367 1.00 0.00 H new ATOM 0 HG2 MET A 71 20.828 11.418 -1.141 1.00 0.00 H new ATOM 0 HG3 MET A 71 21.235 12.949 -0.391 1.00 0.00 H new ATOM 0 HE1 MET A 71 23.796 10.300 -3.065 1.00 0.00 H new ATOM 0 HE2 MET A 71 22.254 9.943 -2.253 1.00 0.00 H new ATOM 0 HE3 MET A 71 22.276 10.957 -3.716 1.00 0.00 H new ATOM 1059 N MET A 72 20.010 8.981 0.313 1.00 0.00 N ATOM 1060 CA MET A 72 19.049 8.210 -0.466 1.00 0.00 C ATOM 1061 C MET A 72 17.643 8.356 0.107 1.00 0.00 C ATOM 1062 O MET A 72 16.679 8.555 -0.633 1.00 0.00 O ATOM 1063 CB MET A 72 19.449 6.734 -0.493 1.00 0.00 C ATOM 1064 CG MET A 72 20.448 6.395 -1.588 1.00 0.00 C ATOM 1065 SD MET A 72 19.656 6.072 -3.176 1.00 0.00 S ATOM 1066 CE MET A 72 18.919 4.469 -2.866 1.00 0.00 C ATOM 0 H MET A 72 20.886 8.494 0.504 1.00 0.00 H new ATOM 0 HA MET A 72 19.050 8.598 -1.484 1.00 0.00 H new ATOM 0 HB2 MET A 72 19.876 6.464 0.473 1.00 0.00 H new ATOM 0 HB3 MET A 72 18.554 6.126 -0.628 1.00 0.00 H new ATOM 0 HG2 MET A 72 21.153 7.219 -1.699 1.00 0.00 H new ATOM 0 HG3 MET A 72 21.025 5.520 -1.290 1.00 0.00 H new ATOM 0 HE1 MET A 72 18.332 4.165 -3.733 1.00 0.00 H new ATOM 0 HE2 MET A 72 19.705 3.736 -2.684 1.00 0.00 H new ATOM 0 HE3 MET A 72 18.271 4.530 -1.992 1.00 0.00 H new ATOM 1076 N ALA A 73 17.533 8.257 1.427 1.00 0.00 N ATOM 1077 CA ALA A 73 16.245 8.380 2.098 1.00 0.00 C ATOM 1078 C ALA A 73 15.577 9.710 1.764 1.00 0.00 C ATOM 1079 O ALA A 73 14.408 9.748 1.378 1.00 0.00 O ATOM 1080 CB ALA A 73 16.418 8.238 3.603 1.00 0.00 C ATOM 0 H ALA A 73 18.321 8.092 2.054 1.00 0.00 H new ATOM 0 HA ALA A 73 15.599 7.578 1.740 1.00 0.00 H new ATOM 0 HB1 ALA A 73 15.448 8.332 4.091 1.00 0.00 H new ATOM 0 HB2 ALA A 73 16.845 7.261 3.830 1.00 0.00 H new ATOM 0 HB3 ALA A 73 17.085 9.019 3.968 1.00 0.00 H new ATOM 1086 N ARG A 74 16.325 10.797 1.916 1.00 0.00 N ATOM 1087 CA ARG A 74 15.804 12.129 1.632 1.00 0.00 C ATOM 1088 C ARG A 74 15.869 12.431 0.137 1.00 0.00 C ATOM 1089 O ARG A 74 15.283 13.404 -0.337 1.00 0.00 O ATOM 1090 CB ARG A 74 16.592 13.185 2.410 1.00 0.00 C ATOM 1091 CG ARG A 74 16.876 12.792 3.851 1.00 0.00 C ATOM 1092 CD ARG A 74 18.197 13.369 4.335 1.00 0.00 C ATOM 1093 NE ARG A 74 18.020 14.653 5.008 1.00 0.00 N ATOM 1094 CZ ARG A 74 17.674 14.772 6.285 1.00 0.00 C ATOM 1095 NH1 ARG A 74 17.471 13.690 7.023 1.00 0.00 N ATOM 1096 NH2 ARG A 74 17.533 15.976 6.826 1.00 0.00 N ATOM 0 H ARG A 74 17.294 10.782 2.234 1.00 0.00 H new ATOM 0 HA ARG A 74 14.761 12.158 1.947 1.00 0.00 H new ATOM 0 HB2 ARG A 74 17.537 13.370 1.900 1.00 0.00 H new ATOM 0 HB3 ARG A 74 16.035 14.122 2.401 1.00 0.00 H new ATOM 0 HG2 ARG A 74 16.067 13.144 4.492 1.00 0.00 H new ATOM 0 HG3 ARG A 74 16.899 11.706 3.935 1.00 0.00 H new ATOM 0 HD2 ARG A 74 18.672 12.664 5.018 1.00 0.00 H new ATOM 0 HD3 ARG A 74 18.870 13.494 3.487 1.00 0.00 H new ATOM 0 HE ARG A 74 18.170 15.505 4.468 1.00 0.00 H new ATOM 0 HH11 ARG A 74 17.580 12.764 6.611 1.00 0.00 H new ATOM 0 HH12 ARG A 74 17.205 13.784 8.003 1.00 0.00 H new ATOM 0 HH21 ARG A 74 17.690 16.811 6.261 1.00 0.00 H new ATOM 0 HH22 ARG A 74 17.267 16.067 7.807 1.00 0.00 H new ATOM 1110 N LYS A 75 16.585 11.589 -0.601 1.00 0.00 N ATOM 1111 CA LYS A 75 16.727 11.764 -2.041 1.00 0.00 C ATOM 1112 C LYS A 75 15.755 10.863 -2.797 1.00 0.00 C ATOM 1113 O LYS A 75 15.557 11.020 -4.001 1.00 0.00 O ATOM 1114 CB LYS A 75 18.163 11.460 -2.474 1.00 0.00 C ATOM 1115 CG LYS A 75 18.448 11.809 -3.925 1.00 0.00 C ATOM 1116 CD LYS A 75 18.467 13.312 -4.143 1.00 0.00 C ATOM 1117 CE LYS A 75 19.784 13.924 -3.689 1.00 0.00 C ATOM 1118 NZ LYS A 75 19.862 15.375 -4.014 1.00 0.00 N ATOM 0 H LYS A 75 17.076 10.778 -0.225 1.00 0.00 H new ATOM 0 HA LYS A 75 16.494 12.802 -2.280 1.00 0.00 H new ATOM 0 HB2 LYS A 75 18.851 12.013 -1.834 1.00 0.00 H new ATOM 0 HB3 LYS A 75 18.364 10.400 -2.318 1.00 0.00 H new ATOM 0 HG2 LYS A 75 19.408 11.385 -4.220 1.00 0.00 H new ATOM 0 HG3 LYS A 75 17.690 11.357 -4.565 1.00 0.00 H new ATOM 0 HD2 LYS A 75 18.308 13.530 -5.199 1.00 0.00 H new ATOM 0 HD3 LYS A 75 17.643 13.771 -3.596 1.00 0.00 H new ATOM 0 HE2 LYS A 75 19.897 13.786 -2.614 1.00 0.00 H new ATOM 0 HE3 LYS A 75 20.612 13.400 -4.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 20.774 15.755 -3.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 19.780 15.505 -5.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 19.087 15.880 -3.538 1.00 0.00 H new ATOM 1132 N MET A 76 15.151 9.920 -2.081 1.00 0.00 N ATOM 1133 CA MET A 76 14.198 8.996 -2.684 1.00 0.00 C ATOM 1134 C MET A 76 13.024 9.751 -3.299 1.00 0.00 C ATOM 1135 O MET A 76 12.349 9.245 -4.196 1.00 0.00 O ATOM 1136 CB MET A 76 13.689 8.001 -1.640 1.00 0.00 C ATOM 1137 CG MET A 76 14.455 6.688 -1.627 1.00 0.00 C ATOM 1138 SD MET A 76 14.413 5.844 -3.220 1.00 0.00 S ATOM 1139 CE MET A 76 16.020 6.283 -3.878 1.00 0.00 C ATOM 0 H MET A 76 15.305 9.776 -1.083 1.00 0.00 H new ATOM 0 HA MET A 76 14.711 8.450 -3.476 1.00 0.00 H new ATOM 0 HB2 MET A 76 13.752 8.459 -0.653 1.00 0.00 H new ATOM 0 HB3 MET A 76 12.635 7.796 -1.829 1.00 0.00 H new ATOM 0 HG2 MET A 76 15.491 6.879 -1.349 1.00 0.00 H new ATOM 0 HG3 MET A 76 14.035 6.034 -0.863 1.00 0.00 H new ATOM 0 HE1 MET A 76 16.469 5.411 -4.355 1.00 0.00 H new ATOM 0 HE2 MET A 76 15.907 7.080 -4.613 1.00 0.00 H new ATOM 0 HE3 MET A 76 16.664 6.625 -3.068 1.00 0.00 H new ATOM 1149 N LYS A 77 12.784 10.963 -2.811 1.00 0.00 N ATOM 1150 CA LYS A 77 11.692 11.788 -3.312 1.00 0.00 C ATOM 1151 C LYS A 77 12.165 12.680 -4.456 1.00 0.00 C ATOM 1152 O LYS A 77 11.368 13.113 -5.288 1.00 0.00 O ATOM 1153 CB LYS A 77 11.117 12.649 -2.185 1.00 0.00 C ATOM 1154 CG LYS A 77 11.816 13.987 -2.024 1.00 0.00 C ATOM 1155 CD LYS A 77 11.283 15.017 -3.005 1.00 0.00 C ATOM 1156 CE LYS A 77 11.351 16.424 -2.429 1.00 0.00 C ATOM 1157 NZ LYS A 77 10.415 16.601 -1.285 1.00 0.00 N ATOM 0 H LYS A 77 13.332 11.396 -2.068 1.00 0.00 H new ATOM 0 HA LYS A 77 10.913 11.125 -3.689 1.00 0.00 H new ATOM 0 HB2 LYS A 77 10.058 12.823 -2.376 1.00 0.00 H new ATOM 0 HB3 LYS A 77 11.185 12.098 -1.247 1.00 0.00 H new ATOM 0 HG2 LYS A 77 11.680 14.349 -1.005 1.00 0.00 H new ATOM 0 HG3 LYS A 77 12.888 13.859 -2.176 1.00 0.00 H new ATOM 0 HD2 LYS A 77 11.859 14.973 -3.929 1.00 0.00 H new ATOM 0 HD3 LYS A 77 10.251 14.777 -3.261 1.00 0.00 H new ATOM 0 HE2 LYS A 77 12.369 16.633 -2.101 1.00 0.00 H new ATOM 0 HE3 LYS A 77 11.112 17.147 -3.209 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 10.180 17.609 -1.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 9.545 16.059 -1.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 10.865 16.259 -0.412 1.00 0.00 H new ATOM 1171 N ASP A 78 13.466 12.949 -4.491 1.00 0.00 N ATOM 1172 CA ASP A 78 14.045 13.787 -5.535 1.00 0.00 C ATOM 1173 C ASP A 78 13.533 13.374 -6.911 1.00 0.00 C ATOM 1174 O ASP A 78 13.379 14.207 -7.804 1.00 0.00 O ATOM 1175 CB ASP A 78 15.572 13.701 -5.498 1.00 0.00 C ATOM 1176 CG ASP A 78 16.109 12.577 -6.362 1.00 0.00 C ATOM 1177 OD1 ASP A 78 15.515 11.479 -6.344 1.00 0.00 O ATOM 1178 OD2 ASP A 78 17.124 12.796 -7.056 1.00 0.00 O ATOM 0 H ASP A 78 14.139 12.599 -3.809 1.00 0.00 H new ATOM 0 HA ASP A 78 13.742 14.817 -5.350 1.00 0.00 H new ATOM 0 HB2 ASP A 78 15.995 14.648 -5.834 1.00 0.00 H new ATOM 0 HB3 ASP A 78 15.900 13.553 -4.469 1.00 0.00 H new ATOM 1183 N THR A 79 13.271 12.081 -7.075 1.00 0.00 N ATOM 1184 CA THR A 79 12.778 11.556 -8.342 1.00 0.00 C ATOM 1185 C THR A 79 11.291 11.844 -8.516 1.00 0.00 C ATOM 1186 O THR A 79 10.803 11.986 -9.638 1.00 0.00 O ATOM 1187 CB THR A 79 13.011 10.037 -8.450 1.00 0.00 C ATOM 1188 OG1 THR A 79 14.378 9.729 -8.157 1.00 0.00 O ATOM 1189 CG2 THR A 79 12.659 9.533 -9.841 1.00 0.00 C ATOM 0 H THR A 79 13.392 11.378 -6.346 1.00 0.00 H new ATOM 0 HA THR A 79 13.337 12.059 -9.131 1.00 0.00 H new ATOM 0 HB THR A 79 12.364 9.540 -7.727 1.00 0.00 H new ATOM 0 HG1 THR A 79 14.743 10.407 -7.551 1.00 0.00 H new ATOM 0 HG21 THR A 79 12.832 8.458 -9.893 1.00 0.00 H new ATOM 0 HG22 THR A 79 11.610 9.742 -10.049 1.00 0.00 H new ATOM 0 HG23 THR A 79 13.283 10.037 -10.579 1.00 0.00 H new ATOM 1197 N ASP A 80 10.576 11.931 -7.400 1.00 0.00 N ATOM 1198 CA ASP A 80 9.144 12.204 -7.429 1.00 0.00 C ATOM 1199 C ASP A 80 8.809 13.237 -8.501 1.00 0.00 C ATOM 1200 O ASP A 80 7.689 13.279 -9.008 1.00 0.00 O ATOM 1201 CB ASP A 80 8.669 12.699 -6.062 1.00 0.00 C ATOM 1202 CG ASP A 80 7.215 13.127 -6.074 1.00 0.00 C ATOM 1203 OD1 ASP A 80 6.893 14.111 -6.772 1.00 0.00 O ATOM 1204 OD2 ASP A 80 6.400 12.479 -5.384 1.00 0.00 O ATOM 0 H ASP A 80 10.965 11.816 -6.464 1.00 0.00 H new ATOM 0 HA ASP A 80 8.628 11.275 -7.670 1.00 0.00 H new ATOM 0 HB2 ASP A 80 8.806 11.908 -5.325 1.00 0.00 H new ATOM 0 HB3 ASP A 80 9.289 13.538 -5.747 1.00 0.00 H new ATOM 1209 N SER A 81 9.789 14.069 -8.840 1.00 0.00 N ATOM 1210 CA SER A 81 9.598 15.105 -9.848 1.00 0.00 C ATOM 1211 C SER A 81 8.916 14.536 -11.089 1.00 0.00 C ATOM 1212 O SER A 81 8.348 15.276 -11.892 1.00 0.00 O ATOM 1213 CB SER A 81 10.941 15.728 -10.231 1.00 0.00 C ATOM 1214 OG SER A 81 11.623 16.213 -9.087 1.00 0.00 O ATOM 0 H SER A 81 10.723 14.046 -8.431 1.00 0.00 H new ATOM 0 HA SER A 81 8.956 15.877 -9.423 1.00 0.00 H new ATOM 0 HB2 SER A 81 11.558 14.987 -10.739 1.00 0.00 H new ATOM 0 HB3 SER A 81 10.779 16.544 -10.935 1.00 0.00 H new ATOM 0 HG SER A 81 12.182 15.500 -8.713 1.00 0.00 H new ATOM 1220 N GLU A 82 8.977 13.217 -11.238 1.00 0.00 N ATOM 1221 CA GLU A 82 8.367 12.549 -12.381 1.00 0.00 C ATOM 1222 C GLU A 82 7.140 13.315 -12.868 1.00 0.00 C ATOM 1223 O GLU A 82 7.040 13.661 -14.045 1.00 0.00 O ATOM 1224 CB GLU A 82 7.974 11.116 -12.013 1.00 0.00 C ATOM 1225 CG GLU A 82 7.734 10.222 -13.218 1.00 0.00 C ATOM 1226 CD GLU A 82 7.821 8.747 -12.877 1.00 0.00 C ATOM 1227 OE1 GLU A 82 8.647 8.386 -12.014 1.00 0.00 O ATOM 1228 OE2 GLU A 82 7.063 7.955 -13.474 1.00 0.00 O ATOM 0 H GLU A 82 9.442 12.590 -10.582 1.00 0.00 H new ATOM 0 HA GLU A 82 9.101 12.522 -13.187 1.00 0.00 H new ATOM 0 HB2 GLU A 82 8.761 10.679 -11.398 1.00 0.00 H new ATOM 0 HB3 GLU A 82 7.070 11.141 -11.404 1.00 0.00 H new ATOM 0 HG2 GLU A 82 6.750 10.437 -13.635 1.00 0.00 H new ATOM 0 HG3 GLU A 82 8.466 10.456 -13.991 1.00 0.00 H new ATOM 1235 N GLU A 83 6.211 13.574 -11.954 1.00 0.00 N ATOM 1236 CA GLU A 83 4.990 14.298 -12.291 1.00 0.00 C ATOM 1237 C GLU A 83 5.315 15.624 -12.973 1.00 0.00 C ATOM 1238 O GLU A 83 4.811 15.915 -14.057 1.00 0.00 O ATOM 1239 CB GLU A 83 4.157 14.550 -11.033 1.00 0.00 C ATOM 1240 CG GLU A 83 3.461 13.307 -10.505 1.00 0.00 C ATOM 1241 CD GLU A 83 2.147 13.622 -9.816 1.00 0.00 C ATOM 1242 OE1 GLU A 83 1.887 14.814 -9.549 1.00 0.00 O ATOM 1243 OE2 GLU A 83 1.378 12.676 -9.545 1.00 0.00 O ATOM 0 H GLU A 83 6.280 13.294 -10.976 1.00 0.00 H new ATOM 0 HA GLU A 83 4.413 13.685 -12.983 1.00 0.00 H new ATOM 0 HB2 GLU A 83 4.804 14.953 -10.254 1.00 0.00 H new ATOM 0 HB3 GLU A 83 3.408 15.311 -11.250 1.00 0.00 H new ATOM 0 HG2 GLU A 83 3.278 12.619 -11.331 1.00 0.00 H new ATOM 0 HG3 GLU A 83 4.121 12.796 -9.804 1.00 0.00 H new ATOM 1250 N GLU A 84 6.160 16.423 -12.329 1.00 0.00 N ATOM 1251 CA GLU A 84 6.550 17.719 -12.873 1.00 0.00 C ATOM 1252 C GLU A 84 6.787 17.627 -14.378 1.00 0.00 C ATOM 1253 O GLU A 84 6.674 18.621 -15.096 1.00 0.00 O ATOM 1254 CB GLU A 84 7.813 18.230 -12.177 1.00 0.00 C ATOM 1255 CG GLU A 84 7.576 18.689 -10.748 1.00 0.00 C ATOM 1256 CD GLU A 84 6.901 20.045 -10.675 1.00 0.00 C ATOM 1257 OE1 GLU A 84 7.291 20.943 -11.450 1.00 0.00 O ATOM 1258 OE2 GLU A 84 5.985 20.208 -9.843 1.00 0.00 O ATOM 0 H GLU A 84 6.587 16.196 -11.431 1.00 0.00 H new ATOM 0 HA GLU A 84 5.736 18.421 -12.692 1.00 0.00 H new ATOM 0 HB2 GLU A 84 8.563 17.439 -12.176 1.00 0.00 H new ATOM 0 HB3 GLU A 84 8.225 19.059 -12.753 1.00 0.00 H new ATOM 0 HG2 GLU A 84 6.960 17.953 -10.231 1.00 0.00 H new ATOM 0 HG3 GLU A 84 8.529 18.733 -10.222 1.00 0.00 H new ATOM 1265 N ILE A 85 7.118 16.429 -14.847 1.00 0.00 N ATOM 1266 CA ILE A 85 7.371 16.208 -16.266 1.00 0.00 C ATOM 1267 C ILE A 85 6.080 15.883 -17.010 1.00 0.00 C ATOM 1268 O ILE A 85 5.799 16.453 -18.064 1.00 0.00 O ATOM 1269 CB ILE A 85 8.379 15.064 -16.486 1.00 0.00 C ATOM 1270 CG1 ILE A 85 9.652 15.314 -15.675 1.00 0.00 C ATOM 1271 CG2 ILE A 85 8.706 14.924 -17.965 1.00 0.00 C ATOM 1272 CD1 ILE A 85 10.593 14.131 -15.647 1.00 0.00 C ATOM 0 H ILE A 85 7.217 15.597 -14.266 1.00 0.00 H new ATOM 0 HA ILE A 85 7.792 17.133 -16.660 1.00 0.00 H new ATOM 0 HB ILE A 85 7.929 14.132 -16.143 1.00 0.00 H new ATOM 0 HG12 ILE A 85 10.175 16.174 -16.092 1.00 0.00 H new ATOM 0 HG13 ILE A 85 9.377 15.573 -14.653 1.00 0.00 H new ATOM 0 HG21 ILE A 85 9.419 14.112 -18.105 1.00 0.00 H new ATOM 0 HG22 ILE A 85 7.794 14.705 -18.520 1.00 0.00 H new ATOM 0 HG23 ILE A 85 9.139 15.855 -18.331 1.00 0.00 H new ATOM 0 HD11 ILE A 85 11.473 14.380 -15.054 1.00 0.00 H new ATOM 0 HD12 ILE A 85 10.087 13.274 -15.202 1.00 0.00 H new ATOM 0 HD13 ILE A 85 10.898 13.885 -16.664 1.00 0.00 H new ATOM 1284 N ARG A 86 5.298 14.963 -16.454 1.00 0.00 N ATOM 1285 CA ARG A 86 4.037 14.563 -17.065 1.00 0.00 C ATOM 1286 C ARG A 86 3.338 15.759 -17.705 1.00 0.00 C ATOM 1287 O ARG A 86 3.067 15.761 -18.905 1.00 0.00 O ATOM 1288 CB ARG A 86 3.120 13.923 -16.020 1.00 0.00 C ATOM 1289 CG ARG A 86 3.327 12.425 -15.864 1.00 0.00 C ATOM 1290 CD ARG A 86 4.756 12.099 -15.460 1.00 0.00 C ATOM 1291 NE ARG A 86 4.937 10.675 -15.189 1.00 0.00 N ATOM 1292 CZ ARG A 86 4.439 10.061 -14.122 1.00 0.00 C ATOM 1293 NH1 ARG A 86 3.733 10.742 -13.230 1.00 0.00 N ATOM 1294 NH2 ARG A 86 4.646 8.762 -13.945 1.00 0.00 N ATOM 0 H ARG A 86 5.516 14.481 -15.582 1.00 0.00 H new ATOM 0 HA ARG A 86 4.256 13.833 -17.844 1.00 0.00 H new ATOM 0 HB2 ARG A 86 3.287 14.407 -15.057 1.00 0.00 H new ATOM 0 HB3 ARG A 86 2.082 14.111 -16.295 1.00 0.00 H new ATOM 0 HG2 ARG A 86 2.638 12.038 -15.113 1.00 0.00 H new ATOM 0 HG3 ARG A 86 3.090 11.924 -16.803 1.00 0.00 H new ATOM 0 HD2 ARG A 86 5.436 12.406 -16.254 1.00 0.00 H new ATOM 0 HD3 ARG A 86 5.022 12.674 -14.573 1.00 0.00 H new ATOM 0 HE ARG A 86 5.475 10.122 -15.856 1.00 0.00 H new ATOM 0 HH11 ARG A 86 3.571 11.740 -13.362 1.00 0.00 H new ATOM 0 HH12 ARG A 86 3.352 10.268 -12.411 1.00 0.00 H new ATOM 0 HH21 ARG A 86 5.188 8.234 -14.629 1.00 0.00 H new ATOM 0 HH22 ARG A 86 4.263 8.292 -13.125 1.00 0.00 H new ATOM 1308 N GLU A 87 3.051 16.773 -16.895 1.00 0.00 N ATOM 1309 CA GLU A 87 2.383 17.974 -17.383 1.00 0.00 C ATOM 1310 C GLU A 87 2.977 18.424 -18.714 1.00 0.00 C ATOM 1311 O GLU A 87 2.252 18.688 -19.672 1.00 0.00 O ATOM 1312 CB GLU A 87 2.497 19.101 -16.354 1.00 0.00 C ATOM 1313 CG GLU A 87 1.726 18.835 -15.072 1.00 0.00 C ATOM 1314 CD GLU A 87 0.237 19.077 -15.225 1.00 0.00 C ATOM 1315 OE1 GLU A 87 -0.144 19.920 -16.065 1.00 0.00 O ATOM 1316 OE2 GLU A 87 -0.547 18.424 -14.505 1.00 0.00 O ATOM 0 H GLU A 87 3.270 16.787 -15.899 1.00 0.00 H new ATOM 0 HA GLU A 87 1.330 17.737 -17.537 1.00 0.00 H new ATOM 0 HB2 GLU A 87 3.548 19.254 -16.111 1.00 0.00 H new ATOM 0 HB3 GLU A 87 2.135 20.027 -16.800 1.00 0.00 H new ATOM 0 HG2 GLU A 87 1.892 17.804 -14.760 1.00 0.00 H new ATOM 0 HG3 GLU A 87 2.115 19.475 -14.280 1.00 0.00 H new ATOM 1323 N ALA A 88 4.303 18.509 -18.765 1.00 0.00 N ATOM 1324 CA ALA A 88 4.995 18.925 -19.979 1.00 0.00 C ATOM 1325 C ALA A 88 4.670 17.996 -21.143 1.00 0.00 C ATOM 1326 O ALA A 88 4.380 18.449 -22.250 1.00 0.00 O ATOM 1327 CB ALA A 88 6.497 18.970 -19.740 1.00 0.00 C ATOM 0 H ALA A 88 4.919 18.295 -17.980 1.00 0.00 H new ATOM 0 HA ALA A 88 4.649 19.925 -20.240 1.00 0.00 H new ATOM 0 HB1 ALA A 88 7.002 19.282 -20.654 1.00 0.00 H new ATOM 0 HB2 ALA A 88 6.718 19.680 -18.943 1.00 0.00 H new ATOM 0 HB3 ALA A 88 6.849 17.980 -19.451 1.00 0.00 H new ATOM 1333 N PHE A 89 4.720 16.693 -20.886 1.00 0.00 N ATOM 1334 CA PHE A 89 4.432 15.699 -21.913 1.00 0.00 C ATOM 1335 C PHE A 89 3.058 15.939 -22.532 1.00 0.00 C ATOM 1336 O PHE A 89 2.872 15.780 -23.739 1.00 0.00 O ATOM 1337 CB PHE A 89 4.498 14.289 -21.322 1.00 0.00 C ATOM 1338 CG PHE A 89 3.621 13.299 -22.034 1.00 0.00 C ATOM 1339 CD1 PHE A 89 3.804 13.034 -23.381 1.00 0.00 C ATOM 1340 CD2 PHE A 89 2.614 12.633 -21.354 1.00 0.00 C ATOM 1341 CE1 PHE A 89 2.997 12.124 -24.038 1.00 0.00 C ATOM 1342 CE2 PHE A 89 1.804 11.721 -22.006 1.00 0.00 C ATOM 1343 CZ PHE A 89 1.997 11.466 -23.349 1.00 0.00 C ATOM 0 H PHE A 89 4.957 16.301 -19.975 1.00 0.00 H new ATOM 0 HA PHE A 89 5.185 15.793 -22.695 1.00 0.00 H new ATOM 0 HB2 PHE A 89 5.529 13.938 -21.355 1.00 0.00 H new ATOM 0 HB3 PHE A 89 4.208 14.330 -20.272 1.00 0.00 H new ATOM 0 HD1 PHE A 89 4.586 13.544 -23.924 1.00 0.00 H new ATOM 0 HD2 PHE A 89 2.460 12.828 -20.303 1.00 0.00 H new ATOM 0 HE1 PHE A 89 3.148 11.928 -25.089 1.00 0.00 H new ATOM 0 HE2 PHE A 89 1.022 11.209 -21.465 1.00 0.00 H new ATOM 0 HZ PHE A 89 1.367 10.753 -23.860 1.00 0.00 H new ATOM 1353 N ARG A 90 2.098 16.322 -21.696 1.00 0.00 N ATOM 1354 CA ARG A 90 0.740 16.582 -22.160 1.00 0.00 C ATOM 1355 C ARG A 90 0.698 17.822 -23.049 1.00 0.00 C ATOM 1356 O ARG A 90 0.137 17.794 -24.144 1.00 0.00 O ATOM 1357 CB ARG A 90 -0.202 16.763 -20.969 1.00 0.00 C ATOM 1358 CG ARG A 90 -0.484 15.474 -20.214 1.00 0.00 C ATOM 1359 CD ARG A 90 -1.131 15.748 -18.865 1.00 0.00 C ATOM 1360 NE ARG A 90 -1.903 14.605 -18.386 1.00 0.00 N ATOM 1361 CZ ARG A 90 -2.210 14.409 -17.109 1.00 0.00 C ATOM 1362 NH1 ARG A 90 -1.812 15.275 -16.187 1.00 0.00 N ATOM 1363 NH2 ARG A 90 -2.917 13.345 -16.751 1.00 0.00 N ATOM 0 H ARG A 90 2.235 16.459 -20.695 1.00 0.00 H new ATOM 0 HA ARG A 90 0.412 15.724 -22.747 1.00 0.00 H new ATOM 0 HB2 ARG A 90 0.231 17.490 -20.281 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -1.145 17.181 -21.322 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -1.138 14.838 -20.810 1.00 0.00 H new ATOM 0 HG3 ARG A 90 0.447 14.926 -20.068 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -0.359 15.995 -18.136 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -1.783 16.618 -18.946 1.00 0.00 H new ATOM 0 HE ARG A 90 -2.224 13.920 -19.070 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -1.268 16.095 -16.458 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -2.049 15.122 -15.207 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -3.225 12.676 -17.457 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -3.152 13.196 -15.770 1.00 0.00 H new ATOM 1377 N VAL A 91 1.294 18.909 -22.569 1.00 0.00 N ATOM 1378 CA VAL A 91 1.324 20.158 -23.320 1.00 0.00 C ATOM 1379 C VAL A 91 1.534 19.901 -24.807 1.00 0.00 C ATOM 1380 O VAL A 91 0.779 20.393 -25.646 1.00 0.00 O ATOM 1381 CB VAL A 91 2.438 21.092 -22.810 1.00 0.00 C ATOM 1382 CG1 VAL A 91 2.522 22.344 -23.670 1.00 0.00 C ATOM 1383 CG2 VAL A 91 2.204 21.453 -21.351 1.00 0.00 C ATOM 0 H VAL A 91 1.762 18.950 -21.664 1.00 0.00 H new ATOM 0 HA VAL A 91 0.358 20.640 -23.171 1.00 0.00 H new ATOM 0 HB VAL A 91 3.390 20.566 -22.883 1.00 0.00 H new ATOM 0 HG11 VAL A 91 3.314 22.991 -23.294 1.00 0.00 H new ATOM 0 HG12 VAL A 91 2.741 22.064 -24.700 1.00 0.00 H new ATOM 0 HG13 VAL A 91 1.571 22.876 -23.633 1.00 0.00 H new ATOM 0 HG21 VAL A 91 3.000 22.113 -21.007 1.00 0.00 H new ATOM 0 HG22 VAL A 91 1.244 21.960 -21.251 1.00 0.00 H new ATOM 0 HG23 VAL A 91 2.200 20.545 -20.748 1.00 0.00 H new ATOM 1393 N PHE A 92 2.565 19.126 -25.129 1.00 0.00 N ATOM 1394 CA PHE A 92 2.875 18.802 -26.516 1.00 0.00 C ATOM 1395 C PHE A 92 1.724 18.040 -27.167 1.00 0.00 C ATOM 1396 O PHE A 92 1.337 18.327 -28.300 1.00 0.00 O ATOM 1397 CB PHE A 92 4.159 17.974 -26.595 1.00 0.00 C ATOM 1398 CG PHE A 92 5.404 18.773 -26.334 1.00 0.00 C ATOM 1399 CD1 PHE A 92 5.878 19.670 -27.277 1.00 0.00 C ATOM 1400 CD2 PHE A 92 6.100 18.626 -25.145 1.00 0.00 C ATOM 1401 CE1 PHE A 92 7.023 20.406 -27.040 1.00 0.00 C ATOM 1402 CE2 PHE A 92 7.246 19.360 -24.902 1.00 0.00 C ATOM 1403 CZ PHE A 92 7.709 20.250 -25.851 1.00 0.00 C ATOM 0 H PHE A 92 3.200 18.711 -24.447 1.00 0.00 H new ATOM 0 HA PHE A 92 3.021 19.737 -27.057 1.00 0.00 H new ATOM 0 HB2 PHE A 92 4.102 17.159 -25.873 1.00 0.00 H new ATOM 0 HB3 PHE A 92 4.229 17.520 -27.583 1.00 0.00 H new ATOM 0 HD1 PHE A 92 5.346 19.796 -28.209 1.00 0.00 H new ATOM 0 HD2 PHE A 92 5.743 17.930 -24.400 1.00 0.00 H new ATOM 0 HE1 PHE A 92 7.381 21.103 -27.783 1.00 0.00 H new ATOM 0 HE2 PHE A 92 7.779 19.237 -23.971 1.00 0.00 H new ATOM 0 HZ PHE A 92 8.605 20.823 -25.664 1.00 0.00 H new ATOM 1413 N ASP A 93 1.182 17.068 -26.443 1.00 0.00 N ATOM 1414 CA ASP A 93 0.075 16.263 -26.948 1.00 0.00 C ATOM 1415 C ASP A 93 -1.154 17.130 -27.202 1.00 0.00 C ATOM 1416 O ASP A 93 -2.056 17.208 -26.368 1.00 0.00 O ATOM 1417 CB ASP A 93 -0.267 15.149 -25.958 1.00 0.00 C ATOM 1418 CG ASP A 93 -0.864 13.933 -26.639 1.00 0.00 C ATOM 1419 OD1 ASP A 93 -0.674 13.787 -27.864 1.00 0.00 O ATOM 1420 OD2 ASP A 93 -1.523 13.129 -25.947 1.00 0.00 O ATOM 0 H ASP A 93 1.491 16.818 -25.504 1.00 0.00 H new ATOM 0 HA ASP A 93 0.384 15.816 -27.893 1.00 0.00 H new ATOM 0 HB2 ASP A 93 0.635 14.855 -25.421 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -0.970 15.529 -25.217 1.00 0.00 H new ATOM 1425 N LYS A 94 -1.184 17.781 -28.360 1.00 0.00 N ATOM 1426 CA LYS A 94 -2.302 18.642 -28.726 1.00 0.00 C ATOM 1427 C LYS A 94 -3.634 17.955 -28.441 1.00 0.00 C ATOM 1428 O LYS A 94 -4.414 18.416 -27.608 1.00 0.00 O ATOM 1429 CB LYS A 94 -2.218 19.020 -30.207 1.00 0.00 C ATOM 1430 CG LYS A 94 -0.892 19.649 -30.600 1.00 0.00 C ATOM 1431 CD LYS A 94 -1.066 20.663 -31.718 1.00 0.00 C ATOM 1432 CE LYS A 94 -1.188 22.078 -31.173 1.00 0.00 C ATOM 1433 NZ LYS A 94 -2.539 22.340 -30.604 1.00 0.00 N ATOM 0 H LYS A 94 -0.446 17.728 -29.062 1.00 0.00 H new ATOM 0 HA LYS A 94 -2.243 19.547 -28.122 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -2.380 18.127 -30.811 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -3.024 19.715 -30.442 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -0.448 20.136 -29.732 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -0.199 18.870 -30.918 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -0.216 20.606 -32.398 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -1.955 20.417 -32.298 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -0.433 22.237 -30.403 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -0.985 22.793 -31.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -2.615 23.342 -30.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -3.264 22.116 -31.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -2.683 21.745 -29.763 1.00 0.00 H new ATOM 1447 N ASP A 95 -3.886 16.852 -29.135 1.00 0.00 N ATOM 1448 CA ASP A 95 -5.122 16.100 -28.955 1.00 0.00 C ATOM 1449 C ASP A 95 -5.230 15.567 -27.529 1.00 0.00 C ATOM 1450 O ASP A 95 -6.317 15.519 -26.954 1.00 0.00 O ATOM 1451 CB ASP A 95 -5.191 14.942 -29.952 1.00 0.00 C ATOM 1452 CG ASP A 95 -3.838 14.299 -30.186 1.00 0.00 C ATOM 1453 OD1 ASP A 95 -3.063 14.178 -29.215 1.00 0.00 O ATOM 1454 OD2 ASP A 95 -3.554 13.917 -31.341 1.00 0.00 O ATOM 0 H ASP A 95 -3.250 16.458 -29.828 1.00 0.00 H new ATOM 0 HA ASP A 95 -5.958 16.775 -29.137 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -5.889 14.190 -29.583 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -5.586 15.306 -30.900 1.00 0.00 H new ATOM 1459 N GLY A 96 -4.095 15.166 -26.965 1.00 0.00 N ATOM 1460 CA GLY A 96 -4.085 14.640 -25.612 1.00 0.00 C ATOM 1461 C GLY A 96 -4.488 13.180 -25.554 1.00 0.00 C ATOM 1462 O GLY A 96 -5.243 12.773 -24.673 1.00 0.00 O ATOM 0 H GLY A 96 -3.183 15.196 -27.420 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -3.087 14.755 -25.188 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -4.764 15.226 -24.993 1.00 0.00 H new ATOM 1466 N ASN A 97 -3.984 12.391 -26.497 1.00 0.00 N ATOM 1467 CA ASN A 97 -4.299 10.968 -26.551 1.00 0.00 C ATOM 1468 C ASN A 97 -3.171 10.138 -25.945 1.00 0.00 C ATOM 1469 O ASN A 97 -3.413 9.221 -25.161 1.00 0.00 O ATOM 1470 CB ASN A 97 -4.545 10.533 -27.997 1.00 0.00 C ATOM 1471 CG ASN A 97 -3.258 10.394 -28.787 1.00 0.00 C ATOM 1472 OD1 ASN A 97 -2.451 11.321 -28.847 1.00 0.00 O ATOM 1473 ND2 ASN A 97 -3.062 9.231 -29.398 1.00 0.00 N ATOM 0 H ASN A 97 -3.356 12.712 -27.234 1.00 0.00 H new ATOM 0 HA ASN A 97 -5.205 10.800 -25.968 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -5.075 9.581 -28.002 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -5.192 11.261 -28.487 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -2.215 9.079 -29.945 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -3.759 8.490 -29.320 1.00 0.00 H new ATOM 1480 N GLY A 98 -1.937 10.468 -26.313 1.00 0.00 N ATOM 1481 CA GLY A 98 -0.790 9.745 -25.796 1.00 0.00 C ATOM 1482 C GLY A 98 0.442 9.913 -26.663 1.00 0.00 C ATOM 1483 O GLY A 98 1.548 10.093 -26.154 1.00 0.00 O ATOM 0 H GLY A 98 -1.711 11.223 -26.960 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -0.570 10.093 -24.787 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -1.036 8.686 -25.721 1.00 0.00 H new ATOM 1487 N TYR A 99 0.251 9.854 -27.976 1.00 0.00 N ATOM 1488 CA TYR A 99 1.356 9.997 -28.916 1.00 0.00 C ATOM 1489 C TYR A 99 1.443 11.427 -29.441 1.00 0.00 C ATOM 1490 O TYR A 99 0.425 12.095 -29.626 1.00 0.00 O ATOM 1491 CB TYR A 99 1.189 9.023 -30.084 1.00 0.00 C ATOM 1492 CG TYR A 99 1.385 7.575 -29.697 1.00 0.00 C ATOM 1493 CD1 TYR A 99 0.660 7.010 -28.654 1.00 0.00 C ATOM 1494 CD2 TYR A 99 2.293 6.771 -30.375 1.00 0.00 C ATOM 1495 CE1 TYR A 99 0.836 5.687 -28.297 1.00 0.00 C ATOM 1496 CE2 TYR A 99 2.475 5.447 -30.025 1.00 0.00 C ATOM 1497 CZ TYR A 99 1.744 4.910 -28.985 1.00 0.00 C ATOM 1498 OH TYR A 99 1.922 3.591 -28.633 1.00 0.00 O ATOM 0 H TYR A 99 -0.659 9.708 -28.414 1.00 0.00 H new ATOM 0 HA TYR A 99 2.281 9.766 -28.388 1.00 0.00 H new ATOM 0 HB2 TYR A 99 0.193 9.145 -30.509 1.00 0.00 H new ATOM 0 HB3 TYR A 99 1.903 9.281 -30.866 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -0.053 7.615 -28.114 1.00 0.00 H new ATOM 0 HD2 TYR A 99 2.866 7.188 -31.190 1.00 0.00 H new ATOM 0 HE1 TYR A 99 0.266 5.264 -27.484 1.00 0.00 H new ATOM 0 HE2 TYR A 99 3.185 4.836 -30.562 1.00 0.00 H new ATOM 0 HH TYR A 99 2.596 3.185 -29.217 1.00 0.00 H new ATOM 1508 N ILE A 100 2.666 11.890 -29.679 1.00 0.00 N ATOM 1509 CA ILE A 100 2.887 13.239 -30.183 1.00 0.00 C ATOM 1510 C ILE A 100 3.433 13.211 -31.607 1.00 0.00 C ATOM 1511 O ILE A 100 4.626 12.997 -31.821 1.00 0.00 O ATOM 1512 CB ILE A 100 3.863 14.022 -29.287 1.00 0.00 C ATOM 1513 CG1 ILE A 100 3.337 14.081 -27.851 1.00 0.00 C ATOM 1514 CG2 ILE A 100 4.078 15.425 -29.836 1.00 0.00 C ATOM 1515 CD1 ILE A 100 4.407 14.386 -26.827 1.00 0.00 C ATOM 0 H ILE A 100 3.519 11.350 -29.531 1.00 0.00 H new ATOM 0 HA ILE A 100 1.919 13.740 -30.177 1.00 0.00 H new ATOM 0 HB ILE A 100 4.822 13.504 -29.282 1.00 0.00 H new ATOM 0 HG12 ILE A 100 2.559 14.842 -27.789 1.00 0.00 H new ATOM 0 HG13 ILE A 100 2.871 13.127 -27.604 1.00 0.00 H new ATOM 0 HG21 ILE A 100 4.771 15.966 -29.191 1.00 0.00 H new ATOM 0 HG22 ILE A 100 4.493 15.362 -30.842 1.00 0.00 H new ATOM 0 HG23 ILE A 100 3.125 15.953 -29.868 1.00 0.00 H new ATOM 0 HD11 ILE A 100 3.962 14.412 -25.832 1.00 0.00 H new ATOM 0 HD12 ILE A 100 5.174 13.612 -26.861 1.00 0.00 H new ATOM 0 HD13 ILE A 100 4.857 15.354 -27.049 1.00 0.00 H new ATOM 1527 N SER A 101 2.551 13.429 -32.578 1.00 0.00 N ATOM 1528 CA SER A 101 2.944 13.427 -33.982 1.00 0.00 C ATOM 1529 C SER A 101 3.864 14.604 -34.290 1.00 0.00 C ATOM 1530 O SER A 101 3.905 15.585 -33.548 1.00 0.00 O ATOM 1531 CB SER A 101 1.706 13.483 -34.880 1.00 0.00 C ATOM 1532 OG SER A 101 0.983 14.685 -34.676 1.00 0.00 O ATOM 0 H SER A 101 1.560 13.609 -32.418 1.00 0.00 H new ATOM 0 HA SER A 101 3.487 12.503 -34.181 1.00 0.00 H new ATOM 0 HB2 SER A 101 2.007 13.409 -35.925 1.00 0.00 H new ATOM 0 HB3 SER A 101 1.063 12.628 -34.672 1.00 0.00 H new ATOM 0 HG SER A 101 0.198 14.698 -35.262 1.00 0.00 H new ATOM 1538 N ALA A 102 4.601 14.498 -35.391 1.00 0.00 N ATOM 1539 CA ALA A 102 5.519 15.554 -35.800 1.00 0.00 C ATOM 1540 C ALA A 102 4.796 16.890 -35.934 1.00 0.00 C ATOM 1541 O ALA A 102 5.289 17.922 -35.480 1.00 0.00 O ATOM 1542 CB ALA A 102 6.197 15.185 -37.112 1.00 0.00 C ATOM 0 H ALA A 102 4.580 13.692 -36.015 1.00 0.00 H new ATOM 0 HA ALA A 102 6.280 15.659 -35.027 1.00 0.00 H new ATOM 0 HB1 ALA A 102 6.880 15.982 -37.406 1.00 0.00 H new ATOM 0 HB2 ALA A 102 6.755 14.258 -36.985 1.00 0.00 H new ATOM 0 HB3 ALA A 102 5.442 15.050 -37.886 1.00 0.00 H new ATOM 1548 N ALA A 103 3.624 16.863 -36.561 1.00 0.00 N ATOM 1549 CA ALA A 103 2.833 18.071 -36.754 1.00 0.00 C ATOM 1550 C ALA A 103 2.392 18.657 -35.417 1.00 0.00 C ATOM 1551 O ALA A 103 2.540 19.855 -35.175 1.00 0.00 O ATOM 1552 CB ALA A 103 1.622 17.776 -37.627 1.00 0.00 C ATOM 0 H ALA A 103 3.202 16.017 -36.944 1.00 0.00 H new ATOM 0 HA ALA A 103 3.459 18.808 -37.257 1.00 0.00 H new ATOM 0 HB1 ALA A 103 1.040 18.688 -37.763 1.00 0.00 H new ATOM 0 HB2 ALA A 103 1.954 17.410 -38.598 1.00 0.00 H new ATOM 0 HB3 ALA A 103 1.003 17.019 -37.146 1.00 0.00 H new ATOM 1558 N GLU A 104 1.849 17.805 -34.552 1.00 0.00 N ATOM 1559 CA GLU A 104 1.386 18.241 -33.240 1.00 0.00 C ATOM 1560 C GLU A 104 2.455 19.069 -32.532 1.00 0.00 C ATOM 1561 O GLU A 104 2.252 20.248 -32.242 1.00 0.00 O ATOM 1562 CB GLU A 104 1.009 17.032 -32.380 1.00 0.00 C ATOM 1563 CG GLU A 104 -0.423 16.566 -32.580 1.00 0.00 C ATOM 1564 CD GLU A 104 -0.726 15.279 -31.838 1.00 0.00 C ATOM 1565 OE1 GLU A 104 -0.514 15.241 -30.607 1.00 0.00 O ATOM 1566 OE2 GLU A 104 -1.175 14.311 -32.486 1.00 0.00 O ATOM 0 H GLU A 104 1.719 16.810 -34.736 1.00 0.00 H new ATOM 0 HA GLU A 104 0.504 18.865 -33.384 1.00 0.00 H new ATOM 0 HB2 GLU A 104 1.685 16.209 -32.609 1.00 0.00 H new ATOM 0 HB3 GLU A 104 1.157 17.283 -31.330 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -1.106 17.346 -32.242 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -0.608 16.420 -33.644 1.00 0.00 H new ATOM 1573 N LEU A 105 3.594 18.442 -32.257 1.00 0.00 N ATOM 1574 CA LEU A 105 4.696 19.120 -31.583 1.00 0.00 C ATOM 1575 C LEU A 105 5.205 20.292 -32.416 1.00 0.00 C ATOM 1576 O LEU A 105 5.444 21.380 -31.892 1.00 0.00 O ATOM 1577 CB LEU A 105 5.837 18.137 -31.315 1.00 0.00 C ATOM 1578 CG LEU A 105 7.186 18.757 -30.950 1.00 0.00 C ATOM 1579 CD1 LEU A 105 7.994 17.806 -30.081 1.00 0.00 C ATOM 1580 CD2 LEU A 105 7.961 19.124 -32.207 1.00 0.00 C ATOM 0 H LEU A 105 3.778 17.466 -32.490 1.00 0.00 H new ATOM 0 HA LEU A 105 4.326 19.507 -30.633 1.00 0.00 H new ATOM 0 HB2 LEU A 105 5.535 17.472 -30.506 1.00 0.00 H new ATOM 0 HB3 LEU A 105 5.972 17.518 -32.202 1.00 0.00 H new ATOM 0 HG LEU A 105 7.003 19.668 -30.381 1.00 0.00 H new ATOM 0 HD11 LEU A 105 8.951 18.265 -29.832 1.00 0.00 H new ATOM 0 HD12 LEU A 105 7.443 17.594 -29.164 1.00 0.00 H new ATOM 0 HD13 LEU A 105 8.168 16.877 -30.623 1.00 0.00 H new ATOM 0 HD21 LEU A 105 8.919 19.564 -31.929 1.00 0.00 H new ATOM 0 HD22 LEU A 105 8.133 18.228 -32.803 1.00 0.00 H new ATOM 0 HD23 LEU A 105 7.387 19.844 -32.791 1.00 0.00 H new ATOM 1592 N ARG A 106 5.367 20.063 -33.715 1.00 0.00 N ATOM 1593 CA ARG A 106 5.847 21.100 -34.620 1.00 0.00 C ATOM 1594 C ARG A 106 5.177 22.438 -34.318 1.00 0.00 C ATOM 1595 O ARG A 106 5.849 23.450 -34.122 1.00 0.00 O ATOM 1596 CB ARG A 106 5.582 20.702 -36.073 1.00 0.00 C ATOM 1597 CG ARG A 106 5.990 21.764 -37.080 1.00 0.00 C ATOM 1598 CD ARG A 106 5.575 21.382 -38.492 1.00 0.00 C ATOM 1599 NE ARG A 106 5.974 22.389 -39.471 1.00 0.00 N ATOM 1600 CZ ARG A 106 5.329 23.537 -39.650 1.00 0.00 C ATOM 1601 NH1 ARG A 106 4.260 23.821 -38.919 1.00 0.00 N ATOM 1602 NH2 ARG A 106 5.753 24.403 -40.561 1.00 0.00 N ATOM 0 H ARG A 106 5.173 19.168 -34.164 1.00 0.00 H new ATOM 0 HA ARG A 106 6.921 21.209 -34.470 1.00 0.00 H new ATOM 0 HB2 ARG A 106 6.120 19.780 -36.292 1.00 0.00 H new ATOM 0 HB3 ARG A 106 4.520 20.488 -36.194 1.00 0.00 H new ATOM 0 HG2 ARG A 106 5.534 22.717 -36.811 1.00 0.00 H new ATOM 0 HG3 ARG A 106 7.070 21.906 -37.043 1.00 0.00 H new ATOM 0 HD2 ARG A 106 6.023 20.424 -38.755 1.00 0.00 H new ATOM 0 HD3 ARG A 106 4.494 21.249 -38.529 1.00 0.00 H new ATOM 0 HE ARG A 106 6.793 22.201 -40.049 1.00 0.00 H new ATOM 0 HH11 ARG A 106 3.931 23.158 -38.217 1.00 0.00 H new ATOM 0 HH12 ARG A 106 3.767 24.703 -39.058 1.00 0.00 H new ATOM 0 HH21 ARG A 106 6.575 24.188 -41.125 1.00 0.00 H new ATOM 0 HH22 ARG A 106 5.257 25.284 -40.697 1.00 0.00 H new ATOM 1616 N HIS A 107 3.848 22.434 -34.282 1.00 0.00 N ATOM 1617 CA HIS A 107 3.087 23.646 -34.004 1.00 0.00 C ATOM 1618 C HIS A 107 3.510 24.260 -32.673 1.00 0.00 C ATOM 1619 O HIS A 107 3.671 25.475 -32.561 1.00 0.00 O ATOM 1620 CB HIS A 107 1.589 23.341 -33.985 1.00 0.00 C ATOM 1621 CG HIS A 107 0.740 24.526 -33.644 1.00 0.00 C ATOM 1622 ND1 HIS A 107 -0.283 24.977 -34.451 1.00 0.00 N ATOM 1623 CD2 HIS A 107 0.765 25.355 -32.574 1.00 0.00 C ATOM 1624 CE1 HIS A 107 -0.849 26.032 -33.893 1.00 0.00 C ATOM 1625 NE2 HIS A 107 -0.231 26.282 -32.753 1.00 0.00 N ATOM 0 H HIS A 107 3.276 21.605 -34.442 1.00 0.00 H new ATOM 0 HA HIS A 107 3.293 24.364 -34.797 1.00 0.00 H new ATOM 0 HB2 HIS A 107 1.292 22.961 -34.962 1.00 0.00 H new ATOM 0 HB3 HIS A 107 1.397 22.547 -33.263 1.00 0.00 H new ATOM 0 HD2 HIS A 107 1.443 25.297 -31.735 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -1.676 26.594 -34.300 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -0.457 27.041 -32.110 1.00 0.00 H new ATOM 1634 N VAL A 108 3.687 23.411 -31.665 1.00 0.00 N ATOM 1635 CA VAL A 108 4.092 23.869 -30.342 1.00 0.00 C ATOM 1636 C VAL A 108 5.407 24.636 -30.404 1.00 0.00 C ATOM 1637 O VAL A 108 5.508 25.757 -29.905 1.00 0.00 O ATOM 1638 CB VAL A 108 4.243 22.690 -29.362 1.00 0.00 C ATOM 1639 CG1 VAL A 108 4.732 23.181 -28.007 1.00 0.00 C ATOM 1640 CG2 VAL A 108 2.927 21.940 -29.223 1.00 0.00 C ATOM 0 H VAL A 108 3.556 22.402 -31.740 1.00 0.00 H new ATOM 0 HA VAL A 108 3.305 24.532 -29.982 1.00 0.00 H new ATOM 0 HB VAL A 108 4.987 22.001 -29.762 1.00 0.00 H new ATOM 0 HG11 VAL A 108 4.833 22.334 -27.328 1.00 0.00 H new ATOM 0 HG12 VAL A 108 5.700 23.669 -28.124 1.00 0.00 H new ATOM 0 HG13 VAL A 108 4.014 23.892 -27.597 1.00 0.00 H new ATOM 0 HG21 VAL A 108 3.053 21.111 -28.527 1.00 0.00 H new ATOM 0 HG22 VAL A 108 2.160 22.617 -28.846 1.00 0.00 H new ATOM 0 HG23 VAL A 108 2.624 21.554 -30.196 1.00 0.00 H new ATOM 1650 N MET A 109 6.414 24.025 -31.020 1.00 0.00 N ATOM 1651 CA MET A 109 7.724 24.653 -31.149 1.00 0.00 C ATOM 1652 C MET A 109 7.609 26.019 -31.818 1.00 0.00 C ATOM 1653 O MET A 109 8.060 27.028 -31.274 1.00 0.00 O ATOM 1654 CB MET A 109 8.666 23.756 -31.955 1.00 0.00 C ATOM 1655 CG MET A 109 9.151 22.538 -31.186 1.00 0.00 C ATOM 1656 SD MET A 109 10.540 22.911 -30.099 1.00 0.00 S ATOM 1657 CE MET A 109 9.719 22.968 -28.508 1.00 0.00 C ATOM 0 H MET A 109 6.348 23.097 -31.437 1.00 0.00 H new ATOM 0 HA MET A 109 8.133 24.791 -30.148 1.00 0.00 H new ATOM 0 HB2 MET A 109 8.154 23.425 -32.859 1.00 0.00 H new ATOM 0 HB3 MET A 109 9.528 24.342 -32.273 1.00 0.00 H new ATOM 0 HG2 MET A 109 8.329 22.136 -30.594 1.00 0.00 H new ATOM 0 HG3 MET A 109 9.445 21.761 -31.892 1.00 0.00 H new ATOM 0 HE1 MET A 109 10.442 23.225 -27.734 1.00 0.00 H new ATOM 0 HE2 MET A 109 8.931 23.721 -28.532 1.00 0.00 H new ATOM 0 HE3 MET A 109 9.283 21.993 -28.288 1.00 0.00 H new ATOM 1667 N THR A 110 7.003 26.046 -33.000 1.00 0.00 N ATOM 1668 CA THR A 110 6.830 27.288 -33.743 1.00 0.00 C ATOM 1669 C THR A 110 6.529 28.452 -32.806 1.00 0.00 C ATOM 1670 O THR A 110 7.189 29.488 -32.857 1.00 0.00 O ATOM 1671 CB THR A 110 5.695 27.170 -34.778 1.00 0.00 C ATOM 1672 OG1 THR A 110 5.943 26.064 -35.653 1.00 0.00 O ATOM 1673 CG2 THR A 110 5.571 28.449 -35.592 1.00 0.00 C ATOM 0 H THR A 110 6.623 25.221 -33.464 1.00 0.00 H new ATOM 0 HA THR A 110 7.768 27.478 -34.264 1.00 0.00 H new ATOM 0 HB THR A 110 4.760 27.006 -34.242 1.00 0.00 H new ATOM 0 HG1 THR A 110 5.755 25.226 -35.182 1.00 0.00 H new ATOM 0 HG21 THR A 110 4.763 28.342 -36.316 1.00 0.00 H new ATOM 0 HG22 THR A 110 5.354 29.284 -34.926 1.00 0.00 H new ATOM 0 HG23 THR A 110 6.507 28.638 -36.118 1.00 0.00 H new ATOM 1681 N ASN A 111 5.528 28.272 -31.950 1.00 0.00 N ATOM 1682 CA ASN A 111 5.140 29.309 -31.000 1.00 0.00 C ATOM 1683 C ASN A 111 6.368 29.936 -30.348 1.00 0.00 C ATOM 1684 O ASN A 111 6.478 31.159 -30.253 1.00 0.00 O ATOM 1685 CB ASN A 111 4.219 28.727 -29.926 1.00 0.00 C ATOM 1686 CG ASN A 111 2.764 28.721 -30.353 1.00 0.00 C ATOM 1687 OD1 ASN A 111 2.258 29.709 -30.887 1.00 0.00 O ATOM 1688 ND2 ASN A 111 2.083 27.606 -30.119 1.00 0.00 N ATOM 0 H ASN A 111 4.971 27.419 -31.895 1.00 0.00 H new ATOM 0 HA ASN A 111 4.604 30.086 -31.546 1.00 0.00 H new ATOM 0 HB2 ASN A 111 4.532 27.708 -29.696 1.00 0.00 H new ATOM 0 HB3 ASN A 111 4.323 29.307 -29.009 1.00 0.00 H new ATOM 0 HD21 ASN A 111 1.100 27.544 -30.384 1.00 0.00 H new ATOM 0 HD22 ASN A 111 2.543 26.812 -29.674 1.00 0.00 H new ATOM 1695 N LEU A 112 7.290 29.091 -29.899 1.00 0.00 N ATOM 1696 CA LEU A 112 8.511 29.561 -29.256 1.00 0.00 C ATOM 1697 C LEU A 112 8.990 30.866 -29.884 1.00 0.00 C ATOM 1698 O LEU A 112 9.393 31.793 -29.184 1.00 0.00 O ATOM 1699 CB LEU A 112 9.607 28.499 -29.359 1.00 0.00 C ATOM 1700 CG LEU A 112 9.377 27.217 -28.558 1.00 0.00 C ATOM 1701 CD1 LEU A 112 10.553 26.267 -28.722 1.00 0.00 C ATOM 1702 CD2 LEU A 112 9.151 27.540 -27.088 1.00 0.00 C ATOM 0 H LEU A 112 7.214 28.076 -29.969 1.00 0.00 H new ATOM 0 HA LEU A 112 8.290 29.745 -28.205 1.00 0.00 H new ATOM 0 HB2 LEU A 112 9.728 28.231 -30.409 1.00 0.00 H new ATOM 0 HB3 LEU A 112 10.547 28.943 -29.033 1.00 0.00 H new ATOM 0 HG LEU A 112 8.483 26.726 -28.943 1.00 0.00 H new ATOM 0 HD11 LEU A 112 10.372 25.360 -28.145 1.00 0.00 H new ATOM 0 HD12 LEU A 112 10.669 26.010 -29.775 1.00 0.00 H new ATOM 0 HD13 LEU A 112 11.463 26.749 -28.364 1.00 0.00 H new ATOM 0 HD21 LEU A 112 8.989 26.616 -26.533 1.00 0.00 H new ATOM 0 HD22 LEU A 112 10.026 28.054 -26.690 1.00 0.00 H new ATOM 0 HD23 LEU A 112 8.276 28.182 -26.987 1.00 0.00 H new ATOM 1714 N GLY A 113 8.942 30.930 -31.212 1.00 0.00 N ATOM 1715 CA GLY A 113 9.372 32.126 -31.913 1.00 0.00 C ATOM 1716 C GLY A 113 10.114 31.810 -33.196 1.00 0.00 C ATOM 1717 O GLY A 113 9.964 32.512 -34.196 1.00 0.00 O ATOM 0 H GLY A 113 8.613 30.175 -31.814 1.00 0.00 H new ATOM 0 HA2 GLY A 113 8.502 32.742 -32.142 1.00 0.00 H new ATOM 0 HA3 GLY A 113 10.016 32.715 -31.260 1.00 0.00 H new ATOM 1721 N GLU A 114 10.919 30.752 -33.168 1.00 0.00 N ATOM 1722 CA GLU A 114 11.689 30.347 -34.338 1.00 0.00 C ATOM 1723 C GLU A 114 10.800 29.641 -35.357 1.00 0.00 C ATOM 1724 O GLU A 114 9.860 28.933 -34.994 1.00 0.00 O ATOM 1725 CB GLU A 114 12.840 29.427 -33.925 1.00 0.00 C ATOM 1726 CG GLU A 114 13.799 30.061 -32.931 1.00 0.00 C ATOM 1727 CD GLU A 114 14.709 31.090 -33.573 1.00 0.00 C ATOM 1728 OE1 GLU A 114 14.316 32.274 -33.633 1.00 0.00 O ATOM 1729 OE2 GLU A 114 15.814 30.712 -34.016 1.00 0.00 O ATOM 0 H GLU A 114 11.055 30.160 -32.348 1.00 0.00 H new ATOM 0 HA GLU A 114 12.099 31.245 -34.800 1.00 0.00 H new ATOM 0 HB2 GLU A 114 12.428 28.517 -33.490 1.00 0.00 H new ATOM 0 HB3 GLU A 114 13.395 29.132 -34.815 1.00 0.00 H new ATOM 0 HG2 GLU A 114 13.228 30.534 -32.132 1.00 0.00 H new ATOM 0 HG3 GLU A 114 14.406 29.282 -32.470 1.00 0.00 H new ATOM 1736 N LYS A 115 11.103 29.839 -36.636 1.00 0.00 N ATOM 1737 CA LYS A 115 10.333 29.222 -37.709 1.00 0.00 C ATOM 1738 C LYS A 115 10.894 27.848 -38.060 1.00 0.00 C ATOM 1739 O LYS A 115 11.959 27.738 -38.669 1.00 0.00 O ATOM 1740 CB LYS A 115 10.339 30.119 -38.949 1.00 0.00 C ATOM 1741 CG LYS A 115 9.354 31.272 -38.871 1.00 0.00 C ATOM 1742 CD LYS A 115 9.811 32.455 -39.707 1.00 0.00 C ATOM 1743 CE LYS A 115 10.969 33.189 -39.049 1.00 0.00 C ATOM 1744 NZ LYS A 115 10.537 33.928 -37.830 1.00 0.00 N ATOM 0 H LYS A 115 11.877 30.422 -36.954 1.00 0.00 H new ATOM 0 HA LYS A 115 9.307 29.098 -37.362 1.00 0.00 H new ATOM 0 HB2 LYS A 115 11.343 30.519 -39.093 1.00 0.00 H new ATOM 0 HB3 LYS A 115 10.108 29.514 -39.826 1.00 0.00 H new ATOM 0 HG2 LYS A 115 8.375 30.939 -39.215 1.00 0.00 H new ATOM 0 HG3 LYS A 115 9.238 31.583 -37.833 1.00 0.00 H new ATOM 0 HD2 LYS A 115 10.113 32.108 -40.695 1.00 0.00 H new ATOM 0 HD3 LYS A 115 8.978 33.143 -39.852 1.00 0.00 H new ATOM 0 HE2 LYS A 115 11.748 32.474 -38.783 1.00 0.00 H new ATOM 0 HE3 LYS A 115 11.407 33.888 -39.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 11.274 34.609 -37.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 9.652 34.437 -38.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 10.383 33.255 -37.052 1.00 0.00 H new ATOM 1758 N LEU A 116 10.170 26.803 -37.675 1.00 0.00 N ATOM 1759 CA LEU A 116 10.595 25.434 -37.951 1.00 0.00 C ATOM 1760 C LEU A 116 9.657 24.764 -38.950 1.00 0.00 C ATOM 1761 O LEU A 116 8.469 25.080 -39.012 1.00 0.00 O ATOM 1762 CB LEU A 116 10.642 24.623 -36.655 1.00 0.00 C ATOM 1763 CG LEU A 116 11.544 25.175 -35.550 1.00 0.00 C ATOM 1764 CD1 LEU A 116 11.346 24.394 -34.260 1.00 0.00 C ATOM 1765 CD2 LEU A 116 13.002 25.136 -35.982 1.00 0.00 C ATOM 0 H LEU A 116 9.286 26.877 -37.171 1.00 0.00 H new ATOM 0 HA LEU A 116 11.594 25.470 -38.386 1.00 0.00 H new ATOM 0 HB2 LEU A 116 9.628 24.543 -36.263 1.00 0.00 H new ATOM 0 HB3 LEU A 116 10.972 23.612 -36.894 1.00 0.00 H new ATOM 0 HG LEU A 116 11.269 26.214 -35.367 1.00 0.00 H new ATOM 0 HD11 LEU A 116 11.996 24.801 -33.485 1.00 0.00 H new ATOM 0 HD12 LEU A 116 10.307 24.475 -33.942 1.00 0.00 H new ATOM 0 HD13 LEU A 116 11.593 23.346 -34.428 1.00 0.00 H new ATOM 0 HD21 LEU A 116 13.629 25.533 -35.183 1.00 0.00 H new ATOM 0 HD22 LEU A 116 13.291 24.107 -36.193 1.00 0.00 H new ATOM 0 HD23 LEU A 116 13.132 25.741 -36.879 1.00 0.00 H new ATOM 1777 N THR A 117 10.199 23.834 -39.730 1.00 0.00 N ATOM 1778 CA THR A 117 9.412 23.118 -40.726 1.00 0.00 C ATOM 1779 C THR A 117 9.536 21.609 -40.543 1.00 0.00 C ATOM 1780 O THR A 117 10.423 21.131 -39.837 1.00 0.00 O ATOM 1781 CB THR A 117 9.845 23.488 -42.157 1.00 0.00 C ATOM 1782 OG1 THR A 117 11.247 23.251 -42.321 1.00 0.00 O ATOM 1783 CG2 THR A 117 9.532 24.946 -42.457 1.00 0.00 C ATOM 0 H THR A 117 11.180 23.559 -39.691 1.00 0.00 H new ATOM 0 HA THR A 117 8.373 23.415 -40.581 1.00 0.00 H new ATOM 0 HB THR A 117 9.288 22.863 -42.855 1.00 0.00 H new ATOM 0 HG1 THR A 117 11.514 23.487 -43.234 1.00 0.00 H new ATOM 0 HG21 THR A 117 9.847 25.184 -43.473 1.00 0.00 H new ATOM 0 HG22 THR A 117 8.460 25.115 -42.360 1.00 0.00 H new ATOM 0 HG23 THR A 117 10.065 25.585 -41.753 1.00 0.00 H new ATOM 1791 N ASP A 118 8.641 20.865 -41.184 1.00 0.00 N ATOM 1792 CA ASP A 118 8.652 19.410 -41.094 1.00 0.00 C ATOM 1793 C ASP A 118 10.080 18.875 -41.111 1.00 0.00 C ATOM 1794 O ASP A 118 10.372 17.841 -40.511 1.00 0.00 O ATOM 1795 CB ASP A 118 7.853 18.800 -42.247 1.00 0.00 C ATOM 1796 CG ASP A 118 7.220 17.473 -41.875 1.00 0.00 C ATOM 1797 OD1 ASP A 118 7.894 16.432 -42.025 1.00 0.00 O ATOM 1798 OD2 ASP A 118 6.052 17.476 -41.434 1.00 0.00 O ATOM 0 H ASP A 118 7.899 21.246 -41.771 1.00 0.00 H new ATOM 0 HA ASP A 118 8.188 19.126 -40.150 1.00 0.00 H new ATOM 0 HB2 ASP A 118 7.074 19.497 -42.554 1.00 0.00 H new ATOM 0 HB3 ASP A 118 8.510 18.658 -43.105 1.00 0.00 H new ATOM 1803 N GLU A 119 10.966 19.586 -41.802 1.00 0.00 N ATOM 1804 CA GLU A 119 12.363 19.180 -41.897 1.00 0.00 C ATOM 1805 C GLU A 119 13.063 19.319 -40.548 1.00 0.00 C ATOM 1806 O GLU A 119 13.667 18.369 -40.051 1.00 0.00 O ATOM 1807 CB GLU A 119 13.090 20.020 -42.950 1.00 0.00 C ATOM 1808 CG GLU A 119 12.599 19.777 -44.367 1.00 0.00 C ATOM 1809 CD GLU A 119 12.627 18.311 -44.751 1.00 0.00 C ATOM 1810 OE1 GLU A 119 13.727 17.719 -44.758 1.00 0.00 O ATOM 1811 OE2 GLU A 119 11.548 17.754 -45.046 1.00 0.00 O ATOM 0 H GLU A 119 10.741 20.445 -42.304 1.00 0.00 H new ATOM 0 HA GLU A 119 12.391 18.132 -42.195 1.00 0.00 H new ATOM 0 HB2 GLU A 119 12.968 21.076 -42.708 1.00 0.00 H new ATOM 0 HB3 GLU A 119 14.157 19.803 -42.902 1.00 0.00 H new ATOM 0 HG2 GLU A 119 11.581 20.155 -44.465 1.00 0.00 H new ATOM 0 HG3 GLU A 119 13.217 20.343 -45.064 1.00 0.00 H new ATOM 1818 N GLU A 120 12.976 20.509 -39.963 1.00 0.00 N ATOM 1819 CA GLU A 120 13.602 20.772 -38.672 1.00 0.00 C ATOM 1820 C GLU A 120 13.128 19.771 -37.623 1.00 0.00 C ATOM 1821 O GLU A 120 13.936 19.139 -36.942 1.00 0.00 O ATOM 1822 CB GLU A 120 13.291 22.197 -38.210 1.00 0.00 C ATOM 1823 CG GLU A 120 13.764 23.268 -39.179 1.00 0.00 C ATOM 1824 CD GLU A 120 15.184 23.037 -39.656 1.00 0.00 C ATOM 1825 OE1 GLU A 120 16.075 22.851 -38.801 1.00 0.00 O ATOM 1826 OE2 GLU A 120 15.405 23.043 -40.886 1.00 0.00 O ATOM 0 H GLU A 120 12.479 21.306 -40.361 1.00 0.00 H new ATOM 0 HA GLU A 120 14.680 20.664 -38.792 1.00 0.00 H new ATOM 0 HB2 GLU A 120 12.215 22.297 -38.068 1.00 0.00 H new ATOM 0 HB3 GLU A 120 13.758 22.365 -37.239 1.00 0.00 H new ATOM 0 HG2 GLU A 120 13.096 23.295 -40.040 1.00 0.00 H new ATOM 0 HG3 GLU A 120 13.701 24.243 -38.696 1.00 0.00 H new ATOM 1833 N VAL A 121 11.812 19.631 -37.499 1.00 0.00 N ATOM 1834 CA VAL A 121 11.229 18.707 -36.534 1.00 0.00 C ATOM 1835 C VAL A 121 11.607 17.265 -36.856 1.00 0.00 C ATOM 1836 O VAL A 121 11.934 16.484 -35.962 1.00 0.00 O ATOM 1837 CB VAL A 121 9.694 18.827 -36.497 1.00 0.00 C ATOM 1838 CG1 VAL A 121 9.089 17.699 -35.676 1.00 0.00 C ATOM 1839 CG2 VAL A 121 9.280 20.182 -35.944 1.00 0.00 C ATOM 0 H VAL A 121 11.129 20.146 -38.055 1.00 0.00 H new ATOM 0 HA VAL A 121 11.630 18.976 -35.557 1.00 0.00 H new ATOM 0 HB VAL A 121 9.316 18.745 -37.516 1.00 0.00 H new ATOM 0 HG11 VAL A 121 8.004 17.801 -35.662 1.00 0.00 H new ATOM 0 HG12 VAL A 121 9.358 16.741 -36.121 1.00 0.00 H new ATOM 0 HG13 VAL A 121 9.471 17.746 -34.656 1.00 0.00 H new ATOM 0 HG21 VAL A 121 8.192 20.250 -35.925 1.00 0.00 H new ATOM 0 HG22 VAL A 121 9.669 20.296 -34.932 1.00 0.00 H new ATOM 0 HG23 VAL A 121 9.682 20.972 -36.578 1.00 0.00 H new ATOM 1849 N ASP A 122 11.561 16.920 -38.138 1.00 0.00 N ATOM 1850 CA ASP A 122 11.900 15.572 -38.579 1.00 0.00 C ATOM 1851 C ASP A 122 13.175 15.082 -37.899 1.00 0.00 C ATOM 1852 O ASP A 122 13.238 13.950 -37.420 1.00 0.00 O ATOM 1853 CB ASP A 122 12.073 15.538 -40.098 1.00 0.00 C ATOM 1854 CG ASP A 122 10.771 15.260 -40.823 1.00 0.00 C ATOM 1855 OD1 ASP A 122 9.947 14.488 -40.288 1.00 0.00 O ATOM 1856 OD2 ASP A 122 10.575 15.814 -41.924 1.00 0.00 O ATOM 0 H ASP A 122 11.292 17.555 -38.890 1.00 0.00 H new ATOM 0 HA ASP A 122 11.082 14.908 -38.299 1.00 0.00 H new ATOM 0 HB2 ASP A 122 12.477 16.492 -40.436 1.00 0.00 H new ATOM 0 HB3 ASP A 122 12.802 14.772 -40.361 1.00 0.00 H new ATOM 1861 N GLU A 123 14.188 15.942 -37.861 1.00 0.00 N ATOM 1862 CA GLU A 123 15.461 15.595 -37.242 1.00 0.00 C ATOM 1863 C GLU A 123 15.272 15.244 -35.769 1.00 0.00 C ATOM 1864 O GLU A 123 15.993 14.411 -35.221 1.00 0.00 O ATOM 1865 CB GLU A 123 16.452 16.754 -37.377 1.00 0.00 C ATOM 1866 CG GLU A 123 17.258 16.718 -38.665 1.00 0.00 C ATOM 1867 CD GLU A 123 18.531 15.905 -38.534 1.00 0.00 C ATOM 1868 OE1 GLU A 123 19.243 16.075 -37.523 1.00 0.00 O ATOM 1869 OE2 GLU A 123 18.815 15.098 -39.445 1.00 0.00 O ATOM 0 H GLU A 123 14.151 16.884 -38.252 1.00 0.00 H new ATOM 0 HA GLU A 123 15.860 14.722 -37.758 1.00 0.00 H new ATOM 0 HB2 GLU A 123 15.906 17.696 -37.326 1.00 0.00 H new ATOM 0 HB3 GLU A 123 17.137 16.736 -36.529 1.00 0.00 H new ATOM 0 HG2 GLU A 123 16.644 16.299 -39.462 1.00 0.00 H new ATOM 0 HG3 GLU A 123 17.511 17.737 -38.960 1.00 0.00 H new ATOM 1876 N MET A 124 14.296 15.886 -35.134 1.00 0.00 N ATOM 1877 CA MET A 124 14.011 15.640 -33.725 1.00 0.00 C ATOM 1878 C MET A 124 13.263 14.324 -33.543 1.00 0.00 C ATOM 1879 O MET A 124 13.634 13.499 -32.708 1.00 0.00 O ATOM 1880 CB MET A 124 13.190 16.792 -33.141 1.00 0.00 C ATOM 1881 CG MET A 124 12.664 16.514 -31.742 1.00 0.00 C ATOM 1882 SD MET A 124 12.432 18.019 -30.776 1.00 0.00 S ATOM 1883 CE MET A 124 11.667 17.358 -29.298 1.00 0.00 C ATOM 0 H MET A 124 13.690 16.580 -35.572 1.00 0.00 H new ATOM 0 HA MET A 124 14.961 15.573 -33.194 1.00 0.00 H new ATOM 0 HB2 MET A 124 13.806 17.691 -33.117 1.00 0.00 H new ATOM 0 HB3 MET A 124 12.349 17.000 -33.802 1.00 0.00 H new ATOM 0 HG2 MET A 124 11.715 15.983 -31.814 1.00 0.00 H new ATOM 0 HG3 MET A 124 13.359 15.856 -31.221 1.00 0.00 H new ATOM 0 HE1 MET A 124 12.132 17.802 -28.418 1.00 0.00 H new ATOM 0 HE2 MET A 124 10.603 17.593 -29.303 1.00 0.00 H new ATOM 0 HE3 MET A 124 11.800 16.276 -29.272 1.00 0.00 H new ATOM 1893 N ILE A 125 12.208 14.134 -34.329 1.00 0.00 N ATOM 1894 CA ILE A 125 11.409 12.917 -34.255 1.00 0.00 C ATOM 1895 C ILE A 125 12.279 11.677 -34.428 1.00 0.00 C ATOM 1896 O ILE A 125 12.017 10.634 -33.829 1.00 0.00 O ATOM 1897 CB ILE A 125 10.299 12.906 -35.322 1.00 0.00 C ATOM 1898 CG1 ILE A 125 9.349 14.087 -35.114 1.00 0.00 C ATOM 1899 CG2 ILE A 125 9.536 11.590 -35.279 1.00 0.00 C ATOM 1900 CD1 ILE A 125 8.449 13.932 -33.907 1.00 0.00 C ATOM 0 H ILE A 125 11.887 14.808 -35.024 1.00 0.00 H new ATOM 0 HA ILE A 125 10.950 12.900 -33.266 1.00 0.00 H new ATOM 0 HB ILE A 125 10.759 13.004 -36.305 1.00 0.00 H new ATOM 0 HG12 ILE A 125 9.935 15.000 -35.006 1.00 0.00 H new ATOM 0 HG13 ILE A 125 8.732 14.208 -36.004 1.00 0.00 H new ATOM 0 HG21 ILE A 125 8.755 11.597 -36.039 1.00 0.00 H new ATOM 0 HG22 ILE A 125 10.222 10.765 -35.472 1.00 0.00 H new ATOM 0 HG23 ILE A 125 9.084 11.463 -34.295 1.00 0.00 H new ATOM 0 HD11 ILE A 125 7.803 14.805 -33.821 1.00 0.00 H new ATOM 0 HD12 ILE A 125 7.837 13.037 -34.022 1.00 0.00 H new ATOM 0 HD13 ILE A 125 9.059 13.841 -33.008 1.00 0.00 H new ATOM 1912 N ARG A 126 13.316 11.799 -35.250 1.00 0.00 N ATOM 1913 CA ARG A 126 14.226 10.687 -35.503 1.00 0.00 C ATOM 1914 C ARG A 126 15.244 10.552 -34.374 1.00 0.00 C ATOM 1915 O ARG A 126 16.258 9.870 -34.520 1.00 0.00 O ATOM 1916 CB ARG A 126 14.949 10.885 -36.836 1.00 0.00 C ATOM 1917 CG ARG A 126 16.022 11.960 -36.793 1.00 0.00 C ATOM 1918 CD ARG A 126 16.945 11.875 -37.999 1.00 0.00 C ATOM 1919 NE ARG A 126 17.645 10.594 -38.062 1.00 0.00 N ATOM 1920 CZ ARG A 126 18.324 10.180 -39.126 1.00 0.00 C ATOM 1921 NH1 ARG A 126 18.394 10.941 -40.209 1.00 0.00 N ATOM 1922 NH2 ARG A 126 18.935 9.002 -39.107 1.00 0.00 N ATOM 0 H ARG A 126 13.547 12.656 -35.752 1.00 0.00 H new ATOM 0 HA ARG A 126 13.637 9.771 -35.550 1.00 0.00 H new ATOM 0 HB2 ARG A 126 15.404 9.941 -37.136 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.218 11.144 -37.601 1.00 0.00 H new ATOM 0 HG2 ARG A 126 15.552 12.943 -36.762 1.00 0.00 H new ATOM 0 HG3 ARG A 126 16.606 11.856 -35.879 1.00 0.00 H new ATOM 0 HD2 ARG A 126 16.365 12.016 -38.911 1.00 0.00 H new ATOM 0 HD3 ARG A 126 17.673 12.685 -37.956 1.00 0.00 H new ATOM 0 HE ARG A 126 17.610 9.985 -37.245 1.00 0.00 H new ATOM 0 HH11 ARG A 126 17.926 11.847 -40.227 1.00 0.00 H new ATOM 0 HH12 ARG A 126 18.916 10.621 -41.025 1.00 0.00 H new ATOM 0 HH21 ARG A 126 18.883 8.414 -38.275 1.00 0.00 H new ATOM 0 HH22 ARG A 126 19.456 8.685 -39.924 1.00 0.00 H new ATOM 1936 N GLU A 127 14.966 11.205 -33.251 1.00 0.00 N ATOM 1937 CA GLU A 127 15.859 11.158 -32.099 1.00 0.00 C ATOM 1938 C GLU A 127 15.171 10.505 -30.904 1.00 0.00 C ATOM 1939 O GLU A 127 15.803 9.796 -30.122 1.00 0.00 O ATOM 1940 CB GLU A 127 16.322 12.568 -31.727 1.00 0.00 C ATOM 1941 CG GLU A 127 17.684 12.603 -31.053 1.00 0.00 C ATOM 1942 CD GLU A 127 17.850 13.799 -30.136 1.00 0.00 C ATOM 1943 OE1 GLU A 127 17.466 13.696 -28.952 1.00 0.00 O ATOM 1944 OE2 GLU A 127 18.363 14.838 -30.601 1.00 0.00 O ATOM 0 H GLU A 127 14.130 11.773 -33.114 1.00 0.00 H new ATOM 0 HA GLU A 127 16.728 10.558 -32.369 1.00 0.00 H new ATOM 0 HB2 GLU A 127 16.356 13.180 -32.628 1.00 0.00 H new ATOM 0 HB3 GLU A 127 15.585 13.020 -31.063 1.00 0.00 H new ATOM 0 HG2 GLU A 127 17.825 11.687 -30.479 1.00 0.00 H new ATOM 0 HG3 GLU A 127 18.462 12.624 -31.816 1.00 0.00 H new ATOM 1951 N ALA A 128 13.872 10.750 -30.770 1.00 0.00 N ATOM 1952 CA ALA A 128 13.097 10.185 -29.671 1.00 0.00 C ATOM 1953 C ALA A 128 12.165 9.084 -30.166 1.00 0.00 C ATOM 1954 O ALA A 128 11.924 8.101 -29.466 1.00 0.00 O ATOM 1955 CB ALA A 128 12.302 11.277 -28.970 1.00 0.00 C ATOM 0 H ALA A 128 13.334 11.336 -31.408 1.00 0.00 H new ATOM 0 HA ALA A 128 13.793 9.743 -28.958 1.00 0.00 H new ATOM 0 HB1 ALA A 128 11.728 10.841 -28.152 1.00 0.00 H new ATOM 0 HB2 ALA A 128 12.986 12.028 -28.574 1.00 0.00 H new ATOM 0 HB3 ALA A 128 11.622 11.745 -29.681 1.00 0.00 H new ATOM 1961 N ASP A 129 11.644 9.257 -31.376 1.00 0.00 N ATOM 1962 CA ASP A 129 10.738 8.277 -31.965 1.00 0.00 C ATOM 1963 C ASP A 129 11.356 6.883 -31.942 1.00 0.00 C ATOM 1964 O ASP A 129 12.194 6.551 -32.781 1.00 0.00 O ATOM 1965 CB ASP A 129 10.390 8.671 -33.401 1.00 0.00 C ATOM 1966 CG ASP A 129 9.299 7.800 -33.992 1.00 0.00 C ATOM 1967 OD1 ASP A 129 8.527 7.205 -33.212 1.00 0.00 O ATOM 1968 OD2 ASP A 129 9.218 7.712 -35.236 1.00 0.00 O ATOM 0 H ASP A 129 11.833 10.066 -31.968 1.00 0.00 H new ATOM 0 HA ASP A 129 9.825 8.259 -31.370 1.00 0.00 H new ATOM 0 HB2 ASP A 129 10.070 9.713 -33.421 1.00 0.00 H new ATOM 0 HB3 ASP A 129 11.284 8.600 -34.021 1.00 0.00 H new ATOM 1973 N ILE A 130 10.938 6.072 -30.976 1.00 0.00 N ATOM 1974 CA ILE A 130 11.451 4.714 -30.844 1.00 0.00 C ATOM 1975 C ILE A 130 10.744 3.763 -31.804 1.00 0.00 C ATOM 1976 O ILE A 130 11.376 3.147 -32.662 1.00 0.00 O ATOM 1977 CB ILE A 130 11.289 4.187 -29.406 1.00 0.00 C ATOM 1978 CG1 ILE A 130 11.880 5.183 -28.406 1.00 0.00 C ATOM 1979 CG2 ILE A 130 11.953 2.826 -29.262 1.00 0.00 C ATOM 1980 CD1 ILE A 130 13.377 5.354 -28.536 1.00 0.00 C ATOM 0 H ILE A 130 10.246 6.332 -30.273 1.00 0.00 H new ATOM 0 HA ILE A 130 12.512 4.753 -31.090 1.00 0.00 H new ATOM 0 HB ILE A 130 10.226 4.074 -29.193 1.00 0.00 H new ATOM 0 HG12 ILE A 130 11.399 6.151 -28.543 1.00 0.00 H new ATOM 0 HG13 ILE A 130 11.647 4.851 -27.394 1.00 0.00 H new ATOM 0 HG21 ILE A 130 11.830 2.467 -28.240 1.00 0.00 H new ATOM 0 HG22 ILE A 130 11.491 2.121 -29.952 1.00 0.00 H new ATOM 0 HG23 ILE A 130 13.015 2.913 -29.490 1.00 0.00 H new ATOM 0 HD11 ILE A 130 13.727 6.074 -27.796 1.00 0.00 H new ATOM 0 HD12 ILE A 130 13.869 4.395 -28.370 1.00 0.00 H new ATOM 0 HD13 ILE A 130 13.616 5.716 -29.536 1.00 0.00 H new ATOM 1992 N ASP A 131 9.429 3.651 -31.654 1.00 0.00 N ATOM 1993 CA ASP A 131 8.633 2.778 -32.509 1.00 0.00 C ATOM 1994 C ASP A 131 8.946 3.027 -33.982 1.00 0.00 C ATOM 1995 O ASP A 131 9.142 2.089 -34.753 1.00 0.00 O ATOM 1996 CB ASP A 131 7.142 2.993 -32.249 1.00 0.00 C ATOM 1997 CG ASP A 131 6.814 4.437 -31.924 1.00 0.00 C ATOM 1998 OD1 ASP A 131 7.099 5.314 -32.766 1.00 0.00 O ATOM 1999 OD2 ASP A 131 6.272 4.691 -30.827 1.00 0.00 O ATOM 0 H ASP A 131 8.891 4.154 -30.948 1.00 0.00 H new ATOM 0 HA ASP A 131 8.890 1.746 -32.270 1.00 0.00 H new ATOM 0 HB2 ASP A 131 6.575 2.683 -33.127 1.00 0.00 H new ATOM 0 HB3 ASP A 131 6.825 2.356 -31.423 1.00 0.00 H new ATOM 2004 N GLY A 132 8.990 4.300 -34.365 1.00 0.00 N ATOM 2005 CA GLY A 132 9.279 4.650 -35.743 1.00 0.00 C ATOM 2006 C GLY A 132 8.022 4.902 -36.552 1.00 0.00 C ATOM 2007 O GLY A 132 7.901 4.436 -37.685 1.00 0.00 O ATOM 0 H GLY A 132 8.831 5.094 -33.745 1.00 0.00 H new ATOM 0 HA2 GLY A 132 9.906 5.541 -35.765 1.00 0.00 H new ATOM 0 HA3 GLY A 132 9.851 3.846 -36.207 1.00 0.00 H new ATOM 2011 N ASP A 133 7.083 5.639 -35.970 1.00 0.00 N ATOM 2012 CA ASP A 133 5.828 5.951 -36.644 1.00 0.00 C ATOM 2013 C ASP A 133 5.643 7.460 -36.776 1.00 0.00 C ATOM 2014 O ASP A 133 4.550 7.938 -37.077 1.00 0.00 O ATOM 2015 CB ASP A 133 4.650 5.346 -35.880 1.00 0.00 C ATOM 2016 CG ASP A 133 4.737 5.595 -34.387 1.00 0.00 C ATOM 2017 OD1 ASP A 133 5.440 6.546 -33.985 1.00 0.00 O ATOM 2018 OD2 ASP A 133 4.103 4.840 -33.621 1.00 0.00 O ATOM 0 H ASP A 133 7.167 6.032 -35.032 1.00 0.00 H new ATOM 0 HA ASP A 133 5.864 5.518 -37.644 1.00 0.00 H new ATOM 0 HB2 ASP A 133 3.719 5.766 -36.262 1.00 0.00 H new ATOM 0 HB3 ASP A 133 4.614 4.272 -36.065 1.00 0.00 H new ATOM 2023 N GLY A 134 6.720 8.206 -36.546 1.00 0.00 N ATOM 2024 CA GLY A 134 6.655 9.652 -36.643 1.00 0.00 C ATOM 2025 C GLY A 134 5.920 10.279 -35.475 1.00 0.00 C ATOM 2026 O GLY A 134 5.324 11.347 -35.610 1.00 0.00 O ATOM 0 H GLY A 134 7.636 7.834 -36.294 1.00 0.00 H new ATOM 0 HA2 GLY A 134 7.666 10.056 -36.691 1.00 0.00 H new ATOM 0 HA3 GLY A 134 6.157 9.929 -37.572 1.00 0.00 H new ATOM 2030 N GLN A 135 5.961 9.613 -34.326 1.00 0.00 N ATOM 2031 CA GLN A 135 5.292 10.111 -33.130 1.00 0.00 C ATOM 2032 C GLN A 135 6.222 10.055 -31.923 1.00 0.00 C ATOM 2033 O GLN A 135 7.221 9.335 -31.927 1.00 0.00 O ATOM 2034 CB GLN A 135 4.027 9.297 -32.852 1.00 0.00 C ATOM 2035 CG GLN A 135 3.135 9.123 -34.071 1.00 0.00 C ATOM 2036 CD GLN A 135 1.670 8.986 -33.707 1.00 0.00 C ATOM 2037 OE1 GLN A 135 1.042 9.937 -33.241 1.00 0.00 O ATOM 2038 NE2 GLN A 135 1.116 7.798 -33.919 1.00 0.00 N ATOM 0 H GLN A 135 6.450 8.727 -34.198 1.00 0.00 H new ATOM 0 HA GLN A 135 5.016 11.151 -33.305 1.00 0.00 H new ATOM 0 HB2 GLN A 135 4.313 8.314 -32.478 1.00 0.00 H new ATOM 0 HB3 GLN A 135 3.457 9.786 -32.062 1.00 0.00 H new ATOM 0 HG2 GLN A 135 3.262 9.978 -34.735 1.00 0.00 H new ATOM 0 HG3 GLN A 135 3.452 8.240 -34.625 1.00 0.00 H new ATOM 0 HE21 GLN A 135 1.674 7.037 -34.307 1.00 0.00 H new ATOM 0 HE22 GLN A 135 0.133 7.646 -33.694 1.00 0.00 H new ATOM 2047 N VAL A 136 5.888 10.821 -30.889 1.00 0.00 N ATOM 2048 CA VAL A 136 6.693 10.859 -29.673 1.00 0.00 C ATOM 2049 C VAL A 136 5.814 10.781 -28.430 1.00 0.00 C ATOM 2050 O VAL A 136 5.435 11.804 -27.861 1.00 0.00 O ATOM 2051 CB VAL A 136 7.547 12.139 -29.606 1.00 0.00 C ATOM 2052 CG1 VAL A 136 8.384 12.155 -28.336 1.00 0.00 C ATOM 2053 CG2 VAL A 136 8.431 12.254 -30.838 1.00 0.00 C ATOM 0 H VAL A 136 5.065 11.424 -30.869 1.00 0.00 H new ATOM 0 HA VAL A 136 7.353 9.992 -29.702 1.00 0.00 H new ATOM 0 HB VAL A 136 6.880 13.001 -29.584 1.00 0.00 H new ATOM 0 HG11 VAL A 136 8.981 13.066 -28.305 1.00 0.00 H new ATOM 0 HG12 VAL A 136 7.727 12.122 -27.467 1.00 0.00 H new ATOM 0 HG13 VAL A 136 9.045 11.288 -28.325 1.00 0.00 H new ATOM 0 HG21 VAL A 136 9.028 13.164 -30.774 1.00 0.00 H new ATOM 0 HG22 VAL A 136 9.093 11.390 -30.893 1.00 0.00 H new ATOM 0 HG23 VAL A 136 7.807 12.291 -31.731 1.00 0.00 H new ATOM 2063 N ASN A 137 5.494 9.560 -28.013 1.00 0.00 N ATOM 2064 CA ASN A 137 4.660 9.348 -26.836 1.00 0.00 C ATOM 2065 C ASN A 137 5.398 9.758 -25.565 1.00 0.00 C ATOM 2066 O ASN A 137 6.534 10.228 -25.619 1.00 0.00 O ATOM 2067 CB ASN A 137 4.236 7.881 -26.743 1.00 0.00 C ATOM 2068 CG ASN A 137 5.386 6.929 -27.013 1.00 0.00 C ATOM 2069 OD1 ASN A 137 5.745 6.684 -28.165 1.00 0.00 O ATOM 2070 ND2 ASN A 137 5.968 6.388 -25.950 1.00 0.00 N ATOM 0 H ASN A 137 5.800 8.703 -28.473 1.00 0.00 H new ATOM 0 HA ASN A 137 3.771 9.970 -26.935 1.00 0.00 H new ATOM 0 HB2 ASN A 137 3.831 7.685 -25.750 1.00 0.00 H new ATOM 0 HB3 ASN A 137 3.435 7.691 -27.457 1.00 0.00 H new ATOM 0 HD21 ASN A 137 6.747 5.740 -26.069 1.00 0.00 H new ATOM 0 HD22 ASN A 137 5.637 6.620 -25.014 1.00 0.00 H new ATOM 2077 N TYR A 138 4.744 9.576 -24.423 1.00 0.00 N ATOM 2078 CA TYR A 138 5.337 9.928 -23.139 1.00 0.00 C ATOM 2079 C TYR A 138 6.710 9.283 -22.977 1.00 0.00 C ATOM 2080 O TYR A 138 7.698 9.963 -22.701 1.00 0.00 O ATOM 2081 CB TYR A 138 4.420 9.493 -21.994 1.00 0.00 C ATOM 2082 CG TYR A 138 5.073 9.569 -20.633 1.00 0.00 C ATOM 2083 CD1 TYR A 138 5.248 10.790 -19.992 1.00 0.00 C ATOM 2084 CD2 TYR A 138 5.516 8.421 -19.988 1.00 0.00 C ATOM 2085 CE1 TYR A 138 5.845 10.864 -18.748 1.00 0.00 C ATOM 2086 CE2 TYR A 138 6.113 8.486 -18.744 1.00 0.00 C ATOM 2087 CZ TYR A 138 6.275 9.709 -18.128 1.00 0.00 C ATOM 2088 OH TYR A 138 6.871 9.778 -16.889 1.00 0.00 O ATOM 0 H TYR A 138 3.803 9.187 -24.361 1.00 0.00 H new ATOM 0 HA TYR A 138 5.458 11.011 -23.109 1.00 0.00 H new ATOM 0 HB2 TYR A 138 3.529 10.120 -21.995 1.00 0.00 H new ATOM 0 HB3 TYR A 138 4.090 8.470 -22.173 1.00 0.00 H new ATOM 0 HD1 TYR A 138 4.912 11.696 -20.474 1.00 0.00 H new ATOM 0 HD2 TYR A 138 5.391 7.461 -20.467 1.00 0.00 H new ATOM 0 HE1 TYR A 138 5.974 11.821 -18.264 1.00 0.00 H new ATOM 0 HE2 TYR A 138 6.451 7.584 -18.256 1.00 0.00 H new ATOM 0 HH TYR A 138 7.114 8.876 -16.592 1.00 0.00 H new ATOM 2098 N GLU A 139 6.763 7.966 -23.153 1.00 0.00 N ATOM 2099 CA GLU A 139 8.015 7.229 -23.027 1.00 0.00 C ATOM 2100 C GLU A 139 9.077 7.796 -23.965 1.00 0.00 C ATOM 2101 O GLU A 139 10.144 8.222 -23.525 1.00 0.00 O ATOM 2102 CB GLU A 139 7.791 5.746 -23.328 1.00 0.00 C ATOM 2103 CG GLU A 139 8.966 4.863 -22.943 1.00 0.00 C ATOM 2104 CD GLU A 139 8.865 3.468 -23.529 1.00 0.00 C ATOM 2105 OE1 GLU A 139 7.793 2.842 -23.391 1.00 0.00 O ATOM 2106 OE2 GLU A 139 9.858 3.003 -24.127 1.00 0.00 O ATOM 0 H GLU A 139 5.954 7.388 -23.383 1.00 0.00 H new ATOM 0 HA GLU A 139 8.368 7.335 -22.001 1.00 0.00 H new ATOM 0 HB2 GLU A 139 6.902 5.406 -22.796 1.00 0.00 H new ATOM 0 HB3 GLU A 139 7.591 5.626 -24.393 1.00 0.00 H new ATOM 0 HG2 GLU A 139 9.892 5.329 -23.281 1.00 0.00 H new ATOM 0 HG3 GLU A 139 9.023 4.793 -21.857 1.00 0.00 H new ATOM 2113 N GLU A 140 8.775 7.795 -25.260 1.00 0.00 N ATOM 2114 CA GLU A 140 9.704 8.307 -26.260 1.00 0.00 C ATOM 2115 C GLU A 140 10.153 9.724 -25.911 1.00 0.00 C ATOM 2116 O GLU A 140 11.258 10.140 -26.259 1.00 0.00 O ATOM 2117 CB GLU A 140 9.055 8.293 -27.646 1.00 0.00 C ATOM 2118 CG GLU A 140 8.620 6.910 -28.100 1.00 0.00 C ATOM 2119 CD GLU A 140 8.067 6.907 -29.512 1.00 0.00 C ATOM 2120 OE1 GLU A 140 7.272 7.812 -29.839 1.00 0.00 O ATOM 2121 OE2 GLU A 140 8.429 5.999 -30.289 1.00 0.00 O ATOM 0 H GLU A 140 7.895 7.446 -25.640 1.00 0.00 H new ATOM 0 HA GLU A 140 10.580 7.659 -26.270 1.00 0.00 H new ATOM 0 HB2 GLU A 140 8.188 8.953 -27.639 1.00 0.00 H new ATOM 0 HB3 GLU A 140 9.759 8.700 -28.372 1.00 0.00 H new ATOM 0 HG2 GLU A 140 9.470 6.230 -28.045 1.00 0.00 H new ATOM 0 HG3 GLU A 140 7.862 6.529 -27.416 1.00 0.00 H new ATOM 2128 N PHE A 141 9.287 10.459 -25.222 1.00 0.00 N ATOM 2129 CA PHE A 141 9.592 11.829 -24.827 1.00 0.00 C ATOM 2130 C PHE A 141 10.513 11.852 -23.610 1.00 0.00 C ATOM 2131 O PHE A 141 11.463 12.632 -23.552 1.00 0.00 O ATOM 2132 CB PHE A 141 8.303 12.593 -24.519 1.00 0.00 C ATOM 2133 CG PHE A 141 8.503 13.759 -23.594 1.00 0.00 C ATOM 2134 CD1 PHE A 141 9.258 14.852 -23.987 1.00 0.00 C ATOM 2135 CD2 PHE A 141 7.935 13.762 -22.330 1.00 0.00 C ATOM 2136 CE1 PHE A 141 9.444 15.925 -23.137 1.00 0.00 C ATOM 2137 CE2 PHE A 141 8.117 14.833 -21.475 1.00 0.00 C ATOM 2138 CZ PHE A 141 8.872 15.916 -21.880 1.00 0.00 C ATOM 0 H PHE A 141 8.368 10.129 -24.926 1.00 0.00 H new ATOM 0 HA PHE A 141 10.104 12.314 -25.658 1.00 0.00 H new ATOM 0 HB2 PHE A 141 7.870 12.951 -25.453 1.00 0.00 H new ATOM 0 HB3 PHE A 141 7.581 11.907 -24.075 1.00 0.00 H new ATOM 0 HD1 PHE A 141 9.706 14.865 -24.969 1.00 0.00 H new ATOM 0 HD2 PHE A 141 7.343 12.918 -22.009 1.00 0.00 H new ATOM 0 HE1 PHE A 141 10.036 16.770 -23.455 1.00 0.00 H new ATOM 0 HE2 PHE A 141 7.670 14.823 -20.492 1.00 0.00 H new ATOM 0 HZ PHE A 141 9.015 16.755 -21.215 1.00 0.00 H new ATOM 2148 N VAL A 142 10.222 10.991 -22.640 1.00 0.00 N ATOM 2149 CA VAL A 142 11.023 10.911 -21.424 1.00 0.00 C ATOM 2150 C VAL A 142 12.477 10.583 -21.744 1.00 0.00 C ATOM 2151 O VAL A 142 13.395 11.220 -21.228 1.00 0.00 O ATOM 2152 CB VAL A 142 10.469 9.849 -20.456 1.00 0.00 C ATOM 2153 CG1 VAL A 142 11.382 9.699 -19.249 1.00 0.00 C ATOM 2154 CG2 VAL A 142 9.055 10.206 -20.025 1.00 0.00 C ATOM 0 H VAL A 142 9.438 10.339 -22.672 1.00 0.00 H new ATOM 0 HA VAL A 142 10.971 11.889 -20.946 1.00 0.00 H new ATOM 0 HB VAL A 142 10.434 8.892 -20.976 1.00 0.00 H new ATOM 0 HG11 VAL A 142 10.975 8.944 -18.576 1.00 0.00 H new ATOM 0 HG12 VAL A 142 12.375 9.393 -19.579 1.00 0.00 H new ATOM 0 HG13 VAL A 142 11.452 10.652 -18.725 1.00 0.00 H new ATOM 0 HG21 VAL A 142 8.680 9.444 -19.341 1.00 0.00 H new ATOM 0 HG22 VAL A 142 9.061 11.173 -19.523 1.00 0.00 H new ATOM 0 HG23 VAL A 142 8.409 10.256 -20.902 1.00 0.00 H new ATOM 2164 N GLN A 143 12.678 9.586 -22.599 1.00 0.00 N ATOM 2165 CA GLN A 143 14.021 9.173 -22.988 1.00 0.00 C ATOM 2166 C GLN A 143 14.848 10.370 -23.445 1.00 0.00 C ATOM 2167 O GLN A 143 15.959 10.590 -22.963 1.00 0.00 O ATOM 2168 CB GLN A 143 13.954 8.129 -24.104 1.00 0.00 C ATOM 2169 CG GLN A 143 13.203 6.867 -23.712 1.00 0.00 C ATOM 2170 CD GLN A 143 14.085 5.860 -23.002 1.00 0.00 C ATOM 2171 OE1 GLN A 143 14.304 5.953 -21.793 1.00 0.00 O ATOM 2172 NE2 GLN A 143 14.597 4.889 -23.749 1.00 0.00 N ATOM 0 H GLN A 143 11.928 9.049 -23.035 1.00 0.00 H new ATOM 0 HA GLN A 143 14.504 8.732 -22.116 1.00 0.00 H new ATOM 0 HB2 GLN A 143 13.473 8.572 -24.976 1.00 0.00 H new ATOM 0 HB3 GLN A 143 14.968 7.861 -24.401 1.00 0.00 H new ATOM 0 HG2 GLN A 143 12.367 7.132 -23.065 1.00 0.00 H new ATOM 0 HG3 GLN A 143 12.781 6.408 -24.606 1.00 0.00 H new ATOM 0 HE21 GLN A 143 14.390 4.850 -24.747 1.00 0.00 H new ATOM 0 HE22 GLN A 143 15.198 4.182 -23.325 1.00 0.00 H new ATOM 2181 N MET A 144 14.298 11.142 -24.377 1.00 0.00 N ATOM 2182 CA MET A 144 14.985 12.318 -24.898 1.00 0.00 C ATOM 2183 C MET A 144 15.481 13.206 -23.761 1.00 0.00 C ATOM 2184 O MET A 144 16.653 13.576 -23.716 1.00 0.00 O ATOM 2185 CB MET A 144 14.055 13.114 -25.815 1.00 0.00 C ATOM 2186 CG MET A 144 14.573 14.503 -26.149 1.00 0.00 C ATOM 2187 SD MET A 144 13.505 15.385 -27.303 1.00 0.00 S ATOM 2188 CE MET A 144 12.550 16.397 -26.175 1.00 0.00 C ATOM 0 H MET A 144 13.379 10.974 -24.787 1.00 0.00 H new ATOM 0 HA MET A 144 15.847 11.980 -25.473 1.00 0.00 H new ATOM 0 HB2 MET A 144 13.908 12.558 -26.741 1.00 0.00 H new ATOM 0 HB3 MET A 144 13.079 13.204 -25.339 1.00 0.00 H new ATOM 0 HG2 MET A 144 14.665 15.082 -25.230 1.00 0.00 H new ATOM 0 HG3 MET A 144 15.573 14.421 -26.576 1.00 0.00 H new ATOM 0 HE1 MET A 144 11.538 16.516 -26.561 1.00 0.00 H new ATOM 0 HE2 MET A 144 12.511 15.915 -25.198 1.00 0.00 H new ATOM 0 HE3 MET A 144 13.019 17.376 -26.078 1.00 0.00 H new ATOM 2198 N MET A 145 14.579 13.546 -22.846 1.00 0.00 N ATOM 2199 CA MET A 145 14.926 14.390 -21.709 1.00 0.00 C ATOM 2200 C MET A 145 16.142 13.838 -20.973 1.00 0.00 C ATOM 2201 O MET A 145 17.035 14.589 -20.578 1.00 0.00 O ATOM 2202 CB MET A 145 13.740 14.501 -20.748 1.00 0.00 C ATOM 2203 CG MET A 145 12.516 15.156 -21.366 1.00 0.00 C ATOM 2204 SD MET A 145 12.874 16.780 -22.062 1.00 0.00 S ATOM 2205 CE MET A 145 12.952 17.775 -20.575 1.00 0.00 C ATOM 0 H MET A 145 13.603 13.250 -22.870 1.00 0.00 H new ATOM 0 HA MET A 145 15.172 15.382 -22.087 1.00 0.00 H new ATOM 0 HB2 MET A 145 13.471 13.504 -20.399 1.00 0.00 H new ATOM 0 HB3 MET A 145 14.045 15.074 -19.872 1.00 0.00 H new ATOM 0 HG2 MET A 145 12.119 14.509 -22.148 1.00 0.00 H new ATOM 0 HG3 MET A 145 11.739 15.253 -20.608 1.00 0.00 H new ATOM 0 HE1 MET A 145 13.167 18.810 -20.841 1.00 0.00 H new ATOM 0 HE2 MET A 145 11.996 17.725 -20.053 1.00 0.00 H new ATOM 0 HE3 MET A 145 13.740 17.396 -19.925 1.00 0.00 H new ATOM 2215 N THR A 146 16.172 12.522 -20.791 1.00 0.00 N ATOM 2216 CA THR A 146 17.277 11.870 -20.101 1.00 0.00 C ATOM 2217 C THR A 146 18.215 11.186 -21.089 1.00 0.00 C ATOM 2218 O THR A 146 18.699 10.082 -20.838 1.00 0.00 O ATOM 2219 CB THR A 146 16.771 10.828 -19.086 1.00 0.00 C ATOM 2220 OG1 THR A 146 15.881 9.909 -19.730 1.00 0.00 O ATOM 2221 CG2 THR A 146 16.056 11.505 -17.926 1.00 0.00 C ATOM 0 H THR A 146 15.442 11.886 -21.113 1.00 0.00 H new ATOM 0 HA THR A 146 17.820 12.650 -19.568 1.00 0.00 H new ATOM 0 HB THR A 146 17.632 10.286 -18.695 1.00 0.00 H new ATOM 0 HG1 THR A 146 15.565 9.249 -19.078 1.00 0.00 H new ATOM 0 HG21 THR A 146 15.708 10.749 -17.222 1.00 0.00 H new ATOM 0 HG22 THR A 146 16.744 12.182 -17.420 1.00 0.00 H new ATOM 0 HG23 THR A 146 15.203 12.069 -18.304 1.00 0.00 H new ATOM 2229 N ALA A 147 18.468 11.848 -22.213 1.00 0.00 N ATOM 2230 CA ALA A 147 19.351 11.305 -23.238 1.00 0.00 C ATOM 2231 C ALA A 147 20.766 11.853 -23.091 1.00 0.00 C ATOM 2232 O ALA A 147 21.140 12.821 -23.754 1.00 0.00 O ATOM 2233 CB ALA A 147 18.804 11.614 -24.623 1.00 0.00 C ATOM 0 H ALA A 147 18.074 12.762 -22.437 1.00 0.00 H new ATOM 0 HA ALA A 147 19.394 10.223 -23.109 1.00 0.00 H new ATOM 0 HB1 ALA A 147 19.473 11.203 -25.379 1.00 0.00 H new ATOM 0 HB2 ALA A 147 17.816 11.167 -24.732 1.00 0.00 H new ATOM 0 HB3 ALA A 147 18.730 12.694 -24.753 1.00 0.00 H new ATOM 2239 N LYS A 148 21.550 11.230 -22.218 1.00 0.00 N ATOM 2240 CA LYS A 148 22.925 11.655 -21.984 1.00 0.00 C ATOM 2241 C LYS A 148 23.781 11.438 -23.228 1.00 0.00 C ATOM 2242 O LYS A 148 24.758 12.160 -23.419 1.00 0.00 O ATOM 2243 CB LYS A 148 23.523 10.889 -20.801 1.00 0.00 C ATOM 2244 CG LYS A 148 22.688 10.977 -19.535 1.00 0.00 C ATOM 2245 CD LYS A 148 22.619 12.402 -19.010 1.00 0.00 C ATOM 2246 CE LYS A 148 22.221 12.437 -17.543 1.00 0.00 C ATOM 2247 NZ LYS A 148 21.697 13.772 -17.141 1.00 0.00 N ATOM 0 H LYS A 148 21.256 10.428 -21.660 1.00 0.00 H new ATOM 0 HA LYS A 148 22.915 12.720 -21.752 1.00 0.00 H new ATOM 0 HB2 LYS A 148 23.638 9.841 -21.078 1.00 0.00 H new ATOM 0 HB3 LYS A 148 24.521 11.276 -20.596 1.00 0.00 H new ATOM 0 HG2 LYS A 148 21.680 10.613 -19.737 1.00 0.00 H new ATOM 0 HG3 LYS A 148 23.114 10.327 -18.771 1.00 0.00 H new ATOM 0 HD2 LYS A 148 23.588 12.885 -19.137 1.00 0.00 H new ATOM 0 HD3 LYS A 148 21.899 12.973 -19.597 1.00 0.00 H new ATOM 0 HE2 LYS A 148 21.462 11.677 -17.355 1.00 0.00 H new ATOM 0 HE3 LYS A 148 23.084 12.185 -16.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 20.855 13.649 -16.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 22.428 14.286 -16.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 21.441 14.315 -17.990 1.00 0.00 H new TER 2261 LYS A 148 HETATM 2262 CA CA A 200 35.188 9.388 -3.879 1.00 0.00 CA HETATM 2263 CA CA A 250 31.083 11.086 6.921 1.00 0.00 CA HETATM 2264 CA CA A 300 -0.928 13.001 -30.426 1.00 0.00 CA HETATM 2265 CA CA A 350 6.699 7.525 -31.853 1.00 0.00 CA