USER MOD reduce.3.24.130724 H: found=0, std=0, add=1109, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1111 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 62 GLNHE21 : A 62 GLN OE1 : A 151 CACA :(metal ligand) USER MOD NoAdj : A 62 GLNHE22 : A 62 GLN OE1 : A 151 CACA :(metal ligand) USER MOD Set 1.1: A 79 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 146 SER OG : rot -25:sc= 0.112 USER MOD Set 1.3: A 147 GLN : amide:sc= -0.319 K(o=-0.21,f=-1) USER MOD Set 2.1: A 109 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 124 MET CE :methyl -115:sc= -2.32! (180deg=-2.88!) USER MOD Set 3.1: A 5 THR OG1 : rot 180:sc= 0.0424 USER MOD Set 3.2: A 8 GLN :FLIP amide:sc= -0.138 F(o=-1.7!,f=-0.15) USER MOD Set 3.3: A 76 MET CE :methyl -141:sc= -0.0536 (180deg=-1.72!) USER MOD Set 4.1: A 36 MET CE :methyl 164:sc= -0.928 (180deg=-0.753) USER MOD Set 4.2: A 41 GLN :FLIP amide:sc= -4.51! F(o=-10,f=-8.3!) USER MOD Set 4.3: A 72 MET CE :methyl -169:sc= -0.983 (180deg=-1.43) USER MOD Set 4.4: A 75 GLN : amide:sc= -1.92 K(o=-8.3,f=-10!) USER MOD Single : A 2 SER OG : rot 26:sc= 0.0362 USER MOD Single : A 13 LYS NZ :NH3+ -109:sc= -0.0414 (180deg=-2.07!) USER MOD Single : A 18 GLN :FLIP amide:sc= -0.252 F(o=-0.76,f=-0.25) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0403) USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot -35:sc= 0.228 USER MOD Single : A 42 ASN : amide:sc= 0 X(o=0,f=-0.026) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= -0.0384 K(o=-0.038,f=-0.69) USER MOD Single : A 57 ASN :FLIP amide:sc= -0.153 F(o=-0.95,f=-0.15) USER MOD Single : A 58 ASN :FLIP amide:sc= -0.466 F(o=-2.8!,f=-0.47) USER MOD Single : A 59 ASN : amide:sc= -0.395 X(o=-0.39,f=-0.39) USER MOD Single : A 60 ASN :FLIP amide:sc= 0 F(o=-0.81,f=0) USER MOD Single : A 64 ASN : amide:sc= -3.51! C(o=-3.5!,f=-5!) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0.0708 USER MOD Single : A 69 CYS SG : rot 149:sc= -0.43 USER MOD Single : A 74 LYS NZ :NH3+ 171:sc= -1.52! (180deg=-1.82!) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 MET CE :methyl -179:sc= -3.6 (180deg=-3.62) USER MOD Single : A 90 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0884) USER MOD Single : A 101 SER OG : rot 90:sc= -2.1! USER MOD Single : A 111 ASN : amide:sc= -0.243 K(o=-0.24,f=-0.99) USER MOD Single : A 115 LYS NZ :NH3+ -162:sc= -0.0566 (180deg=-0.37) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 MET CE :methyl 136:sc= -0.143 (180deg=-1.62) USER MOD Single : A 137 ASN : amide:sc= -0.642 K(o=-0.64,f=-11!) USER MOD Single : A 138 TYR OH : rot 7:sc= -1.37! USER MOD Single : A 144 MET CE :methyl -126:sc= -4.22! (180deg=-4.88!) USER MOD Single : A 148 LYS NZ :NH3+ 167:sc= -0.0385 (180deg=-0.233) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 1.054 8.146 -3.029 1.00 3.85 N ATOM 2 CA SER A 2 0.381 9.102 -2.112 1.00 3.35 C ATOM 3 C SER A 2 0.001 8.423 -0.800 1.00 2.64 C ATOM 4 O SER A 2 -1.076 7.838 -0.681 1.00 3.12 O ATOM 5 CB SER A 2 -0.869 9.682 -2.777 1.00 4.09 C ATOM 6 OG SER A 2 -0.535 10.406 -3.947 1.00 4.89 O ATOM 0 HA SER A 2 1.079 9.910 -1.894 1.00 3.35 H new ATOM 0 HB2 SER A 2 -1.558 8.876 -3.029 1.00 4.09 H new ATOM 0 HB3 SER A 2 -1.387 10.337 -2.076 1.00 4.09 H new ATOM 0 HG SER A 2 0.308 10.065 -4.313 1.00 4.89 H new ATOM 12 N GLU A 3 0.896 8.505 0.179 1.00 1.91 N ATOM 13 CA GLU A 3 0.661 7.905 1.487 1.00 1.35 C ATOM 14 C GLU A 3 -0.587 8.492 2.138 1.00 1.08 C ATOM 15 O GLU A 3 -0.970 9.627 1.854 1.00 1.52 O ATOM 16 CB GLU A 3 1.876 8.125 2.392 1.00 1.52 C ATOM 17 CG GLU A 3 2.248 9.589 2.562 1.00 2.09 C ATOM 18 CD GLU A 3 3.443 9.783 3.474 1.00 2.74 C ATOM 19 OE1 GLU A 3 4.587 9.688 2.981 1.00 3.26 O ATOM 20 OE2 GLU A 3 3.237 10.029 4.680 1.00 3.22 O ATOM 0 H GLU A 3 1.793 8.983 0.091 1.00 1.91 H new ATOM 0 HA GLU A 3 0.506 6.835 1.349 1.00 1.35 H new ATOM 0 HB2 GLU A 3 1.672 7.694 3.372 1.00 1.52 H new ATOM 0 HB3 GLU A 3 2.729 7.587 1.979 1.00 1.52 H new ATOM 0 HG2 GLU A 3 2.467 10.021 1.585 1.00 2.09 H new ATOM 0 HG3 GLU A 3 1.394 10.133 2.967 1.00 2.09 H new ATOM 27 N LEU A 4 -1.218 7.711 3.012 1.00 0.73 N ATOM 28 CA LEU A 4 -2.425 8.156 3.699 1.00 0.45 C ATOM 29 C LEU A 4 -2.112 9.290 4.671 1.00 0.47 C ATOM 30 O LEU A 4 -1.809 9.052 5.840 1.00 0.58 O ATOM 31 CB LEU A 4 -3.078 6.993 4.454 1.00 0.41 C ATOM 32 CG LEU A 4 -3.210 5.683 3.670 1.00 0.50 C ATOM 33 CD1 LEU A 4 -3.935 4.636 4.499 1.00 1.27 C ATOM 34 CD2 LEU A 4 -3.935 5.912 2.351 1.00 1.19 C ATOM 0 H LEU A 4 -0.913 6.770 3.260 1.00 0.73 H new ATOM 0 HA LEU A 4 -3.120 8.524 2.944 1.00 0.45 H new ATOM 0 HB2 LEU A 4 -2.498 6.798 5.356 1.00 0.41 H new ATOM 0 HB3 LEU A 4 -4.072 7.305 4.775 1.00 0.41 H new ATOM 0 HG LEU A 4 -2.207 5.317 3.449 1.00 0.50 H new ATOM 0 HD11 LEU A 4 -4.019 3.713 3.926 1.00 1.27 H new ATOM 0 HD12 LEU A 4 -3.375 4.445 5.414 1.00 1.27 H new ATOM 0 HD13 LEU A 4 -4.931 4.998 4.752 1.00 1.27 H new ATOM 0 HD21 LEU A 4 -4.017 4.968 1.812 1.00 1.19 H new ATOM 0 HD22 LEU A 4 -4.932 6.305 2.548 1.00 1.19 H new ATOM 0 HD23 LEU A 4 -3.376 6.627 1.748 1.00 1.19 H new ATOM 46 N THR A 5 -2.186 10.522 4.178 1.00 0.47 N ATOM 47 CA THR A 5 -1.912 11.694 5.000 1.00 0.54 C ATOM 48 C THR A 5 -3.056 11.952 5.978 1.00 0.51 C ATOM 49 O THR A 5 -3.965 11.136 6.109 1.00 0.55 O ATOM 50 CB THR A 5 -1.700 12.949 4.131 1.00 0.62 C ATOM 51 OG1 THR A 5 -1.315 12.567 2.805 1.00 1.12 O ATOM 52 CG2 THR A 5 -0.630 13.850 4.729 1.00 0.99 C ATOM 0 H THR A 5 -2.434 10.734 3.212 1.00 0.47 H new ATOM 0 HA THR A 5 -0.998 11.489 5.557 1.00 0.54 H new ATOM 0 HB THR A 5 -2.640 13.500 4.096 1.00 0.62 H new ATOM 0 HG1 THR A 5 -1.184 13.370 2.258 1.00 1.12 H new ATOM 0 HG21 THR A 5 -0.499 14.728 4.097 1.00 0.99 H new ATOM 0 HG22 THR A 5 -0.935 14.163 5.728 1.00 0.99 H new ATOM 0 HG23 THR A 5 0.312 13.305 4.791 1.00 0.99 H new ATOM 60 N GLU A 6 -3.009 13.092 6.656 1.00 0.60 N ATOM 61 CA GLU A 6 -4.038 13.456 7.615 1.00 0.62 C ATOM 62 C GLU A 6 -5.342 13.778 6.899 1.00 0.55 C ATOM 63 O GLU A 6 -6.415 13.316 7.291 1.00 0.53 O ATOM 64 CB GLU A 6 -3.579 14.659 8.431 1.00 0.75 C ATOM 65 CG GLU A 6 -4.572 15.071 9.502 1.00 1.46 C ATOM 66 CD GLU A 6 -4.929 13.934 10.439 1.00 1.74 C ATOM 67 OE1 GLU A 6 -4.220 13.753 11.452 1.00 2.20 O ATOM 68 OE2 GLU A 6 -5.918 13.224 10.160 1.00 2.00 O ATOM 0 H GLU A 6 -2.264 13.782 6.557 1.00 0.60 H new ATOM 0 HA GLU A 6 -4.210 12.613 8.284 1.00 0.62 H new ATOM 0 HB2 GLU A 6 -2.623 14.427 8.901 1.00 0.75 H new ATOM 0 HB3 GLU A 6 -3.408 15.501 7.760 1.00 0.75 H new ATOM 0 HG2 GLU A 6 -4.155 15.895 10.080 1.00 1.46 H new ATOM 0 HG3 GLU A 6 -5.480 15.443 9.026 1.00 1.46 H new ATOM 75 N GLU A 7 -5.234 14.572 5.842 1.00 0.58 N ATOM 76 CA GLU A 7 -6.388 14.968 5.052 1.00 0.58 C ATOM 77 C GLU A 7 -6.903 13.795 4.227 1.00 0.48 C ATOM 78 O GLU A 7 -8.111 13.583 4.118 1.00 0.46 O ATOM 79 CB GLU A 7 -6.017 16.134 4.135 1.00 0.69 C ATOM 80 CG GLU A 7 -4.768 15.882 3.306 1.00 0.69 C ATOM 81 CD GLU A 7 -4.419 17.053 2.408 1.00 1.02 C ATOM 82 OE1 GLU A 7 -4.949 17.116 1.279 1.00 1.19 O ATOM 83 OE2 GLU A 7 -3.612 17.908 2.833 1.00 1.35 O ATOM 0 H GLU A 7 -4.349 14.957 5.511 1.00 0.58 H new ATOM 0 HA GLU A 7 -7.180 15.285 5.730 1.00 0.58 H new ATOM 0 HB2 GLU A 7 -6.852 16.339 3.465 1.00 0.69 H new ATOM 0 HB3 GLU A 7 -5.867 17.028 4.740 1.00 0.69 H new ATOM 0 HG2 GLU A 7 -3.930 15.677 3.972 1.00 0.69 H new ATOM 0 HG3 GLU A 7 -4.915 14.991 2.695 1.00 0.69 H new ATOM 90 N GLN A 8 -5.978 13.038 3.646 1.00 0.44 N ATOM 91 CA GLN A 8 -6.334 11.883 2.834 1.00 0.37 C ATOM 92 C GLN A 8 -7.102 10.861 3.663 1.00 0.31 C ATOM 93 O GLN A 8 -8.127 10.337 3.225 1.00 0.29 O ATOM 94 CB GLN A 8 -5.080 11.237 2.243 1.00 0.40 C ATOM 95 CG GLN A 8 -4.414 12.078 1.166 1.00 0.48 C ATOM 96 CD GLN A 8 -3.254 11.362 0.498 1.00 1.35 C ATOM 97 OE1 GLN A 8 -3.347 10.041 0.402 1.00 2.22 O flip ATOM 98 NE2 GLN A 8 -2.289 11.992 0.066 1.00 1.68 N flip ATOM 0 H GLN A 8 -4.975 13.205 3.723 1.00 0.44 H new ATOM 0 HA GLN A 8 -6.972 12.225 2.019 1.00 0.37 H new ATOM 0 HB2 GLN A 8 -4.364 11.053 3.044 1.00 0.40 H new ATOM 0 HB3 GLN A 8 -5.344 10.267 1.823 1.00 0.40 H new ATOM 0 HG2 GLN A 8 -5.153 12.346 0.411 1.00 0.48 H new ATOM 0 HG3 GLN A 8 -4.056 13.008 1.607 1.00 0.48 H new ATOM 0 HE21 GLN A 8 -2.259 13.007 0.161 1.00 1.68 H new ATOM 0 HE22 GLN A 8 -1.520 11.499 -0.387 1.00 1.68 H new ATOM 107 N ILE A 9 -6.601 10.584 4.863 1.00 0.33 N ATOM 108 CA ILE A 9 -7.244 9.630 5.753 1.00 0.33 C ATOM 109 C ILE A 9 -8.679 10.045 6.048 1.00 0.34 C ATOM 110 O ILE A 9 -9.607 9.260 5.876 1.00 0.36 O ATOM 111 CB ILE A 9 -6.465 9.467 7.079 1.00 0.42 C ATOM 112 CG1 ILE A 9 -5.226 8.598 6.859 1.00 0.44 C ATOM 113 CG2 ILE A 9 -7.355 8.863 8.159 1.00 0.51 C ATOM 114 CD1 ILE A 9 -4.293 8.555 8.052 1.00 0.54 C ATOM 0 H ILE A 9 -5.753 11.007 5.239 1.00 0.33 H new ATOM 0 HA ILE A 9 -7.248 8.668 5.240 1.00 0.33 H new ATOM 0 HB ILE A 9 -6.146 10.454 7.415 1.00 0.42 H new ATOM 0 HG12 ILE A 9 -5.543 7.583 6.620 1.00 0.44 H new ATOM 0 HG13 ILE A 9 -4.679 8.973 5.994 1.00 0.44 H new ATOM 0 HG21 ILE A 9 -6.786 8.758 9.083 1.00 0.51 H new ATOM 0 HG22 ILE A 9 -8.211 9.516 8.332 1.00 0.51 H new ATOM 0 HG23 ILE A 9 -7.706 7.883 7.835 1.00 0.51 H new ATOM 0 HD11 ILE A 9 -3.438 7.920 7.822 1.00 0.54 H new ATOM 0 HD12 ILE A 9 -3.946 9.563 8.279 1.00 0.54 H new ATOM 0 HD13 ILE A 9 -4.823 8.151 8.914 1.00 0.54 H new ATOM 126 N ALA A 10 -8.849 11.286 6.482 1.00 0.36 N ATOM 127 CA ALA A 10 -10.169 11.810 6.810 1.00 0.40 C ATOM 128 C ALA A 10 -11.090 11.827 5.590 1.00 0.35 C ATOM 129 O ALA A 10 -12.314 11.844 5.729 1.00 0.36 O ATOM 130 CB ALA A 10 -10.038 13.210 7.390 1.00 0.50 C ATOM 0 H ALA A 10 -8.087 11.951 6.616 1.00 0.36 H new ATOM 0 HA ALA A 10 -10.619 11.149 7.551 1.00 0.40 H new ATOM 0 HB1 ALA A 10 -11.027 13.597 7.633 1.00 0.50 H new ATOM 0 HB2 ALA A 10 -9.430 13.174 8.294 1.00 0.50 H new ATOM 0 HB3 ALA A 10 -9.563 13.864 6.659 1.00 0.50 H new ATOM 136 N GLU A 11 -10.502 11.811 4.396 1.00 0.33 N ATOM 137 CA GLU A 11 -11.285 11.847 3.164 1.00 0.33 C ATOM 138 C GLU A 11 -11.998 10.521 2.900 1.00 0.27 C ATOM 139 O GLU A 11 -13.223 10.486 2.768 1.00 0.28 O ATOM 140 CB GLU A 11 -10.386 12.198 1.976 1.00 0.37 C ATOM 141 CG GLU A 11 -11.134 12.310 0.657 1.00 0.41 C ATOM 142 CD GLU A 11 -12.223 13.365 0.691 1.00 1.27 C ATOM 143 OE1 GLU A 11 -11.909 14.550 0.453 1.00 1.19 O ATOM 144 OE2 GLU A 11 -13.390 13.007 0.957 1.00 2.27 O ATOM 0 H GLU A 11 -9.492 11.774 4.256 1.00 0.33 H new ATOM 0 HA GLU A 11 -12.048 12.616 3.286 1.00 0.33 H new ATOM 0 HB2 GLU A 11 -9.882 13.143 2.179 1.00 0.37 H new ATOM 0 HB3 GLU A 11 -9.611 11.438 1.881 1.00 0.37 H new ATOM 0 HG2 GLU A 11 -10.427 12.548 -0.138 1.00 0.41 H new ATOM 0 HG3 GLU A 11 -11.576 11.345 0.411 1.00 0.41 H new ATOM 151 N PHE A 12 -11.240 9.428 2.831 1.00 0.23 N ATOM 152 CA PHE A 12 -11.839 8.121 2.577 1.00 0.22 C ATOM 153 C PHE A 12 -12.487 7.568 3.841 1.00 0.19 C ATOM 154 O PHE A 12 -13.414 6.762 3.768 1.00 0.20 O ATOM 155 CB PHE A 12 -10.812 7.130 2.012 1.00 0.26 C ATOM 156 CG PHE A 12 -9.625 6.883 2.900 1.00 0.25 C ATOM 157 CD1 PHE A 12 -9.774 6.204 4.099 1.00 0.31 C ATOM 158 CD2 PHE A 12 -8.367 7.338 2.545 1.00 0.27 C ATOM 159 CE1 PHE A 12 -8.688 5.986 4.924 1.00 0.37 C ATOM 160 CE2 PHE A 12 -7.280 7.120 3.363 1.00 0.30 C ATOM 161 CZ PHE A 12 -7.429 6.406 4.528 1.00 0.35 C ATOM 0 H PHE A 12 -10.226 9.421 2.945 1.00 0.23 H new ATOM 0 HA PHE A 12 -12.615 8.255 1.824 1.00 0.22 H new ATOM 0 HB2 PHE A 12 -11.311 6.180 1.822 1.00 0.26 H new ATOM 0 HB3 PHE A 12 -10.458 7.502 1.051 1.00 0.26 H new ATOM 0 HD1 PHE A 12 -10.749 5.842 4.391 1.00 0.31 H new ATOM 0 HD2 PHE A 12 -8.236 7.871 1.615 1.00 0.27 H new ATOM 0 HE1 PHE A 12 -8.820 5.490 5.874 1.00 0.37 H new ATOM 0 HE2 PHE A 12 -6.311 7.510 3.089 1.00 0.30 H new ATOM 0 HZ PHE A 12 -6.566 6.173 5.134 1.00 0.35 H new ATOM 171 N LYS A 13 -11.989 7.997 4.999 1.00 0.19 N ATOM 172 CA LYS A 13 -12.543 7.554 6.269 1.00 0.22 C ATOM 173 C LYS A 13 -13.973 8.061 6.401 1.00 0.21 C ATOM 174 O LYS A 13 -14.852 7.365 6.910 1.00 0.23 O ATOM 175 CB LYS A 13 -11.678 8.043 7.434 1.00 0.28 C ATOM 176 CG LYS A 13 -12.315 7.841 8.800 1.00 0.32 C ATOM 177 CD LYS A 13 -12.553 6.367 9.086 1.00 0.33 C ATOM 178 CE LYS A 13 -13.182 6.163 10.452 1.00 0.48 C ATOM 179 NZ LYS A 13 -14.515 6.818 10.552 1.00 1.23 N ATOM 0 H LYS A 13 -11.207 8.647 5.080 1.00 0.19 H new ATOM 0 HA LYS A 13 -12.551 6.464 6.298 1.00 0.22 H new ATOM 0 HB2 LYS A 13 -10.722 7.520 7.409 1.00 0.28 H new ATOM 0 HB3 LYS A 13 -11.465 9.103 7.296 1.00 0.28 H new ATOM 0 HG2 LYS A 13 -11.670 8.264 9.570 1.00 0.32 H new ATOM 0 HG3 LYS A 13 -13.261 8.380 8.846 1.00 0.32 H new ATOM 0 HD2 LYS A 13 -13.202 5.946 8.318 1.00 0.33 H new ATOM 0 HD3 LYS A 13 -11.607 5.827 9.035 1.00 0.33 H new ATOM 0 HE2 LYS A 13 -13.286 5.096 10.648 1.00 0.48 H new ATOM 0 HE3 LYS A 13 -12.521 6.565 11.220 1.00 0.48 H new ATOM 0 HZ1 LYS A 13 -14.449 7.645 11.179 1.00 1.23 H new ATOM 0 HZ2 LYS A 13 -14.824 7.123 9.607 1.00 1.23 H new ATOM 0 HZ3 LYS A 13 -15.205 6.144 10.941 1.00 1.23 H new ATOM 193 N ASP A 14 -14.194 9.288 5.937 1.00 0.23 N ATOM 194 CA ASP A 14 -15.521 9.879 5.965 1.00 0.25 C ATOM 195 C ASP A 14 -16.426 9.107 5.015 1.00 0.22 C ATOM 196 O ASP A 14 -17.535 8.706 5.370 1.00 0.23 O ATOM 197 CB ASP A 14 -15.460 11.351 5.554 1.00 0.31 C ATOM 198 CG ASP A 14 -16.798 12.049 5.702 1.00 0.37 C ATOM 199 OD1 ASP A 14 -17.082 12.559 6.807 1.00 0.44 O ATOM 200 OD2 ASP A 14 -17.561 12.086 4.714 1.00 0.41 O ATOM 0 H ASP A 14 -13.471 9.888 5.539 1.00 0.23 H new ATOM 0 HA ASP A 14 -15.919 9.825 6.978 1.00 0.25 H new ATOM 0 HB2 ASP A 14 -14.716 11.865 6.163 1.00 0.31 H new ATOM 0 HB3 ASP A 14 -15.129 11.423 4.518 1.00 0.31 H new ATOM 205 N ALA A 15 -15.928 8.892 3.801 1.00 0.22 N ATOM 206 CA ALA A 15 -16.668 8.154 2.790 1.00 0.24 C ATOM 207 C ALA A 15 -16.869 6.705 3.219 1.00 0.22 C ATOM 208 O ALA A 15 -17.689 5.986 2.651 1.00 0.29 O ATOM 209 CB ALA A 15 -15.940 8.215 1.458 1.00 0.27 C ATOM 0 H ALA A 15 -15.012 9.221 3.496 1.00 0.22 H new ATOM 0 HA ALA A 15 -17.649 8.615 2.676 1.00 0.24 H new ATOM 0 HB1 ALA A 15 -16.504 7.659 0.709 1.00 0.27 H new ATOM 0 HB2 ALA A 15 -15.845 9.254 1.143 1.00 0.27 H new ATOM 0 HB3 ALA A 15 -14.948 7.776 1.565 1.00 0.27 H new ATOM 215 N PHE A 16 -16.115 6.286 4.233 1.00 0.20 N ATOM 216 CA PHE A 16 -16.199 4.922 4.738 1.00 0.22 C ATOM 217 C PHE A 16 -17.439 4.751 5.602 1.00 0.22 C ATOM 218 O PHE A 16 -18.215 3.815 5.413 1.00 0.25 O ATOM 219 CB PHE A 16 -14.941 4.570 5.540 1.00 0.26 C ATOM 220 CG PHE A 16 -14.985 3.204 6.167 1.00 0.31 C ATOM 221 CD1 PHE A 16 -14.665 2.077 5.427 1.00 0.38 C ATOM 222 CD2 PHE A 16 -15.351 3.046 7.495 1.00 0.37 C ATOM 223 CE1 PHE A 16 -14.705 0.820 5.998 1.00 0.46 C ATOM 224 CE2 PHE A 16 -15.394 1.791 8.073 1.00 0.45 C ATOM 225 CZ PHE A 16 -15.061 0.681 7.334 1.00 0.48 C ATOM 0 H PHE A 16 -15.439 6.874 4.720 1.00 0.20 H new ATOM 0 HA PHE A 16 -16.271 4.244 3.888 1.00 0.22 H new ATOM 0 HB2 PHE A 16 -14.073 4.630 4.883 1.00 0.26 H new ATOM 0 HB3 PHE A 16 -14.800 5.315 6.323 1.00 0.26 H new ATOM 0 HD1 PHE A 16 -14.381 2.183 4.390 1.00 0.38 H new ATOM 0 HD2 PHE A 16 -15.606 3.914 8.085 1.00 0.37 H new ATOM 0 HE1 PHE A 16 -14.461 -0.051 5.409 1.00 0.46 H new ATOM 0 HE2 PHE A 16 -15.690 1.683 9.106 1.00 0.45 H new ATOM 0 HZ PHE A 16 -15.076 -0.297 7.791 1.00 0.48 H new ATOM 235 N VAL A 17 -17.624 5.663 6.550 1.00 0.22 N ATOM 236 CA VAL A 17 -18.778 5.607 7.433 1.00 0.23 C ATOM 237 C VAL A 17 -20.055 5.874 6.649 1.00 0.23 C ATOM 238 O VAL A 17 -21.147 5.484 7.064 1.00 0.26 O ATOM 239 CB VAL A 17 -18.665 6.617 8.590 1.00 0.30 C ATOM 240 CG1 VAL A 17 -17.567 6.201 9.555 1.00 1.11 C ATOM 241 CG2 VAL A 17 -18.413 8.020 8.061 1.00 0.91 C ATOM 0 H VAL A 17 -16.993 6.445 6.725 1.00 0.22 H new ATOM 0 HA VAL A 17 -18.810 4.605 7.860 1.00 0.23 H new ATOM 0 HB VAL A 17 -19.612 6.625 9.130 1.00 0.30 H new ATOM 0 HG11 VAL A 17 -17.501 6.926 10.366 1.00 1.11 H new ATOM 0 HG12 VAL A 17 -17.796 5.218 9.965 1.00 1.11 H new ATOM 0 HG13 VAL A 17 -16.614 6.160 9.027 1.00 1.11 H new ATOM 0 HG21 VAL A 17 -18.337 8.716 8.897 1.00 0.91 H new ATOM 0 HG22 VAL A 17 -17.483 8.033 7.492 1.00 0.91 H new ATOM 0 HG23 VAL A 17 -19.238 8.319 7.414 1.00 0.91 H new ATOM 251 N GLN A 18 -19.906 6.543 5.509 1.00 0.24 N ATOM 252 CA GLN A 18 -21.041 6.858 4.651 1.00 0.29 C ATOM 253 C GLN A 18 -21.693 5.590 4.102 1.00 0.32 C ATOM 254 O GLN A 18 -22.854 5.612 3.690 1.00 0.43 O ATOM 255 CB GLN A 18 -20.599 7.748 3.489 1.00 0.33 C ATOM 256 CG GLN A 18 -20.268 9.176 3.895 1.00 0.34 C ATOM 257 CD GLN A 18 -21.411 9.856 4.619 1.00 1.09 C ATOM 258 OE1 GLN A 18 -21.415 9.750 5.941 1.00 1.54 O flip ATOM 259 NE2 GLN A 18 -22.277 10.473 3.998 1.00 1.60 N flip ATOM 0 H GLN A 18 -19.008 6.877 5.159 1.00 0.24 H new ATOM 0 HA GLN A 18 -21.775 7.389 5.258 1.00 0.29 H new ATOM 0 HB2 GLN A 18 -19.723 7.303 3.017 1.00 0.33 H new ATOM 0 HB3 GLN A 18 -21.390 7.768 2.739 1.00 0.33 H new ATOM 0 HG2 GLN A 18 -19.387 9.172 4.537 1.00 0.34 H new ATOM 0 HG3 GLN A 18 -20.012 9.752 3.006 1.00 0.34 H new ATOM 0 HE21 GLN A 18 -22.233 10.528 2.980 1.00 1.60 H new ATOM 0 HE22 GLN A 18 -23.038 10.929 4.501 1.00 1.60 H new ATOM 268 N PHE A 19 -20.947 4.486 4.098 1.00 0.28 N ATOM 269 CA PHE A 19 -21.464 3.220 3.583 1.00 0.33 C ATOM 270 C PHE A 19 -21.583 2.164 4.681 1.00 0.35 C ATOM 271 O PHE A 19 -21.568 0.965 4.401 1.00 0.64 O ATOM 272 CB PHE A 19 -20.569 2.697 2.458 1.00 0.36 C ATOM 273 CG PHE A 19 -20.687 3.485 1.183 1.00 0.37 C ATOM 274 CD1 PHE A 19 -20.103 4.737 1.073 1.00 0.41 C ATOM 275 CD2 PHE A 19 -21.380 2.975 0.097 1.00 0.48 C ATOM 276 CE1 PHE A 19 -20.207 5.466 -0.096 1.00 0.44 C ATOM 277 CE2 PHE A 19 -21.488 3.698 -1.075 1.00 0.54 C ATOM 278 CZ PHE A 19 -20.909 4.938 -1.176 1.00 0.47 C ATOM 0 H PHE A 19 -19.988 4.443 4.444 1.00 0.28 H new ATOM 0 HA PHE A 19 -22.463 3.413 3.193 1.00 0.33 H new ATOM 0 HB2 PHE A 19 -19.532 2.714 2.792 1.00 0.36 H new ATOM 0 HB3 PHE A 19 -20.822 1.656 2.257 1.00 0.36 H new ATOM 0 HD1 PHE A 19 -19.560 5.148 1.911 1.00 0.41 H new ATOM 0 HD2 PHE A 19 -21.841 2.001 0.168 1.00 0.48 H new ATOM 0 HE1 PHE A 19 -19.746 6.440 -0.172 1.00 0.44 H new ATOM 0 HE2 PHE A 19 -22.029 3.286 -1.914 1.00 0.54 H new ATOM 0 HZ PHE A 19 -20.998 5.503 -2.092 1.00 0.47 H new ATOM 288 N ASP A 20 -21.705 2.610 5.927 1.00 0.29 N ATOM 289 CA ASP A 20 -21.840 1.689 7.050 1.00 0.28 C ATOM 290 C ASP A 20 -23.231 1.796 7.664 1.00 0.37 C ATOM 291 O ASP A 20 -23.428 2.475 8.672 1.00 0.44 O ATOM 292 CB ASP A 20 -20.772 1.962 8.111 1.00 0.25 C ATOM 293 CG ASP A 20 -20.847 0.980 9.266 1.00 0.27 C ATOM 294 OD1 ASP A 20 -20.810 -0.242 9.009 1.00 0.29 O ATOM 295 OD2 ASP A 20 -20.941 1.435 10.425 1.00 0.33 O ATOM 0 H ASP A 20 -21.713 3.597 6.184 1.00 0.29 H new ATOM 0 HA ASP A 20 -21.700 0.676 6.674 1.00 0.28 H new ATOM 0 HB2 ASP A 20 -19.785 1.907 7.653 1.00 0.25 H new ATOM 0 HB3 ASP A 20 -20.891 2.977 8.491 1.00 0.25 H new ATOM 300 N LYS A 21 -24.192 1.121 7.042 1.00 0.47 N ATOM 301 CA LYS A 21 -25.572 1.139 7.514 1.00 0.59 C ATOM 302 C LYS A 21 -25.847 -0.021 8.465 1.00 0.64 C ATOM 303 O LYS A 21 -26.737 0.055 9.312 1.00 0.83 O ATOM 304 CB LYS A 21 -26.529 1.070 6.327 1.00 0.68 C ATOM 305 CG LYS A 21 -26.429 2.274 5.408 1.00 1.02 C ATOM 306 CD LYS A 21 -27.074 3.509 6.021 1.00 1.14 C ATOM 307 CE LYS A 21 -28.586 3.372 6.097 1.00 1.67 C ATOM 308 NZ LYS A 21 -29.225 4.587 6.673 1.00 2.10 N ATOM 0 H LYS A 21 -24.040 0.554 6.208 1.00 0.47 H new ATOM 0 HA LYS A 21 -25.730 2.070 8.058 1.00 0.59 H new ATOM 0 HB2 LYS A 21 -26.323 0.166 5.754 1.00 0.68 H new ATOM 0 HB3 LYS A 21 -27.551 0.987 6.697 1.00 0.68 H new ATOM 0 HG2 LYS A 21 -25.381 2.481 5.193 1.00 1.02 H new ATOM 0 HG3 LYS A 21 -26.911 2.046 4.457 1.00 1.02 H new ATOM 0 HD2 LYS A 21 -26.672 3.671 7.021 1.00 1.14 H new ATOM 0 HD3 LYS A 21 -26.817 4.387 5.428 1.00 1.14 H new ATOM 0 HE2 LYS A 21 -28.985 3.191 5.099 1.00 1.67 H new ATOM 0 HE3 LYS A 21 -28.842 2.504 6.705 1.00 1.67 H new ATOM 0 HZ1 LYS A 21 -30.256 4.454 6.708 1.00 2.10 H new ATOM 0 HZ2 LYS A 21 -28.864 4.746 7.635 1.00 2.10 H new ATOM 0 HZ3 LYS A 21 -29.002 5.411 6.079 1.00 2.10 H new ATOM 322 N GLU A 22 -25.075 -1.092 8.319 1.00 0.58 N ATOM 323 CA GLU A 22 -25.237 -2.275 9.154 1.00 0.63 C ATOM 324 C GLU A 22 -24.787 -2.009 10.588 1.00 0.60 C ATOM 325 O GLU A 22 -25.102 -2.777 11.498 1.00 0.80 O ATOM 326 CB GLU A 22 -24.450 -3.443 8.560 1.00 0.62 C ATOM 327 CG GLU A 22 -24.836 -3.758 7.124 1.00 0.71 C ATOM 328 CD GLU A 22 -26.247 -4.299 7.006 1.00 0.98 C ATOM 329 OE1 GLU A 22 -26.447 -5.501 7.280 1.00 0.96 O ATOM 330 OE2 GLU A 22 -27.153 -3.520 6.642 1.00 1.80 O ATOM 0 H GLU A 22 -24.329 -1.165 7.628 1.00 0.58 H new ATOM 0 HA GLU A 22 -26.296 -2.530 9.179 1.00 0.63 H new ATOM 0 HB2 GLU A 22 -23.385 -3.213 8.601 1.00 0.62 H new ATOM 0 HB3 GLU A 22 -24.609 -4.329 9.175 1.00 0.62 H new ATOM 0 HG2 GLU A 22 -24.745 -2.855 6.521 1.00 0.71 H new ATOM 0 HG3 GLU A 22 -24.136 -4.486 6.715 1.00 0.71 H new ATOM 337 N GLY A 23 -24.052 -0.919 10.782 1.00 0.45 N ATOM 338 CA GLY A 23 -23.577 -0.570 12.110 1.00 0.46 C ATOM 339 C GLY A 23 -22.390 -1.409 12.547 1.00 0.39 C ATOM 340 O GLY A 23 -21.872 -1.232 13.649 1.00 0.45 O ATOM 0 H GLY A 23 -23.776 -0.271 10.044 1.00 0.45 H new ATOM 0 HA2 GLY A 23 -23.298 0.483 12.126 1.00 0.46 H new ATOM 0 HA3 GLY A 23 -24.389 -0.696 12.826 1.00 0.46 H new ATOM 344 N THR A 24 -21.961 -2.322 11.682 1.00 0.34 N ATOM 345 CA THR A 24 -20.829 -3.190 11.985 1.00 0.30 C ATOM 346 C THR A 24 -19.504 -2.489 11.701 1.00 0.28 C ATOM 347 O THR A 24 -18.449 -3.123 11.689 1.00 0.29 O ATOM 348 CB THR A 24 -20.885 -4.494 11.165 1.00 0.32 C ATOM 349 OG1 THR A 24 -21.003 -4.192 9.770 1.00 0.33 O ATOM 350 CG2 THR A 24 -22.057 -5.361 11.599 1.00 0.40 C ATOM 0 H THR A 24 -22.380 -2.480 10.766 1.00 0.34 H new ATOM 0 HA THR A 24 -20.893 -3.429 13.046 1.00 0.30 H new ATOM 0 HB THR A 24 -19.961 -5.045 11.342 1.00 0.32 H new ATOM 0 HG21 THR A 24 -22.073 -6.275 11.005 1.00 0.40 H new ATOM 0 HG22 THR A 24 -21.950 -5.616 12.653 1.00 0.40 H new ATOM 0 HG23 THR A 24 -22.988 -4.815 11.450 1.00 0.40 H new ATOM 358 N GLY A 25 -19.565 -1.179 11.477 1.00 0.30 N ATOM 359 CA GLY A 25 -18.361 -0.420 11.186 1.00 0.32 C ATOM 360 C GLY A 25 -17.640 -0.958 9.968 1.00 0.28 C ATOM 361 O GLY A 25 -16.432 -0.778 9.818 1.00 0.33 O ATOM 0 H GLY A 25 -20.425 -0.631 11.492 1.00 0.30 H new ATOM 0 HA2 GLY A 25 -18.621 0.626 11.023 1.00 0.32 H new ATOM 0 HA3 GLY A 25 -17.694 -0.452 12.047 1.00 0.32 H new ATOM 365 N LYS A 26 -18.393 -1.625 9.100 1.00 0.22 N ATOM 366 CA LYS A 26 -17.842 -2.211 7.886 1.00 0.19 C ATOM 367 C LYS A 26 -18.667 -1.802 6.667 1.00 0.20 C ATOM 368 O LYS A 26 -19.845 -1.471 6.788 1.00 0.23 O ATOM 369 CB LYS A 26 -17.809 -3.736 8.017 1.00 0.20 C ATOM 370 CG LYS A 26 -16.753 -4.237 8.989 1.00 0.25 C ATOM 371 CD LYS A 26 -16.787 -5.752 9.125 1.00 0.62 C ATOM 372 CE LYS A 26 -16.272 -6.440 7.871 1.00 0.62 C ATOM 373 NZ LYS A 26 -16.575 -7.897 7.869 1.00 1.10 N ATOM 0 H LYS A 26 -19.395 -1.773 9.218 1.00 0.22 H new ATOM 0 HA LYS A 26 -16.826 -1.842 7.749 1.00 0.19 H new ATOM 0 HB2 LYS A 26 -18.788 -4.086 8.344 1.00 0.20 H new ATOM 0 HB3 LYS A 26 -17.625 -4.173 7.036 1.00 0.20 H new ATOM 0 HG2 LYS A 26 -15.766 -3.924 8.647 1.00 0.25 H new ATOM 0 HG3 LYS A 26 -16.912 -3.780 9.966 1.00 0.25 H new ATOM 0 HD2 LYS A 26 -16.183 -6.054 9.980 1.00 0.62 H new ATOM 0 HD3 LYS A 26 -17.808 -6.077 9.325 1.00 0.62 H new ATOM 0 HE2 LYS A 26 -16.720 -5.975 6.993 1.00 0.62 H new ATOM 0 HE3 LYS A 26 -15.195 -6.294 7.794 1.00 0.62 H new ATOM 0 HZ1 LYS A 26 -16.283 -8.311 6.961 1.00 1.10 H new ATOM 0 HZ2 LYS A 26 -16.058 -8.360 8.643 1.00 1.10 H new ATOM 0 HZ3 LYS A 26 -17.597 -8.039 8.001 1.00 1.10 H new ATOM 387 N ILE A 27 -18.039 -1.822 5.493 1.00 0.22 N ATOM 388 CA ILE A 27 -18.720 -1.450 4.255 1.00 0.26 C ATOM 389 C ILE A 27 -18.757 -2.616 3.271 1.00 0.24 C ATOM 390 O ILE A 27 -17.741 -3.253 3.013 1.00 0.25 O ATOM 391 CB ILE A 27 -18.035 -0.246 3.583 1.00 0.34 C ATOM 392 CG1 ILE A 27 -16.577 -0.575 3.253 1.00 0.40 C ATOM 393 CG2 ILE A 27 -18.121 0.976 4.486 1.00 0.33 C ATOM 394 CD1 ILE A 27 -15.853 0.534 2.525 1.00 0.50 C ATOM 0 H ILE A 27 -17.062 -2.091 5.373 1.00 0.22 H new ATOM 0 HA ILE A 27 -19.741 -1.178 4.524 1.00 0.26 H new ATOM 0 HB ILE A 27 -18.552 -0.024 2.650 1.00 0.34 H new ATOM 0 HG12 ILE A 27 -16.046 -0.797 4.178 1.00 0.40 H new ATOM 0 HG13 ILE A 27 -16.547 -1.478 2.643 1.00 0.40 H new ATOM 0 HG21 ILE A 27 -17.633 1.822 4.001 1.00 0.33 H new ATOM 0 HG22 ILE A 27 -19.167 1.218 4.672 1.00 0.33 H new ATOM 0 HG23 ILE A 27 -17.624 0.765 5.433 1.00 0.33 H new ATOM 0 HD11 ILE A 27 -14.826 0.228 2.325 1.00 0.50 H new ATOM 0 HD12 ILE A 27 -16.360 0.742 1.582 1.00 0.50 H new ATOM 0 HD13 ILE A 27 -15.851 1.433 3.141 1.00 0.50 H new ATOM 406 N ALA A 28 -19.938 -2.893 2.728 1.00 0.26 N ATOM 407 CA ALA A 28 -20.105 -3.985 1.772 1.00 0.26 C ATOM 408 C ALA A 28 -19.065 -3.911 0.661 1.00 0.23 C ATOM 409 O ALA A 28 -18.876 -2.862 0.044 1.00 0.25 O ATOM 410 CB ALA A 28 -21.508 -3.960 1.186 1.00 0.30 C ATOM 0 H ALA A 28 -20.794 -2.377 2.933 1.00 0.26 H new ATOM 0 HA ALA A 28 -19.960 -4.925 2.304 1.00 0.26 H new ATOM 0 HB1 ALA A 28 -21.620 -4.779 0.475 1.00 0.30 H new ATOM 0 HB2 ALA A 28 -22.239 -4.072 1.987 1.00 0.30 H new ATOM 0 HB3 ALA A 28 -21.672 -3.011 0.675 1.00 0.30 H new ATOM 416 N THR A 29 -18.388 -5.030 0.417 1.00 0.27 N ATOM 417 CA THR A 29 -17.367 -5.100 -0.621 1.00 0.30 C ATOM 418 C THR A 29 -17.971 -4.819 -1.991 1.00 0.29 C ATOM 419 O THR A 29 -17.267 -4.450 -2.931 1.00 0.39 O ATOM 420 CB THR A 29 -16.681 -6.479 -0.646 1.00 0.37 C ATOM 421 OG1 THR A 29 -17.642 -7.500 -0.937 1.00 1.03 O ATOM 422 CG2 THR A 29 -16.011 -6.773 0.689 1.00 0.96 C ATOM 0 H THR A 29 -18.530 -5.902 0.926 1.00 0.27 H new ATOM 0 HA THR A 29 -16.620 -4.341 -0.388 1.00 0.30 H new ATOM 0 HB THR A 29 -15.918 -6.467 -1.424 1.00 0.37 H new ATOM 0 HG1 THR A 29 -17.197 -8.373 -0.953 1.00 1.03 H new ATOM 0 HG21 THR A 29 -15.533 -7.752 0.648 1.00 0.96 H new ATOM 0 HG22 THR A 29 -15.260 -6.011 0.895 1.00 0.96 H new ATOM 0 HG23 THR A 29 -16.760 -6.767 1.481 1.00 0.96 H new ATOM 430 N ARG A 30 -19.283 -5.003 -2.092 1.00 0.25 N ATOM 431 CA ARG A 30 -20.000 -4.763 -3.338 1.00 0.29 C ATOM 432 C ARG A 30 -20.283 -3.275 -3.504 1.00 0.28 C ATOM 433 O ARG A 30 -20.944 -2.855 -4.454 1.00 0.44 O ATOM 434 CB ARG A 30 -21.310 -5.553 -3.345 1.00 0.35 C ATOM 435 CG ARG A 30 -21.114 -7.050 -3.181 1.00 0.43 C ATOM 436 CD ARG A 30 -22.343 -7.711 -2.579 1.00 0.83 C ATOM 437 NE ARG A 30 -23.547 -7.444 -3.360 1.00 1.56 N ATOM 438 CZ ARG A 30 -24.774 -7.758 -2.955 1.00 2.17 C ATOM 439 NH1 ARG A 30 -24.957 -8.357 -1.785 1.00 2.25 N ATOM 440 NH2 ARG A 30 -25.820 -7.473 -3.719 1.00 3.08 N ATOM 0 H ARG A 30 -19.873 -5.319 -1.322 1.00 0.25 H new ATOM 0 HA ARG A 30 -19.381 -5.095 -4.172 1.00 0.29 H new ATOM 0 HB2 ARG A 30 -21.950 -5.188 -2.542 1.00 0.35 H new ATOM 0 HB3 ARG A 30 -21.835 -5.363 -4.281 1.00 0.35 H new ATOM 0 HG2 ARG A 30 -20.897 -7.498 -4.151 1.00 0.43 H new ATOM 0 HG3 ARG A 30 -20.250 -7.237 -2.543 1.00 0.43 H new ATOM 0 HD2 ARG A 30 -22.182 -8.787 -2.518 1.00 0.83 H new ATOM 0 HD3 ARG A 30 -22.485 -7.352 -1.560 1.00 0.83 H new ATOM 0 HE ARG A 30 -23.441 -6.991 -4.268 1.00 1.56 H new ATOM 0 HH11 ARG A 30 -24.155 -8.578 -1.194 1.00 2.25 H new ATOM 0 HH12 ARG A 30 -25.899 -8.597 -1.477 1.00 2.25 H new ATOM 0 HH21 ARG A 30 -25.684 -7.012 -4.619 1.00 3.08 H new ATOM 0 HH22 ARG A 30 -26.761 -7.715 -3.407 1.00 3.08 H new ATOM 454 N GLU A 31 -19.770 -2.486 -2.566 1.00 0.22 N ATOM 455 CA GLU A 31 -19.950 -1.041 -2.585 1.00 0.23 C ATOM 456 C GLU A 31 -18.604 -0.336 -2.681 1.00 0.21 C ATOM 457 O GLU A 31 -18.543 0.883 -2.829 1.00 0.21 O ATOM 458 CB GLU A 31 -20.691 -0.581 -1.328 1.00 0.30 C ATOM 459 CG GLU A 31 -22.159 -0.975 -1.310 1.00 0.32 C ATOM 460 CD GLU A 31 -22.888 -0.456 -0.084 1.00 1.30 C ATOM 461 OE1 GLU A 31 -22.784 -1.095 0.983 1.00 2.26 O ATOM 462 OE2 GLU A 31 -23.565 0.588 -0.194 1.00 1.40 O ATOM 0 H GLU A 31 -19.222 -2.828 -1.777 1.00 0.22 H new ATOM 0 HA GLU A 31 -20.544 -0.782 -3.461 1.00 0.23 H new ATOM 0 HB2 GLU A 31 -20.199 -1.003 -0.451 1.00 0.30 H new ATOM 0 HB3 GLU A 31 -20.613 0.503 -1.246 1.00 0.30 H new ATOM 0 HG2 GLU A 31 -22.645 -0.591 -2.207 1.00 0.32 H new ATOM 0 HG3 GLU A 31 -22.240 -2.061 -1.344 1.00 0.32 H new ATOM 469 N LEU A 32 -17.525 -1.112 -2.592 1.00 0.21 N ATOM 470 CA LEU A 32 -16.182 -0.554 -2.680 1.00 0.24 C ATOM 471 C LEU A 32 -16.027 0.242 -3.970 1.00 0.23 C ATOM 472 O LEU A 32 -15.591 1.390 -3.944 1.00 0.25 O ATOM 473 CB LEU A 32 -15.127 -1.663 -2.607 1.00 0.29 C ATOM 474 CG LEU A 32 -13.671 -1.182 -2.638 1.00 0.44 C ATOM 475 CD1 LEU A 32 -12.775 -2.132 -1.860 1.00 1.04 C ATOM 476 CD2 LEU A 32 -13.178 -1.053 -4.073 1.00 1.37 C ATOM 0 H LEU A 32 -17.557 -2.123 -2.460 1.00 0.21 H new ATOM 0 HA LEU A 32 -16.031 0.116 -1.833 1.00 0.24 H new ATOM 0 HB2 LEU A 32 -15.285 -2.233 -1.692 1.00 0.29 H new ATOM 0 HB3 LEU A 32 -15.285 -2.348 -3.440 1.00 0.29 H new ATOM 0 HG LEU A 32 -13.629 -0.200 -2.166 1.00 0.44 H new ATOM 0 HD11 LEU A 32 -11.747 -1.773 -1.895 1.00 1.04 H new ATOM 0 HD12 LEU A 32 -13.108 -2.179 -0.823 1.00 1.04 H new ATOM 0 HD13 LEU A 32 -12.827 -3.126 -2.304 1.00 1.04 H new ATOM 0 HD21 LEU A 32 -12.143 -0.711 -4.073 1.00 1.37 H new ATOM 0 HD22 LEU A 32 -13.239 -2.023 -4.567 1.00 1.37 H new ATOM 0 HD23 LEU A 32 -13.798 -0.333 -4.607 1.00 1.37 H new ATOM 488 N GLY A 33 -16.383 -0.376 -5.094 1.00 0.25 N ATOM 489 CA GLY A 33 -16.288 0.306 -6.373 1.00 0.28 C ATOM 490 C GLY A 33 -16.992 1.645 -6.341 1.00 0.27 C ATOM 491 O GLY A 33 -16.433 2.665 -6.750 1.00 0.32 O ATOM 0 H GLY A 33 -16.734 -1.333 -5.142 1.00 0.25 H new ATOM 0 HA2 GLY A 33 -15.239 0.451 -6.632 1.00 0.28 H new ATOM 0 HA3 GLY A 33 -16.725 -0.318 -7.153 1.00 0.28 H new ATOM 495 N THR A 34 -18.226 1.639 -5.845 1.00 0.23 N ATOM 496 CA THR A 34 -19.009 2.856 -5.731 1.00 0.24 C ATOM 497 C THR A 34 -18.282 3.857 -4.845 1.00 0.22 C ATOM 498 O THR A 34 -18.342 5.068 -5.064 1.00 0.23 O ATOM 499 CB THR A 34 -20.398 2.567 -5.132 1.00 0.26 C ATOM 500 OG1 THR A 34 -21.087 1.603 -5.937 1.00 0.31 O ATOM 501 CG2 THR A 34 -21.225 3.839 -5.038 1.00 0.29 C ATOM 0 H THR A 34 -18.703 0.800 -5.516 1.00 0.23 H new ATOM 0 HA THR A 34 -19.138 3.269 -6.732 1.00 0.24 H new ATOM 0 HB THR A 34 -20.259 2.170 -4.127 1.00 0.26 H new ATOM 0 HG1 THR A 34 -21.969 1.423 -5.549 1.00 0.31 H new ATOM 0 HG21 THR A 34 -22.201 3.608 -4.612 1.00 0.29 H new ATOM 0 HG22 THR A 34 -20.713 4.560 -4.401 1.00 0.29 H new ATOM 0 HG23 THR A 34 -21.355 4.263 -6.034 1.00 0.29 H new ATOM 509 N LEU A 35 -17.586 3.328 -3.842 1.00 0.22 N ATOM 510 CA LEU A 35 -16.833 4.153 -2.915 1.00 0.24 C ATOM 511 C LEU A 35 -15.619 4.757 -3.612 1.00 0.25 C ATOM 512 O LEU A 35 -15.151 5.833 -3.246 1.00 0.29 O ATOM 513 CB LEU A 35 -16.393 3.324 -1.706 1.00 0.29 C ATOM 514 CG LEU A 35 -15.688 4.108 -0.600 1.00 0.42 C ATOM 515 CD1 LEU A 35 -16.609 5.174 -0.030 1.00 1.24 C ATOM 516 CD2 LEU A 35 -15.217 3.168 0.497 1.00 1.16 C ATOM 0 H LEU A 35 -17.531 2.327 -3.654 1.00 0.22 H new ATOM 0 HA LEU A 35 -17.474 4.963 -2.568 1.00 0.24 H new ATOM 0 HB2 LEU A 35 -17.271 2.837 -1.281 1.00 0.29 H new ATOM 0 HB3 LEU A 35 -15.726 2.534 -2.051 1.00 0.29 H new ATOM 0 HG LEU A 35 -14.817 4.603 -1.029 1.00 0.42 H new ATOM 0 HD11 LEU A 35 -16.089 5.722 0.756 1.00 1.24 H new ATOM 0 HD12 LEU A 35 -16.900 5.864 -0.822 1.00 1.24 H new ATOM 0 HD13 LEU A 35 -17.499 4.702 0.385 1.00 1.24 H new ATOM 0 HD21 LEU A 35 -14.717 3.741 1.277 1.00 1.16 H new ATOM 0 HD22 LEU A 35 -16.075 2.647 0.923 1.00 1.16 H new ATOM 0 HD23 LEU A 35 -14.521 2.440 0.079 1.00 1.16 H new ATOM 528 N MET A 36 -15.112 4.051 -4.619 1.00 0.28 N ATOM 529 CA MET A 36 -13.965 4.526 -5.381 1.00 0.32 C ATOM 530 C MET A 36 -14.403 5.624 -6.340 1.00 0.30 C ATOM 531 O MET A 36 -13.591 6.423 -6.802 1.00 0.40 O ATOM 532 CB MET A 36 -13.318 3.379 -6.159 1.00 0.45 C ATOM 533 CG MET A 36 -12.858 2.230 -5.279 1.00 0.51 C ATOM 534 SD MET A 36 -11.644 2.743 -4.050 1.00 1.10 S ATOM 535 CE MET A 36 -10.145 2.066 -4.754 1.00 0.69 C ATOM 0 H MET A 36 -15.478 3.149 -4.925 1.00 0.28 H new ATOM 0 HA MET A 36 -13.228 4.927 -4.685 1.00 0.32 H new ATOM 0 HB2 MET A 36 -14.031 3.001 -6.892 1.00 0.45 H new ATOM 0 HB3 MET A 36 -12.463 3.765 -6.715 1.00 0.45 H new ATOM 0 HG2 MET A 36 -13.721 1.796 -4.773 1.00 0.51 H new ATOM 0 HG3 MET A 36 -12.428 1.447 -5.904 1.00 0.51 H new ATOM 0 HE1 MET A 36 -9.279 2.528 -4.279 1.00 0.69 H new ATOM 0 HE2 MET A 36 -10.119 0.989 -4.588 1.00 0.69 H new ATOM 0 HE3 MET A 36 -10.122 2.268 -5.825 1.00 0.69 H new ATOM 545 N ARG A 37 -15.698 5.641 -6.643 1.00 0.30 N ATOM 546 CA ARG A 37 -16.266 6.647 -7.533 1.00 0.34 C ATOM 547 C ARG A 37 -16.390 7.985 -6.810 1.00 0.33 C ATOM 548 O ARG A 37 -16.048 9.032 -7.357 1.00 0.43 O ATOM 549 CB ARG A 37 -17.633 6.191 -8.045 1.00 0.44 C ATOM 550 CG ARG A 37 -17.567 4.935 -8.901 1.00 0.64 C ATOM 551 CD ARG A 37 -18.952 4.455 -9.303 1.00 0.70 C ATOM 552 NE ARG A 37 -18.890 3.280 -10.167 1.00 1.40 N ATOM 553 CZ ARG A 37 -19.936 2.505 -10.441 1.00 1.73 C ATOM 554 NH1 ARG A 37 -21.123 2.776 -9.917 1.00 1.52 N ATOM 555 NH2 ARG A 37 -19.793 1.458 -11.241 1.00 2.69 N ATOM 0 H ARG A 37 -16.375 4.967 -6.284 1.00 0.30 H new ATOM 0 HA ARG A 37 -15.599 6.774 -8.386 1.00 0.34 H new ATOM 0 HB2 ARG A 37 -18.289 6.008 -7.194 1.00 0.44 H new ATOM 0 HB3 ARG A 37 -18.082 6.996 -8.627 1.00 0.44 H new ATOM 0 HG2 ARG A 37 -16.977 5.135 -9.796 1.00 0.64 H new ATOM 0 HG3 ARG A 37 -17.054 4.146 -8.351 1.00 0.64 H new ATOM 0 HD2 ARG A 37 -19.528 4.218 -8.409 1.00 0.70 H new ATOM 0 HD3 ARG A 37 -19.479 5.258 -9.819 1.00 0.70 H new ATOM 0 HE ARG A 37 -17.992 3.039 -10.585 1.00 1.40 H new ATOM 0 HH11 ARG A 37 -21.237 3.581 -9.301 1.00 1.52 H new ATOM 0 HH12 ARG A 37 -21.923 2.179 -10.130 1.00 1.52 H new ATOM 0 HH21 ARG A 37 -18.881 1.247 -11.646 1.00 2.69 H new ATOM 0 HH22 ARG A 37 -20.595 0.864 -11.451 1.00 2.69 H new ATOM 569 N THR A 38 -16.884 7.938 -5.575 1.00 0.31 N ATOM 570 CA THR A 38 -17.039 9.142 -4.763 1.00 0.39 C ATOM 571 C THR A 38 -15.676 9.659 -4.312 1.00 0.36 C ATOM 572 O THR A 38 -15.552 10.785 -3.829 1.00 0.43 O ATOM 573 CB THR A 38 -17.925 8.888 -3.528 1.00 0.50 C ATOM 574 OG1 THR A 38 -18.036 10.087 -2.751 1.00 1.06 O ATOM 575 CG2 THR A 38 -17.354 7.773 -2.665 1.00 0.61 C ATOM 0 H THR A 38 -17.184 7.079 -5.115 1.00 0.31 H new ATOM 0 HA THR A 38 -17.528 9.891 -5.386 1.00 0.39 H new ATOM 0 HB THR A 38 -18.912 8.584 -3.876 1.00 0.50 H new ATOM 0 HG1 THR A 38 -17.192 10.584 -2.793 1.00 1.06 H new ATOM 0 HG21 THR A 38 -17.999 7.615 -1.801 1.00 0.61 H new ATOM 0 HG22 THR A 38 -17.298 6.854 -3.248 1.00 0.61 H new ATOM 0 HG23 THR A 38 -16.356 8.050 -2.327 1.00 0.61 H new ATOM 583 N LEU A 39 -14.657 8.821 -4.478 1.00 0.30 N ATOM 584 CA LEU A 39 -13.291 9.165 -4.098 1.00 0.33 C ATOM 585 C LEU A 39 -12.413 9.286 -5.341 1.00 0.33 C ATOM 586 O LEU A 39 -12.743 8.748 -6.396 1.00 0.31 O ATOM 587 CB LEU A 39 -12.711 8.100 -3.160 1.00 0.38 C ATOM 588 CG LEU A 39 -13.473 7.889 -1.850 1.00 0.64 C ATOM 589 CD1 LEU A 39 -12.923 6.680 -1.105 1.00 1.26 C ATOM 590 CD2 LEU A 39 -13.394 9.132 -0.976 1.00 1.07 C ATOM 0 H LEU A 39 -14.754 7.888 -4.878 1.00 0.30 H new ATOM 0 HA LEU A 39 -13.310 10.122 -3.577 1.00 0.33 H new ATOM 0 HB2 LEU A 39 -12.674 7.151 -3.695 1.00 0.38 H new ATOM 0 HB3 LEU A 39 -11.683 8.372 -2.922 1.00 0.38 H new ATOM 0 HG LEU A 39 -14.520 7.704 -2.089 1.00 0.64 H new ATOM 0 HD11 LEU A 39 -13.475 6.543 -0.175 1.00 1.26 H new ATOM 0 HD12 LEU A 39 -13.031 5.790 -1.725 1.00 1.26 H new ATOM 0 HD13 LEU A 39 -11.868 6.840 -0.880 1.00 1.26 H new ATOM 0 HD21 LEU A 39 -13.942 8.961 -0.050 1.00 1.07 H new ATOM 0 HD22 LEU A 39 -12.351 9.349 -0.746 1.00 1.07 H new ATOM 0 HD23 LEU A 39 -13.832 9.978 -1.506 1.00 1.07 H new ATOM 602 N GLY A 40 -11.312 10.022 -5.218 1.00 0.42 N ATOM 603 CA GLY A 40 -10.409 10.203 -6.343 1.00 0.47 C ATOM 604 C GLY A 40 -9.614 8.952 -6.685 1.00 0.43 C ATOM 605 O GLY A 40 -8.455 9.043 -7.092 1.00 0.69 O ATOM 0 H GLY A 40 -11.029 10.496 -4.361 1.00 0.42 H new ATOM 0 HA2 GLY A 40 -10.985 10.509 -7.216 1.00 0.47 H new ATOM 0 HA3 GLY A 40 -9.717 11.014 -6.117 1.00 0.47 H new ATOM 609 N GLN A 41 -10.233 7.784 -6.518 1.00 0.44 N ATOM 610 CA GLN A 41 -9.577 6.517 -6.821 1.00 0.40 C ATOM 611 C GLN A 41 -9.890 6.063 -8.245 1.00 0.51 C ATOM 612 O GLN A 41 -9.086 6.251 -9.157 1.00 1.45 O ATOM 613 CB GLN A 41 -10.020 5.439 -5.829 1.00 0.48 C ATOM 614 CG GLN A 41 -9.293 5.493 -4.497 1.00 0.74 C ATOM 615 CD GLN A 41 -7.871 4.976 -4.587 1.00 1.06 C ATOM 616 OE1 GLN A 41 -7.398 4.363 -3.509 1.00 1.97 O flip ATOM 617 NE2 GLN A 41 -7.208 5.115 -5.615 1.00 1.30 N flip ATOM 0 H GLN A 41 -11.189 7.691 -6.174 1.00 0.44 H new ATOM 0 HA GLN A 41 -8.501 6.669 -6.734 1.00 0.40 H new ATOM 0 HB2 GLN A 41 -11.091 5.540 -5.652 1.00 0.48 H new ATOM 0 HB3 GLN A 41 -9.862 4.459 -6.278 1.00 0.48 H new ATOM 0 HG2 GLN A 41 -9.279 6.521 -4.136 1.00 0.74 H new ATOM 0 HG3 GLN A 41 -9.844 4.905 -3.763 1.00 0.74 H new ATOM 0 HE21 GLN A 41 -7.611 5.593 -6.421 1.00 1.30 H new ATOM 0 HE22 GLN A 41 -6.256 4.752 -5.661 1.00 1.30 H new ATOM 626 N ASN A 42 -11.066 5.463 -8.420 1.00 0.74 N ATOM 627 CA ASN A 42 -11.497 4.977 -9.728 1.00 0.68 C ATOM 628 C ASN A 42 -10.484 3.989 -10.308 1.00 0.53 C ATOM 629 O ASN A 42 -9.730 4.325 -11.220 1.00 0.62 O ATOM 630 CB ASN A 42 -11.696 6.151 -10.689 1.00 0.85 C ATOM 631 CG ASN A 42 -12.708 7.153 -10.170 1.00 1.87 C ATOM 632 OD1 ASN A 42 -13.906 7.036 -10.430 1.00 2.57 O ATOM 633 ND2 ASN A 42 -12.231 8.148 -9.431 1.00 2.66 N ATOM 0 H ASN A 42 -11.738 5.302 -7.670 1.00 0.74 H new ATOM 0 HA ASN A 42 -12.446 4.456 -9.600 1.00 0.68 H new ATOM 0 HB2 ASN A 42 -10.741 6.652 -10.850 1.00 0.85 H new ATOM 0 HB3 ASN A 42 -12.025 5.774 -11.657 1.00 0.85 H new ATOM 0 HD21 ASN A 42 -12.865 8.853 -9.055 1.00 2.66 H new ATOM 0 HD22 ASN A 42 -11.231 8.207 -9.240 1.00 2.66 H new ATOM 640 N PRO A 43 -10.455 2.750 -9.781 1.00 0.41 N ATOM 641 CA PRO A 43 -9.531 1.714 -10.248 1.00 0.40 C ATOM 642 C PRO A 43 -10.001 1.054 -11.540 1.00 0.39 C ATOM 643 O PRO A 43 -11.104 1.319 -12.018 1.00 0.51 O ATOM 644 CB PRO A 43 -9.539 0.706 -9.102 1.00 0.44 C ATOM 645 CG PRO A 43 -10.901 0.821 -8.511 1.00 0.45 C ATOM 646 CD PRO A 43 -11.319 2.259 -8.686 1.00 0.44 C ATOM 0 HA PRO A 43 -8.545 2.117 -10.480 1.00 0.40 H new ATOM 0 HB2 PRO A 43 -9.347 -0.305 -9.462 1.00 0.44 H new ATOM 0 HB3 PRO A 43 -8.767 0.935 -8.367 1.00 0.44 H new ATOM 0 HG2 PRO A 43 -11.599 0.150 -9.011 1.00 0.45 H new ATOM 0 HG3 PRO A 43 -10.892 0.544 -7.457 1.00 0.45 H new ATOM 0 HD2 PRO A 43 -12.375 2.340 -8.944 1.00 0.44 H new ATOM 0 HD3 PRO A 43 -11.169 2.833 -7.771 1.00 0.44 H new ATOM 654 N THR A 44 -9.158 0.192 -12.098 1.00 0.35 N ATOM 655 CA THR A 44 -9.490 -0.510 -13.332 1.00 0.36 C ATOM 656 C THR A 44 -10.607 -1.523 -13.095 1.00 0.32 C ATOM 657 O THR A 44 -10.766 -2.028 -11.984 1.00 0.33 O ATOM 658 CB THR A 44 -8.261 -1.236 -13.915 1.00 0.43 C ATOM 659 OG1 THR A 44 -7.145 -0.339 -13.976 1.00 0.73 O ATOM 660 CG2 THR A 44 -8.557 -1.772 -15.308 1.00 0.69 C ATOM 0 H THR A 44 -8.241 -0.037 -11.716 1.00 0.35 H new ATOM 0 HA THR A 44 -9.826 0.240 -14.048 1.00 0.36 H new ATOM 0 HB THR A 44 -8.021 -2.075 -13.262 1.00 0.43 H new ATOM 0 HG1 THR A 44 -6.368 -0.808 -14.346 1.00 0.73 H new ATOM 0 HG21 THR A 44 -7.675 -2.280 -15.698 1.00 0.69 H new ATOM 0 HG22 THR A 44 -9.388 -2.475 -15.258 1.00 0.69 H new ATOM 0 HG23 THR A 44 -8.821 -0.945 -15.968 1.00 0.69 H new ATOM 668 N GLU A 45 -11.378 -1.815 -14.138 1.00 0.32 N ATOM 669 CA GLU A 45 -12.482 -2.763 -14.031 1.00 0.33 C ATOM 670 C GLU A 45 -12.002 -4.108 -13.492 1.00 0.32 C ATOM 671 O GLU A 45 -12.518 -4.605 -12.490 1.00 0.34 O ATOM 672 CB GLU A 45 -13.149 -2.956 -15.393 1.00 0.40 C ATOM 673 CG GLU A 45 -14.370 -3.862 -15.351 1.00 1.14 C ATOM 674 CD GLU A 45 -15.010 -4.041 -16.713 1.00 1.84 C ATOM 675 OE1 GLU A 45 -14.594 -4.960 -17.450 1.00 2.70 O ATOM 676 OE2 GLU A 45 -15.929 -3.262 -17.045 1.00 2.04 O ATOM 0 H GLU A 45 -11.259 -1.409 -15.066 1.00 0.32 H new ATOM 0 HA GLU A 45 -13.210 -2.353 -13.331 1.00 0.33 H new ATOM 0 HB2 GLU A 45 -13.443 -1.982 -15.785 1.00 0.40 H new ATOM 0 HB3 GLU A 45 -12.421 -3.374 -16.089 1.00 0.40 H new ATOM 0 HG2 GLU A 45 -14.081 -4.837 -14.958 1.00 1.14 H new ATOM 0 HG3 GLU A 45 -15.104 -3.445 -14.661 1.00 1.14 H new ATOM 683 N ALA A 46 -11.009 -4.686 -14.162 1.00 0.33 N ATOM 684 CA ALA A 46 -10.460 -5.977 -13.762 1.00 0.37 C ATOM 685 C ALA A 46 -10.012 -5.975 -12.303 1.00 0.33 C ATOM 686 O ALA A 46 -10.342 -6.886 -11.546 1.00 0.34 O ATOM 687 CB ALA A 46 -9.297 -6.356 -14.664 1.00 0.46 C ATOM 0 H ALA A 46 -10.567 -4.279 -14.987 1.00 0.33 H new ATOM 0 HA ALA A 46 -11.253 -6.717 -13.865 1.00 0.37 H new ATOM 0 HB1 ALA A 46 -8.896 -7.321 -14.355 1.00 0.46 H new ATOM 0 HB2 ALA A 46 -9.643 -6.420 -15.696 1.00 0.46 H new ATOM 0 HB3 ALA A 46 -8.517 -5.599 -14.589 1.00 0.46 H new ATOM 693 N GLU A 47 -9.262 -4.947 -11.915 1.00 0.32 N ATOM 694 CA GLU A 47 -8.767 -4.839 -10.547 1.00 0.32 C ATOM 695 C GLU A 47 -9.925 -4.841 -9.561 1.00 0.28 C ATOM 696 O GLU A 47 -9.914 -5.577 -8.577 1.00 0.28 O ATOM 697 CB GLU A 47 -7.934 -3.565 -10.380 1.00 0.37 C ATOM 698 CG GLU A 47 -7.295 -3.432 -9.008 1.00 0.43 C ATOM 699 CD GLU A 47 -6.440 -2.186 -8.882 1.00 1.24 C ATOM 700 OE1 GLU A 47 -5.235 -2.256 -9.204 1.00 1.27 O ATOM 701 OE2 GLU A 47 -6.976 -1.138 -8.461 1.00 2.23 O ATOM 0 H GLU A 47 -8.985 -4.179 -12.527 1.00 0.32 H new ATOM 0 HA GLU A 47 -8.133 -5.701 -10.341 1.00 0.32 H new ATOM 0 HB2 GLU A 47 -7.152 -3.550 -11.139 1.00 0.37 H new ATOM 0 HB3 GLU A 47 -8.570 -2.699 -10.561 1.00 0.37 H new ATOM 0 HG2 GLU A 47 -8.076 -3.411 -8.248 1.00 0.43 H new ATOM 0 HG3 GLU A 47 -6.681 -4.311 -8.810 1.00 0.43 H new ATOM 708 N LEU A 48 -10.925 -4.017 -9.844 1.00 0.29 N ATOM 709 CA LEU A 48 -12.098 -3.913 -8.990 1.00 0.31 C ATOM 710 C LEU A 48 -12.773 -5.270 -8.822 1.00 0.30 C ATOM 711 O LEU A 48 -13.242 -5.611 -7.737 1.00 0.35 O ATOM 712 CB LEU A 48 -13.084 -2.902 -9.579 1.00 0.35 C ATOM 713 CG LEU A 48 -14.258 -2.528 -8.673 1.00 0.65 C ATOM 714 CD1 LEU A 48 -13.756 -1.863 -7.400 1.00 1.34 C ATOM 715 CD2 LEU A 48 -15.223 -1.615 -9.410 1.00 1.36 C ATOM 0 H LEU A 48 -10.946 -3.409 -10.663 1.00 0.29 H new ATOM 0 HA LEU A 48 -11.778 -3.570 -8.006 1.00 0.31 H new ATOM 0 HB2 LEU A 48 -12.538 -1.993 -9.832 1.00 0.35 H new ATOM 0 HB3 LEU A 48 -13.480 -3.306 -10.511 1.00 0.35 H new ATOM 0 HG LEU A 48 -14.789 -3.439 -8.397 1.00 0.65 H new ATOM 0 HD11 LEU A 48 -14.604 -1.603 -6.766 1.00 1.34 H new ATOM 0 HD12 LEU A 48 -13.100 -2.550 -6.865 1.00 1.34 H new ATOM 0 HD13 LEU A 48 -13.203 -0.959 -7.655 1.00 1.34 H new ATOM 0 HD21 LEU A 48 -16.054 -1.357 -8.753 1.00 1.36 H new ATOM 0 HD22 LEU A 48 -14.704 -0.706 -9.713 1.00 1.36 H new ATOM 0 HD23 LEU A 48 -15.605 -2.126 -10.294 1.00 1.36 H new ATOM 727 N GLN A 49 -12.810 -6.047 -9.900 1.00 0.30 N ATOM 728 CA GLN A 49 -13.434 -7.366 -9.871 1.00 0.35 C ATOM 729 C GLN A 49 -12.584 -8.372 -9.097 1.00 0.35 C ATOM 730 O GLN A 49 -13.113 -9.296 -8.481 1.00 0.38 O ATOM 731 CB GLN A 49 -13.663 -7.875 -11.296 1.00 0.41 C ATOM 732 CG GLN A 49 -14.586 -6.991 -12.121 1.00 0.48 C ATOM 733 CD GLN A 49 -15.989 -6.916 -11.553 1.00 0.78 C ATOM 734 OE1 GLN A 49 -16.462 -7.851 -10.907 1.00 1.22 O ATOM 735 NE2 GLN A 49 -16.665 -5.799 -11.797 1.00 1.19 N ATOM 0 H GLN A 49 -12.416 -5.787 -10.804 1.00 0.30 H new ATOM 0 HA GLN A 49 -14.392 -7.266 -9.361 1.00 0.35 H new ATOM 0 HB2 GLN A 49 -12.701 -7.954 -11.803 1.00 0.41 H new ATOM 0 HB3 GLN A 49 -14.082 -8.880 -11.250 1.00 0.41 H new ATOM 0 HG2 GLN A 49 -14.167 -5.986 -12.175 1.00 0.48 H new ATOM 0 HG3 GLN A 49 -14.632 -7.373 -13.141 1.00 0.48 H new ATOM 0 HE21 GLN A 49 -16.233 -5.049 -12.337 1.00 1.19 H new ATOM 0 HE22 GLN A 49 -17.616 -5.691 -11.444 1.00 1.19 H new ATOM 744 N ASP A 50 -11.266 -8.188 -9.131 1.00 0.34 N ATOM 745 CA ASP A 50 -10.350 -9.091 -8.440 1.00 0.38 C ATOM 746 C ASP A 50 -10.381 -8.882 -6.927 1.00 0.35 C ATOM 747 O ASP A 50 -10.607 -9.825 -6.169 1.00 0.39 O ATOM 748 CB ASP A 50 -8.924 -8.905 -8.958 1.00 0.43 C ATOM 749 CG ASP A 50 -8.729 -9.496 -10.342 1.00 0.49 C ATOM 750 OD1 ASP A 50 -8.827 -10.733 -10.480 1.00 0.62 O ATOM 751 OD2 ASP A 50 -8.479 -8.720 -11.288 1.00 0.53 O ATOM 0 H ASP A 50 -10.810 -7.423 -9.629 1.00 0.34 H new ATOM 0 HA ASP A 50 -10.681 -10.109 -8.647 1.00 0.38 H new ATOM 0 HB2 ASP A 50 -8.685 -7.842 -8.983 1.00 0.43 H new ATOM 0 HB3 ASP A 50 -8.225 -9.372 -8.265 1.00 0.43 H new ATOM 756 N LEU A 51 -10.149 -7.646 -6.491 1.00 0.32 N ATOM 757 CA LEU A 51 -10.136 -7.327 -5.066 1.00 0.33 C ATOM 758 C LEU A 51 -11.484 -7.625 -4.413 1.00 0.32 C ATOM 759 O LEU A 51 -11.540 -8.098 -3.278 1.00 0.35 O ATOM 760 CB LEU A 51 -9.755 -5.863 -4.852 1.00 0.36 C ATOM 761 CG LEU A 51 -10.674 -4.849 -5.527 1.00 0.30 C ATOM 762 CD1 LEU A 51 -11.630 -4.235 -4.516 1.00 0.39 C ATOM 763 CD2 LEU A 51 -9.855 -3.771 -6.218 1.00 0.31 C ATOM 0 H LEU A 51 -9.968 -6.850 -7.103 1.00 0.32 H new ATOM 0 HA LEU A 51 -9.388 -7.961 -4.591 1.00 0.33 H new ATOM 0 HB2 LEU A 51 -9.741 -5.660 -3.781 1.00 0.36 H new ATOM 0 HB3 LEU A 51 -8.740 -5.711 -5.219 1.00 0.36 H new ATOM 0 HG LEU A 51 -11.266 -5.367 -6.281 1.00 0.30 H new ATOM 0 HD11 LEU A 51 -12.277 -3.515 -5.017 1.00 0.39 H new ATOM 0 HD12 LEU A 51 -12.240 -5.020 -4.068 1.00 0.39 H new ATOM 0 HD13 LEU A 51 -11.060 -3.730 -3.736 1.00 0.39 H new ATOM 0 HD21 LEU A 51 -10.524 -3.055 -6.695 1.00 0.31 H new ATOM 0 HD22 LEU A 51 -9.237 -3.256 -5.482 1.00 0.31 H new ATOM 0 HD23 LEU A 51 -9.215 -4.228 -6.973 1.00 0.31 H new ATOM 775 N ILE A 52 -12.570 -7.342 -5.128 1.00 0.31 N ATOM 776 CA ILE A 52 -13.907 -7.595 -4.604 1.00 0.34 C ATOM 777 C ILE A 52 -14.171 -9.095 -4.497 1.00 0.37 C ATOM 778 O ILE A 52 -14.815 -9.559 -3.555 1.00 0.41 O ATOM 779 CB ILE A 52 -14.994 -6.940 -5.486 1.00 0.38 C ATOM 780 CG1 ILE A 52 -14.923 -5.414 -5.369 1.00 0.42 C ATOM 781 CG2 ILE A 52 -16.381 -7.442 -5.099 1.00 0.50 C ATOM 782 CD1 ILE A 52 -15.851 -4.685 -6.319 1.00 0.50 C ATOM 0 H ILE A 52 -12.550 -6.940 -6.065 1.00 0.31 H new ATOM 0 HA ILE A 52 -13.954 -7.150 -3.610 1.00 0.34 H new ATOM 0 HB ILE A 52 -14.810 -7.220 -6.523 1.00 0.38 H new ATOM 0 HG12 ILE A 52 -15.165 -5.126 -4.346 1.00 0.42 H new ATOM 0 HG13 ILE A 52 -13.899 -5.092 -5.557 1.00 0.42 H new ATOM 0 HG21 ILE A 52 -17.130 -6.967 -5.733 1.00 0.50 H new ATOM 0 HG22 ILE A 52 -16.427 -8.523 -5.231 1.00 0.50 H new ATOM 0 HG23 ILE A 52 -16.579 -7.195 -4.056 1.00 0.50 H new ATOM 0 HD11 ILE A 52 -15.745 -3.609 -6.178 1.00 0.50 H new ATOM 0 HD12 ILE A 52 -15.596 -4.943 -7.347 1.00 0.50 H new ATOM 0 HD13 ILE A 52 -16.881 -4.977 -6.117 1.00 0.50 H new ATOM 794 N ALA A 53 -13.657 -9.850 -5.464 1.00 0.41 N ATOM 795 CA ALA A 53 -13.835 -11.297 -5.481 1.00 0.50 C ATOM 796 C ALA A 53 -13.098 -11.953 -4.321 1.00 0.49 C ATOM 797 O ALA A 53 -13.672 -12.750 -3.580 1.00 0.58 O ATOM 798 CB ALA A 53 -13.358 -11.872 -6.806 1.00 0.59 C ATOM 0 H ALA A 53 -13.114 -9.483 -6.246 1.00 0.41 H new ATOM 0 HA ALA A 53 -14.898 -11.509 -5.368 1.00 0.50 H new ATOM 0 HB1 ALA A 53 -13.497 -12.953 -6.805 1.00 0.59 H new ATOM 0 HB2 ALA A 53 -13.933 -11.433 -7.621 1.00 0.59 H new ATOM 0 HB3 ALA A 53 -12.301 -11.642 -6.943 1.00 0.59 H new ATOM 804 N GLU A 54 -11.820 -11.616 -4.169 1.00 0.45 N ATOM 805 CA GLU A 54 -11.008 -12.175 -3.097 1.00 0.51 C ATOM 806 C GLU A 54 -11.574 -11.785 -1.736 1.00 0.50 C ATOM 807 O GLU A 54 -11.573 -12.586 -0.801 1.00 0.59 O ATOM 808 CB GLU A 54 -9.555 -11.705 -3.218 1.00 0.57 C ATOM 809 CG GLU A 54 -9.387 -10.199 -3.104 1.00 1.07 C ATOM 810 CD GLU A 54 -7.934 -9.770 -3.152 1.00 1.77 C ATOM 811 OE1 GLU A 54 -7.411 -9.572 -4.269 1.00 1.99 O ATOM 812 OE2 GLU A 54 -7.320 -9.630 -2.073 1.00 2.54 O ATOM 0 H GLU A 54 -11.327 -10.960 -4.774 1.00 0.45 H new ATOM 0 HA GLU A 54 -11.031 -13.261 -3.186 1.00 0.51 H new ATOM 0 HB2 GLU A 54 -8.961 -12.187 -2.442 1.00 0.57 H new ATOM 0 HB3 GLU A 54 -9.155 -12.034 -4.177 1.00 0.57 H new ATOM 0 HG2 GLU A 54 -9.932 -9.714 -3.914 1.00 1.07 H new ATOM 0 HG3 GLU A 54 -9.832 -9.857 -2.170 1.00 1.07 H new ATOM 819 N ALA A 55 -12.057 -10.551 -1.631 1.00 0.43 N ATOM 820 CA ALA A 55 -12.630 -10.063 -0.382 1.00 0.47 C ATOM 821 C ALA A 55 -13.999 -10.683 -0.129 1.00 0.46 C ATOM 822 O ALA A 55 -14.498 -10.671 0.997 1.00 0.53 O ATOM 823 CB ALA A 55 -12.728 -8.546 -0.400 1.00 0.50 C ATOM 0 H ALA A 55 -12.063 -9.873 -2.393 1.00 0.43 H new ATOM 0 HA ALA A 55 -11.969 -10.360 0.432 1.00 0.47 H new ATOM 0 HB1 ALA A 55 -13.158 -8.198 0.539 1.00 0.50 H new ATOM 0 HB2 ALA A 55 -11.733 -8.119 -0.524 1.00 0.50 H new ATOM 0 HB3 ALA A 55 -13.364 -8.232 -1.228 1.00 0.50 H new ATOM 829 N GLU A 56 -14.604 -11.225 -1.183 1.00 0.41 N ATOM 830 CA GLU A 56 -15.916 -11.852 -1.072 1.00 0.44 C ATOM 831 C GLU A 56 -15.820 -13.167 -0.301 1.00 0.49 C ATOM 832 O GLU A 56 -16.520 -13.367 0.692 1.00 0.63 O ATOM 833 CB GLU A 56 -16.505 -12.097 -2.463 1.00 0.47 C ATOM 834 CG GLU A 56 -17.985 -12.453 -2.453 1.00 0.52 C ATOM 835 CD GLU A 56 -18.247 -13.869 -1.977 1.00 1.26 C ATOM 836 OE1 GLU A 56 -18.008 -14.812 -2.759 1.00 1.95 O ATOM 837 OE2 GLU A 56 -18.691 -14.034 -0.821 1.00 1.66 O ATOM 0 H GLU A 56 -14.206 -11.242 -2.122 1.00 0.41 H new ATOM 0 HA GLU A 56 -16.575 -11.178 -0.524 1.00 0.44 H new ATOM 0 HB2 GLU A 56 -16.361 -11.203 -3.070 1.00 0.47 H new ATOM 0 HB3 GLU A 56 -15.951 -12.903 -2.945 1.00 0.47 H new ATOM 0 HG2 GLU A 56 -18.518 -11.754 -1.808 1.00 0.52 H new ATOM 0 HG3 GLU A 56 -18.390 -12.332 -3.458 1.00 0.52 H new ATOM 844 N ASN A 57 -14.951 -14.059 -0.768 1.00 0.53 N ATOM 845 CA ASN A 57 -14.765 -15.355 -0.120 1.00 0.68 C ATOM 846 C ASN A 57 -13.686 -15.279 0.952 1.00 0.79 C ATOM 847 O ASN A 57 -12.841 -16.166 1.063 1.00 1.19 O ATOM 848 CB ASN A 57 -14.411 -16.424 -1.155 1.00 0.87 C ATOM 849 CG ASN A 57 -13.158 -16.082 -1.938 1.00 1.67 C ATOM 850 OD1 ASN A 57 -13.332 -15.399 -3.064 1.00 2.38 O flip ATOM 851 ND2 ASN A 57 -12.047 -16.427 -1.538 1.00 2.48 N flip ATOM 0 H ASN A 57 -14.366 -13.910 -1.590 1.00 0.53 H new ATOM 0 HA ASN A 57 -15.704 -15.630 0.361 1.00 0.68 H new ATOM 0 HB2 ASN A 57 -14.271 -17.380 -0.651 1.00 0.87 H new ATOM 0 HB3 ASN A 57 -15.245 -16.547 -1.846 1.00 0.87 H new ATOM 0 HD21 ASN A 57 -11.958 -16.951 -0.667 1.00 2.48 H new ATOM 0 HD22 ASN A 57 -11.214 -16.189 -2.077 1.00 2.48 H new ATOM 858 N ASN A 58 -13.733 -14.214 1.741 1.00 0.84 N ATOM 859 CA ASN A 58 -12.771 -14.005 2.814 1.00 1.03 C ATOM 860 C ASN A 58 -13.363 -13.115 3.899 1.00 1.09 C ATOM 861 O ASN A 58 -12.843 -13.042 5.013 1.00 1.84 O ATOM 862 CB ASN A 58 -11.489 -13.379 2.264 1.00 1.12 C ATOM 863 CG ASN A 58 -10.561 -14.399 1.632 1.00 1.81 C ATOM 864 OD1 ASN A 58 -10.502 -15.591 2.214 1.00 2.48 O flip ATOM 865 ND2 ASN A 58 -9.896 -14.115 0.636 1.00 2.14 N flip ATOM 0 H ASN A 58 -14.433 -13.477 1.657 1.00 0.84 H new ATOM 0 HA ASN A 58 -12.531 -14.974 3.252 1.00 1.03 H new ATOM 0 HB2 ASN A 58 -11.748 -12.622 1.523 1.00 1.12 H new ATOM 0 HB3 ASN A 58 -10.964 -12.868 3.071 1.00 1.12 H new ATOM 0 HD21 ASN A 58 -9.972 -13.187 0.220 1.00 2.14 H new ATOM 0 HD22 ASN A 58 -9.269 -14.808 0.227 1.00 2.14 H new ATOM 872 N ASN A 59 -14.455 -12.439 3.563 1.00 1.04 N ATOM 873 CA ASN A 59 -15.128 -11.555 4.504 1.00 1.01 C ATOM 874 C ASN A 59 -16.639 -11.607 4.303 1.00 0.88 C ATOM 875 O ASN A 59 -17.359 -10.689 4.695 1.00 0.91 O ATOM 876 CB ASN A 59 -14.623 -10.121 4.340 1.00 1.08 C ATOM 877 CG ASN A 59 -13.116 -10.020 4.468 1.00 1.31 C ATOM 878 OD1 ASN A 59 -12.394 -10.043 3.471 1.00 2.05 O ATOM 879 ND2 ASN A 59 -12.634 -9.919 5.700 1.00 1.51 N ATOM 0 H ASN A 59 -14.893 -12.487 2.643 1.00 1.04 H new ATOM 0 HA ASN A 59 -14.902 -11.894 5.515 1.00 1.01 H new ATOM 0 HB2 ASN A 59 -14.928 -9.741 3.365 1.00 1.08 H new ATOM 0 HB3 ASN A 59 -15.092 -9.486 5.091 1.00 1.08 H new ATOM 0 HD21 ASN A 59 -11.627 -9.857 5.850 1.00 1.51 H new ATOM 0 HD22 ASN A 59 -13.270 -9.904 6.497 1.00 1.51 H new ATOM 886 N ASN A 60 -17.107 -12.694 3.688 1.00 0.80 N ATOM 887 CA ASN A 60 -18.531 -12.893 3.426 1.00 0.76 C ATOM 888 C ASN A 60 -19.069 -11.843 2.457 1.00 0.74 C ATOM 889 O ASN A 60 -19.169 -12.090 1.255 1.00 1.42 O ATOM 890 CB ASN A 60 -19.326 -12.865 4.735 1.00 0.86 C ATOM 891 CG ASN A 60 -18.787 -13.843 5.761 1.00 0.95 C ATOM 892 OD1 ASN A 60 -18.234 -14.955 5.289 1.00 1.47 O flip ATOM 893 ND2 ASN A 60 -18.867 -13.603 6.966 1.00 1.19 N flip ATOM 0 H ASN A 60 -16.513 -13.456 3.360 1.00 0.80 H new ATOM 0 HA ASN A 60 -18.651 -13.872 2.962 1.00 0.76 H new ATOM 0 HB2 ASN A 60 -19.302 -11.857 5.150 1.00 0.86 H new ATOM 0 HB3 ASN A 60 -20.370 -13.099 4.528 1.00 0.86 H new ATOM 0 HD21 ASN A 60 -19.300 -12.736 7.286 1.00 1.19 H new ATOM 0 HD22 ASN A 60 -18.501 -14.271 7.644 1.00 1.19 H new ATOM 900 N GLY A 61 -19.416 -10.674 2.986 1.00 0.43 N ATOM 901 CA GLY A 61 -19.939 -9.608 2.153 1.00 0.40 C ATOM 902 C GLY A 61 -19.703 -8.237 2.756 1.00 0.32 C ATOM 903 O GLY A 61 -20.367 -7.267 2.393 1.00 0.38 O ATOM 0 H GLY A 61 -19.344 -10.446 3.978 1.00 0.43 H new ATOM 0 HA2 GLY A 61 -19.471 -9.655 1.170 1.00 0.40 H new ATOM 0 HA3 GLY A 61 -21.008 -9.758 2.004 1.00 0.40 H new ATOM 907 N GLN A 62 -18.751 -8.161 3.681 1.00 0.36 N ATOM 908 CA GLN A 62 -18.424 -6.906 4.343 1.00 0.29 C ATOM 909 C GLN A 62 -16.923 -6.622 4.277 1.00 0.31 C ATOM 910 O GLN A 62 -16.111 -7.536 4.141 1.00 0.38 O ATOM 911 CB GLN A 62 -18.896 -6.936 5.800 1.00 0.27 C ATOM 912 CG GLN A 62 -20.337 -6.489 5.988 1.00 0.27 C ATOM 913 CD GLN A 62 -20.466 -4.980 6.075 1.00 0.23 C ATOM 914 OE1 GLN A 62 -21.359 -4.457 6.743 1.00 0.25 O ATOM 915 NE2 GLN A 62 -19.568 -4.269 5.402 1.00 0.21 N ATOM 0 H GLN A 62 -18.192 -8.957 3.989 1.00 0.36 H new ATOM 0 HA GLN A 62 -18.942 -6.103 3.820 1.00 0.29 H new ATOM 0 HB2 GLN A 62 -18.786 -7.949 6.187 1.00 0.27 H new ATOM 0 HB3 GLN A 62 -18.246 -6.295 6.396 1.00 0.27 H new ATOM 0 HG2 GLN A 62 -20.940 -6.855 5.157 1.00 0.27 H new ATOM 0 HG3 GLN A 62 -20.739 -6.939 6.896 1.00 0.27 H new ATOM 0 HE21 GLN A 62 -18.844 -4.742 4.861 1.00 0.21 H new ATOM 0 HE22 GLN A 62 -19.602 -3.250 5.427 1.00 0.21 H new ATOM 924 N LEU A 63 -16.569 -5.343 4.369 1.00 0.30 N ATOM 925 CA LEU A 63 -15.174 -4.911 4.314 1.00 0.36 C ATOM 926 C LEU A 63 -14.820 -4.090 5.551 1.00 0.31 C ATOM 927 O LEU A 63 -15.691 -3.464 6.148 1.00 0.27 O ATOM 928 CB LEU A 63 -14.943 -4.075 3.053 1.00 0.45 C ATOM 929 CG LEU A 63 -13.483 -3.849 2.673 1.00 0.79 C ATOM 930 CD1 LEU A 63 -12.944 -5.044 1.903 1.00 1.41 C ATOM 931 CD2 LEU A 63 -13.339 -2.571 1.858 1.00 1.43 C ATOM 0 H LEU A 63 -17.236 -4.580 4.483 1.00 0.30 H new ATOM 0 HA LEU A 63 -14.534 -5.793 4.287 1.00 0.36 H new ATOM 0 HB2 LEU A 63 -15.446 -4.562 2.218 1.00 0.45 H new ATOM 0 HB3 LEU A 63 -15.419 -3.104 3.190 1.00 0.45 H new ATOM 0 HG LEU A 63 -12.898 -3.740 3.586 1.00 0.79 H new ATOM 0 HD11 LEU A 63 -11.901 -4.867 1.639 1.00 1.41 H new ATOM 0 HD12 LEU A 63 -13.015 -5.938 2.523 1.00 1.41 H new ATOM 0 HD13 LEU A 63 -13.529 -5.185 0.994 1.00 1.41 H new ATOM 0 HD21 LEU A 63 -12.292 -2.424 1.595 1.00 1.43 H new ATOM 0 HD22 LEU A 63 -13.934 -2.651 0.948 1.00 1.43 H new ATOM 0 HD23 LEU A 63 -13.688 -1.723 2.447 1.00 1.43 H new ATOM 943 N ASN A 64 -13.544 -4.073 5.924 1.00 0.33 N ATOM 944 CA ASN A 64 -13.112 -3.320 7.099 1.00 0.31 C ATOM 945 C ASN A 64 -12.216 -2.157 6.717 1.00 0.31 C ATOM 946 O ASN A 64 -11.610 -2.146 5.645 1.00 0.33 O ATOM 947 CB ASN A 64 -12.361 -4.202 8.097 1.00 0.34 C ATOM 948 CG ASN A 64 -13.071 -5.497 8.389 1.00 0.53 C ATOM 949 OD1 ASN A 64 -13.831 -5.601 9.350 1.00 1.19 O ATOM 950 ND2 ASN A 64 -12.814 -6.496 7.565 1.00 0.99 N ATOM 0 H ASN A 64 -12.797 -4.567 5.436 1.00 0.33 H new ATOM 0 HA ASN A 64 -14.022 -2.943 7.566 1.00 0.31 H new ATOM 0 HB2 ASN A 64 -11.367 -4.419 7.705 1.00 0.34 H new ATOM 0 HB3 ASN A 64 -12.223 -3.652 9.028 1.00 0.34 H new ATOM 0 HD21 ASN A 64 -13.254 -7.404 7.712 1.00 0.99 H new ATOM 0 HD22 ASN A 64 -12.176 -6.359 6.781 1.00 0.99 H new ATOM 957 N PHE A 65 -12.154 -1.177 7.603 1.00 0.30 N ATOM 958 CA PHE A 65 -11.337 0.013 7.390 1.00 0.30 C ATOM 959 C PHE A 65 -9.935 -0.363 6.912 1.00 0.29 C ATOM 960 O PHE A 65 -9.396 0.252 5.992 1.00 0.31 O ATOM 961 CB PHE A 65 -11.249 0.820 8.687 1.00 0.32 C ATOM 962 CG PHE A 65 -10.343 2.014 8.601 1.00 0.33 C ATOM 963 CD1 PHE A 65 -10.751 3.162 7.942 1.00 0.37 C ATOM 964 CD2 PHE A 65 -9.084 1.988 9.177 1.00 0.35 C ATOM 965 CE1 PHE A 65 -9.920 4.263 7.858 1.00 0.40 C ATOM 966 CE2 PHE A 65 -8.248 3.084 9.097 1.00 0.38 C ATOM 967 CZ PHE A 65 -8.667 4.225 8.447 1.00 0.39 C ATOM 0 H PHE A 65 -12.664 -1.180 8.486 1.00 0.30 H new ATOM 0 HA PHE A 65 -11.808 0.620 6.617 1.00 0.30 H new ATOM 0 HB2 PHE A 65 -12.249 1.154 8.964 1.00 0.32 H new ATOM 0 HB3 PHE A 65 -10.898 0.167 9.486 1.00 0.32 H new ATOM 0 HD1 PHE A 65 -11.730 3.197 7.488 1.00 0.37 H new ATOM 0 HD2 PHE A 65 -8.752 1.100 9.695 1.00 0.35 H new ATOM 0 HE1 PHE A 65 -10.246 5.150 7.335 1.00 0.40 H new ATOM 0 HE2 PHE A 65 -7.265 3.047 9.544 1.00 0.38 H new ATOM 0 HZ PHE A 65 -8.019 5.088 8.397 1.00 0.39 H new ATOM 977 N THR A 66 -9.354 -1.381 7.539 1.00 0.31 N ATOM 978 CA THR A 66 -8.015 -1.839 7.183 1.00 0.32 C ATOM 979 C THR A 66 -7.980 -2.465 5.798 1.00 0.31 C ATOM 980 O THR A 66 -6.984 -2.350 5.088 1.00 0.30 O ATOM 981 CB THR A 66 -7.482 -2.866 8.194 1.00 0.40 C ATOM 982 OG1 THR A 66 -8.573 -3.549 8.825 1.00 0.56 O ATOM 983 CG2 THR A 66 -6.622 -2.189 9.241 1.00 0.81 C ATOM 0 H THR A 66 -9.790 -1.905 8.297 1.00 0.31 H new ATOM 0 HA THR A 66 -7.381 -0.952 7.193 1.00 0.32 H new ATOM 0 HB THR A 66 -6.870 -3.590 7.657 1.00 0.40 H new ATOM 0 HG1 THR A 66 -8.223 -4.202 9.466 1.00 0.56 H new ATOM 0 HG21 THR A 66 -6.255 -2.934 9.947 1.00 0.81 H new ATOM 0 HG22 THR A 66 -5.777 -1.700 8.757 1.00 0.81 H new ATOM 0 HG23 THR A 66 -7.215 -1.445 9.774 1.00 0.81 H new ATOM 991 N GLU A 67 -9.056 -3.141 5.420 1.00 0.34 N ATOM 992 CA GLU A 67 -9.121 -3.770 4.111 1.00 0.37 C ATOM 993 C GLU A 67 -9.081 -2.712 3.015 1.00 0.32 C ATOM 994 O GLU A 67 -8.250 -2.771 2.107 1.00 0.35 O ATOM 995 CB GLU A 67 -10.388 -4.616 3.988 1.00 0.42 C ATOM 996 CG GLU A 67 -10.433 -5.787 4.958 1.00 0.49 C ATOM 997 CD GLU A 67 -9.286 -6.758 4.752 1.00 0.88 C ATOM 998 OE1 GLU A 67 -9.397 -7.628 3.863 1.00 1.36 O ATOM 999 OE2 GLU A 67 -8.278 -6.648 5.481 1.00 1.21 O ATOM 0 H GLU A 67 -9.888 -3.267 5.996 1.00 0.34 H new ATOM 0 HA GLU A 67 -8.257 -4.424 3.996 1.00 0.37 H new ATOM 0 HB2 GLU A 67 -11.257 -3.981 4.157 1.00 0.42 H new ATOM 0 HB3 GLU A 67 -10.464 -4.996 2.969 1.00 0.42 H new ATOM 0 HG2 GLU A 67 -10.405 -5.409 5.980 1.00 0.49 H new ATOM 0 HG3 GLU A 67 -11.378 -6.316 4.839 1.00 0.49 H new ATOM 1006 N PHE A 68 -9.984 -1.741 3.114 1.00 0.29 N ATOM 1007 CA PHE A 68 -10.049 -0.657 2.145 1.00 0.27 C ATOM 1008 C PHE A 68 -8.733 0.114 2.123 1.00 0.26 C ATOM 1009 O PHE A 68 -8.142 0.322 1.065 1.00 0.32 O ATOM 1010 CB PHE A 68 -11.205 0.288 2.487 1.00 0.26 C ATOM 1011 CG PHE A 68 -11.491 1.305 1.418 1.00 0.30 C ATOM 1012 CD1 PHE A 68 -11.779 0.903 0.125 1.00 0.38 C ATOM 1013 CD2 PHE A 68 -11.476 2.661 1.706 1.00 0.35 C ATOM 1014 CE1 PHE A 68 -12.043 1.830 -0.862 1.00 0.48 C ATOM 1015 CE2 PHE A 68 -11.740 3.595 0.721 1.00 0.45 C ATOM 1016 CZ PHE A 68 -12.024 3.179 -0.564 1.00 0.51 C ATOM 0 H PHE A 68 -10.681 -1.685 3.857 1.00 0.29 H new ATOM 0 HA PHE A 68 -10.222 -1.084 1.157 1.00 0.27 H new ATOM 0 HB2 PHE A 68 -12.104 -0.302 2.665 1.00 0.26 H new ATOM 0 HB3 PHE A 68 -10.975 0.807 3.418 1.00 0.26 H new ATOM 0 HD1 PHE A 68 -11.797 -0.150 -0.114 1.00 0.38 H new ATOM 0 HD2 PHE A 68 -11.256 2.991 2.710 1.00 0.35 H new ATOM 0 HE1 PHE A 68 -12.264 1.502 -1.867 1.00 0.48 H new ATOM 0 HE2 PHE A 68 -11.724 4.649 0.957 1.00 0.45 H new ATOM 0 HZ PHE A 68 -12.231 3.906 -1.335 1.00 0.51 H new ATOM 1026 N CYS A 69 -8.281 0.522 3.305 1.00 0.23 N ATOM 1027 CA CYS A 69 -7.032 1.266 3.443 1.00 0.23 C ATOM 1028 C CYS A 69 -5.870 0.507 2.816 1.00 0.27 C ATOM 1029 O CYS A 69 -5.100 1.068 2.035 1.00 0.31 O ATOM 1030 CB CYS A 69 -6.740 1.526 4.922 1.00 0.23 C ATOM 1031 SG CYS A 69 -7.386 3.094 5.538 1.00 0.75 S ATOM 0 H CYS A 69 -8.764 0.349 4.186 1.00 0.23 H new ATOM 0 HA CYS A 69 -7.144 2.216 2.921 1.00 0.23 H new ATOM 0 HB2 CYS A 69 -7.164 0.714 5.513 1.00 0.23 H new ATOM 0 HB3 CYS A 69 -5.661 1.504 5.077 1.00 0.23 H new ATOM 0 HG CYS A 69 -7.700 2.971 6.793 1.00 0.75 H new ATOM 1037 N GLY A 70 -5.747 -0.769 3.170 1.00 0.30 N ATOM 1038 CA GLY A 70 -4.680 -1.594 2.633 1.00 0.35 C ATOM 1039 C GLY A 70 -4.554 -1.460 1.131 1.00 0.37 C ATOM 1040 O GLY A 70 -3.458 -1.238 0.610 1.00 0.41 O ATOM 0 H GLY A 70 -6.370 -1.247 3.821 1.00 0.30 H new ATOM 0 HA2 GLY A 70 -3.736 -1.314 3.101 1.00 0.35 H new ATOM 0 HA3 GLY A 70 -4.866 -2.637 2.889 1.00 0.35 H new ATOM 1044 N ILE A 71 -5.675 -1.593 0.429 1.00 0.37 N ATOM 1045 CA ILE A 71 -5.671 -1.473 -1.021 1.00 0.41 C ATOM 1046 C ILE A 71 -5.274 -0.071 -1.443 1.00 0.40 C ATOM 1047 O ILE A 71 -4.463 0.112 -2.347 1.00 0.44 O ATOM 1048 CB ILE A 71 -7.037 -1.807 -1.633 1.00 0.42 C ATOM 1049 CG1 ILE A 71 -7.386 -3.265 -1.360 1.00 0.47 C ATOM 1050 CG2 ILE A 71 -7.016 -1.526 -3.128 1.00 0.46 C ATOM 1051 CD1 ILE A 71 -8.865 -3.500 -1.151 1.00 0.51 C ATOM 0 H ILE A 71 -6.590 -1.782 0.838 1.00 0.37 H new ATOM 0 HA ILE A 71 -4.941 -2.194 -1.390 1.00 0.41 H new ATOM 0 HB ILE A 71 -7.802 -1.180 -1.175 1.00 0.42 H new ATOM 0 HG12 ILE A 71 -7.043 -3.875 -2.196 1.00 0.47 H new ATOM 0 HG13 ILE A 71 -6.844 -3.601 -0.476 1.00 0.47 H new ATOM 0 HG21 ILE A 71 -7.989 -1.765 -3.557 1.00 0.46 H new ATOM 0 HG22 ILE A 71 -6.794 -0.472 -3.297 1.00 0.46 H new ATOM 0 HG23 ILE A 71 -6.250 -2.139 -3.603 1.00 0.46 H new ATOM 0 HD11 ILE A 71 -9.042 -4.559 -0.962 1.00 0.51 H new ATOM 0 HD12 ILE A 71 -9.209 -2.916 -0.297 1.00 0.51 H new ATOM 0 HD13 ILE A 71 -9.412 -3.195 -2.043 1.00 0.51 H new ATOM 1063 N MET A 72 -5.859 0.918 -0.786 1.00 0.38 N ATOM 1064 CA MET A 72 -5.556 2.310 -1.090 1.00 0.41 C ATOM 1065 C MET A 72 -4.059 2.553 -0.992 1.00 0.45 C ATOM 1066 O MET A 72 -3.527 3.463 -1.617 1.00 0.52 O ATOM 1067 CB MET A 72 -6.294 3.257 -0.142 1.00 0.39 C ATOM 1068 CG MET A 72 -7.808 3.166 -0.236 1.00 0.41 C ATOM 1069 SD MET A 72 -8.634 4.617 0.448 1.00 1.01 S ATOM 1070 CE MET A 72 -8.731 5.672 -0.998 1.00 0.58 C ATOM 0 H MET A 72 -6.544 0.785 -0.042 1.00 0.38 H new ATOM 0 HA MET A 72 -5.892 2.511 -2.107 1.00 0.41 H new ATOM 0 HB2 MET A 72 -5.990 3.040 0.882 1.00 0.39 H new ATOM 0 HB3 MET A 72 -5.987 4.281 -0.356 1.00 0.39 H new ATOM 0 HG2 MET A 72 -8.097 3.046 -1.280 1.00 0.41 H new ATOM 0 HG3 MET A 72 -8.148 2.276 0.293 1.00 0.41 H new ATOM 0 HE1 MET A 72 -9.036 6.674 -0.697 1.00 0.58 H new ATOM 0 HE2 MET A 72 -7.755 5.719 -1.480 1.00 0.58 H new ATOM 0 HE3 MET A 72 -9.461 5.265 -1.697 1.00 0.58 H new ATOM 1080 N ALA A 73 -3.380 1.732 -0.204 1.00 0.46 N ATOM 1081 CA ALA A 73 -1.941 1.866 -0.039 1.00 0.53 C ATOM 1082 C ALA A 73 -1.205 1.327 -1.260 1.00 0.59 C ATOM 1083 O ALA A 73 -0.334 1.994 -1.815 1.00 0.70 O ATOM 1084 CB ALA A 73 -1.482 1.150 1.221 1.00 0.54 C ATOM 0 H ALA A 73 -3.800 0.970 0.328 1.00 0.46 H new ATOM 0 HA ALA A 73 -1.705 2.925 0.060 1.00 0.53 H new ATOM 0 HB1 ALA A 73 -0.403 1.260 1.329 1.00 0.54 H new ATOM 0 HB2 ALA A 73 -1.980 1.584 2.088 1.00 0.54 H new ATOM 0 HB3 ALA A 73 -1.733 0.092 1.150 1.00 0.54 H new ATOM 1090 N LYS A 74 -1.565 0.120 -1.685 1.00 0.55 N ATOM 1091 CA LYS A 74 -0.926 -0.493 -2.845 1.00 0.62 C ATOM 1092 C LYS A 74 -1.229 0.293 -4.118 1.00 0.63 C ATOM 1093 O LYS A 74 -0.384 0.401 -5.007 1.00 0.70 O ATOM 1094 CB LYS A 74 -1.378 -1.949 -3.011 1.00 0.63 C ATOM 1095 CG LYS A 74 -2.857 -2.123 -3.308 1.00 0.65 C ATOM 1096 CD LYS A 74 -3.166 -3.556 -3.717 1.00 0.74 C ATOM 1097 CE LYS A 74 -4.603 -3.711 -4.188 1.00 0.73 C ATOM 1098 NZ LYS A 74 -4.919 -2.796 -5.321 1.00 1.38 N ATOM 0 H LYS A 74 -2.290 -0.449 -1.248 1.00 0.55 H new ATOM 0 HA LYS A 74 0.150 -0.476 -2.675 1.00 0.62 H new ATOM 0 HB2 LYS A 74 -0.803 -2.404 -3.817 1.00 0.63 H new ATOM 0 HB3 LYS A 74 -1.137 -2.496 -2.100 1.00 0.63 H new ATOM 0 HG2 LYS A 74 -3.442 -1.858 -2.427 1.00 0.65 H new ATOM 0 HG3 LYS A 74 -3.154 -1.441 -4.105 1.00 0.65 H new ATOM 0 HD2 LYS A 74 -2.487 -3.861 -4.514 1.00 0.74 H new ATOM 0 HD3 LYS A 74 -2.986 -4.222 -2.873 1.00 0.74 H new ATOM 0 HE2 LYS A 74 -4.775 -4.742 -4.496 1.00 0.73 H new ATOM 0 HE3 LYS A 74 -5.281 -3.509 -3.358 1.00 0.73 H new ATOM 0 HZ1 LYS A 74 -5.852 -3.037 -5.712 1.00 1.38 H new ATOM 0 HZ2 LYS A 74 -4.929 -1.813 -4.981 1.00 1.38 H new ATOM 0 HZ3 LYS A 74 -4.197 -2.899 -6.062 1.00 1.38 H new ATOM 1112 N GLN A 75 -2.437 0.838 -4.197 1.00 0.59 N ATOM 1113 CA GLN A 75 -2.861 1.597 -5.369 1.00 0.63 C ATOM 1114 C GLN A 75 -2.355 3.041 -5.353 1.00 0.67 C ATOM 1115 O GLN A 75 -1.696 3.481 -6.296 1.00 0.79 O ATOM 1116 CB GLN A 75 -4.383 1.576 -5.479 1.00 0.63 C ATOM 1117 CG GLN A 75 -4.926 2.389 -6.643 1.00 1.04 C ATOM 1118 CD GLN A 75 -6.399 2.133 -6.902 1.00 1.23 C ATOM 1119 OE1 GLN A 75 -6.866 2.233 -8.036 1.00 1.98 O ATOM 1120 NE2 GLN A 75 -7.139 1.801 -5.849 1.00 1.54 N ATOM 0 H GLN A 75 -3.142 0.769 -3.463 1.00 0.59 H new ATOM 0 HA GLN A 75 -2.419 1.115 -6.241 1.00 0.63 H new ATOM 0 HB2 GLN A 75 -4.716 0.543 -5.583 1.00 0.63 H new ATOM 0 HB3 GLN A 75 -4.810 1.957 -4.551 1.00 0.63 H new ATOM 0 HG2 GLN A 75 -4.776 3.450 -6.441 1.00 1.04 H new ATOM 0 HG3 GLN A 75 -4.357 2.153 -7.542 1.00 1.04 H new ATOM 0 HE21 GLN A 75 -6.710 1.730 -4.926 1.00 1.54 H new ATOM 0 HE22 GLN A 75 -8.136 1.618 -5.964 1.00 1.54 H new ATOM 1129 N MET A 76 -2.663 3.778 -4.286 1.00 0.65 N ATOM 1130 CA MET A 76 -2.266 5.172 -4.180 1.00 0.73 C ATOM 1131 C MET A 76 -0.775 5.350 -3.887 1.00 0.89 C ATOM 1132 O MET A 76 -0.068 6.021 -4.640 1.00 1.06 O ATOM 1133 CB MET A 76 -3.082 5.850 -3.087 1.00 0.76 C ATOM 1134 CG MET A 76 -4.583 5.687 -3.250 1.00 0.80 C ATOM 1135 SD MET A 76 -5.517 6.997 -2.434 1.00 1.20 S ATOM 1136 CE MET A 76 -4.847 6.916 -0.776 1.00 0.75 C ATOM 0 H MET A 76 -3.187 3.427 -3.484 1.00 0.65 H new ATOM 0 HA MET A 76 -2.458 5.633 -5.149 1.00 0.73 H new ATOM 0 HB2 MET A 76 -2.785 5.444 -2.120 1.00 0.76 H new ATOM 0 HB3 MET A 76 -2.841 6.913 -3.074 1.00 0.76 H new ATOM 0 HG2 MET A 76 -4.830 5.677 -4.312 1.00 0.80 H new ATOM 0 HG3 MET A 76 -4.886 4.722 -2.843 1.00 0.80 H new ATOM 0 HE1 MET A 76 -5.647 7.070 -0.052 1.00 0.75 H new ATOM 0 HE2 MET A 76 -4.394 5.938 -0.614 1.00 0.75 H new ATOM 0 HE3 MET A 76 -4.091 7.691 -0.651 1.00 0.75 H new ATOM 1146 N ARG A 77 -0.295 4.747 -2.802 1.00 0.96 N ATOM 1147 CA ARG A 77 1.108 4.885 -2.415 1.00 1.19 C ATOM 1148 C ARG A 77 2.047 4.197 -3.402 1.00 1.32 C ATOM 1149 O ARG A 77 2.945 4.834 -3.949 1.00 1.53 O ATOM 1150 CB ARG A 77 1.330 4.342 -0.996 1.00 1.43 C ATOM 1151 CG ARG A 77 2.735 3.816 -0.741 1.00 1.88 C ATOM 1152 CD ARG A 77 2.954 3.492 0.727 1.00 2.24 C ATOM 1153 NE ARG A 77 4.277 2.923 0.969 1.00 3.04 N ATOM 1154 CZ ARG A 77 4.649 2.379 2.125 1.00 3.73 C ATOM 1155 NH1 ARG A 77 3.807 2.342 3.150 1.00 3.83 N ATOM 1156 NH2 ARG A 77 5.867 1.875 2.257 1.00 4.69 N ATOM 0 H ARG A 77 -0.852 4.162 -2.179 1.00 0.96 H new ATOM 0 HA ARG A 77 1.345 5.949 -2.430 1.00 1.19 H new ATOM 0 HB2 ARG A 77 1.115 5.134 -0.279 1.00 1.43 H new ATOM 0 HB3 ARG A 77 0.615 3.541 -0.810 1.00 1.43 H new ATOM 0 HG2 ARG A 77 2.903 2.921 -1.340 1.00 1.88 H new ATOM 0 HG3 ARG A 77 3.466 4.558 -1.063 1.00 1.88 H new ATOM 0 HD2 ARG A 77 2.835 4.399 1.320 1.00 2.24 H new ATOM 0 HD3 ARG A 77 2.190 2.790 1.061 1.00 2.24 H new ATOM 0 HE ARG A 77 4.955 2.944 0.208 1.00 3.04 H new ATOM 0 HH11 ARG A 77 2.869 2.732 3.054 1.00 3.83 H new ATOM 0 HH12 ARG A 77 4.097 1.924 4.034 1.00 3.83 H new ATOM 0 HH21 ARG A 77 6.519 1.904 1.473 1.00 4.69 H new ATOM 0 HH22 ARG A 77 6.153 1.458 3.143 1.00 4.69 H new ATOM 1170 N GLU A 78 1.829 2.905 -3.632 1.00 1.44 N ATOM 1171 CA GLU A 78 2.673 2.134 -4.542 1.00 1.86 C ATOM 1172 C GLU A 78 4.125 2.134 -4.062 1.00 2.54 C ATOM 1173 O GLU A 78 4.578 1.174 -3.438 1.00 3.23 O ATOM 1174 CB GLU A 78 2.585 2.692 -5.966 1.00 2.05 C ATOM 1175 CG GLU A 78 3.419 1.920 -6.977 1.00 2.65 C ATOM 1176 CD GLU A 78 2.997 0.469 -7.097 1.00 3.46 C ATOM 1177 OE1 GLU A 78 3.473 -0.354 -6.287 1.00 3.90 O ATOM 1178 OE2 GLU A 78 2.193 0.155 -7.999 1.00 4.01 O ATOM 0 H GLU A 78 1.075 2.369 -3.201 1.00 1.44 H new ATOM 0 HA GLU A 78 2.311 1.106 -4.550 1.00 1.86 H new ATOM 0 HB2 GLU A 78 1.543 2.684 -6.286 1.00 2.05 H new ATOM 0 HB3 GLU A 78 2.909 3.733 -5.960 1.00 2.05 H new ATOM 0 HG2 GLU A 78 3.336 2.400 -7.952 1.00 2.65 H new ATOM 0 HG3 GLU A 78 4.469 1.966 -6.687 1.00 2.65 H new ATOM 1185 N THR A 79 4.847 3.215 -4.355 1.00 2.81 N ATOM 1186 CA THR A 79 6.243 3.344 -3.943 1.00 3.72 C ATOM 1187 C THR A 79 6.603 4.796 -3.647 1.00 3.90 C ATOM 1188 O THR A 79 7.690 5.252 -3.997 1.00 4.36 O ATOM 1189 CB THR A 79 7.209 2.813 -5.021 1.00 4.37 C ATOM 1190 OG1 THR A 79 6.852 3.342 -6.304 1.00 4.67 O ATOM 1191 CG2 THR A 79 7.190 1.292 -5.068 1.00 5.28 C ATOM 0 H THR A 79 4.487 4.014 -4.877 1.00 2.81 H new ATOM 0 HA THR A 79 6.350 2.746 -3.038 1.00 3.72 H new ATOM 0 HB THR A 79 8.217 3.138 -4.763 1.00 4.37 H new ATOM 0 HG1 THR A 79 7.472 3.001 -6.982 1.00 4.67 H new ATOM 0 HG21 THR A 79 7.880 0.943 -5.836 1.00 5.28 H new ATOM 0 HG22 THR A 79 7.494 0.894 -4.100 1.00 5.28 H new ATOM 0 HG23 THR A 79 6.182 0.948 -5.301 1.00 5.28 H new ATOM 1199 N ASP A 80 5.694 5.522 -2.998 1.00 3.93 N ATOM 1200 CA ASP A 80 5.942 6.924 -2.672 1.00 4.35 C ATOM 1201 C ASP A 80 6.701 7.048 -1.352 1.00 4.98 C ATOM 1202 O ASP A 80 6.796 8.132 -0.773 1.00 5.60 O ATOM 1203 CB ASP A 80 4.625 7.704 -2.601 1.00 4.57 C ATOM 1204 CG ASP A 80 3.981 7.661 -1.228 1.00 4.84 C ATOM 1205 OD1 ASP A 80 3.191 6.729 -0.972 1.00 4.80 O ATOM 1206 OD2 ASP A 80 4.273 8.553 -0.409 1.00 5.42 O ATOM 0 H ASP A 80 4.789 5.167 -2.691 1.00 3.93 H new ATOM 0 HA ASP A 80 6.556 7.351 -3.465 1.00 4.35 H new ATOM 0 HB2 ASP A 80 4.809 8.742 -2.877 1.00 4.57 H new ATOM 0 HB3 ASP A 80 3.929 7.298 -3.335 1.00 4.57 H new ATOM 1211 N THR A 81 7.251 5.930 -0.893 1.00 5.18 N ATOM 1212 CA THR A 81 8.004 5.893 0.356 1.00 6.15 C ATOM 1213 C THR A 81 9.341 6.623 0.229 1.00 6.80 C ATOM 1214 O THR A 81 10.359 6.032 -0.123 1.00 7.13 O ATOM 1215 CB THR A 81 8.241 4.442 0.810 1.00 6.60 C ATOM 1216 OG1 THR A 81 9.098 4.417 1.957 1.00 7.29 O ATOM 1217 CG2 THR A 81 8.849 3.600 -0.306 1.00 6.89 C ATOM 0 H THR A 81 7.189 5.031 -1.371 1.00 5.18 H new ATOM 0 HA THR A 81 7.405 6.407 1.108 1.00 6.15 H new ATOM 0 HB THR A 81 7.273 4.014 1.070 1.00 6.60 H new ATOM 0 HG1 THR A 81 9.241 3.489 2.238 1.00 7.29 H new ATOM 0 HG21 THR A 81 9.003 2.581 0.050 1.00 6.89 H new ATOM 0 HG22 THR A 81 8.174 3.588 -1.162 1.00 6.89 H new ATOM 0 HG23 THR A 81 9.806 4.028 -0.605 1.00 6.89 H new ATOM 1225 N GLU A 82 9.326 7.915 0.545 1.00 7.25 N ATOM 1226 CA GLU A 82 10.519 8.756 0.452 1.00 8.05 C ATOM 1227 C GLU A 82 11.735 8.140 1.150 1.00 8.92 C ATOM 1228 O GLU A 82 12.873 8.504 0.853 1.00 9.53 O ATOM 1229 CB GLU A 82 10.231 10.134 1.048 1.00 8.64 C ATOM 1230 CG GLU A 82 9.854 10.093 2.520 1.00 8.69 C ATOM 1231 CD GLU A 82 9.684 11.477 3.116 1.00 9.34 C ATOM 1232 OE1 GLU A 82 10.686 12.037 3.610 1.00 9.74 O ATOM 1233 OE2 GLU A 82 8.551 12.000 3.088 1.00 9.63 O ATOM 0 H GLU A 82 8.494 8.407 0.871 1.00 7.25 H new ATOM 0 HA GLU A 82 10.764 8.844 -0.607 1.00 8.05 H new ATOM 0 HB2 GLU A 82 11.111 10.765 0.924 1.00 8.64 H new ATOM 0 HB3 GLU A 82 9.422 10.601 0.487 1.00 8.64 H new ATOM 0 HG2 GLU A 82 8.926 9.534 2.638 1.00 8.69 H new ATOM 0 HG3 GLU A 82 10.623 9.555 3.074 1.00 8.69 H new ATOM 1240 N GLU A 83 11.501 7.210 2.073 1.00 9.15 N ATOM 1241 CA GLU A 83 12.598 6.576 2.803 1.00 10.17 C ATOM 1242 C GLU A 83 13.435 5.675 1.893 1.00 10.27 C ATOM 1243 O GLU A 83 14.646 5.867 1.756 1.00 11.05 O ATOM 1244 CB GLU A 83 12.048 5.759 3.973 1.00 10.55 C ATOM 1245 CG GLU A 83 11.324 6.597 5.013 1.00 10.83 C ATOM 1246 CD GLU A 83 12.216 7.652 5.639 1.00 11.60 C ATOM 1247 OE1 GLU A 83 12.992 7.306 6.554 1.00 12.11 O ATOM 1248 OE2 GLU A 83 12.139 8.822 5.211 1.00 11.85 O ATOM 0 H GLU A 83 10.571 6.880 2.332 1.00 9.15 H new ATOM 0 HA GLU A 83 13.244 7.368 3.181 1.00 10.17 H new ATOM 0 HB2 GLU A 83 11.364 5.003 3.587 1.00 10.55 H new ATOM 0 HB3 GLU A 83 12.870 5.229 4.454 1.00 10.55 H new ATOM 0 HG2 GLU A 83 10.465 7.082 4.549 1.00 10.83 H new ATOM 0 HG3 GLU A 83 10.937 5.944 5.795 1.00 10.83 H new ATOM 1255 N GLU A 84 12.783 4.706 1.261 1.00 9.63 N ATOM 1256 CA GLU A 84 13.473 3.781 0.369 1.00 9.95 C ATOM 1257 C GLU A 84 13.880 4.485 -0.919 1.00 9.87 C ATOM 1258 O GLU A 84 14.860 4.112 -1.566 1.00 10.51 O ATOM 1259 CB GLU A 84 12.579 2.581 0.048 1.00 9.47 C ATOM 1260 CG GLU A 84 13.253 1.540 -0.832 1.00 9.88 C ATOM 1261 CD GLU A 84 12.336 0.381 -1.172 1.00 10.40 C ATOM 1262 OE1 GLU A 84 12.231 -0.555 -0.351 1.00 10.87 O ATOM 1263 OE2 GLU A 84 11.719 0.410 -2.258 1.00 10.49 O ATOM 0 H GLU A 84 11.780 4.540 1.349 1.00 9.63 H new ATOM 0 HA GLU A 84 14.371 3.426 0.874 1.00 9.95 H new ATOM 0 HB2 GLU A 84 12.268 2.110 0.981 1.00 9.47 H new ATOM 0 HB3 GLU A 84 11.675 2.934 -0.448 1.00 9.47 H new ATOM 0 HG2 GLU A 84 13.591 2.013 -1.754 1.00 9.88 H new ATOM 0 HG3 GLU A 84 14.140 1.160 -0.325 1.00 9.88 H new ATOM 1270 N MET A 85 13.123 5.514 -1.274 1.00 9.31 N ATOM 1271 CA MET A 85 13.386 6.278 -2.481 1.00 9.45 C ATOM 1272 C MET A 85 14.648 7.113 -2.318 1.00 10.49 C ATOM 1273 O MET A 85 15.418 7.290 -3.264 1.00 11.09 O ATOM 1274 CB MET A 85 12.194 7.177 -2.796 1.00 8.75 C ATOM 1275 CG MET A 85 10.891 6.413 -2.946 1.00 7.71 C ATOM 1276 SD MET A 85 9.448 7.485 -2.841 1.00 7.19 S ATOM 1277 CE MET A 85 9.101 7.742 -4.575 1.00 6.73 C ATOM 0 H MET A 85 12.318 5.839 -0.738 1.00 9.31 H new ATOM 0 HA MET A 85 13.537 5.585 -3.309 1.00 9.45 H new ATOM 0 HB2 MET A 85 12.085 7.916 -2.002 1.00 8.75 H new ATOM 0 HB3 MET A 85 12.394 7.725 -3.717 1.00 8.75 H new ATOM 0 HG2 MET A 85 10.886 5.895 -3.905 1.00 7.71 H new ATOM 0 HG3 MET A 85 10.830 5.649 -2.171 1.00 7.71 H new ATOM 0 HE1 MET A 85 8.241 8.403 -4.680 1.00 6.73 H new ATOM 0 HE2 MET A 85 9.968 8.195 -5.056 1.00 6.73 H new ATOM 0 HE3 MET A 85 8.882 6.785 -5.048 1.00 6.73 H new ATOM 1287 N ARG A 86 14.858 7.620 -1.108 1.00 10.82 N ATOM 1288 CA ARG A 86 16.031 8.428 -0.818 1.00 11.88 C ATOM 1289 C ARG A 86 17.285 7.571 -0.872 1.00 12.66 C ATOM 1290 O ARG A 86 18.305 7.982 -1.427 1.00 13.43 O ATOM 1291 CB ARG A 86 15.903 9.096 0.550 1.00 12.21 C ATOM 1292 CG ARG A 86 16.922 10.198 0.780 1.00 13.16 C ATOM 1293 CD ARG A 86 16.705 10.888 2.118 1.00 13.63 C ATOM 1294 NE ARG A 86 17.781 11.823 2.433 1.00 14.25 N ATOM 1295 CZ ARG A 86 17.912 12.428 3.610 1.00 14.86 C ATOM 1296 NH1 ARG A 86 17.034 12.202 4.578 1.00 14.96 N ATOM 1297 NH2 ARG A 86 18.924 13.259 3.820 1.00 15.52 N ATOM 0 H ARG A 86 14.231 7.485 -0.315 1.00 10.82 H new ATOM 0 HA ARG A 86 16.106 9.209 -1.574 1.00 11.88 H new ATOM 0 HB2 ARG A 86 14.900 9.511 0.651 1.00 12.21 H new ATOM 0 HB3 ARG A 86 16.015 8.340 1.327 1.00 12.21 H new ATOM 0 HG2 ARG A 86 17.927 9.778 0.745 1.00 13.16 H new ATOM 0 HG3 ARG A 86 16.854 10.931 -0.024 1.00 13.16 H new ATOM 0 HD2 ARG A 86 15.755 11.422 2.101 1.00 13.63 H new ATOM 0 HD3 ARG A 86 16.635 10.138 2.906 1.00 13.63 H new ATOM 0 HE ARG A 86 18.471 12.024 1.709 1.00 14.25 H new ATOM 0 HH11 ARG A 86 16.255 11.562 4.421 1.00 14.96 H new ATOM 0 HH12 ARG A 86 17.138 12.668 5.480 1.00 14.96 H new ATOM 0 HH21 ARG A 86 19.602 13.434 3.079 1.00 15.52 H new ATOM 0 HH22 ARG A 86 19.024 13.723 4.723 1.00 15.52 H new ATOM 1311 N GLU A 87 17.207 6.378 -0.287 1.00 12.58 N ATOM 1312 CA GLU A 87 18.336 5.457 -0.295 1.00 13.44 C ATOM 1313 C GLU A 87 18.786 5.207 -1.729 1.00 13.54 C ATOM 1314 O GLU A 87 19.982 5.191 -2.027 1.00 14.45 O ATOM 1315 CB GLU A 87 17.958 4.135 0.374 1.00 13.42 C ATOM 1316 CG GLU A 87 17.560 4.281 1.833 1.00 14.12 C ATOM 1317 CD GLU A 87 18.689 4.810 2.696 1.00 14.57 C ATOM 1318 OE1 GLU A 87 18.834 6.046 2.789 1.00 14.85 O ATOM 1319 OE2 GLU A 87 19.427 3.987 3.277 1.00 14.77 O ATOM 0 H GLU A 87 16.378 6.030 0.195 1.00 12.58 H new ATOM 0 HA GLU A 87 19.156 5.904 0.267 1.00 13.44 H new ATOM 0 HB2 GLU A 87 17.132 3.683 -0.175 1.00 13.42 H new ATOM 0 HB3 GLU A 87 18.801 3.448 0.304 1.00 13.42 H new ATOM 0 HG2 GLU A 87 16.705 4.954 1.907 1.00 14.12 H new ATOM 0 HG3 GLU A 87 17.238 3.313 2.216 1.00 14.12 H new ATOM 1326 N ALA A 88 17.812 5.019 -2.617 1.00 12.70 N ATOM 1327 CA ALA A 88 18.097 4.780 -4.026 1.00 12.92 C ATOM 1328 C ALA A 88 18.838 5.965 -4.634 1.00 13.38 C ATOM 1329 O ALA A 88 19.735 5.789 -5.459 1.00 14.11 O ATOM 1330 CB ALA A 88 16.809 4.512 -4.788 1.00 12.02 C ATOM 0 H ALA A 88 16.819 5.028 -2.384 1.00 12.70 H new ATOM 0 HA ALA A 88 18.737 3.901 -4.103 1.00 12.92 H new ATOM 0 HB1 ALA A 88 17.038 4.335 -5.839 1.00 12.02 H new ATOM 0 HB2 ALA A 88 16.316 3.634 -4.371 1.00 12.02 H new ATOM 0 HB3 ALA A 88 16.148 5.375 -4.701 1.00 12.02 H new ATOM 1336 N PHE A 89 18.452 7.172 -4.227 1.00 13.10 N ATOM 1337 CA PHE A 89 19.089 8.386 -4.729 1.00 13.68 C ATOM 1338 C PHE A 89 20.584 8.366 -4.436 1.00 14.81 C ATOM 1339 O PHE A 89 21.397 8.760 -5.270 1.00 15.53 O ATOM 1340 CB PHE A 89 18.447 9.623 -4.099 1.00 13.32 C ATOM 1341 CG PHE A 89 19.043 10.918 -4.572 1.00 14.09 C ATOM 1342 CD1 PHE A 89 18.944 11.298 -5.900 1.00 14.63 C ATOM 1343 CD2 PHE A 89 19.704 11.755 -3.687 1.00 14.41 C ATOM 1344 CE1 PHE A 89 19.494 12.488 -6.337 1.00 15.44 C ATOM 1345 CE2 PHE A 89 20.256 12.945 -4.117 1.00 15.22 C ATOM 1346 CZ PHE A 89 20.137 13.316 -5.450 1.00 15.73 C ATOM 0 H PHE A 89 17.704 7.335 -3.553 1.00 13.10 H new ATOM 0 HA PHE A 89 18.946 8.427 -5.809 1.00 13.68 H new ATOM 0 HB2 PHE A 89 17.380 9.621 -4.322 1.00 13.32 H new ATOM 0 HB3 PHE A 89 18.547 9.561 -3.015 1.00 13.32 H new ATOM 0 HD1 PHE A 89 18.431 10.657 -6.602 1.00 14.63 H new ATOM 0 HD2 PHE A 89 19.788 11.473 -2.648 1.00 14.41 H new ATOM 0 HE1 PHE A 89 19.418 12.767 -7.378 1.00 15.44 H new ATOM 0 HE2 PHE A 89 20.778 13.584 -3.420 1.00 15.22 H new ATOM 0 HZ PHE A 89 20.550 14.255 -5.789 1.00 15.73 H new ATOM 1356 N LYS A 90 20.933 7.904 -3.242 1.00 15.06 N ATOM 1357 CA LYS A 90 22.329 7.820 -2.830 1.00 16.18 C ATOM 1358 C LYS A 90 23.090 6.836 -3.712 1.00 16.76 C ATOM 1359 O LYS A 90 24.252 7.059 -4.052 1.00 17.66 O ATOM 1360 CB LYS A 90 22.421 7.381 -1.368 1.00 16.38 C ATOM 1361 CG LYS A 90 21.724 8.326 -0.401 1.00 16.21 C ATOM 1362 CD LYS A 90 21.618 7.736 0.994 1.00 16.55 C ATOM 1363 CE LYS A 90 22.984 7.395 1.574 1.00 16.86 C ATOM 1364 NZ LYS A 90 23.845 8.602 1.712 1.00 17.18 N ATOM 0 H LYS A 90 20.267 7.581 -2.540 1.00 15.06 H new ATOM 0 HA LYS A 90 22.778 8.807 -2.937 1.00 16.18 H new ATOM 0 HB2 LYS A 90 21.985 6.387 -1.268 1.00 16.38 H new ATOM 0 HB3 LYS A 90 23.471 7.298 -1.088 1.00 16.38 H new ATOM 0 HG2 LYS A 90 22.272 9.267 -0.356 1.00 16.21 H new ATOM 0 HG3 LYS A 90 20.726 8.556 -0.774 1.00 16.21 H new ATOM 0 HD2 LYS A 90 21.112 8.445 1.650 1.00 16.55 H new ATOM 0 HD3 LYS A 90 21.003 6.837 0.962 1.00 16.55 H new ATOM 0 HE2 LYS A 90 22.857 6.926 2.550 1.00 16.86 H new ATOM 0 HE3 LYS A 90 23.480 6.667 0.932 1.00 16.86 H new ATOM 0 HZ1 LYS A 90 24.703 8.357 2.247 1.00 17.18 H new ATOM 0 HZ2 LYS A 90 24.113 8.947 0.768 1.00 17.18 H new ATOM 0 HZ3 LYS A 90 23.322 9.346 2.217 1.00 17.18 H new ATOM 1378 N ILE A 91 22.422 5.746 -4.075 1.00 16.32 N ATOM 1379 CA ILE A 91 23.027 4.718 -4.917 1.00 16.96 C ATOM 1380 C ILE A 91 23.404 5.267 -6.291 1.00 17.21 C ATOM 1381 O ILE A 91 24.487 4.985 -6.803 1.00 18.15 O ATOM 1382 CB ILE A 91 22.081 3.514 -5.097 1.00 16.50 C ATOM 1383 CG1 ILE A 91 21.662 2.958 -3.733 1.00 16.43 C ATOM 1384 CG2 ILE A 91 22.752 2.431 -5.932 1.00 17.34 C ATOM 1385 CD1 ILE A 91 20.606 1.876 -3.812 1.00 16.26 C ATOM 0 H ILE A 91 21.460 5.551 -3.799 1.00 16.32 H new ATOM 0 HA ILE A 91 23.933 4.390 -4.407 1.00 16.96 H new ATOM 0 HB ILE A 91 21.187 3.850 -5.623 1.00 16.50 H new ATOM 0 HG12 ILE A 91 22.542 2.558 -3.228 1.00 16.43 H new ATOM 0 HG13 ILE A 91 21.286 3.775 -3.118 1.00 16.43 H new ATOM 0 HG21 ILE A 91 22.071 1.588 -6.050 1.00 17.34 H new ATOM 0 HG22 ILE A 91 23.005 2.833 -6.913 1.00 17.34 H new ATOM 0 HG23 ILE A 91 23.661 2.096 -5.431 1.00 17.34 H new ATOM 0 HD11 ILE A 91 20.361 1.532 -2.807 1.00 16.26 H new ATOM 0 HD12 ILE A 91 19.710 2.276 -4.287 1.00 16.26 H new ATOM 0 HD13 ILE A 91 20.985 1.040 -4.399 1.00 16.26 H new ATOM 1397 N PHE A 92 22.507 6.046 -6.890 1.00 16.44 N ATOM 1398 CA PHE A 92 22.757 6.620 -8.210 1.00 16.75 C ATOM 1399 C PHE A 92 23.645 7.861 -8.130 1.00 17.52 C ATOM 1400 O PHE A 92 24.266 8.252 -9.118 1.00 18.34 O ATOM 1401 CB PHE A 92 21.437 6.967 -8.906 1.00 15.83 C ATOM 1402 CG PHE A 92 20.822 5.811 -9.644 1.00 15.63 C ATOM 1403 CD1 PHE A 92 21.466 5.251 -10.736 1.00 15.41 C ATOM 1404 CD2 PHE A 92 19.602 5.287 -9.249 1.00 15.79 C ATOM 1405 CE1 PHE A 92 20.904 4.189 -11.418 1.00 15.39 C ATOM 1406 CE2 PHE A 92 19.035 4.226 -9.928 1.00 15.74 C ATOM 1407 CZ PHE A 92 19.688 3.676 -11.014 1.00 15.56 C ATOM 0 H PHE A 92 21.604 6.294 -6.485 1.00 16.44 H new ATOM 0 HA PHE A 92 23.284 5.866 -8.795 1.00 16.75 H new ATOM 0 HB2 PHE A 92 20.728 7.330 -8.162 1.00 15.83 H new ATOM 0 HB3 PHE A 92 21.610 7.784 -9.607 1.00 15.83 H new ATOM 0 HD1 PHE A 92 22.417 5.649 -11.057 1.00 15.41 H new ATOM 0 HD2 PHE A 92 19.088 5.713 -8.400 1.00 15.79 H new ATOM 0 HE1 PHE A 92 21.416 3.760 -12.267 1.00 15.39 H new ATOM 0 HE2 PHE A 92 18.083 3.827 -9.610 1.00 15.74 H new ATOM 0 HZ PHE A 92 19.248 2.846 -11.546 1.00 15.56 H new ATOM 1417 N ASP A 93 23.707 8.476 -6.952 1.00 17.35 N ATOM 1418 CA ASP A 93 24.522 9.672 -6.760 1.00 18.13 C ATOM 1419 C ASP A 93 25.881 9.319 -6.160 1.00 19.15 C ATOM 1420 O ASP A 93 25.979 8.954 -4.989 1.00 19.29 O ATOM 1421 CB ASP A 93 23.796 10.673 -5.858 1.00 17.78 C ATOM 1422 CG ASP A 93 24.575 11.962 -5.678 1.00 18.61 C ATOM 1423 OD1 ASP A 93 25.278 12.366 -6.628 1.00 18.94 O ATOM 1424 OD2 ASP A 93 24.487 12.566 -4.586 1.00 18.99 O ATOM 0 H ASP A 93 23.205 8.168 -6.119 1.00 17.35 H new ATOM 0 HA ASP A 93 24.686 10.127 -7.737 1.00 18.13 H new ATOM 0 HB2 ASP A 93 22.819 10.899 -6.284 1.00 17.78 H new ATOM 0 HB3 ASP A 93 23.621 10.218 -4.883 1.00 17.78 H new ATOM 1429 N ARG A 94 26.924 9.430 -6.977 1.00 19.94 N ATOM 1430 CA ARG A 94 28.285 9.126 -6.543 1.00 20.98 C ATOM 1431 C ARG A 94 28.796 10.167 -5.552 1.00 21.56 C ATOM 1432 O ARG A 94 29.156 9.840 -4.422 1.00 22.25 O ATOM 1433 CB ARG A 94 29.222 9.062 -7.754 1.00 21.74 C ATOM 1434 CG ARG A 94 29.287 7.697 -8.430 1.00 21.43 C ATOM 1435 CD ARG A 94 27.904 7.149 -8.757 1.00 21.19 C ATOM 1436 NE ARG A 94 27.322 6.434 -7.625 1.00 21.42 N ATOM 1437 CZ ARG A 94 27.612 5.172 -7.328 1.00 21.61 C ATOM 1438 NH1 ARG A 94 28.456 4.485 -8.088 1.00 21.58 N ATOM 1439 NH2 ARG A 94 27.060 4.594 -6.270 1.00 21.94 N ATOM 0 H ARG A 94 26.852 9.730 -7.949 1.00 19.94 H new ATOM 0 HA ARG A 94 28.268 8.157 -6.043 1.00 20.98 H new ATOM 0 HB2 ARG A 94 28.899 9.802 -8.487 1.00 21.74 H new ATOM 0 HB3 ARG A 94 30.226 9.345 -7.437 1.00 21.74 H new ATOM 0 HG2 ARG A 94 29.871 7.775 -9.347 1.00 21.43 H new ATOM 0 HG3 ARG A 94 29.809 6.996 -7.779 1.00 21.43 H new ATOM 0 HD2 ARG A 94 27.247 7.969 -9.045 1.00 21.19 H new ATOM 0 HD3 ARG A 94 27.972 6.479 -9.614 1.00 21.19 H new ATOM 0 HE ARG A 94 26.658 6.930 -7.031 1.00 21.42 H new ATOM 0 HH11 ARG A 94 28.884 4.926 -8.902 1.00 21.58 H new ATOM 0 HH12 ARG A 94 28.677 3.516 -7.858 1.00 21.58 H new ATOM 0 HH21 ARG A 94 26.412 5.118 -5.683 1.00 21.94 H new ATOM 0 HH22 ARG A 94 27.284 3.625 -6.043 1.00 21.94 H new ATOM 1453 N ASP A 95 28.827 11.424 -5.986 1.00 21.37 N ATOM 1454 CA ASP A 95 29.304 12.518 -5.146 1.00 21.99 C ATOM 1455 C ASP A 95 28.279 12.887 -4.081 1.00 21.37 C ATOM 1456 O ASP A 95 27.093 12.590 -4.216 1.00 20.39 O ATOM 1457 CB ASP A 95 29.608 13.749 -6.001 1.00 22.48 C ATOM 1458 CG ASP A 95 29.968 13.393 -7.427 1.00 22.92 C ATOM 1459 OD1 ASP A 95 31.151 13.076 -7.675 1.00 23.34 O ATOM 1460 OD2 ASP A 95 29.071 13.432 -8.296 1.00 22.92 O ATOM 0 H ASP A 95 28.526 11.711 -6.918 1.00 21.37 H new ATOM 0 HA ASP A 95 30.214 12.180 -4.651 1.00 21.99 H new ATOM 0 HB2 ASP A 95 28.740 14.409 -6.003 1.00 22.48 H new ATOM 0 HB3 ASP A 95 30.430 14.305 -5.551 1.00 22.48 H new ATOM 1465 N GLY A 96 28.749 13.535 -3.019 1.00 22.00 N ATOM 1466 CA GLY A 96 27.860 13.956 -1.952 1.00 21.64 C ATOM 1467 C GLY A 96 27.142 15.243 -2.305 1.00 21.55 C ATOM 1468 O GLY A 96 26.421 15.811 -1.484 1.00 21.40 O ATOM 0 H GLY A 96 29.730 13.776 -2.879 1.00 22.00 H new ATOM 0 HA2 GLY A 96 27.129 13.172 -1.755 1.00 21.64 H new ATOM 0 HA3 GLY A 96 28.431 14.096 -1.035 1.00 21.64 H new ATOM 1472 N ASP A 97 27.354 15.698 -3.536 1.00 21.75 N ATOM 1473 CA ASP A 97 26.738 16.921 -4.034 1.00 21.82 C ATOM 1474 C ASP A 97 25.220 16.872 -3.903 1.00 20.80 C ATOM 1475 O ASP A 97 24.575 17.887 -3.640 1.00 20.85 O ATOM 1476 CB ASP A 97 27.122 17.139 -5.501 1.00 22.28 C ATOM 1477 CG ASP A 97 26.741 15.958 -6.381 1.00 21.72 C ATOM 1478 OD1 ASP A 97 26.574 14.843 -5.843 1.00 21.34 O ATOM 1479 OD2 ASP A 97 26.609 16.147 -7.609 1.00 21.74 O ATOM 0 H ASP A 97 27.956 15.230 -4.214 1.00 21.75 H new ATOM 0 HA ASP A 97 27.105 17.751 -3.431 1.00 21.82 H new ATOM 0 HB2 ASP A 97 26.631 18.039 -5.872 1.00 22.28 H new ATOM 0 HB3 ASP A 97 28.196 17.310 -5.571 1.00 22.28 H new ATOM 1484 N GLY A 98 24.656 15.682 -4.087 1.00 19.93 N ATOM 1485 CA GLY A 98 23.219 15.517 -3.990 1.00 18.92 C ATOM 1486 C GLY A 98 22.528 15.726 -5.323 1.00 18.54 C ATOM 1487 O GLY A 98 21.387 16.184 -5.373 1.00 17.94 O ATOM 0 H GLY A 98 25.171 14.828 -4.302 1.00 19.93 H new ATOM 0 HA2 GLY A 98 22.994 14.517 -3.619 1.00 18.92 H new ATOM 0 HA3 GLY A 98 22.822 16.224 -3.262 1.00 18.92 H new ATOM 1491 N PHE A 99 23.227 15.392 -6.406 1.00 19.01 N ATOM 1492 CA PHE A 99 22.679 15.541 -7.751 1.00 18.88 C ATOM 1493 C PHE A 99 23.200 14.444 -8.676 1.00 18.97 C ATOM 1494 O PHE A 99 24.338 13.990 -8.534 1.00 19.56 O ATOM 1495 CB PHE A 99 23.043 16.913 -8.327 1.00 19.81 C ATOM 1496 CG PHE A 99 22.395 18.064 -7.611 1.00 19.89 C ATOM 1497 CD1 PHE A 99 21.125 18.493 -7.965 1.00 20.07 C ATOM 1498 CD2 PHE A 99 23.056 18.718 -6.584 1.00 19.90 C ATOM 1499 CE1 PHE A 99 20.527 19.551 -7.308 1.00 20.28 C ATOM 1500 CE2 PHE A 99 22.464 19.778 -5.924 1.00 20.10 C ATOM 1501 CZ PHE A 99 21.195 20.195 -6.289 1.00 20.30 C ATOM 0 H PHE A 99 24.175 15.016 -6.377 1.00 19.01 H new ATOM 0 HA PHE A 99 21.595 15.456 -7.682 1.00 18.88 H new ATOM 0 HB2 PHE A 99 24.125 17.037 -8.289 1.00 19.81 H new ATOM 0 HB3 PHE A 99 22.755 16.943 -9.378 1.00 19.81 H new ATOM 0 HD1 PHE A 99 20.597 17.994 -8.764 1.00 20.07 H new ATOM 0 HD2 PHE A 99 24.046 18.396 -6.296 1.00 19.90 H new ATOM 0 HE1 PHE A 99 19.536 19.873 -7.593 1.00 20.28 H new ATOM 0 HE2 PHE A 99 22.990 20.280 -5.125 1.00 20.10 H new ATOM 0 HZ PHE A 99 20.730 21.024 -5.776 1.00 20.30 H new ATOM 1511 N ILE A 100 22.365 14.022 -9.624 1.00 18.48 N ATOM 1512 CA ILE A 100 22.750 12.983 -10.570 1.00 18.67 C ATOM 1513 C ILE A 100 22.832 13.536 -11.990 1.00 19.37 C ATOM 1514 O ILE A 100 21.875 14.123 -12.495 1.00 19.21 O ATOM 1515 CB ILE A 100 21.755 11.806 -10.546 1.00 17.64 C ATOM 1516 CG1 ILE A 100 21.521 11.339 -9.107 1.00 16.97 C ATOM 1517 CG2 ILE A 100 22.271 10.660 -11.404 1.00 18.04 C ATOM 1518 CD1 ILE A 100 20.412 10.318 -8.974 1.00 15.92 C ATOM 0 H ILE A 100 21.420 14.384 -9.755 1.00 18.48 H new ATOM 0 HA ILE A 100 23.733 12.625 -10.265 1.00 18.67 H new ATOM 0 HB ILE A 100 20.804 12.143 -10.958 1.00 17.64 H new ATOM 0 HG12 ILE A 100 22.445 10.912 -8.718 1.00 16.97 H new ATOM 0 HG13 ILE A 100 21.284 12.204 -8.487 1.00 16.97 H new ATOM 0 HG21 ILE A 100 21.558 9.836 -11.377 1.00 18.04 H new ATOM 0 HG22 ILE A 100 22.393 11.001 -12.432 1.00 18.04 H new ATOM 0 HG23 ILE A 100 23.232 10.321 -11.018 1.00 18.04 H new ATOM 0 HD11 ILE A 100 20.303 10.033 -7.927 1.00 15.92 H new ATOM 0 HD12 ILE A 100 19.477 10.748 -9.332 1.00 15.92 H new ATOM 0 HD13 ILE A 100 20.656 9.436 -9.566 1.00 15.92 H new ATOM 1530 N SER A 101 23.984 13.344 -12.626 1.00 20.25 N ATOM 1531 CA SER A 101 24.205 13.820 -13.988 1.00 21.07 C ATOM 1532 C SER A 101 24.392 12.642 -14.940 1.00 21.23 C ATOM 1533 O SER A 101 24.828 11.576 -14.514 1.00 20.98 O ATOM 1534 CB SER A 101 25.437 14.730 -14.029 1.00 22.16 C ATOM 1535 OG SER A 101 25.695 15.198 -15.340 1.00 22.49 O ATOM 0 H SER A 101 24.783 12.859 -12.217 1.00 20.25 H new ATOM 0 HA SER A 101 23.331 14.388 -14.307 1.00 21.07 H new ATOM 0 HB2 SER A 101 25.286 15.579 -13.362 1.00 22.16 H new ATOM 0 HB3 SER A 101 26.305 14.185 -13.659 1.00 22.16 H new ATOM 0 HG SER A 101 25.216 16.040 -15.487 1.00 22.49 H new ATOM 1541 N PRO A 102 24.056 12.804 -16.237 1.00 21.74 N ATOM 1542 CA PRO A 102 24.205 11.736 -17.230 1.00 22.05 C ATOM 1543 C PRO A 102 25.494 10.935 -17.051 1.00 22.55 C ATOM 1544 O PRO A 102 25.521 9.725 -17.283 1.00 22.43 O ATOM 1545 CB PRO A 102 24.230 12.510 -18.543 1.00 23.00 C ATOM 1546 CG PRO A 102 23.330 13.672 -18.298 1.00 22.78 C ATOM 1547 CD PRO A 102 23.500 14.033 -16.842 1.00 22.19 C ATOM 0 HA PRO A 102 23.412 10.991 -17.160 1.00 22.05 H new ATOM 0 HB2 PRO A 102 25.240 12.834 -18.795 1.00 23.00 H new ATOM 0 HB3 PRO A 102 23.875 11.899 -19.373 1.00 23.00 H new ATOM 0 HG2 PRO A 102 23.594 14.512 -18.941 1.00 22.78 H new ATOM 0 HG3 PRO A 102 22.294 13.415 -18.518 1.00 22.78 H new ATOM 0 HD2 PRO A 102 24.173 14.881 -16.716 1.00 22.19 H new ATOM 0 HD3 PRO A 102 22.550 14.310 -16.385 1.00 22.19 H new ATOM 1555 N ALA A 103 26.555 11.614 -16.627 1.00 23.17 N ATOM 1556 CA ALA A 103 27.847 10.965 -16.418 1.00 23.77 C ATOM 1557 C ALA A 103 27.771 9.938 -15.292 1.00 23.02 C ATOM 1558 O ALA A 103 28.250 8.813 -15.430 1.00 23.22 O ATOM 1559 CB ALA A 103 28.915 12.004 -16.111 1.00 24.56 C ATOM 0 H ALA A 103 26.547 12.613 -16.421 1.00 23.17 H new ATOM 0 HA ALA A 103 28.115 10.442 -17.336 1.00 23.77 H new ATOM 0 HB1 ALA A 103 29.873 11.507 -15.957 1.00 24.56 H new ATOM 0 HB2 ALA A 103 28.997 12.699 -16.946 1.00 24.56 H new ATOM 0 HB3 ALA A 103 28.642 12.551 -15.209 1.00 24.56 H new ATOM 1565 N GLU A 104 27.163 10.338 -14.181 1.00 22.23 N ATOM 1566 CA GLU A 104 27.016 9.463 -13.025 1.00 21.53 C ATOM 1567 C GLU A 104 25.946 8.408 -13.279 1.00 20.75 C ATOM 1568 O GLU A 104 26.098 7.250 -12.891 1.00 20.59 O ATOM 1569 CB GLU A 104 26.647 10.281 -11.786 1.00 20.94 C ATOM 1570 CG GLU A 104 27.750 11.214 -11.316 1.00 21.74 C ATOM 1571 CD GLU A 104 27.325 12.067 -10.135 1.00 21.28 C ATOM 1572 OE1 GLU A 104 27.284 11.537 -9.005 1.00 20.84 O ATOM 1573 OE2 GLU A 104 27.035 13.264 -10.340 1.00 21.43 O ATOM 0 H GLU A 104 26.762 11.268 -14.057 1.00 22.23 H new ATOM 0 HA GLU A 104 27.969 8.962 -12.855 1.00 21.53 H new ATOM 0 HB2 GLU A 104 25.755 10.869 -12.003 1.00 20.94 H new ATOM 0 HB3 GLU A 104 26.391 9.599 -10.975 1.00 20.94 H new ATOM 0 HG2 GLU A 104 28.625 10.626 -11.039 1.00 21.74 H new ATOM 0 HG3 GLU A 104 28.049 11.862 -12.140 1.00 21.74 H new ATOM 1580 N LEU A 105 24.867 8.821 -13.936 1.00 20.36 N ATOM 1581 CA LEU A 105 23.765 7.922 -14.247 1.00 19.67 C ATOM 1582 C LEU A 105 24.272 6.703 -15.003 1.00 20.33 C ATOM 1583 O LEU A 105 23.966 5.565 -14.648 1.00 19.95 O ATOM 1584 CB LEU A 105 22.709 8.649 -15.080 1.00 19.42 C ATOM 1585 CG LEU A 105 21.300 8.065 -14.990 1.00 18.62 C ATOM 1586 CD1 LEU A 105 20.654 8.437 -13.667 1.00 17.90 C ATOM 1587 CD2 LEU A 105 20.450 8.545 -16.153 1.00 18.59 C ATOM 0 H LEU A 105 24.734 9.778 -14.264 1.00 20.36 H new ATOM 0 HA LEU A 105 23.314 7.592 -13.311 1.00 19.67 H new ATOM 0 HB2 LEU A 105 22.674 9.692 -14.765 1.00 19.42 H new ATOM 0 HB3 LEU A 105 23.023 8.641 -16.124 1.00 19.42 H new ATOM 0 HG LEU A 105 21.373 6.979 -15.043 1.00 18.62 H new ATOM 0 HD11 LEU A 105 19.651 8.013 -13.620 1.00 17.90 H new ATOM 0 HD12 LEU A 105 21.253 8.043 -12.846 1.00 17.90 H new ATOM 0 HD13 LEU A 105 20.593 9.522 -13.584 1.00 17.90 H new ATOM 0 HD21 LEU A 105 19.450 8.119 -16.073 1.00 18.59 H new ATOM 0 HD22 LEU A 105 20.384 9.633 -16.131 1.00 18.59 H new ATOM 0 HD23 LEU A 105 20.905 8.228 -17.091 1.00 18.59 H new ATOM 1599 N ARG A 106 25.054 6.952 -16.048 1.00 21.40 N ATOM 1600 CA ARG A 106 25.618 5.877 -16.852 1.00 22.20 C ATOM 1601 C ARG A 106 26.571 5.027 -16.018 1.00 22.44 C ATOM 1602 O ARG A 106 26.497 3.800 -16.030 1.00 22.57 O ATOM 1603 CB ARG A 106 26.354 6.447 -18.072 1.00 23.35 C ATOM 1604 CG ARG A 106 27.616 5.677 -18.434 1.00 24.22 C ATOM 1605 CD ARG A 106 28.208 6.134 -19.757 1.00 25.21 C ATOM 1606 NE ARG A 106 29.574 5.645 -19.936 1.00 25.76 N ATOM 1607 CZ ARG A 106 30.266 5.780 -21.064 1.00 26.69 C ATOM 1608 NH1 ARG A 106 29.720 6.374 -22.116 1.00 27.16 N ATOM 1609 NH2 ARG A 106 31.507 5.315 -21.140 1.00 27.19 N ATOM 0 H ARG A 106 25.311 7.889 -16.357 1.00 21.40 H new ATOM 0 HA ARG A 106 24.799 5.246 -17.199 1.00 22.20 H new ATOM 0 HB2 ARG A 106 25.679 6.445 -18.928 1.00 23.35 H new ATOM 0 HB3 ARG A 106 26.616 7.487 -17.875 1.00 23.35 H new ATOM 0 HG2 ARG A 106 28.356 5.804 -17.644 1.00 24.22 H new ATOM 0 HG3 ARG A 106 27.387 4.613 -18.489 1.00 24.22 H new ATOM 0 HD2 ARG A 106 27.584 5.779 -20.577 1.00 25.21 H new ATOM 0 HD3 ARG A 106 28.203 7.223 -19.801 1.00 25.21 H new ATOM 0 HE ARG A 106 30.022 5.173 -19.151 1.00 25.76 H new ATOM 0 HH11 ARG A 106 28.766 6.730 -22.062 1.00 27.16 H new ATOM 0 HH12 ARG A 106 30.254 6.475 -22.979 1.00 27.16 H new ATOM 0 HH21 ARG A 106 31.929 4.855 -20.334 1.00 27.19 H new ATOM 0 HH22 ARG A 106 32.038 5.418 -22.005 1.00 27.19 H new ATOM 1623 N PHE A 107 27.465 5.697 -15.294 1.00 22.61 N ATOM 1624 CA PHE A 107 28.449 5.016 -14.458 1.00 22.97 C ATOM 1625 C PHE A 107 27.793 3.970 -13.562 1.00 22.14 C ATOM 1626 O PHE A 107 28.303 2.859 -13.421 1.00 22.53 O ATOM 1627 CB PHE A 107 29.207 6.034 -13.603 1.00 23.24 C ATOM 1628 CG PHE A 107 30.318 5.431 -12.790 1.00 23.93 C ATOM 1629 CD1 PHE A 107 31.578 5.256 -13.337 1.00 24.11 C ATOM 1630 CD2 PHE A 107 30.101 5.038 -11.479 1.00 24.48 C ATOM 1631 CE1 PHE A 107 32.602 4.701 -12.593 1.00 24.82 C ATOM 1632 CE2 PHE A 107 31.121 4.483 -10.729 1.00 25.19 C ATOM 1633 CZ PHE A 107 32.373 4.314 -11.288 1.00 25.36 C ATOM 0 H PHE A 107 27.527 6.715 -15.270 1.00 22.61 H new ATOM 0 HA PHE A 107 29.149 4.503 -15.117 1.00 22.97 H new ATOM 0 HB2 PHE A 107 29.621 6.805 -14.253 1.00 23.24 H new ATOM 0 HB3 PHE A 107 28.504 6.527 -12.932 1.00 23.24 H new ATOM 0 HD1 PHE A 107 31.763 5.557 -14.358 1.00 24.11 H new ATOM 0 HD2 PHE A 107 29.124 5.167 -11.038 1.00 24.48 H new ATOM 0 HE1 PHE A 107 33.580 4.570 -13.032 1.00 24.82 H new ATOM 0 HE2 PHE A 107 30.939 4.182 -9.708 1.00 25.19 H new ATOM 0 HZ PHE A 107 33.171 3.880 -10.705 1.00 25.36 H new ATOM 1643 N VAL A 108 26.661 4.326 -12.962 1.00 21.06 N ATOM 1644 CA VAL A 108 25.949 3.411 -12.080 1.00 20.23 C ATOM 1645 C VAL A 108 25.277 2.293 -12.869 1.00 20.08 C ATOM 1646 O VAL A 108 25.432 1.118 -12.543 1.00 20.21 O ATOM 1647 CB VAL A 108 24.884 4.145 -11.241 1.00 19.12 C ATOM 1648 CG1 VAL A 108 24.192 3.178 -10.292 1.00 18.33 C ATOM 1649 CG2 VAL A 108 25.511 5.298 -10.473 1.00 19.13 C ATOM 0 H VAL A 108 26.219 5.239 -13.071 1.00 21.06 H new ATOM 0 HA VAL A 108 26.693 2.982 -11.410 1.00 20.23 H new ATOM 0 HB VAL A 108 24.134 4.554 -11.918 1.00 19.12 H new ATOM 0 HG11 VAL A 108 23.444 3.714 -9.708 1.00 18.33 H new ATOM 0 HG12 VAL A 108 23.707 2.389 -10.867 1.00 18.33 H new ATOM 0 HG13 VAL A 108 24.929 2.737 -9.620 1.00 18.33 H new ATOM 0 HG21 VAL A 108 24.744 5.804 -9.887 1.00 19.13 H new ATOM 0 HG22 VAL A 108 26.283 4.914 -9.806 1.00 19.13 H new ATOM 0 HG23 VAL A 108 25.956 6.003 -11.175 1.00 19.13 H new ATOM 1659 N MET A 109 24.535 2.668 -13.907 1.00 19.93 N ATOM 1660 CA MET A 109 23.833 1.700 -14.746 1.00 19.90 C ATOM 1661 C MET A 109 24.759 0.569 -15.183 1.00 20.93 C ATOM 1662 O MET A 109 24.421 -0.608 -15.054 1.00 20.91 O ATOM 1663 CB MET A 109 23.249 2.393 -15.977 1.00 20.00 C ATOM 1664 CG MET A 109 22.075 3.307 -15.665 1.00 18.99 C ATOM 1665 SD MET A 109 20.582 2.394 -15.229 1.00 18.30 S ATOM 1666 CE MET A 109 19.372 3.713 -15.226 1.00 17.64 C ATOM 0 H MET A 109 24.404 3.640 -14.189 1.00 19.93 H new ATOM 0 HA MET A 109 23.025 1.271 -14.153 1.00 19.90 H new ATOM 0 HB2 MET A 109 24.033 2.976 -16.461 1.00 20.00 H new ATOM 0 HB3 MET A 109 22.928 1.635 -16.692 1.00 20.00 H new ATOM 0 HG2 MET A 109 22.344 3.970 -14.843 1.00 18.99 H new ATOM 0 HG3 MET A 109 21.871 3.938 -16.530 1.00 18.99 H new ATOM 0 HE1 MET A 109 18.392 3.308 -14.973 1.00 17.64 H new ATOM 0 HE2 MET A 109 19.655 4.465 -14.489 1.00 17.64 H new ATOM 0 HE3 MET A 109 19.331 4.171 -16.214 1.00 17.64 H new ATOM 1676 N ILE A 110 25.927 0.933 -15.699 1.00 21.91 N ATOM 1677 CA ILE A 110 26.904 -0.047 -16.156 1.00 22.98 C ATOM 1678 C ILE A 110 27.330 -0.966 -15.014 1.00 22.97 C ATOM 1679 O ILE A 110 27.702 -2.118 -15.235 1.00 23.58 O ATOM 1680 CB ILE A 110 28.146 0.644 -16.756 1.00 24.01 C ATOM 1681 CG1 ILE A 110 27.722 1.613 -17.864 1.00 24.18 C ATOM 1682 CG2 ILE A 110 29.126 -0.388 -17.295 1.00 25.13 C ATOM 1683 CD1 ILE A 110 28.851 2.479 -18.378 1.00 25.10 C ATOM 0 H ILE A 110 26.221 1.903 -15.811 1.00 21.91 H new ATOM 0 HA ILE A 110 26.427 -0.645 -16.932 1.00 22.98 H new ATOM 0 HB ILE A 110 28.647 1.208 -15.969 1.00 24.01 H new ATOM 0 HG12 ILE A 110 27.306 1.042 -18.694 1.00 24.18 H new ATOM 0 HG13 ILE A 110 26.925 2.255 -17.488 1.00 24.18 H new ATOM 0 HG21 ILE A 110 29.995 0.119 -17.714 1.00 25.13 H new ATOM 0 HG22 ILE A 110 29.445 -1.045 -16.486 1.00 25.13 H new ATOM 0 HG23 ILE A 110 28.641 -0.979 -18.072 1.00 25.13 H new ATOM 0 HD11 ILE A 110 28.476 3.139 -19.160 1.00 25.10 H new ATOM 0 HD12 ILE A 110 29.252 3.077 -17.560 1.00 25.10 H new ATOM 0 HD13 ILE A 110 29.639 1.846 -18.785 1.00 25.10 H new ATOM 1695 N ASN A 111 27.267 -0.447 -13.789 1.00 22.36 N ATOM 1696 CA ASN A 111 27.639 -1.221 -12.609 1.00 22.40 C ATOM 1697 C ASN A 111 26.526 -2.192 -12.220 1.00 21.78 C ATOM 1698 O ASN A 111 26.788 -3.256 -11.658 1.00 22.21 O ATOM 1699 CB ASN A 111 27.949 -0.289 -11.435 1.00 21.96 C ATOM 1700 CG ASN A 111 29.160 0.587 -11.693 1.00 22.60 C ATOM 1701 OD1 ASN A 111 30.068 0.210 -12.434 1.00 23.32 O ATOM 1702 ND2 ASN A 111 29.180 1.765 -11.079 1.00 22.44 N ATOM 0 H ASN A 111 26.962 0.506 -13.589 1.00 22.36 H new ATOM 0 HA ASN A 111 28.532 -1.797 -12.853 1.00 22.40 H new ATOM 0 HB2 ASN A 111 27.083 0.343 -11.238 1.00 21.96 H new ATOM 0 HB3 ASN A 111 28.120 -0.884 -10.538 1.00 21.96 H new ATOM 0 HD21 ASN A 111 29.969 2.397 -11.213 1.00 22.44 H new ATOM 0 HD22 ASN A 111 28.406 2.038 -10.473 1.00 22.44 H new ATOM 1709 N LEU A 112 25.284 -1.820 -12.522 1.00 20.83 N ATOM 1710 CA LEU A 112 24.134 -2.660 -12.200 1.00 20.19 C ATOM 1711 C LEU A 112 24.051 -3.852 -13.147 1.00 20.95 C ATOM 1712 O LEU A 112 23.762 -4.973 -12.727 1.00 21.07 O ATOM 1713 CB LEU A 112 22.838 -1.851 -12.278 1.00 19.00 C ATOM 1714 CG LEU A 112 22.901 -0.449 -11.667 1.00 18.25 C ATOM 1715 CD1 LEU A 112 21.570 0.267 -11.837 1.00 17.58 C ATOM 1716 CD2 LEU A 112 23.285 -0.518 -10.195 1.00 17.84 C ATOM 0 H LEU A 112 25.049 -0.944 -12.988 1.00 20.83 H new ATOM 0 HA LEU A 112 24.264 -3.028 -11.182 1.00 20.19 H new ATOM 0 HB2 LEU A 112 22.549 -1.760 -13.325 1.00 19.00 H new ATOM 0 HB3 LEU A 112 22.049 -2.412 -11.777 1.00 19.00 H new ATOM 0 HG LEU A 112 23.669 0.118 -12.194 1.00 18.25 H new ATOM 0 HD11 LEU A 112 21.633 1.262 -11.397 1.00 17.58 H new ATOM 0 HD12 LEU A 112 21.337 0.354 -12.898 1.00 17.58 H new ATOM 0 HD13 LEU A 112 20.785 -0.301 -11.338 1.00 17.58 H new ATOM 0 HD21 LEU A 112 23.324 0.490 -9.781 1.00 17.84 H new ATOM 0 HD22 LEU A 112 22.543 -1.105 -9.653 1.00 17.84 H new ATOM 0 HD23 LEU A 112 24.263 -0.989 -10.096 1.00 17.84 H new ATOM 1728 N GLY A 113 24.309 -3.600 -14.427 1.00 21.57 N ATOM 1729 CA GLY A 113 24.257 -4.657 -15.419 1.00 22.41 C ATOM 1730 C GLY A 113 23.445 -4.266 -16.639 1.00 22.40 C ATOM 1731 O GLY A 113 23.302 -5.051 -17.575 1.00 23.05 O ATOM 0 H GLY A 113 24.554 -2.680 -14.795 1.00 21.57 H new ATOM 0 HA2 GLY A 113 25.271 -4.912 -15.727 1.00 22.41 H new ATOM 0 HA3 GLY A 113 23.825 -5.552 -14.970 1.00 22.41 H new ATOM 1735 N GLU A 114 22.912 -3.047 -16.625 1.00 21.76 N ATOM 1736 CA GLU A 114 22.108 -2.550 -17.737 1.00 21.80 C ATOM 1737 C GLU A 114 22.919 -1.607 -18.620 1.00 22.59 C ATOM 1738 O GLU A 114 23.240 -0.487 -18.221 1.00 22.48 O ATOM 1739 CB GLU A 114 20.866 -1.830 -17.210 1.00 20.80 C ATOM 1740 CG GLU A 114 19.913 -2.738 -16.450 1.00 20.26 C ATOM 1741 CD GLU A 114 19.331 -3.834 -17.320 1.00 20.12 C ATOM 1742 OE1 GLU A 114 19.952 -4.914 -17.410 1.00 19.96 O ATOM 1743 OE2 GLU A 114 18.252 -3.614 -17.911 1.00 20.27 O ATOM 0 H GLU A 114 23.022 -2.386 -15.856 1.00 21.76 H new ATOM 0 HA GLU A 114 21.799 -3.404 -18.339 1.00 21.80 H new ATOM 0 HB2 GLU A 114 21.178 -1.016 -16.556 1.00 20.80 H new ATOM 0 HB3 GLU A 114 20.334 -1.379 -18.048 1.00 20.80 H new ATOM 0 HG2 GLU A 114 20.440 -3.189 -15.609 1.00 20.26 H new ATOM 0 HG3 GLU A 114 19.102 -2.140 -16.034 1.00 20.26 H new ATOM 1750 N LYS A 115 23.248 -2.069 -19.823 1.00 23.45 N ATOM 1751 CA LYS A 115 24.021 -1.271 -20.768 1.00 24.32 C ATOM 1752 C LYS A 115 23.161 -0.176 -21.391 1.00 23.94 C ATOM 1753 O LYS A 115 22.221 -0.459 -22.135 1.00 23.86 O ATOM 1754 CB LYS A 115 24.602 -2.160 -21.871 1.00 25.48 C ATOM 1755 CG LYS A 115 25.781 -3.013 -21.424 1.00 26.26 C ATOM 1756 CD LYS A 115 25.360 -4.083 -20.430 1.00 26.75 C ATOM 1757 CE LYS A 115 26.521 -4.997 -20.072 1.00 27.55 C ATOM 1758 NZ LYS A 115 27.033 -5.732 -21.262 1.00 27.96 N ATOM 0 H LYS A 115 22.990 -2.994 -20.166 1.00 23.45 H new ATOM 0 HA LYS A 115 24.837 -0.803 -20.218 1.00 24.32 H new ATOM 0 HB2 LYS A 115 23.816 -2.814 -22.248 1.00 25.48 H new ATOM 0 HB3 LYS A 115 24.918 -1.530 -22.702 1.00 25.48 H new ATOM 0 HG2 LYS A 115 26.238 -3.485 -22.294 1.00 26.26 H new ATOM 0 HG3 LYS A 115 26.540 -2.375 -20.971 1.00 26.26 H new ATOM 0 HD2 LYS A 115 24.975 -3.611 -19.526 1.00 26.75 H new ATOM 0 HD3 LYS A 115 24.547 -4.674 -20.852 1.00 26.75 H new ATOM 0 HE2 LYS A 115 27.327 -4.407 -19.635 1.00 27.55 H new ATOM 0 HE3 LYS A 115 26.201 -5.711 -19.313 1.00 27.55 H new ATOM 0 HZ1 LYS A 115 27.596 -6.549 -20.950 1.00 27.96 H new ATOM 0 HZ2 LYS A 115 26.232 -6.063 -21.837 1.00 27.96 H new ATOM 0 HZ3 LYS A 115 27.629 -5.098 -21.832 1.00 27.96 H new ATOM 1772 N VAL A 116 23.487 1.076 -21.083 1.00 23.78 N ATOM 1773 CA VAL A 116 22.748 2.212 -21.620 1.00 23.53 C ATOM 1774 C VAL A 116 23.686 3.264 -22.196 1.00 24.38 C ATOM 1775 O VAL A 116 24.794 3.467 -21.698 1.00 24.75 O ATOM 1776 CB VAL A 116 21.871 2.876 -20.545 1.00 22.24 C ATOM 1777 CG1 VAL A 116 20.638 2.036 -20.254 1.00 21.40 C ATOM 1778 CG2 VAL A 116 22.675 3.115 -19.277 1.00 21.91 C ATOM 0 H VAL A 116 24.258 1.329 -20.465 1.00 23.78 H new ATOM 0 HA VAL A 116 22.112 1.817 -22.412 1.00 23.53 H new ATOM 0 HB VAL A 116 21.535 3.841 -20.926 1.00 22.24 H new ATOM 0 HG11 VAL A 116 20.035 2.527 -19.491 1.00 21.40 H new ATOM 0 HG12 VAL A 116 20.050 1.925 -21.165 1.00 21.40 H new ATOM 0 HG13 VAL A 116 20.944 1.052 -19.897 1.00 21.40 H new ATOM 0 HG21 VAL A 116 22.040 3.585 -18.527 1.00 21.91 H new ATOM 0 HG22 VAL A 116 23.044 2.163 -18.895 1.00 21.91 H new ATOM 0 HG23 VAL A 116 23.519 3.768 -19.499 1.00 21.91 H new ATOM 1788 N THR A 117 23.232 3.930 -23.251 1.00 24.76 N ATOM 1789 CA THR A 117 24.017 4.974 -23.894 1.00 25.62 C ATOM 1790 C THR A 117 23.662 6.333 -23.307 1.00 25.03 C ATOM 1791 O THR A 117 22.546 6.539 -22.833 1.00 24.12 O ATOM 1792 CB THR A 117 23.779 5.005 -25.414 1.00 26.54 C ATOM 1793 OG1 THR A 117 22.424 5.377 -25.692 1.00 25.98 O ATOM 1794 CG2 THR A 117 24.070 3.646 -26.034 1.00 27.24 C ATOM 0 H THR A 117 22.321 3.764 -23.680 1.00 24.76 H new ATOM 0 HA THR A 117 25.068 4.752 -23.712 1.00 25.62 H new ATOM 0 HB THR A 117 24.455 5.741 -25.849 1.00 26.54 H new ATOM 0 HG1 THR A 117 22.282 5.396 -26.662 1.00 25.98 H new ATOM 0 HG21 THR A 117 23.895 3.691 -27.109 1.00 27.24 H new ATOM 0 HG22 THR A 117 25.109 3.376 -25.847 1.00 27.24 H new ATOM 0 HG23 THR A 117 23.415 2.896 -25.591 1.00 27.24 H new ATOM 1802 N ASP A 118 24.615 7.258 -23.344 1.00 25.62 N ATOM 1803 CA ASP A 118 24.399 8.597 -22.807 1.00 25.26 C ATOM 1804 C ASP A 118 23.183 9.257 -23.449 1.00 25.12 C ATOM 1805 O ASP A 118 22.623 10.208 -22.904 1.00 24.60 O ATOM 1806 CB ASP A 118 25.638 9.466 -23.031 1.00 26.22 C ATOM 1807 CG ASP A 118 26.878 8.883 -22.382 1.00 26.44 C ATOM 1808 OD1 ASP A 118 27.103 9.152 -21.183 1.00 26.51 O ATOM 1809 OD2 ASP A 118 27.623 8.156 -23.072 1.00 26.63 O ATOM 0 H ASP A 118 25.543 7.106 -23.739 1.00 25.62 H new ATOM 0 HA ASP A 118 24.215 8.502 -21.737 1.00 25.26 H new ATOM 0 HB2 ASP A 118 25.810 9.579 -24.101 1.00 26.22 H new ATOM 0 HB3 ASP A 118 25.456 10.463 -22.630 1.00 26.22 H new ATOM 1814 N GLU A 119 22.772 8.741 -24.603 1.00 25.66 N ATOM 1815 CA GLU A 119 21.627 9.288 -25.323 1.00 25.70 C ATOM 1816 C GLU A 119 20.305 8.878 -24.677 1.00 24.54 C ATOM 1817 O GLU A 119 19.489 9.730 -24.326 1.00 24.02 O ATOM 1818 CB GLU A 119 21.655 8.829 -26.782 1.00 26.79 C ATOM 1819 CG GLU A 119 22.896 9.275 -27.538 1.00 27.99 C ATOM 1820 CD GLU A 119 23.002 10.782 -27.651 1.00 28.61 C ATOM 1821 OE1 GLU A 119 23.539 11.411 -26.716 1.00 28.61 O ATOM 1822 OE2 GLU A 119 22.550 11.334 -28.677 1.00 29.14 O ATOM 0 H GLU A 119 23.215 7.944 -25.060 1.00 25.66 H new ATOM 0 HA GLU A 119 21.699 10.375 -25.280 1.00 25.70 H new ATOM 0 HB2 GLU A 119 21.593 7.741 -26.813 1.00 26.79 H new ATOM 0 HB3 GLU A 119 20.772 9.214 -27.292 1.00 26.79 H new ATOM 0 HG2 GLU A 119 23.782 8.889 -27.033 1.00 27.99 H new ATOM 0 HG3 GLU A 119 22.884 8.840 -28.537 1.00 27.99 H new ATOM 1829 N GLU A 120 20.099 7.574 -24.518 1.00 24.19 N ATOM 1830 CA GLU A 120 18.864 7.065 -23.929 1.00 23.13 C ATOM 1831 C GLU A 120 18.686 7.534 -22.488 1.00 21.97 C ATOM 1832 O GLU A 120 17.580 7.896 -22.081 1.00 21.17 O ATOM 1833 CB GLU A 120 18.825 5.537 -24.000 1.00 23.10 C ATOM 1834 CG GLU A 120 19.900 4.847 -23.180 1.00 22.97 C ATOM 1835 CD GLU A 120 19.801 3.337 -23.263 1.00 23.00 C ATOM 1836 OE1 GLU A 120 18.866 2.768 -22.663 1.00 22.54 O ATOM 1837 OE2 GLU A 120 20.663 2.723 -23.925 1.00 23.55 O ATOM 0 H GLU A 120 20.768 6.853 -24.787 1.00 24.19 H new ATOM 0 HA GLU A 120 18.035 7.468 -24.511 1.00 23.13 H new ATOM 0 HB2 GLU A 120 17.848 5.194 -23.660 1.00 23.10 H new ATOM 0 HB3 GLU A 120 18.926 5.230 -25.041 1.00 23.10 H new ATOM 0 HG2 GLU A 120 20.882 5.165 -23.530 1.00 22.97 H new ATOM 0 HG3 GLU A 120 19.817 5.158 -22.139 1.00 22.97 H new ATOM 1844 N ILE A 121 19.770 7.539 -21.718 1.00 21.93 N ATOM 1845 CA ILE A 121 19.696 7.964 -20.326 1.00 20.94 C ATOM 1846 C ILE A 121 19.451 9.465 -20.219 1.00 20.97 C ATOM 1847 O ILE A 121 18.752 9.921 -19.314 1.00 20.10 O ATOM 1848 CB ILE A 121 20.963 7.591 -19.531 1.00 21.05 C ATOM 1849 CG1 ILE A 121 22.202 8.267 -20.119 1.00 22.23 C ATOM 1850 CG2 ILE A 121 21.139 6.082 -19.506 1.00 20.98 C ATOM 1851 CD1 ILE A 121 23.415 8.182 -19.216 1.00 22.33 C ATOM 0 H ILE A 121 20.699 7.257 -22.030 1.00 21.93 H new ATOM 0 HA ILE A 121 18.853 7.430 -19.889 1.00 20.94 H new ATOM 0 HB ILE A 121 20.842 7.949 -18.508 1.00 21.05 H new ATOM 0 HG12 ILE A 121 22.438 7.806 -21.078 1.00 22.23 H new ATOM 0 HG13 ILE A 121 21.977 9.315 -20.316 1.00 22.23 H new ATOM 0 HG21 ILE A 121 22.037 5.830 -18.942 1.00 20.98 H new ATOM 0 HG22 ILE A 121 20.272 5.622 -19.032 1.00 20.98 H new ATOM 0 HG23 ILE A 121 21.235 5.710 -20.526 1.00 20.98 H new ATOM 0 HD11 ILE A 121 24.259 8.681 -19.692 1.00 22.33 H new ATOM 0 HD12 ILE A 121 23.196 8.668 -18.265 1.00 22.33 H new ATOM 0 HD13 ILE A 121 23.665 7.136 -19.039 1.00 22.33 H new ATOM 1863 N ASP A 122 20.023 10.230 -21.145 1.00 22.05 N ATOM 1864 CA ASP A 122 19.843 11.676 -21.142 1.00 22.30 C ATOM 1865 C ASP A 122 18.368 12.026 -21.307 1.00 21.86 C ATOM 1866 O ASP A 122 17.868 12.962 -20.683 1.00 21.46 O ATOM 1867 CB ASP A 122 20.661 12.324 -22.260 1.00 23.63 C ATOM 1868 CG ASP A 122 20.467 13.827 -22.322 1.00 24.02 C ATOM 1869 OD1 ASP A 122 19.529 14.276 -23.014 1.00 24.14 O ATOM 1870 OD2 ASP A 122 21.252 14.554 -21.678 1.00 24.29 O ATOM 0 H ASP A 122 20.610 9.875 -21.900 1.00 22.05 H new ATOM 0 HA ASP A 122 20.194 12.062 -20.185 1.00 22.30 H new ATOM 0 HB2 ASP A 122 21.717 12.103 -22.108 1.00 23.63 H new ATOM 0 HB3 ASP A 122 20.377 11.884 -23.216 1.00 23.63 H new ATOM 1875 N GLU A 123 17.679 11.267 -22.153 1.00 22.03 N ATOM 1876 CA GLU A 123 16.258 11.487 -22.394 1.00 21.74 C ATOM 1877 C GLU A 123 15.456 11.227 -21.124 1.00 20.39 C ATOM 1878 O GLU A 123 14.587 12.016 -20.755 1.00 20.02 O ATOM 1879 CB GLU A 123 15.760 10.585 -23.525 1.00 22.27 C ATOM 1880 CG GLU A 123 16.460 10.829 -24.852 1.00 23.66 C ATOM 1881 CD GLU A 123 16.244 12.235 -25.376 1.00 24.40 C ATOM 1882 OE1 GLU A 123 17.049 13.127 -25.035 1.00 24.71 O ATOM 1883 OE2 GLU A 123 15.269 12.445 -26.129 1.00 24.74 O ATOM 0 H GLU A 123 18.082 10.494 -22.683 1.00 22.03 H new ATOM 0 HA GLU A 123 16.118 12.527 -22.690 1.00 21.74 H new ATOM 0 HB2 GLU A 123 15.900 9.543 -23.236 1.00 22.27 H new ATOM 0 HB3 GLU A 123 14.689 10.738 -23.655 1.00 22.27 H new ATOM 0 HG2 GLU A 123 17.529 10.650 -24.733 1.00 23.66 H new ATOM 0 HG3 GLU A 123 16.096 10.111 -25.588 1.00 23.66 H new ATOM 1890 N MET A 124 15.755 10.110 -20.460 1.00 19.71 N ATOM 1891 CA MET A 124 15.070 9.749 -19.223 1.00 18.41 C ATOM 1892 C MET A 124 15.206 10.864 -18.191 1.00 17.96 C ATOM 1893 O MET A 124 14.266 11.163 -17.455 1.00 17.13 O ATOM 1894 CB MET A 124 15.635 8.441 -18.664 1.00 17.97 C ATOM 1895 CG MET A 124 15.152 8.115 -17.259 1.00 16.63 C ATOM 1896 SD MET A 124 15.717 6.500 -16.687 1.00 16.29 S ATOM 1897 CE MET A 124 17.487 6.761 -16.622 1.00 17.07 C ATOM 0 H MET A 124 16.466 9.442 -20.759 1.00 19.71 H new ATOM 0 HA MET A 124 14.012 9.608 -19.444 1.00 18.41 H new ATOM 0 HB2 MET A 124 15.362 7.623 -19.331 1.00 17.97 H new ATOM 0 HB3 MET A 124 16.723 8.499 -18.660 1.00 17.97 H new ATOM 0 HG2 MET A 124 15.504 8.883 -16.571 1.00 16.63 H new ATOM 0 HG3 MET A 124 14.063 8.143 -17.238 1.00 16.63 H new ATOM 0 HE1 MET A 124 17.977 6.119 -17.355 1.00 17.07 H new ATOM 0 HE2 MET A 124 17.709 7.804 -16.847 1.00 17.07 H new ATOM 0 HE3 MET A 124 17.854 6.519 -15.625 1.00 17.07 H new ATOM 1907 N ILE A 125 16.387 11.472 -18.145 1.00 18.60 N ATOM 1908 CA ILE A 125 16.654 12.560 -17.217 1.00 18.41 C ATOM 1909 C ILE A 125 15.793 13.769 -17.551 1.00 18.72 C ATOM 1910 O ILE A 125 15.258 14.431 -16.664 1.00 18.18 O ATOM 1911 CB ILE A 125 18.141 12.964 -17.250 1.00 19.25 C ATOM 1912 CG1 ILE A 125 19.009 11.797 -16.769 1.00 19.04 C ATOM 1913 CG2 ILE A 125 18.382 14.206 -16.402 1.00 19.27 C ATOM 1914 CD1 ILE A 125 20.498 12.063 -16.850 1.00 19.95 C ATOM 0 H ILE A 125 17.176 11.227 -18.743 1.00 18.60 H new ATOM 0 HA ILE A 125 16.409 12.208 -16.215 1.00 18.41 H new ATOM 0 HB ILE A 125 18.417 13.204 -18.277 1.00 19.25 H new ATOM 0 HG12 ILE A 125 18.747 11.564 -15.737 1.00 19.04 H new ATOM 0 HG13 ILE A 125 18.775 10.914 -17.364 1.00 19.04 H new ATOM 0 HG21 ILE A 125 19.438 14.473 -16.440 1.00 19.27 H new ATOM 0 HG22 ILE A 125 17.785 15.032 -16.788 1.00 19.27 H new ATOM 0 HG23 ILE A 125 18.096 14.003 -15.370 1.00 19.27 H new ATOM 0 HD11 ILE A 125 21.044 11.190 -16.492 1.00 19.95 H new ATOM 0 HD12 ILE A 125 20.776 12.265 -17.884 1.00 19.95 H new ATOM 0 HD13 ILE A 125 20.748 12.925 -16.232 1.00 19.95 H new ATOM 1926 N ARG A 126 15.667 14.046 -18.844 1.00 19.67 N ATOM 1927 CA ARG A 126 14.867 15.170 -19.315 1.00 20.18 C ATOM 1928 C ARG A 126 13.410 15.016 -18.887 1.00 19.36 C ATOM 1929 O ARG A 126 12.718 16.004 -18.636 1.00 19.42 O ATOM 1930 CB ARG A 126 14.955 15.275 -20.840 1.00 21.37 C ATOM 1931 CG ARG A 126 14.099 16.383 -21.432 1.00 22.05 C ATOM 1932 CD ARG A 126 14.132 16.354 -22.951 1.00 22.88 C ATOM 1933 NE ARG A 126 13.276 17.380 -23.540 1.00 23.53 N ATOM 1934 CZ ARG A 126 12.845 17.346 -24.796 1.00 24.32 C ATOM 1935 NH1 ARG A 126 13.184 16.339 -25.591 1.00 24.55 N ATOM 1936 NH2 ARG A 126 12.070 18.317 -25.261 1.00 24.95 N ATOM 0 H ARG A 126 16.110 13.505 -19.587 1.00 19.67 H new ATOM 0 HA ARG A 126 15.263 16.083 -18.869 1.00 20.18 H new ATOM 0 HB2 ARG A 126 15.994 15.441 -21.123 1.00 21.37 H new ATOM 0 HB3 ARG A 126 14.654 14.323 -21.278 1.00 21.37 H new ATOM 0 HG2 ARG A 126 13.071 16.275 -21.086 1.00 22.05 H new ATOM 0 HG3 ARG A 126 14.455 17.350 -21.077 1.00 22.05 H new ATOM 0 HD2 ARG A 126 15.157 16.497 -23.293 1.00 22.88 H new ATOM 0 HD3 ARG A 126 13.813 15.372 -23.301 1.00 22.88 H new ATOM 0 HE ARG A 126 12.993 18.166 -22.955 1.00 23.53 H new ATOM 0 HH11 ARG A 126 13.777 15.588 -25.238 1.00 24.55 H new ATOM 0 HH12 ARG A 126 12.851 16.316 -26.555 1.00 24.55 H new ATOM 0 HH21 ARG A 126 11.804 19.092 -24.654 1.00 24.95 H new ATOM 0 HH22 ARG A 126 11.740 18.289 -26.226 1.00 24.95 H new ATOM 1950 N GLU A 127 12.953 13.771 -18.804 1.00 18.69 N ATOM 1951 CA GLU A 127 11.580 13.482 -18.406 1.00 17.91 C ATOM 1952 C GLU A 127 11.345 13.846 -16.943 1.00 16.85 C ATOM 1953 O GLU A 127 10.266 14.314 -16.576 1.00 16.48 O ATOM 1954 CB GLU A 127 11.262 12.004 -18.639 1.00 17.50 C ATOM 1955 CG GLU A 127 11.302 11.599 -20.102 1.00 18.61 C ATOM 1956 CD GLU A 127 10.882 10.159 -20.321 1.00 18.51 C ATOM 1957 OE1 GLU A 127 11.754 9.268 -20.242 1.00 18.54 O ATOM 1958 OE2 GLU A 127 9.681 9.921 -20.572 1.00 18.51 O ATOM 0 H GLU A 127 13.515 12.944 -19.008 1.00 18.69 H new ATOM 0 HA GLU A 127 10.915 14.090 -19.019 1.00 17.91 H new ATOM 0 HB2 GLU A 127 11.974 11.395 -18.082 1.00 17.50 H new ATOM 0 HB3 GLU A 127 10.273 11.786 -18.237 1.00 17.50 H new ATOM 0 HG2 GLU A 127 10.647 12.256 -20.675 1.00 18.61 H new ATOM 0 HG3 GLU A 127 12.312 11.741 -20.487 1.00 18.61 H new ATOM 1965 N ALA A 128 12.360 13.630 -16.113 1.00 16.47 N ATOM 1966 CA ALA A 128 12.263 13.938 -14.691 1.00 15.57 C ATOM 1967 C ALA A 128 12.733 15.358 -14.408 1.00 16.23 C ATOM 1968 O ALA A 128 12.469 15.910 -13.340 1.00 15.78 O ATOM 1969 CB ALA A 128 13.080 12.946 -13.880 1.00 14.84 C ATOM 0 H ALA A 128 13.259 13.243 -16.400 1.00 16.47 H new ATOM 0 HA ALA A 128 11.216 13.859 -14.398 1.00 15.57 H new ATOM 0 HB1 ALA A 128 12.999 13.188 -12.820 1.00 14.84 H new ATOM 0 HB2 ALA A 128 12.703 11.938 -14.052 1.00 14.84 H new ATOM 0 HB3 ALA A 128 14.125 13.000 -14.185 1.00 14.84 H new ATOM 1975 N ASP A 129 13.427 15.944 -15.375 1.00 17.37 N ATOM 1976 CA ASP A 129 13.941 17.296 -15.231 1.00 18.16 C ATOM 1977 C ASP A 129 13.022 18.303 -15.914 1.00 18.88 C ATOM 1978 O ASP A 129 12.976 18.387 -17.142 1.00 19.74 O ATOM 1979 CB ASP A 129 15.353 17.384 -15.808 1.00 19.04 C ATOM 1980 CG ASP A 129 15.899 18.795 -15.793 1.00 19.91 C ATOM 1981 OD1 ASP A 129 15.853 19.440 -14.725 1.00 20.40 O ATOM 1982 OD2 ASP A 129 16.377 19.256 -16.850 1.00 20.17 O ATOM 0 H ASP A 129 13.646 15.502 -16.268 1.00 17.37 H new ATOM 0 HA ASP A 129 13.978 17.540 -14.169 1.00 18.16 H new ATOM 0 HB2 ASP A 129 16.017 16.735 -15.236 1.00 19.04 H new ATOM 0 HB3 ASP A 129 15.347 17.011 -16.832 1.00 19.04 H new ATOM 1987 N PHE A 130 12.291 19.061 -15.104 1.00 18.61 N ATOM 1988 CA PHE A 130 11.363 20.061 -15.618 1.00 19.35 C ATOM 1989 C PHE A 130 12.014 21.440 -15.694 1.00 20.46 C ATOM 1990 O PHE A 130 11.707 22.230 -16.588 1.00 21.43 O ATOM 1991 CB PHE A 130 10.114 20.123 -14.736 1.00 18.69 C ATOM 1992 CG PHE A 130 9.355 18.827 -14.684 1.00 17.66 C ATOM 1993 CD1 PHE A 130 8.369 18.550 -15.618 1.00 17.07 C ATOM 1994 CD2 PHE A 130 9.627 17.887 -13.704 1.00 17.35 C ATOM 1995 CE1 PHE A 130 7.670 17.359 -15.575 1.00 16.17 C ATOM 1996 CE2 PHE A 130 8.931 16.694 -13.655 1.00 16.46 C ATOM 1997 CZ PHE A 130 7.951 16.429 -14.593 1.00 15.86 C ATOM 0 H PHE A 130 12.324 19.001 -14.086 1.00 18.61 H new ATOM 0 HA PHE A 130 11.080 19.765 -16.628 1.00 19.35 H new ATOM 0 HB2 PHE A 130 10.406 20.405 -13.725 1.00 18.69 H new ATOM 0 HB3 PHE A 130 9.454 20.907 -15.108 1.00 18.69 H new ATOM 0 HD1 PHE A 130 8.145 19.273 -16.388 1.00 17.07 H new ATOM 0 HD2 PHE A 130 10.392 18.089 -12.969 1.00 17.35 H new ATOM 0 HE1 PHE A 130 6.904 17.155 -16.309 1.00 16.17 H new ATOM 0 HE2 PHE A 130 9.153 15.970 -12.885 1.00 16.46 H new ATOM 0 HZ PHE A 130 7.406 15.497 -14.558 1.00 15.86 H new ATOM 2007 N ASP A 131 12.914 21.725 -14.757 1.00 20.37 N ATOM 2008 CA ASP A 131 13.600 23.014 -14.727 1.00 21.43 C ATOM 2009 C ASP A 131 14.535 23.153 -15.922 1.00 22.32 C ATOM 2010 O ASP A 131 14.983 24.252 -16.249 1.00 23.37 O ATOM 2011 CB ASP A 131 14.384 23.173 -13.423 1.00 21.16 C ATOM 2012 CG ASP A 131 15.505 22.162 -13.291 1.00 20.32 C ATOM 2013 OD1 ASP A 131 16.580 22.388 -13.886 1.00 20.09 O ATOM 2014 OD2 ASP A 131 15.307 21.145 -12.594 1.00 19.96 O ATOM 0 H ASP A 131 13.185 21.084 -14.011 1.00 20.37 H new ATOM 0 HA ASP A 131 12.848 23.801 -14.781 1.00 21.43 H new ATOM 0 HB2 ASP A 131 14.800 24.179 -13.373 1.00 21.16 H new ATOM 0 HB3 ASP A 131 13.703 23.067 -12.579 1.00 21.16 H new ATOM 2019 N GLY A 132 14.826 22.029 -16.569 1.00 21.94 N ATOM 2020 CA GLY A 132 15.701 22.039 -17.726 1.00 22.81 C ATOM 2021 C GLY A 132 17.091 22.558 -17.409 1.00 23.39 C ATOM 2022 O GLY A 132 17.373 23.744 -17.584 1.00 24.32 O ATOM 0 H GLY A 132 14.470 21.109 -16.311 1.00 21.94 H new ATOM 0 HA2 GLY A 132 15.778 21.028 -18.126 1.00 22.81 H new ATOM 0 HA3 GLY A 132 15.257 22.657 -18.506 1.00 22.81 H new ATOM 2026 N ASP A 133 17.962 21.668 -16.941 1.00 22.90 N ATOM 2027 CA ASP A 133 19.332 22.042 -16.606 1.00 23.47 C ATOM 2028 C ASP A 133 20.306 20.924 -16.973 1.00 23.33 C ATOM 2029 O ASP A 133 21.434 21.184 -17.390 1.00 23.88 O ATOM 2030 CB ASP A 133 19.445 22.369 -15.116 1.00 23.07 C ATOM 2031 CG ASP A 133 19.335 21.138 -14.239 1.00 21.88 C ATOM 2032 OD1 ASP A 133 18.315 20.424 -14.342 1.00 21.33 O ATOM 2033 OD2 ASP A 133 20.267 20.889 -13.448 1.00 21.56 O ATOM 0 H ASP A 133 17.743 20.684 -16.785 1.00 22.90 H new ATOM 0 HA ASP A 133 19.592 22.929 -17.184 1.00 23.47 H new ATOM 0 HB2 ASP A 133 20.399 22.861 -14.927 1.00 23.07 H new ATOM 0 HB3 ASP A 133 18.662 23.076 -14.843 1.00 23.07 H new ATOM 2038 N GLY A 134 19.861 19.680 -16.813 1.00 22.67 N ATOM 2039 CA GLY A 134 20.703 18.540 -17.137 1.00 22.60 C ATOM 2040 C GLY A 134 21.136 17.763 -15.908 1.00 21.81 C ATOM 2041 O GLY A 134 21.942 16.837 -16.005 1.00 21.94 O ATOM 0 H GLY A 134 18.933 19.441 -16.465 1.00 22.67 H new ATOM 0 HA2 GLY A 134 20.163 17.875 -17.811 1.00 22.60 H new ATOM 0 HA3 GLY A 134 21.587 18.887 -17.672 1.00 22.60 H new ATOM 2045 N MET A 135 20.601 18.140 -14.752 1.00 21.09 N ATOM 2046 CA MET A 135 20.933 17.472 -13.499 1.00 20.37 C ATOM 2047 C MET A 135 19.667 17.124 -12.724 1.00 19.18 C ATOM 2048 O MET A 135 18.628 17.762 -12.900 1.00 19.03 O ATOM 2049 CB MET A 135 21.844 18.359 -12.647 1.00 20.92 C ATOM 2050 CG MET A 135 23.117 18.786 -13.363 1.00 22.12 C ATOM 2051 SD MET A 135 24.189 19.803 -12.331 1.00 22.91 S ATOM 2052 CE MET A 135 24.604 18.644 -11.031 1.00 22.22 C ATOM 0 H MET A 135 19.934 18.906 -14.657 1.00 21.09 H new ATOM 0 HA MET A 135 21.461 16.548 -13.734 1.00 20.37 H new ATOM 0 HB2 MET A 135 21.292 19.248 -12.343 1.00 20.92 H new ATOM 0 HB3 MET A 135 22.111 17.823 -11.736 1.00 20.92 H new ATOM 0 HG2 MET A 135 23.663 17.899 -13.684 1.00 22.12 H new ATOM 0 HG3 MET A 135 22.854 19.341 -14.263 1.00 22.12 H new ATOM 0 HE1 MET A 135 25.670 18.707 -10.814 1.00 22.22 H new ATOM 0 HE2 MET A 135 24.036 18.886 -10.133 1.00 22.22 H new ATOM 0 HE3 MET A 135 24.359 17.632 -11.354 1.00 22.22 H new ATOM 2062 N ILE A 136 19.756 16.111 -11.867 1.00 18.41 N ATOM 2063 CA ILE A 136 18.609 15.679 -11.078 1.00 17.25 C ATOM 2064 C ILE A 136 18.852 15.849 -9.585 1.00 16.93 C ATOM 2065 O ILE A 136 19.966 15.672 -9.097 1.00 17.36 O ATOM 2066 CB ILE A 136 18.262 14.199 -11.354 1.00 16.55 C ATOM 2067 CG1 ILE A 136 17.913 13.997 -12.833 1.00 16.94 C ATOM 2068 CG2 ILE A 136 17.112 13.738 -10.462 1.00 15.33 C ATOM 2069 CD1 ILE A 136 16.708 14.792 -13.295 1.00 16.79 C ATOM 0 H ILE A 136 20.608 15.576 -11.702 1.00 18.41 H new ATOM 0 HA ILE A 136 17.776 16.314 -11.379 1.00 17.25 H new ATOM 0 HB ILE A 136 19.137 13.593 -11.120 1.00 16.55 H new ATOM 0 HG12 ILE A 136 18.774 14.276 -13.440 1.00 16.94 H new ATOM 0 HG13 ILE A 136 17.727 12.938 -13.011 1.00 16.94 H new ATOM 0 HG21 ILE A 136 16.884 12.693 -10.673 1.00 15.33 H new ATOM 0 HG22 ILE A 136 17.399 13.843 -9.416 1.00 15.33 H new ATOM 0 HG23 ILE A 136 16.231 14.349 -10.660 1.00 15.33 H new ATOM 0 HD11 ILE A 136 16.526 14.595 -14.351 1.00 16.79 H new ATOM 0 HD12 ILE A 136 15.834 14.497 -12.715 1.00 16.79 H new ATOM 0 HD13 ILE A 136 16.897 15.856 -13.151 1.00 16.79 H new ATOM 2081 N ASN A 137 17.788 16.195 -8.872 1.00 16.28 N ATOM 2082 CA ASN A 137 17.843 16.365 -7.429 1.00 16.03 C ATOM 2083 C ASN A 137 16.932 15.339 -6.769 1.00 14.85 C ATOM 2084 O ASN A 137 16.037 14.806 -7.423 1.00 14.21 O ATOM 2085 CB ASN A 137 17.435 17.785 -7.026 1.00 16.50 C ATOM 2086 CG ASN A 137 15.979 18.080 -7.322 1.00 16.54 C ATOM 2087 OD1 ASN A 137 15.406 17.548 -8.271 1.00 16.44 O ATOM 2088 ND2 ASN A 137 15.371 18.935 -6.507 1.00 16.82 N ATOM 0 H ASN A 137 16.867 16.365 -9.277 1.00 16.28 H new ATOM 0 HA ASN A 137 18.868 16.210 -7.093 1.00 16.03 H new ATOM 0 HB2 ASN A 137 17.621 17.924 -5.961 1.00 16.50 H new ATOM 0 HB3 ASN A 137 18.062 18.503 -7.555 1.00 16.50 H new ATOM 0 HD21 ASN A 137 14.391 19.173 -6.657 1.00 16.82 H new ATOM 0 HD22 ASN A 137 15.885 19.353 -5.731 1.00 16.82 H new ATOM 2095 N TYR A 138 17.177 15.038 -5.496 1.00 14.65 N ATOM 2096 CA TYR A 138 16.372 14.058 -4.763 1.00 13.62 C ATOM 2097 C TYR A 138 14.878 14.155 -5.106 1.00 12.81 C ATOM 2098 O TYR A 138 14.140 13.178 -4.968 1.00 11.86 O ATOM 2099 CB TYR A 138 16.580 14.246 -3.256 1.00 13.81 C ATOM 2100 CG TYR A 138 15.606 13.473 -2.395 1.00 12.91 C ATOM 2101 CD1 TYR A 138 15.517 12.090 -2.489 1.00 12.17 C ATOM 2102 CD2 TYR A 138 14.779 14.123 -1.489 1.00 12.92 C ATOM 2103 CE1 TYR A 138 14.630 11.378 -1.705 1.00 11.46 C ATOM 2104 CE2 TYR A 138 13.891 13.418 -0.701 1.00 12.20 C ATOM 2105 CZ TYR A 138 13.810 12.059 -0.813 1.00 11.46 C ATOM 2106 OH TYR A 138 12.937 11.341 -0.030 1.00 10.87 O ATOM 0 H TYR A 138 17.927 15.458 -4.948 1.00 14.65 H new ATOM 0 HA TYR A 138 16.706 13.065 -5.064 1.00 13.62 H new ATOM 0 HB2 TYR A 138 17.595 13.942 -3.000 1.00 13.81 H new ATOM 0 HB3 TYR A 138 16.496 15.306 -3.018 1.00 13.81 H new ATOM 0 HD1 TYR A 138 16.151 11.563 -3.186 1.00 12.17 H new ATOM 0 HD2 TYR A 138 14.831 15.198 -1.399 1.00 12.92 H new ATOM 0 HE1 TYR A 138 14.574 10.302 -1.784 1.00 11.46 H new ATOM 0 HE2 TYR A 138 13.261 13.941 0.003 1.00 12.20 H new ATOM 0 HH TYR A 138 13.109 10.383 -0.143 1.00 10.87 H new ATOM 2116 N GLU A 139 14.438 15.321 -5.575 1.00 13.28 N ATOM 2117 CA GLU A 139 13.032 15.518 -5.920 1.00 12.75 C ATOM 2118 C GLU A 139 12.710 14.942 -7.299 1.00 12.57 C ATOM 2119 O GLU A 139 11.821 14.097 -7.438 1.00 11.70 O ATOM 2120 CB GLU A 139 12.680 17.006 -5.877 1.00 13.59 C ATOM 2121 CG GLU A 139 12.810 17.620 -4.491 1.00 13.94 C ATOM 2122 CD GLU A 139 12.402 19.080 -4.459 1.00 14.48 C ATOM 2123 OE1 GLU A 139 11.208 19.358 -4.220 1.00 14.82 O ATOM 2124 OE2 GLU A 139 13.277 19.946 -4.674 1.00 14.68 O ATOM 0 H GLU A 139 15.030 16.138 -5.724 1.00 13.28 H new ATOM 0 HA GLU A 139 12.430 14.986 -5.184 1.00 12.75 H new ATOM 0 HB2 GLU A 139 13.329 17.545 -6.567 1.00 13.59 H new ATOM 0 HB3 GLU A 139 11.658 17.140 -6.231 1.00 13.59 H new ATOM 0 HG2 GLU A 139 12.193 17.059 -3.790 1.00 13.94 H new ATOM 0 HG3 GLU A 139 13.842 17.527 -4.152 1.00 13.94 H new ATOM 2131 N GLU A 140 13.442 15.392 -8.315 1.00 13.49 N ATOM 2132 CA GLU A 140 13.227 14.917 -9.678 1.00 13.65 C ATOM 2133 C GLU A 140 13.510 13.422 -9.770 1.00 13.01 C ATOM 2134 O GLU A 140 12.901 12.711 -10.570 1.00 12.80 O ATOM 2135 CB GLU A 140 14.110 15.693 -10.660 1.00 14.90 C ATOM 2136 CG GLU A 140 13.771 17.173 -10.738 1.00 15.69 C ATOM 2137 CD GLU A 140 14.857 17.987 -11.412 1.00 16.90 C ATOM 2138 OE1 GLU A 140 16.000 17.984 -10.911 1.00 17.46 O ATOM 2139 OE2 GLU A 140 14.563 18.632 -12.439 1.00 17.35 O ATOM 0 H GLU A 140 14.187 16.083 -8.220 1.00 13.49 H new ATOM 0 HA GLU A 140 12.184 15.087 -9.945 1.00 13.65 H new ATOM 0 HB2 GLU A 140 15.153 15.582 -10.365 1.00 14.90 H new ATOM 0 HB3 GLU A 140 14.011 15.253 -11.652 1.00 14.90 H new ATOM 0 HG2 GLU A 140 12.836 17.299 -11.284 1.00 15.69 H new ATOM 0 HG3 GLU A 140 13.606 17.557 -9.731 1.00 15.69 H new ATOM 2146 N PHE A 141 14.439 12.953 -8.942 1.00 12.87 N ATOM 2147 CA PHE A 141 14.792 11.540 -8.907 1.00 12.46 C ATOM 2148 C PHE A 141 13.615 10.730 -8.380 1.00 11.27 C ATOM 2149 O PHE A 141 13.160 9.782 -9.018 1.00 11.00 O ATOM 2150 CB PHE A 141 16.022 11.327 -8.017 1.00 12.80 C ATOM 2151 CG PHE A 141 16.379 9.882 -7.809 1.00 12.57 C ATOM 2152 CD1 PHE A 141 17.148 9.204 -8.739 1.00 12.93 C ATOM 2153 CD2 PHE A 141 15.946 9.204 -6.683 1.00 12.17 C ATOM 2154 CE1 PHE A 141 17.478 7.877 -8.549 1.00 12.93 C ATOM 2155 CE2 PHE A 141 16.272 7.878 -6.487 1.00 12.17 C ATOM 2156 CZ PHE A 141 17.039 7.210 -7.427 1.00 12.56 C ATOM 0 H PHE A 141 14.961 13.533 -8.286 1.00 12.87 H new ATOM 0 HA PHE A 141 15.030 11.205 -9.917 1.00 12.46 H new ATOM 0 HB2 PHE A 141 16.874 11.841 -8.462 1.00 12.80 H new ATOM 0 HB3 PHE A 141 15.841 11.790 -7.047 1.00 12.80 H new ATOM 0 HD1 PHE A 141 17.494 9.719 -9.623 1.00 12.93 H new ATOM 0 HD2 PHE A 141 15.345 9.720 -5.948 1.00 12.17 H new ATOM 0 HE1 PHE A 141 18.081 7.361 -9.281 1.00 12.93 H new ATOM 0 HE2 PHE A 141 15.930 7.362 -5.602 1.00 12.17 H new ATOM 0 HZ PHE A 141 17.292 6.170 -7.281 1.00 12.56 H new ATOM 2166 N VAL A 142 13.139 11.120 -7.202 1.00 10.70 N ATOM 2167 CA VAL A 142 12.004 10.468 -6.562 1.00 9.58 C ATOM 2168 C VAL A 142 10.846 10.282 -7.542 1.00 9.23 C ATOM 2169 O VAL A 142 10.126 9.281 -7.492 1.00 8.50 O ATOM 2170 CB VAL A 142 11.532 11.284 -5.335 1.00 9.36 C ATOM 2171 CG1 VAL A 142 10.024 11.197 -5.144 1.00 8.32 C ATOM 2172 CG2 VAL A 142 12.258 10.818 -4.084 1.00 9.69 C ATOM 0 H VAL A 142 13.529 11.895 -6.666 1.00 10.70 H new ATOM 0 HA VAL A 142 12.332 9.483 -6.230 1.00 9.58 H new ATOM 0 HB VAL A 142 11.776 12.331 -5.518 1.00 9.36 H new ATOM 0 HG11 VAL A 142 9.733 11.783 -4.272 1.00 8.32 H new ATOM 0 HG12 VAL A 142 9.522 11.589 -6.029 1.00 8.32 H new ATOM 0 HG13 VAL A 142 9.736 10.157 -4.994 1.00 8.32 H new ATOM 0 HG21 VAL A 142 11.917 11.400 -3.228 1.00 9.69 H new ATOM 0 HG22 VAL A 142 12.047 9.762 -3.913 1.00 9.69 H new ATOM 0 HG23 VAL A 142 13.331 10.957 -4.213 1.00 9.69 H new ATOM 2182 N TRP A 143 10.674 11.246 -8.436 1.00 9.94 N ATOM 2183 CA TRP A 143 9.596 11.185 -9.413 1.00 9.97 C ATOM 2184 C TRP A 143 9.822 10.092 -10.458 1.00 10.29 C ATOM 2185 O TRP A 143 8.974 9.223 -10.643 1.00 9.82 O ATOM 2186 CB TRP A 143 9.428 12.534 -10.118 1.00 10.95 C ATOM 2187 CG TRP A 143 8.239 12.573 -11.024 1.00 11.20 C ATOM 2188 CD1 TRP A 143 6.979 13.004 -10.725 1.00 10.93 C ATOM 2189 CD2 TRP A 143 8.207 12.146 -12.381 1.00 11.97 C ATOM 2190 NE1 TRP A 143 6.164 12.867 -11.825 1.00 11.51 N ATOM 2191 CE2 TRP A 143 6.898 12.339 -12.855 1.00 12.15 C ATOM 2192 CE3 TRP A 143 9.166 11.618 -13.234 1.00 12.67 C ATOM 2193 CZ2 TRP A 143 6.528 12.016 -14.157 1.00 13.01 C ATOM 2194 CZ3 TRP A 143 8.805 11.294 -14.527 1.00 13.49 C ATOM 2195 CH2 TRP A 143 7.493 11.495 -14.979 1.00 13.66 C ATOM 0 H TRP A 143 11.264 12.075 -8.505 1.00 9.94 H new ATOM 0 HA TRP A 143 8.688 10.942 -8.861 1.00 9.97 H new ATOM 0 HB2 TRP A 143 9.334 13.320 -9.369 1.00 10.95 H new ATOM 0 HB3 TRP A 143 10.326 12.750 -10.696 1.00 10.95 H new ATOM 0 HD1 TRP A 143 6.668 13.395 -9.767 1.00 10.93 H new ATOM 0 HE1 TRP A 143 5.176 13.117 -11.867 1.00 11.51 H new ATOM 0 HE3 TRP A 143 10.179 11.463 -12.892 1.00 12.67 H new ATOM 0 HZ2 TRP A 143 5.518 12.170 -14.507 1.00 13.01 H new ATOM 0 HZ3 TRP A 143 9.543 10.880 -15.199 1.00 13.49 H new ATOM 0 HH2 TRP A 143 7.238 11.234 -15.995 1.00 13.66 H new ATOM 2206 N MET A 144 10.968 10.130 -11.136 1.00 11.22 N ATOM 2207 CA MET A 144 11.259 9.161 -12.193 1.00 11.83 C ATOM 2208 C MET A 144 11.394 7.729 -11.680 1.00 11.29 C ATOM 2209 O MET A 144 11.237 6.784 -12.452 1.00 11.65 O ATOM 2210 CB MET A 144 12.513 9.567 -12.970 1.00 13.01 C ATOM 2211 CG MET A 144 13.779 9.601 -12.138 1.00 13.05 C ATOM 2212 SD MET A 144 15.255 9.870 -13.143 1.00 14.50 S ATOM 2213 CE MET A 144 16.506 10.119 -11.884 1.00 14.50 C ATOM 0 H MET A 144 11.706 10.816 -10.975 1.00 11.22 H new ATOM 0 HA MET A 144 10.398 9.173 -12.861 1.00 11.83 H new ATOM 0 HB2 MET A 144 12.655 8.872 -13.797 1.00 13.01 H new ATOM 0 HB3 MET A 144 12.352 10.553 -13.406 1.00 13.01 H new ATOM 0 HG2 MET A 144 13.700 10.393 -11.393 1.00 13.05 H new ATOM 0 HG3 MET A 144 13.879 8.661 -11.594 1.00 13.05 H new ATOM 0 HE1 MET A 144 17.023 11.061 -12.066 1.00 14.50 H new ATOM 0 HE2 MET A 144 16.033 10.149 -10.902 1.00 14.50 H new ATOM 0 HE3 MET A 144 17.223 9.299 -11.917 1.00 14.50 H new ATOM 2223 N ILE A 145 11.680 7.556 -10.394 1.00 10.61 N ATOM 2224 CA ILE A 145 11.828 6.214 -9.834 1.00 10.28 C ATOM 2225 C ILE A 145 10.478 5.576 -9.524 1.00 9.33 C ATOM 2226 O ILE A 145 10.261 4.399 -9.812 1.00 9.45 O ATOM 2227 CB ILE A 145 12.684 6.214 -8.564 1.00 10.17 C ATOM 2228 CG1 ILE A 145 12.085 7.151 -7.522 1.00 9.32 C ATOM 2229 CG2 ILE A 145 14.110 6.612 -8.898 1.00 11.25 C ATOM 2230 CD1 ILE A 145 12.760 7.064 -6.174 1.00 9.30 C ATOM 0 H ILE A 145 11.813 8.315 -9.726 1.00 10.61 H new ATOM 0 HA ILE A 145 12.332 5.625 -10.600 1.00 10.28 H new ATOM 0 HB ILE A 145 12.698 5.208 -8.145 1.00 10.17 H new ATOM 0 HG12 ILE A 145 12.150 8.176 -7.887 1.00 9.32 H new ATOM 0 HG13 ILE A 145 11.026 6.921 -7.405 1.00 9.32 H new ATOM 0 HG21 ILE A 145 14.711 6.609 -7.989 1.00 11.25 H new ATOM 0 HG22 ILE A 145 14.528 5.902 -9.612 1.00 11.25 H new ATOM 0 HG23 ILE A 145 14.116 7.611 -9.334 1.00 11.25 H new ATOM 0 HD11 ILE A 145 12.282 7.758 -5.482 1.00 9.30 H new ATOM 0 HD12 ILE A 145 12.672 6.048 -5.788 1.00 9.30 H new ATOM 0 HD13 ILE A 145 13.814 7.323 -6.277 1.00 9.30 H new ATOM 2242 N SER A 146 9.574 6.351 -8.929 1.00 8.54 N ATOM 2243 CA SER A 146 8.248 5.845 -8.596 1.00 7.66 C ATOM 2244 C SER A 146 7.510 5.481 -9.872 1.00 8.22 C ATOM 2245 O SER A 146 6.481 4.805 -9.849 1.00 7.89 O ATOM 2246 CB SER A 146 7.459 6.897 -7.816 1.00 6.98 C ATOM 2247 OG SER A 146 6.169 6.420 -7.476 1.00 6.80 O ATOM 0 H SER A 146 9.735 7.324 -8.670 1.00 8.54 H new ATOM 0 HA SER A 146 8.351 4.957 -7.972 1.00 7.66 H new ATOM 0 HB2 SER A 146 8.002 7.164 -6.909 1.00 6.98 H new ATOM 0 HB3 SER A 146 7.369 7.805 -8.413 1.00 6.98 H new ATOM 0 HG SER A 146 5.900 5.723 -8.110 1.00 6.80 H new ATOM 2253 N GLN A 147 8.060 5.947 -10.984 1.00 9.26 N ATOM 2254 CA GLN A 147 7.488 5.714 -12.296 1.00 10.11 C ATOM 2255 C GLN A 147 8.535 5.100 -13.221 1.00 11.05 C ATOM 2256 O GLN A 147 8.428 5.178 -14.446 1.00 11.87 O ATOM 2257 CB GLN A 147 6.987 7.044 -12.855 1.00 10.77 C ATOM 2258 CG GLN A 147 6.565 8.019 -11.762 1.00 10.15 C ATOM 2259 CD GLN A 147 5.158 7.764 -11.253 1.00 9.47 C ATOM 2260 OE1 GLN A 147 4.278 7.358 -12.012 1.00 10.00 O ATOM 2261 NE2 GLN A 147 4.943 7.988 -9.958 1.00 8.44 N ATOM 0 H GLN A 147 8.918 6.499 -10.998 1.00 9.26 H new ATOM 0 HA GLN A 147 6.654 5.016 -12.221 1.00 10.11 H new ATOM 0 HB2 GLN A 147 7.772 7.499 -13.459 1.00 10.77 H new ATOM 0 HB3 GLN A 147 6.142 6.860 -13.518 1.00 10.77 H new ATOM 0 HG2 GLN A 147 7.265 7.949 -10.930 1.00 10.15 H new ATOM 0 HG3 GLN A 147 6.628 9.037 -12.146 1.00 10.15 H new ATOM 0 HE21 GLN A 147 5.702 8.325 -9.366 1.00 8.44 H new ATOM 0 HE22 GLN A 147 4.019 7.823 -9.558 1.00 8.44 H new ATOM 2270 N LYS A 148 9.549 4.490 -12.611 1.00 11.08 N ATOM 2271 CA LYS A 148 10.641 3.860 -13.348 1.00 12.08 C ATOM 2272 C LYS A 148 10.267 2.441 -13.770 1.00 12.24 C ATOM 2273 O LYS A 148 9.732 2.279 -14.887 1.00 12.44 O ATOM 2274 CB LYS A 148 11.903 3.837 -12.480 1.00 12.12 C ATOM 2275 CG LYS A 148 13.168 3.443 -13.227 1.00 12.94 C ATOM 2276 CD LYS A 148 14.418 3.735 -12.404 1.00 13.10 C ATOM 2277 CE LYS A 148 14.455 2.918 -11.121 1.00 13.06 C ATOM 2278 NZ LYS A 148 14.427 1.455 -11.393 1.00 13.68 N ATOM 2279 OXT LYS A 148 10.515 1.505 -12.981 1.00 12.34 O ATOM 0 H LYS A 148 9.636 4.419 -11.597 1.00 11.08 H new ATOM 0 HA LYS A 148 10.833 4.442 -14.250 1.00 12.08 H new ATOM 0 HB2 LYS A 148 12.046 4.824 -12.041 1.00 12.12 H new ATOM 0 HB3 LYS A 148 11.750 3.141 -11.655 1.00 12.12 H new ATOM 0 HG2 LYS A 148 13.132 2.381 -13.471 1.00 12.94 H new ATOM 0 HG3 LYS A 148 13.218 3.985 -14.171 1.00 12.94 H new ATOM 0 HD2 LYS A 148 15.304 3.516 -13.000 1.00 13.10 H new ATOM 0 HD3 LYS A 148 14.452 4.797 -12.160 1.00 13.10 H new ATOM 0 HE2 LYS A 148 15.356 3.165 -10.559 1.00 13.06 H new ATOM 0 HE3 LYS A 148 13.604 3.187 -10.495 1.00 13.06 H new ATOM 0 HZ1 LYS A 148 14.673 0.936 -10.526 1.00 13.68 H new ATOM 0 HZ2 LYS A 148 13.474 1.178 -11.704 1.00 13.68 H new ATOM 0 HZ3 LYS A 148 15.114 1.227 -12.140 1.00 13.68 H new TER 2293 LYS A 148 HETATM 2294 CA CA A 149 26.598 13.754 -7.966 1.00 20.82 CA HETATM 2295 CA CA A 150 16.962 19.346 -12.721 1.00 19.22 CA HETATM 2296 CA CA A 151 -21.394 -2.460 8.158 1.00 0.33 CA