USER MOD reduce.3.24.130724 H: found=0, std=0, add=949, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 950 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 107 ASN : amide:sc= -4.57! K(o=-4.5!,f=-1.6) USER MOD Set 1.2: A 109 SER OG : rot 180:sc= 0.0495 USER MOD Set 2.1: A 81 THR OG1 : rot 4:sc= -1.94! USER MOD Set 2.2: A 114 LYS NZ :NH3+ -155:sc= 0.204 (180deg=-1.1) USER MOD Set 3.1: A 25 ASN : amide:sc= -1.59 K(o=-1.6,f=-2.3) USER MOD Set 3.2: A 128 HIS : no HD1:sc= 0 X(o=-1.6,f=-1.6) USER MOD Single : A 3 LYS NZ :NH3+ -167:sc= 1.11 (180deg=0.984) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 ASN : amide:sc= -0.428 K(o=-0.43,f=-2.2!) USER MOD Single : A 11 ASN : amide:sc= -3.34! K(o=-3.3!,f=-2.1) USER MOD Single : A 12 GLN : amide:sc= -0.205 X(o=-0.21,f=-0.0031) USER MOD Single : A 14 LYS NZ :NH3+ -149:sc= -3.19! (180deg=-8.19!) USER MOD Single : A 15 SER OG : rot 96:sc= 0.0714 USER MOD Single : A 20 SER OG : rot 124:sc= -2.71! USER MOD Single : A 29 TYR OH : rot 179:sc= -5.2! USER MOD Single : A 30 HIS : no HD1:sc= -9.94! C(o=-9.9!,f=-12!) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 151:sc= 0.955 (180deg=-0.161) USER MOD Single : A 38 THR OG1 : rot -160:sc= -1.88 USER MOD Single : A 42 ASN : amide:sc= -6.62! C(o=-6.6!,f=-3.5!) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 ASN : amide:sc= 0.479 X(o=0.48,f=-0.0051) USER MOD Single : A 50 LYS NZ :NH3+ -165:sc= 0.0488 (180deg=-0.0633) USER MOD Single : A 54 THR OG1 : rot 180:sc= -0.0264! USER MOD Single : A 59 ASN : amide:sc= -0.296 K(o=-0.3,f=-6.2!) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= -7.93! C(o=-7.9!,f=-8.2!) USER MOD Single : A 74 SER OG : rot -74:sc= 0.333 USER MOD Single : A 80 SER OG : rot -59:sc= 1.13 USER MOD Single : A 85 ASN : amide:sc= -0.132 K(o=-0.13,f=-1.1) USER MOD Single : A 87 ASN : amide:sc= -9.09! C(o=-9.1!,f=-22!) USER MOD Single : A 89 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0106) USER MOD Single : A 97 MET CE :methyl 137:sc= -6.21! (180deg=-13.1!) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ -152:sc= 1 (180deg=0.513) USER MOD Single : A 101 ASN : amide:sc= -3.5! K(o=-3.5!,f=-1.2) USER MOD Single : A 104 SER OG : rot 180:sc=-0.00195 USER MOD Single : A 105 THR OG1 : rot 180:sc= -0.377 USER MOD Single : A 106 THR OG1 : rot 180:sc= -0.0196 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 ASN : amide:sc= -9.83! C(o=-9.8!,f=-14!) USER MOD Single : A 117 SER OG : rot 55:sc= -0.274 USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 124 SER OG : rot -90:sc= 0.874 USER MOD Single : A 127 ASN : amide:sc= -4.25! C(o=-4.3!,f=-5.6!) USER MOD ----------------------------------------------------------------- ATOM 32 N LYS A 3 -14.980 22.047 -2.183 1.00 0.00 N ATOM 33 CA LYS A 3 -15.542 21.405 -0.999 1.00 0.00 C ATOM 34 C LYS A 3 -15.852 19.931 -1.262 1.00 0.00 C ATOM 35 O LYS A 3 -16.415 19.244 -0.409 1.00 0.00 O ATOM 36 CB LYS A 3 -16.819 22.133 -0.566 1.00 0.00 C ATOM 37 CG LYS A 3 -16.630 23.020 0.654 1.00 0.00 C ATOM 38 CD LYS A 3 -17.765 22.847 1.651 1.00 0.00 C ATOM 39 CE LYS A 3 -17.873 21.409 2.133 1.00 0.00 C ATOM 40 NZ LYS A 3 -19.268 20.895 2.036 1.00 0.00 N ATOM 0 HA LYS A 3 -14.801 21.461 -0.201 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -17.179 22.742 -1.395 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -17.593 21.396 -0.352 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -15.682 22.781 1.136 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -16.575 24.063 0.342 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -17.604 23.506 2.504 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -18.705 23.148 1.189 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -17.211 20.777 1.541 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -17.534 21.346 3.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -19.348 20.006 2.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -19.925 21.597 2.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -19.506 20.723 1.038 1.00 0.00 H new ATOM 54 N THR A 4 -15.485 19.452 -2.448 1.00 0.00 N ATOM 55 CA THR A 4 -15.726 18.065 -2.825 1.00 0.00 C ATOM 56 C THR A 4 -14.536 17.180 -2.460 1.00 0.00 C ATOM 57 O THR A 4 -14.668 15.959 -2.377 1.00 0.00 O ATOM 58 CB THR A 4 -16.011 17.982 -4.330 1.00 0.00 C ATOM 59 OG1 THR A 4 -17.393 18.153 -4.587 1.00 0.00 O ATOM 60 CG2 THR A 4 -15.587 16.674 -4.968 1.00 0.00 C ATOM 0 H THR A 4 -15.018 20.007 -3.165 1.00 0.00 H new ATOM 0 HA THR A 4 -16.593 17.702 -2.273 1.00 0.00 H new ATOM 0 HB THR A 4 -15.417 18.783 -4.771 1.00 0.00 H new ATOM 0 HG1 THR A 4 -17.555 18.099 -5.552 1.00 0.00 H new ATOM 0 HG21 THR A 4 -15.823 16.695 -6.032 1.00 0.00 H new ATOM 0 HG22 THR A 4 -14.514 16.536 -4.837 1.00 0.00 H new ATOM 0 HG23 THR A 4 -16.119 15.849 -4.495 1.00 0.00 H new ATOM 68 N ASN A 5 -13.374 17.797 -2.256 1.00 0.00 N ATOM 69 CA ASN A 5 -12.159 17.061 -1.916 1.00 0.00 C ATOM 70 C ASN A 5 -12.435 15.959 -0.895 1.00 0.00 C ATOM 71 O ASN A 5 -11.925 14.846 -1.021 1.00 0.00 O ATOM 72 CB ASN A 5 -11.095 18.018 -1.385 1.00 0.00 C ATOM 73 CG ASN A 5 -10.411 18.788 -2.497 1.00 0.00 C ATOM 74 OD1 ASN A 5 -10.310 20.015 -2.448 1.00 0.00 O ATOM 75 ND2 ASN A 5 -9.938 18.070 -3.510 1.00 0.00 N ATOM 0 H ASN A 5 -13.249 18.807 -2.321 1.00 0.00 H new ATOM 0 HA ASN A 5 -11.793 16.586 -2.826 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -11.555 18.720 -0.689 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -10.350 17.455 -0.824 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -9.469 18.533 -4.288 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -10.044 17.056 -3.509 1.00 0.00 H new ATOM 82 N LEU A 6 -13.257 16.265 0.104 1.00 0.00 N ATOM 83 CA LEU A 6 -13.605 15.287 1.119 1.00 0.00 C ATOM 84 C LEU A 6 -14.572 14.268 0.543 1.00 0.00 C ATOM 85 O LEU A 6 -14.237 13.097 0.402 1.00 0.00 O ATOM 86 CB LEU A 6 -14.236 15.969 2.330 1.00 0.00 C ATOM 87 CG LEU A 6 -13.286 16.826 3.160 1.00 0.00 C ATOM 88 CD1 LEU A 6 -12.164 15.973 3.726 1.00 0.00 C ATOM 89 CD2 LEU A 6 -12.731 17.969 2.324 1.00 0.00 C ATOM 0 H LEU A 6 -13.691 17.180 0.229 1.00 0.00 H new ATOM 0 HA LEU A 6 -12.694 14.782 1.439 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -15.059 16.596 1.986 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -14.667 15.203 2.975 1.00 0.00 H new ATOM 0 HG LEU A 6 -13.842 17.256 3.993 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -11.494 16.598 4.316 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -12.585 15.193 4.360 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -11.607 15.515 2.908 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -12.055 18.570 2.932 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -12.188 17.565 1.470 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -13.552 18.593 1.970 1.00 0.00 H new ATOM 101 N GLY A 7 -15.770 14.736 0.193 1.00 0.00 N ATOM 102 CA GLY A 7 -16.778 13.861 -0.380 1.00 0.00 C ATOM 103 C GLY A 7 -16.244 13.022 -1.524 1.00 0.00 C ATOM 104 O GLY A 7 -16.808 11.985 -1.859 1.00 0.00 O ATOM 0 H GLY A 7 -16.059 15.709 0.297 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -17.166 13.203 0.397 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -17.615 14.462 -0.736 1.00 0.00 H new ATOM 108 N GLU A 8 -15.152 13.471 -2.125 1.00 0.00 N ATOM 109 CA GLU A 8 -14.547 12.750 -3.235 1.00 0.00 C ATOM 110 C GLU A 8 -13.567 11.698 -2.728 1.00 0.00 C ATOM 111 O GLU A 8 -13.297 10.710 -3.411 1.00 0.00 O ATOM 112 CB GLU A 8 -13.826 13.726 -4.167 1.00 0.00 C ATOM 113 CG GLU A 8 -13.626 13.195 -5.576 1.00 0.00 C ATOM 114 CD GLU A 8 -12.573 12.107 -5.645 1.00 0.00 C ATOM 115 OE1 GLU A 8 -11.554 12.220 -4.931 1.00 0.00 O ATOM 116 OE2 GLU A 8 -12.766 11.141 -6.413 1.00 0.00 O ATOM 0 H GLU A 8 -14.668 14.330 -1.863 1.00 0.00 H new ATOM 0 HA GLU A 8 -15.340 12.246 -3.787 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -14.395 14.654 -4.216 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -12.854 13.971 -3.740 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -14.572 12.804 -5.951 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -13.338 14.016 -6.232 1.00 0.00 H new ATOM 123 N LEU A 9 -13.038 11.910 -1.526 1.00 0.00 N ATOM 124 CA LEU A 9 -12.092 10.974 -0.939 1.00 0.00 C ATOM 125 C LEU A 9 -12.788 10.061 0.063 1.00 0.00 C ATOM 126 O LEU A 9 -12.489 8.871 0.142 1.00 0.00 O ATOM 127 CB LEU A 9 -10.948 11.728 -0.264 1.00 0.00 C ATOM 128 CG LEU A 9 -9.999 12.457 -1.218 1.00 0.00 C ATOM 129 CD1 LEU A 9 -8.921 13.200 -0.443 1.00 0.00 C ATOM 130 CD2 LEU A 9 -9.374 11.476 -2.200 1.00 0.00 C ATOM 0 H LEU A 9 -13.249 12.720 -0.943 1.00 0.00 H new ATOM 0 HA LEU A 9 -11.681 10.357 -1.738 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -11.372 12.455 0.429 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -10.369 11.022 0.331 1.00 0.00 H new ATOM 0 HG LEU A 9 -10.577 13.189 -1.782 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -8.258 13.711 -1.141 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -9.387 13.932 0.217 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -8.345 12.490 0.151 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -8.702 12.011 -2.871 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -8.813 10.720 -1.651 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -10.159 10.994 -2.782 1.00 0.00 H new ATOM 142 N ILE A 10 -13.720 10.624 0.827 1.00 0.00 N ATOM 143 CA ILE A 10 -14.451 9.847 1.816 1.00 0.00 C ATOM 144 C ILE A 10 -15.406 8.870 1.145 1.00 0.00 C ATOM 145 O ILE A 10 -15.661 7.784 1.664 1.00 0.00 O ATOM 146 CB ILE A 10 -15.229 10.730 2.813 1.00 0.00 C ATOM 147 CG1 ILE A 10 -16.083 11.791 2.086 1.00 0.00 C ATOM 148 CG2 ILE A 10 -14.256 11.361 3.798 1.00 0.00 C ATOM 149 CD1 ILE A 10 -16.277 13.097 2.854 1.00 0.00 C ATOM 0 H ILE A 10 -13.984 11.608 0.779 1.00 0.00 H new ATOM 0 HA ILE A 10 -13.701 9.293 2.381 1.00 0.00 H new ATOM 0 HB ILE A 10 -15.927 10.104 3.369 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -15.617 12.016 1.127 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -17.063 11.363 1.872 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -14.805 11.985 4.503 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -13.729 10.577 4.342 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -13.536 11.974 3.256 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -16.889 13.779 2.264 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -16.774 12.891 3.802 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -15.306 13.554 3.045 1.00 0.00 H new ATOM 161 N ASN A 11 -15.918 9.249 -0.023 1.00 0.00 N ATOM 162 CA ASN A 11 -16.828 8.384 -0.769 1.00 0.00 C ATOM 163 C ASN A 11 -16.225 6.992 -0.901 1.00 0.00 C ATOM 164 O ASN A 11 -16.932 5.985 -0.883 1.00 0.00 O ATOM 165 CB ASN A 11 -17.097 8.964 -2.160 1.00 0.00 C ATOM 166 CG ASN A 11 -18.377 9.774 -2.215 1.00 0.00 C ATOM 167 OD1 ASN A 11 -19.113 9.726 -3.202 1.00 0.00 O ATOM 168 ND2 ASN A 11 -18.651 10.522 -1.154 1.00 0.00 N ATOM 0 H ASN A 11 -15.720 10.144 -0.471 1.00 0.00 H new ATOM 0 HA ASN A 11 -17.772 8.320 -0.227 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -16.259 9.595 -2.455 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -17.154 8.151 -2.884 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -19.500 11.087 -1.134 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -18.013 10.532 -0.358 1.00 0.00 H new ATOM 175 N GLN A 12 -14.902 6.956 -1.019 1.00 0.00 N ATOM 176 CA GLN A 12 -14.172 5.702 -1.140 1.00 0.00 C ATOM 177 C GLN A 12 -13.644 5.259 0.220 1.00 0.00 C ATOM 178 O GLN A 12 -13.498 4.065 0.482 1.00 0.00 O ATOM 179 CB GLN A 12 -13.015 5.848 -2.132 1.00 0.00 C ATOM 180 CG GLN A 12 -12.093 7.017 -1.827 1.00 0.00 C ATOM 181 CD GLN A 12 -10.930 7.111 -2.795 1.00 0.00 C ATOM 182 OE1 GLN A 12 -10.182 6.151 -2.980 1.00 0.00 O ATOM 183 NE2 GLN A 12 -10.774 8.272 -3.419 1.00 0.00 N ATOM 0 H GLN A 12 -14.311 7.787 -1.033 1.00 0.00 H new ATOM 0 HA GLN A 12 -14.858 4.942 -1.514 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -12.431 4.927 -2.134 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -13.422 5.970 -3.136 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -12.665 7.944 -1.861 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -11.709 6.916 -0.812 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -11.418 9.041 -3.235 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -10.010 8.395 -4.083 1.00 0.00 H new ATOM 192 N GLY A 13 -13.366 6.231 1.087 1.00 0.00 N ATOM 193 CA GLY A 13 -12.864 5.919 2.413 1.00 0.00 C ATOM 194 C GLY A 13 -13.902 5.214 3.261 1.00 0.00 C ATOM 195 O GLY A 13 -13.610 4.207 3.906 1.00 0.00 O ATOM 0 H GLY A 13 -13.480 7.226 0.894 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -11.978 5.290 2.327 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -12.554 6.839 2.909 1.00 0.00 H new ATOM 199 N LYS A 14 -15.124 5.739 3.245 1.00 0.00 N ATOM 200 CA LYS A 14 -16.223 5.152 4.001 1.00 0.00 C ATOM 201 C LYS A 14 -16.410 3.695 3.603 1.00 0.00 C ATOM 202 O LYS A 14 -16.853 2.871 4.401 1.00 0.00 O ATOM 203 CB LYS A 14 -17.518 5.928 3.742 1.00 0.00 C ATOM 204 CG LYS A 14 -17.832 6.971 4.799 1.00 0.00 C ATOM 205 CD LYS A 14 -17.337 8.350 4.391 1.00 0.00 C ATOM 206 CE LYS A 14 -16.193 8.806 5.279 1.00 0.00 C ATOM 207 NZ LYS A 14 -16.567 8.737 6.720 1.00 0.00 N ATOM 0 H LYS A 14 -15.377 6.573 2.715 1.00 0.00 H new ATOM 0 HA LYS A 14 -15.983 5.206 5.063 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -17.448 6.419 2.771 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -18.347 5.223 3.684 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -18.908 7.006 4.968 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -17.370 6.683 5.743 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -17.008 8.329 3.352 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -18.156 9.066 4.452 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -15.318 8.182 5.098 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -15.915 9.828 5.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -16.065 9.481 7.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -17.593 8.875 6.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -16.305 7.806 7.103 1.00 0.00 H new ATOM 221 N SER A 15 -16.062 3.393 2.358 1.00 0.00 N ATOM 222 CA SER A 15 -16.180 2.037 1.834 1.00 0.00 C ATOM 223 C SER A 15 -14.950 1.216 2.202 1.00 0.00 C ATOM 224 O SER A 15 -15.051 0.029 2.515 1.00 0.00 O ATOM 225 CB SER A 15 -16.354 2.066 0.314 1.00 0.00 C ATOM 226 OG SER A 15 -17.414 2.929 -0.061 1.00 0.00 O ATOM 0 H SER A 15 -15.695 4.071 1.690 1.00 0.00 H new ATOM 0 HA SER A 15 -17.059 1.572 2.280 1.00 0.00 H new ATOM 0 HB2 SER A 15 -15.428 2.397 -0.155 1.00 0.00 H new ATOM 0 HB3 SER A 15 -16.554 1.059 -0.052 1.00 0.00 H new ATOM 0 HG SER A 15 -17.053 3.812 -0.287 1.00 0.00 H new ATOM 232 N LEU A 16 -13.790 1.863 2.171 1.00 0.00 N ATOM 233 CA LEU A 16 -12.537 1.208 2.512 1.00 0.00 C ATOM 234 C LEU A 16 -12.572 0.734 3.960 1.00 0.00 C ATOM 235 O LEU A 16 -12.520 -0.464 4.235 1.00 0.00 O ATOM 236 CB LEU A 16 -11.371 2.178 2.297 1.00 0.00 C ATOM 237 CG LEU A 16 -10.335 1.737 1.261 1.00 0.00 C ATOM 238 CD1 LEU A 16 -9.421 2.896 0.888 1.00 0.00 C ATOM 239 CD2 LEU A 16 -9.524 0.561 1.788 1.00 0.00 C ATOM 0 H LEU A 16 -13.694 2.845 1.912 1.00 0.00 H new ATOM 0 HA LEU A 16 -12.399 0.341 1.866 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -11.775 3.144 1.994 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -10.865 2.329 3.251 1.00 0.00 H new ATOM 0 HG LEU A 16 -10.862 1.417 0.362 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.692 2.561 0.150 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -10.015 3.708 0.468 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.901 3.250 1.778 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -8.792 0.259 1.039 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -9.008 0.855 2.702 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -10.191 -0.275 2.001 1.00 0.00 H new ATOM 251 N LEU A 17 -12.676 1.688 4.879 1.00 0.00 N ATOM 252 CA LEU A 17 -12.736 1.388 6.303 1.00 0.00 C ATOM 253 C LEU A 17 -13.924 0.477 6.619 1.00 0.00 C ATOM 254 O LEU A 17 -13.976 -0.141 7.680 1.00 0.00 O ATOM 255 CB LEU A 17 -12.814 2.692 7.104 1.00 0.00 C ATOM 256 CG LEU A 17 -11.530 3.085 7.849 1.00 0.00 C ATOM 257 CD1 LEU A 17 -11.390 2.283 9.134 1.00 0.00 C ATOM 258 CD2 LEU A 17 -10.302 2.890 6.960 1.00 0.00 C ATOM 0 H LEU A 17 -12.721 2.683 4.659 1.00 0.00 H new ATOM 0 HA LEU A 17 -11.829 0.856 6.590 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -13.081 3.501 6.424 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -13.623 2.605 7.830 1.00 0.00 H new ATOM 0 HG LEU A 17 -11.599 4.142 8.107 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -10.474 2.576 9.648 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -12.246 2.478 9.780 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -11.349 1.220 8.897 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -9.405 3.175 7.510 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -10.229 1.843 6.665 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -10.395 3.512 6.070 1.00 0.00 H new ATOM 270 N ASP A 18 -14.877 0.386 5.693 1.00 0.00 N ATOM 271 CA ASP A 18 -16.045 -0.466 5.895 1.00 0.00 C ATOM 272 C ASP A 18 -15.879 -1.824 5.206 1.00 0.00 C ATOM 273 O ASP A 18 -16.570 -2.784 5.544 1.00 0.00 O ATOM 274 CB ASP A 18 -17.307 0.223 5.375 1.00 0.00 C ATOM 275 CG ASP A 18 -17.843 1.258 6.345 1.00 0.00 C ATOM 276 OD1 ASP A 18 -17.044 2.086 6.831 1.00 0.00 O ATOM 277 OD2 ASP A 18 -19.061 1.240 6.619 1.00 0.00 O ATOM 0 H ASP A 18 -14.864 0.887 4.804 1.00 0.00 H new ATOM 0 HA ASP A 18 -16.141 -0.637 6.967 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -17.089 0.702 4.421 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -18.075 -0.527 5.187 1.00 0.00 H new ATOM 282 N GLU A 19 -14.970 -1.902 4.231 1.00 0.00 N ATOM 283 CA GLU A 19 -14.742 -3.148 3.500 1.00 0.00 C ATOM 284 C GLU A 19 -13.464 -3.853 3.959 1.00 0.00 C ATOM 285 O GLU A 19 -13.517 -4.942 4.528 1.00 0.00 O ATOM 286 CB GLU A 19 -14.666 -2.871 1.997 1.00 0.00 C ATOM 287 CG GLU A 19 -16.025 -2.828 1.318 1.00 0.00 C ATOM 288 CD GLU A 19 -16.977 -1.851 1.981 1.00 0.00 C ATOM 289 OE1 GLU A 19 -17.537 -2.196 3.042 1.00 0.00 O ATOM 290 OE2 GLU A 19 -17.163 -0.742 1.438 1.00 0.00 O ATOM 0 H GLU A 19 -14.384 -1.122 3.932 1.00 0.00 H new ATOM 0 HA GLU A 19 -15.583 -3.808 3.710 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -14.158 -1.920 1.836 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -14.057 -3.641 1.524 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -15.896 -2.551 0.272 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -16.466 -3.825 1.331 1.00 0.00 H new ATOM 297 N SER A 20 -12.319 -3.224 3.706 1.00 0.00 N ATOM 298 CA SER A 20 -11.029 -3.784 4.088 1.00 0.00 C ATOM 299 C SER A 20 -10.993 -4.056 5.575 1.00 0.00 C ATOM 300 O SER A 20 -10.874 -3.138 6.386 1.00 0.00 O ATOM 301 CB SER A 20 -9.913 -2.814 3.736 1.00 0.00 C ATOM 302 OG SER A 20 -10.290 -1.509 4.098 1.00 0.00 O ATOM 0 H SER A 20 -12.260 -2.321 3.235 1.00 0.00 H new ATOM 0 HA SER A 20 -10.888 -4.718 3.545 1.00 0.00 H new ATOM 0 HB2 SER A 20 -8.996 -3.095 4.254 1.00 0.00 H new ATOM 0 HB3 SER A 20 -9.702 -2.859 2.668 1.00 0.00 H new ATOM 0 HG SER A 20 -9.616 -1.128 4.699 1.00 0.00 H new ATOM 308 N VAL A 21 -11.099 -5.317 5.925 1.00 0.00 N ATOM 309 CA VAL A 21 -11.081 -5.712 7.315 1.00 0.00 C ATOM 310 C VAL A 21 -9.719 -6.248 7.704 1.00 0.00 C ATOM 311 O VAL A 21 -9.039 -6.880 6.907 1.00 0.00 O ATOM 312 CB VAL A 21 -12.148 -6.778 7.588 1.00 0.00 C ATOM 313 CG1 VAL A 21 -12.066 -7.893 6.559 1.00 0.00 C ATOM 314 CG2 VAL A 21 -12.032 -7.327 9.005 1.00 0.00 C ATOM 0 H VAL A 21 -11.199 -6.088 5.265 1.00 0.00 H new ATOM 0 HA VAL A 21 -11.298 -4.828 7.915 1.00 0.00 H new ATOM 0 HB VAL A 21 -13.127 -6.306 7.500 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -12.831 -8.640 6.770 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -12.226 -7.481 5.563 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -11.082 -8.359 6.605 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -12.802 -8.081 9.167 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -11.049 -7.778 9.141 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -12.162 -6.516 9.721 1.00 0.00 H new ATOM 324 N GLU A 22 -9.330 -5.992 8.935 1.00 0.00 N ATOM 325 CA GLU A 22 -8.044 -6.457 9.423 1.00 0.00 C ATOM 326 C GLU A 22 -8.108 -7.950 9.740 1.00 0.00 C ATOM 327 O GLU A 22 -8.752 -8.365 10.703 1.00 0.00 O ATOM 328 CB GLU A 22 -7.646 -5.676 10.675 1.00 0.00 C ATOM 329 CG GLU A 22 -8.732 -5.628 11.738 1.00 0.00 C ATOM 330 CD GLU A 22 -8.316 -6.303 13.030 1.00 0.00 C ATOM 331 OE1 GLU A 22 -7.946 -7.495 12.986 1.00 0.00 O ATOM 332 OE2 GLU A 22 -8.359 -5.639 14.087 1.00 0.00 O ATOM 0 H GLU A 22 -9.881 -5.468 9.615 1.00 0.00 H new ATOM 0 HA GLU A 22 -7.295 -6.293 8.648 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -6.751 -6.126 11.104 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -7.385 -4.657 10.389 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -8.989 -4.589 11.942 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -9.632 -6.109 11.355 1.00 0.00 H new ATOM 339 N GLY A 23 -7.437 -8.751 8.916 1.00 0.00 N ATOM 340 CA GLY A 23 -7.428 -10.187 9.110 1.00 0.00 C ATOM 341 C GLY A 23 -6.026 -10.767 9.129 1.00 0.00 C ATOM 342 O GLY A 23 -5.378 -10.798 10.175 1.00 0.00 O ATOM 0 H GLY A 23 -6.897 -8.426 8.114 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -7.928 -10.426 10.049 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -8.002 -10.661 8.313 1.00 0.00 H new ATOM 346 N PHE A 24 -5.555 -11.231 7.969 1.00 0.00 N ATOM 347 CA PHE A 24 -4.217 -11.819 7.864 1.00 0.00 C ATOM 348 C PHE A 24 -3.970 -12.402 6.474 1.00 0.00 C ATOM 349 O PHE A 24 -3.347 -13.456 6.340 1.00 0.00 O ATOM 350 CB PHE A 24 -4.034 -12.920 8.916 1.00 0.00 C ATOM 351 CG PHE A 24 -2.706 -12.873 9.619 1.00 0.00 C ATOM 352 CD1 PHE A 24 -2.173 -11.669 10.046 1.00 0.00 C ATOM 353 CD2 PHE A 24 -1.993 -14.039 9.854 1.00 0.00 C ATOM 354 CE1 PHE A 24 -0.953 -11.626 10.694 1.00 0.00 C ATOM 355 CE2 PHE A 24 -0.773 -14.002 10.502 1.00 0.00 C ATOM 356 CZ PHE A 24 -0.253 -12.794 10.922 1.00 0.00 C ATOM 0 H PHE A 24 -6.077 -11.211 7.093 1.00 0.00 H new ATOM 0 HA PHE A 24 -3.495 -11.021 8.038 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -4.830 -12.838 9.656 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -4.146 -13.892 8.435 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -2.717 -10.753 9.871 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -2.396 -14.986 9.527 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -0.548 -10.680 11.022 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -0.227 -14.917 10.680 1.00 0.00 H new ATOM 0 HZ PHE A 24 0.700 -12.763 11.428 1.00 0.00 H new ATOM 366 N ASN A 25 -4.453 -11.722 5.440 1.00 0.00 N ATOM 367 CA ASN A 25 -4.270 -12.193 4.069 1.00 0.00 C ATOM 368 C ASN A 25 -4.883 -11.222 3.066 1.00 0.00 C ATOM 369 O ASN A 25 -5.503 -10.231 3.447 1.00 0.00 O ATOM 370 CB ASN A 25 -4.892 -13.582 3.897 1.00 0.00 C ATOM 371 CG ASN A 25 -3.857 -14.689 3.944 1.00 0.00 C ATOM 372 OD1 ASN A 25 -3.823 -15.484 4.883 1.00 0.00 O ATOM 373 ND2 ASN A 25 -3.006 -14.745 2.927 1.00 0.00 N ATOM 0 H ASN A 25 -4.972 -10.848 5.522 1.00 0.00 H new ATOM 0 HA ASN A 25 -3.199 -12.253 3.876 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -5.631 -13.746 4.681 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -5.422 -13.624 2.946 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -2.287 -15.468 2.903 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -3.071 -14.065 2.170 1.00 0.00 H new ATOM 380 N VAL A 26 -4.709 -11.517 1.778 1.00 0.00 N ATOM 381 CA VAL A 26 -5.250 -10.670 0.719 1.00 0.00 C ATOM 382 C VAL A 26 -6.719 -10.353 0.976 1.00 0.00 C ATOM 383 O VAL A 26 -7.541 -11.254 1.137 1.00 0.00 O ATOM 384 CB VAL A 26 -5.104 -11.331 -0.666 1.00 0.00 C ATOM 385 CG1 VAL A 26 -5.911 -12.620 -0.736 1.00 0.00 C ATOM 386 CG2 VAL A 26 -5.524 -10.368 -1.766 1.00 0.00 C ATOM 0 H VAL A 26 -4.199 -12.335 1.445 1.00 0.00 H new ATOM 0 HA VAL A 26 -4.674 -9.744 0.724 1.00 0.00 H new ATOM 0 HB VAL A 26 -4.054 -11.582 -0.817 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.794 -13.070 -1.722 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -5.554 -13.315 0.024 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -6.964 -12.400 -0.561 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -5.414 -10.853 -2.736 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -6.565 -10.081 -1.620 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -4.894 -9.479 -1.731 1.00 0.00 H new ATOM 396 N GLY A 27 -7.040 -9.066 1.030 1.00 0.00 N ATOM 397 CA GLY A 27 -8.405 -8.653 1.288 1.00 0.00 C ATOM 398 C GLY A 27 -8.593 -8.179 2.716 1.00 0.00 C ATOM 399 O GLY A 27 -9.556 -7.477 3.024 1.00 0.00 O ATOM 0 H GLY A 27 -6.378 -8.301 0.900 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -8.678 -7.852 0.601 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -9.080 -9.486 1.090 1.00 0.00 H new ATOM 403 N GLU A 28 -7.660 -8.557 3.587 1.00 0.00 N ATOM 404 CA GLU A 28 -7.709 -8.167 4.985 1.00 0.00 C ATOM 405 C GLU A 28 -6.320 -7.778 5.465 1.00 0.00 C ATOM 406 O GLU A 28 -5.337 -8.420 5.113 1.00 0.00 O ATOM 407 CB GLU A 28 -8.268 -9.307 5.839 1.00 0.00 C ATOM 408 CG GLU A 28 -9.564 -9.892 5.299 1.00 0.00 C ATOM 409 CD GLU A 28 -10.353 -10.637 6.357 1.00 0.00 C ATOM 410 OE1 GLU A 28 -10.141 -10.363 7.559 1.00 0.00 O ATOM 411 OE2 GLU A 28 -11.182 -11.494 5.987 1.00 0.00 O ATOM 0 H GLU A 28 -6.858 -9.137 3.342 1.00 0.00 H new ATOM 0 HA GLU A 28 -8.370 -7.306 5.086 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -7.522 -10.099 5.907 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -8.438 -8.942 6.852 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -10.178 -9.089 4.891 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -9.337 -10.570 4.476 1.00 0.00 H new ATOM 418 N TYR A 29 -6.238 -6.713 6.253 1.00 0.00 N ATOM 419 CA TYR A 29 -4.942 -6.244 6.746 1.00 0.00 C ATOM 420 C TYR A 29 -4.672 -6.723 8.166 1.00 0.00 C ATOM 421 O TYR A 29 -5.502 -7.387 8.776 1.00 0.00 O ATOM 422 CB TYR A 29 -4.870 -4.720 6.676 1.00 0.00 C ATOM 423 CG TYR A 29 -5.714 -4.029 7.708 1.00 0.00 C ATOM 424 CD1 TYR A 29 -7.058 -3.761 7.470 1.00 0.00 C ATOM 425 CD2 TYR A 29 -5.165 -3.648 8.923 1.00 0.00 C ATOM 426 CE1 TYR A 29 -7.832 -3.128 8.418 1.00 0.00 C ATOM 427 CE2 TYR A 29 -5.935 -3.017 9.877 1.00 0.00 C ATOM 428 CZ TYR A 29 -7.265 -2.757 9.621 1.00 0.00 C ATOM 429 OH TYR A 29 -8.029 -2.141 10.580 1.00 0.00 O ATOM 0 H TYR A 29 -7.039 -6.162 6.563 1.00 0.00 H new ATOM 0 HA TYR A 29 -4.170 -6.668 6.104 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -3.833 -4.408 6.799 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -5.185 -4.395 5.684 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -7.501 -4.053 6.529 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -4.123 -3.848 9.124 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -8.874 -2.924 8.222 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -5.498 -2.727 10.821 1.00 0.00 H new ATOM 0 HH TYR A 29 -7.479 -1.963 11.371 1.00 0.00 H new ATOM 439 N HIS A 30 -3.494 -6.396 8.688 1.00 0.00 N ATOM 440 CA HIS A 30 -3.137 -6.823 10.043 1.00 0.00 C ATOM 441 C HIS A 30 -2.975 -5.646 11.005 1.00 0.00 C ATOM 442 O HIS A 30 -1.861 -5.304 11.401 1.00 0.00 O ATOM 443 CB HIS A 30 -1.856 -7.655 10.029 1.00 0.00 C ATOM 444 CG HIS A 30 -1.664 -8.461 11.276 1.00 0.00 C ATOM 445 ND1 HIS A 30 -2.592 -9.371 11.735 1.00 0.00 N ATOM 446 CD2 HIS A 30 -0.643 -8.486 12.166 1.00 0.00 C ATOM 447 CE1 HIS A 30 -2.153 -9.920 12.853 1.00 0.00 C ATOM 448 NE2 HIS A 30 -0.972 -9.400 13.136 1.00 0.00 N ATOM 0 H HIS A 30 -2.781 -5.848 8.207 1.00 0.00 H new ATOM 0 HA HIS A 30 -3.965 -7.434 10.403 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -1.875 -8.325 9.170 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -1.001 -6.992 9.897 1.00 0.00 H new ATOM 0 HD2 HIS A 30 0.261 -7.897 12.121 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -2.671 -10.667 13.436 1.00 0.00 H new ATOM 0 HE2 HIS A 30 -0.398 -9.639 13.944 1.00 0.00 H new ATOM 457 N LYS A 31 -4.099 -5.059 11.402 1.00 0.00 N ATOM 458 CA LYS A 31 -4.100 -3.943 12.350 1.00 0.00 C ATOM 459 C LYS A 31 -3.205 -2.793 11.890 1.00 0.00 C ATOM 460 O LYS A 31 -2.305 -2.974 11.070 1.00 0.00 O ATOM 461 CB LYS A 31 -3.645 -4.428 13.727 1.00 0.00 C ATOM 462 CG LYS A 31 -4.740 -5.125 14.519 1.00 0.00 C ATOM 463 CD LYS A 31 -4.612 -4.849 16.008 1.00 0.00 C ATOM 464 CE LYS A 31 -5.252 -5.952 16.836 1.00 0.00 C ATOM 465 NZ LYS A 31 -5.931 -5.415 18.047 1.00 0.00 N ATOM 0 H LYS A 31 -5.027 -5.337 11.082 1.00 0.00 H new ATOM 0 HA LYS A 31 -5.121 -3.566 12.405 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -2.806 -5.113 13.603 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -3.279 -3.576 14.300 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -5.715 -4.788 14.168 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -4.691 -6.199 14.341 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -3.559 -4.758 16.273 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -5.084 -3.895 16.244 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -5.975 -6.492 16.224 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -4.489 -6.670 17.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -6.354 -6.199 18.584 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -5.237 -4.921 18.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -6.677 -4.749 17.760 1.00 0.00 H new ATOM 479 N GLY A 32 -3.456 -1.608 12.444 1.00 0.00 N ATOM 480 CA GLY A 32 -2.665 -0.437 12.106 1.00 0.00 C ATOM 481 C GLY A 32 -3.075 0.224 10.800 1.00 0.00 C ATOM 482 O GLY A 32 -2.589 1.307 10.476 1.00 0.00 O ATOM 0 H GLY A 32 -4.197 -1.439 13.124 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -2.748 0.291 12.913 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -1.616 -0.725 12.043 1.00 0.00 H new ATOM 486 N ALA A 33 -3.955 -0.423 10.043 1.00 0.00 N ATOM 487 CA ALA A 33 -4.398 0.126 8.767 1.00 0.00 C ATOM 488 C ALA A 33 -5.617 1.036 8.925 1.00 0.00 C ATOM 489 O ALA A 33 -5.554 2.228 8.622 1.00 0.00 O ATOM 490 CB ALA A 33 -4.698 -1.005 7.797 1.00 0.00 C ATOM 0 H ALA A 33 -4.373 -1.321 10.288 1.00 0.00 H new ATOM 0 HA ALA A 33 -3.591 0.741 8.369 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -5.029 -0.590 6.845 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -3.797 -1.599 7.641 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -5.483 -1.639 8.209 1.00 0.00 H new ATOM 496 N LYS A 34 -6.733 0.461 9.373 1.00 0.00 N ATOM 497 CA LYS A 34 -7.982 1.206 9.543 1.00 0.00 C ATOM 498 C LYS A 34 -7.765 2.600 10.135 1.00 0.00 C ATOM 499 O LYS A 34 -8.058 3.606 9.489 1.00 0.00 O ATOM 500 CB LYS A 34 -8.957 0.423 10.420 1.00 0.00 C ATOM 501 CG LYS A 34 -9.907 -0.452 9.617 1.00 0.00 C ATOM 502 CD LYS A 34 -11.088 -0.912 10.452 1.00 0.00 C ATOM 503 CE LYS A 34 -12.336 -1.064 9.601 1.00 0.00 C ATOM 504 NZ LYS A 34 -13.522 -0.424 10.236 1.00 0.00 N ATOM 0 H LYS A 34 -6.798 -0.525 9.626 1.00 0.00 H new ATOM 0 HA LYS A 34 -8.403 1.336 8.546 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -8.393 -0.202 11.112 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -9.537 1.122 11.022 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -10.268 0.102 8.751 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -9.369 -1.321 9.238 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -10.851 -1.863 10.928 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -11.274 -0.194 11.250 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -12.164 -0.618 8.621 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -12.538 -2.123 9.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -14.182 -0.107 9.498 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -13.998 -1.111 10.854 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -13.215 0.394 10.800 1.00 0.00 H new ATOM 518 N ASP A 35 -7.275 2.643 11.371 1.00 0.00 N ATOM 519 CA ASP A 35 -7.036 3.901 12.087 1.00 0.00 C ATOM 520 C ASP A 35 -6.626 5.040 11.155 1.00 0.00 C ATOM 521 O ASP A 35 -7.384 5.980 10.961 1.00 0.00 O ATOM 522 CB ASP A 35 -5.955 3.693 13.136 1.00 0.00 C ATOM 523 CG ASP A 35 -6.281 4.373 14.450 1.00 0.00 C ATOM 524 OD1 ASP A 35 -7.212 3.911 15.143 1.00 0.00 O ATOM 525 OD2 ASP A 35 -5.604 5.367 14.789 1.00 0.00 O ATOM 0 H ASP A 35 -7.031 1.810 11.907 1.00 0.00 H new ATOM 0 HA ASP A 35 -7.977 4.188 12.557 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -5.821 2.625 13.307 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -5.008 4.077 12.757 1.00 0.00 H new ATOM 530 N GLY A 36 -5.424 4.951 10.590 1.00 0.00 N ATOM 531 CA GLY A 36 -4.929 5.982 9.686 1.00 0.00 C ATOM 532 C GLY A 36 -6.025 6.588 8.830 1.00 0.00 C ATOM 533 O GLY A 36 -6.564 7.644 9.161 1.00 0.00 O ATOM 0 H GLY A 36 -4.778 4.177 10.743 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -4.451 6.770 10.268 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -4.163 5.554 9.039 1.00 0.00 H new ATOM 537 N LEU A 37 -6.365 5.918 7.734 1.00 0.00 N ATOM 538 CA LEU A 37 -7.410 6.395 6.846 1.00 0.00 C ATOM 539 C LEU A 37 -8.654 6.815 7.632 1.00 0.00 C ATOM 540 O LEU A 37 -9.214 7.879 7.396 1.00 0.00 O ATOM 541 CB LEU A 37 -7.768 5.302 5.839 1.00 0.00 C ATOM 542 CG LEU A 37 -9.137 5.446 5.177 1.00 0.00 C ATOM 543 CD1 LEU A 37 -9.184 6.703 4.334 1.00 0.00 C ATOM 544 CD2 LEU A 37 -9.445 4.220 4.338 1.00 0.00 C ATOM 0 H LEU A 37 -5.930 5.043 7.442 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.037 7.271 6.315 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -7.006 5.285 5.060 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -7.727 4.337 6.345 1.00 0.00 H new ATOM 0 HG LEU A 37 -9.897 5.529 5.954 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -10.166 6.792 3.868 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -9.002 7.572 4.966 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -8.419 6.651 3.560 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -10.423 4.335 3.871 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -8.685 4.108 3.565 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -9.448 3.335 4.974 1.00 0.00 H new ATOM 556 N THR A 38 -9.087 5.974 8.563 1.00 0.00 N ATOM 557 CA THR A 38 -10.271 6.285 9.355 1.00 0.00 C ATOM 558 C THR A 38 -10.071 7.565 10.161 1.00 0.00 C ATOM 559 O THR A 38 -10.999 8.343 10.358 1.00 0.00 O ATOM 560 CB THR A 38 -10.627 5.108 10.269 1.00 0.00 C ATOM 561 OG1 THR A 38 -12.011 4.820 10.178 1.00 0.00 O ATOM 562 CG2 THR A 38 -10.317 5.324 11.734 1.00 0.00 C ATOM 0 H THR A 38 -8.644 5.083 8.787 1.00 0.00 H new ATOM 0 HA THR A 38 -11.105 6.452 8.673 1.00 0.00 H new ATOM 0 HB THR A 38 -10.002 4.289 9.913 1.00 0.00 H new ATOM 0 HG1 THR A 38 -12.291 4.308 10.965 1.00 0.00 H new ATOM 0 HG21 THR A 38 -10.603 4.438 12.301 1.00 0.00 H new ATOM 0 HG22 THR A 38 -9.249 5.504 11.857 1.00 0.00 H new ATOM 0 HG23 THR A 38 -10.875 6.185 12.101 1.00 0.00 H new ATOM 570 N VAL A 39 -8.852 7.760 10.629 1.00 0.00 N ATOM 571 CA VAL A 39 -8.501 8.927 11.422 1.00 0.00 C ATOM 572 C VAL A 39 -8.609 10.186 10.584 1.00 0.00 C ATOM 573 O VAL A 39 -8.951 11.256 11.089 1.00 0.00 O ATOM 574 CB VAL A 39 -7.082 8.755 11.998 1.00 0.00 C ATOM 575 CG1 VAL A 39 -6.506 10.057 12.525 1.00 0.00 C ATOM 576 CG2 VAL A 39 -7.113 7.698 13.083 1.00 0.00 C ATOM 0 H VAL A 39 -8.077 7.116 10.471 1.00 0.00 H new ATOM 0 HA VAL A 39 -9.199 9.023 12.254 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.423 8.437 11.190 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -5.505 9.879 12.919 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -6.453 10.785 11.716 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -7.145 10.443 13.319 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -6.112 7.571 13.496 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -7.795 8.009 13.874 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -7.454 6.753 12.661 1.00 0.00 H new ATOM 586 N GLU A 40 -8.372 10.040 9.290 1.00 0.00 N ATOM 587 CA GLU A 40 -8.503 11.155 8.374 1.00 0.00 C ATOM 588 C GLU A 40 -9.923 11.157 7.827 1.00 0.00 C ATOM 589 O GLU A 40 -10.426 12.188 7.399 1.00 0.00 O ATOM 590 CB GLU A 40 -7.476 11.087 7.245 1.00 0.00 C ATOM 591 CG GLU A 40 -7.288 9.705 6.668 1.00 0.00 C ATOM 592 CD GLU A 40 -8.191 9.446 5.481 1.00 0.00 C ATOM 593 OE1 GLU A 40 -9.407 9.705 5.593 1.00 0.00 O ATOM 594 OE2 GLU A 40 -7.688 8.981 4.437 1.00 0.00 O ATOM 0 H GLU A 40 -8.089 9.162 8.854 1.00 0.00 H new ATOM 0 HA GLU A 40 -8.308 12.085 8.908 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -7.783 11.764 6.448 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -6.517 11.447 7.618 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -6.249 9.580 6.364 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -7.486 8.962 7.440 1.00 0.00 H new ATOM 601 N ILE A 41 -10.578 9.990 7.895 1.00 0.00 N ATOM 602 CA ILE A 41 -11.963 9.856 7.464 1.00 0.00 C ATOM 603 C ILE A 41 -12.844 10.505 8.513 1.00 0.00 C ATOM 604 O ILE A 41 -13.543 11.481 8.240 1.00 0.00 O ATOM 605 CB ILE A 41 -12.377 8.378 7.299 1.00 0.00 C ATOM 606 CG1 ILE A 41 -11.678 7.753 6.095 1.00 0.00 C ATOM 607 CG2 ILE A 41 -13.882 8.255 7.154 1.00 0.00 C ATOM 608 CD1 ILE A 41 -12.087 8.357 4.771 1.00 0.00 C ATOM 0 H ILE A 41 -10.163 9.127 8.246 1.00 0.00 H new ATOM 0 HA ILE A 41 -12.075 10.338 6.493 1.00 0.00 H new ATOM 0 HB ILE A 41 -12.070 7.840 8.196 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -10.600 7.861 6.216 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -11.891 6.684 6.077 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -14.152 7.205 7.039 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -14.367 8.659 8.042 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -14.210 8.812 6.276 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -11.548 7.861 3.963 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -13.159 8.225 4.627 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -11.848 9.421 4.767 1.00 0.00 H new ATOM 620 N ASN A 42 -12.766 9.980 9.738 1.00 0.00 N ATOM 621 CA ASN A 42 -13.517 10.538 10.849 1.00 0.00 C ATOM 622 C ASN A 42 -13.290 12.041 10.882 1.00 0.00 C ATOM 623 O ASN A 42 -14.206 12.825 11.130 1.00 0.00 O ATOM 624 CB ASN A 42 -13.055 9.913 12.168 1.00 0.00 C ATOM 625 CG ASN A 42 -13.084 8.399 12.137 1.00 0.00 C ATOM 626 OD1 ASN A 42 -14.005 7.793 11.590 1.00 0.00 O ATOM 627 ND2 ASN A 42 -12.069 7.780 12.730 1.00 0.00 N ATOM 0 H ASN A 42 -12.191 9.173 9.978 1.00 0.00 H new ATOM 0 HA ASN A 42 -14.578 10.323 10.719 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -12.042 10.249 12.390 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -13.693 10.268 12.977 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -12.031 6.761 12.744 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -11.327 8.324 13.171 1.00 0.00 H new ATOM 634 N LYS A 43 -12.043 12.426 10.616 1.00 0.00 N ATOM 635 CA LYS A 43 -11.659 13.834 10.598 1.00 0.00 C ATOM 636 C LYS A 43 -11.998 14.507 9.259 1.00 0.00 C ATOM 637 O LYS A 43 -12.122 15.729 9.193 1.00 0.00 O ATOM 638 CB LYS A 43 -10.162 13.973 10.878 1.00 0.00 C ATOM 639 CG LYS A 43 -9.761 15.353 11.374 1.00 0.00 C ATOM 640 CD LYS A 43 -8.381 15.745 10.873 1.00 0.00 C ATOM 641 CE LYS A 43 -8.467 16.633 9.642 1.00 0.00 C ATOM 642 NZ LYS A 43 -8.739 18.053 10.000 1.00 0.00 N ATOM 0 H LYS A 43 -11.281 11.780 10.410 1.00 0.00 H new ATOM 0 HA LYS A 43 -12.230 14.337 11.378 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -9.869 13.230 11.620 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -9.608 13.749 9.966 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -10.493 16.088 11.040 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -9.771 15.366 12.464 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -7.841 16.267 11.663 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -7.810 14.847 10.636 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -7.533 16.572 9.084 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -9.255 16.267 8.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -8.790 18.626 9.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -9.643 18.115 10.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -7.974 18.411 10.607 1.00 0.00 H new ATOM 656 N ALA A 44 -12.141 13.713 8.194 1.00 0.00 N ATOM 657 CA ALA A 44 -12.456 14.258 6.873 1.00 0.00 C ATOM 658 C ALA A 44 -13.926 14.641 6.776 1.00 0.00 C ATOM 659 O ALA A 44 -14.254 15.794 6.500 1.00 0.00 O ATOM 660 CB ALA A 44 -12.089 13.270 5.772 1.00 0.00 C ATOM 0 H ALA A 44 -12.044 12.698 8.221 1.00 0.00 H new ATOM 0 HA ALA A 44 -11.859 15.159 6.736 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -12.333 13.700 4.801 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -11.021 13.057 5.816 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -12.650 12.346 5.911 1.00 0.00 H new ATOM 666 N GLU A 45 -14.814 13.677 7.012 1.00 0.00 N ATOM 667 CA GLU A 45 -16.249 13.939 6.961 1.00 0.00 C ATOM 668 C GLU A 45 -16.589 15.156 7.807 1.00 0.00 C ATOM 669 O GLU A 45 -17.406 15.990 7.421 1.00 0.00 O ATOM 670 CB GLU A 45 -17.036 12.726 7.448 1.00 0.00 C ATOM 671 CG GLU A 45 -17.390 11.758 6.338 1.00 0.00 C ATOM 672 CD GLU A 45 -18.715 11.058 6.572 1.00 0.00 C ATOM 673 OE1 GLU A 45 -18.736 10.066 7.331 1.00 0.00 O ATOM 674 OE2 GLU A 45 -19.730 11.501 5.995 1.00 0.00 O ATOM 0 H GLU A 45 -14.566 12.714 7.239 1.00 0.00 H new ATOM 0 HA GLU A 45 -16.526 14.137 5.926 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -16.452 12.202 8.205 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -17.952 13.066 7.931 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -17.431 12.296 5.391 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -16.601 11.012 6.247 1.00 0.00 H new ATOM 681 N GLU A 46 -15.925 15.263 8.956 1.00 0.00 N ATOM 682 CA GLU A 46 -16.125 16.393 9.849 1.00 0.00 C ATOM 683 C GLU A 46 -15.909 17.690 9.085 1.00 0.00 C ATOM 684 O GLU A 46 -16.474 18.725 9.428 1.00 0.00 O ATOM 685 CB GLU A 46 -15.166 16.316 11.038 1.00 0.00 C ATOM 686 CG GLU A 46 -15.697 15.484 12.195 1.00 0.00 C ATOM 687 CD GLU A 46 -14.706 15.376 13.338 1.00 0.00 C ATOM 688 OE1 GLU A 46 -14.025 16.382 13.630 1.00 0.00 O ATOM 689 OE2 GLU A 46 -14.612 14.286 13.939 1.00 0.00 O ATOM 0 H GLU A 46 -15.245 14.579 9.287 1.00 0.00 H new ATOM 0 HA GLU A 46 -17.146 16.364 10.231 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -14.218 15.894 10.703 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -14.958 17.326 11.393 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -16.623 15.928 12.562 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -15.943 14.484 11.836 1.00 0.00 H new ATOM 696 N VAL A 47 -15.097 17.608 8.030 1.00 0.00 N ATOM 697 CA VAL A 47 -14.808 18.752 7.185 1.00 0.00 C ATOM 698 C VAL A 47 -15.738 18.755 5.979 1.00 0.00 C ATOM 699 O VAL A 47 -16.283 19.792 5.607 1.00 0.00 O ATOM 700 CB VAL A 47 -13.324 18.762 6.739 1.00 0.00 C ATOM 701 CG1 VAL A 47 -13.139 19.300 5.321 1.00 0.00 C ATOM 702 CG2 VAL A 47 -12.519 19.594 7.713 1.00 0.00 C ATOM 0 H VAL A 47 -14.627 16.749 7.744 1.00 0.00 H new ATOM 0 HA VAL A 47 -14.980 19.659 7.764 1.00 0.00 H new ATOM 0 HB VAL A 47 -12.973 17.730 6.735 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -12.081 19.284 5.061 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -13.694 18.677 4.620 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -13.510 20.324 5.269 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -11.474 19.605 7.405 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -12.904 20.614 7.726 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -12.598 19.164 8.711 1.00 0.00 H new ATOM 712 N PHE A 48 -15.929 17.584 5.380 1.00 0.00 N ATOM 713 CA PHE A 48 -16.808 17.453 4.221 1.00 0.00 C ATOM 714 C PHE A 48 -18.117 18.197 4.454 1.00 0.00 C ATOM 715 O PHE A 48 -18.578 18.953 3.599 1.00 0.00 O ATOM 716 CB PHE A 48 -17.113 15.983 3.933 1.00 0.00 C ATOM 717 CG PHE A 48 -17.982 15.777 2.723 1.00 0.00 C ATOM 718 CD1 PHE A 48 -17.873 16.614 1.622 1.00 0.00 C ATOM 719 CD2 PHE A 48 -18.909 14.748 2.686 1.00 0.00 C ATOM 720 CE1 PHE A 48 -18.670 16.428 0.510 1.00 0.00 C ATOM 721 CE2 PHE A 48 -19.710 14.557 1.575 1.00 0.00 C ATOM 722 CZ PHE A 48 -19.591 15.398 0.486 1.00 0.00 C ATOM 0 H PHE A 48 -15.488 16.713 5.676 1.00 0.00 H new ATOM 0 HA PHE A 48 -16.292 17.886 3.364 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -16.175 15.446 3.792 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -17.604 15.545 4.802 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -17.156 17.421 1.635 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -19.007 14.087 3.535 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -18.574 17.087 -0.340 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -20.428 13.751 1.559 1.00 0.00 H new ATOM 0 HZ PHE A 48 -20.216 15.251 -0.382 1.00 0.00 H new ATOM 732 N ASN A 49 -18.707 17.974 5.622 1.00 0.00 N ATOM 733 CA ASN A 49 -19.964 18.622 5.975 1.00 0.00 C ATOM 734 C ASN A 49 -19.725 19.863 6.834 1.00 0.00 C ATOM 735 O ASN A 49 -20.672 20.454 7.352 1.00 0.00 O ATOM 736 CB ASN A 49 -20.873 17.642 6.718 1.00 0.00 C ATOM 737 CG ASN A 49 -20.980 16.304 6.013 1.00 0.00 C ATOM 738 OD1 ASN A 49 -21.936 16.051 5.280 1.00 0.00 O ATOM 739 ND2 ASN A 49 -19.997 15.439 6.233 1.00 0.00 N ATOM 0 H ASN A 49 -18.336 17.351 6.339 1.00 0.00 H new ATOM 0 HA ASN A 49 -20.451 18.935 5.051 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -20.489 17.488 7.727 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -21.867 18.077 6.818 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -20.015 14.522 5.786 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -19.224 15.691 6.848 1.00 0.00 H new ATOM 746 N LYS A 50 -18.460 20.252 6.990 1.00 0.00 N ATOM 747 CA LYS A 50 -18.125 21.424 7.801 1.00 0.00 C ATOM 748 C LYS A 50 -18.445 22.728 7.075 1.00 0.00 C ATOM 749 O LYS A 50 -18.480 22.777 5.845 1.00 0.00 O ATOM 750 CB LYS A 50 -16.647 21.402 8.174 1.00 0.00 C ATOM 751 CG LYS A 50 -16.226 22.536 9.091 1.00 0.00 C ATOM 752 CD LYS A 50 -15.080 22.113 9.994 1.00 0.00 C ATOM 753 CE LYS A 50 -14.292 23.314 10.491 1.00 0.00 C ATOM 754 NZ LYS A 50 -15.156 24.282 11.222 1.00 0.00 N ATOM 0 H LYS A 50 -17.658 19.780 6.572 1.00 0.00 H new ATOM 0 HA LYS A 50 -18.735 21.379 8.703 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -16.419 20.453 8.658 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -16.052 21.446 7.262 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -15.924 23.397 8.495 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -17.075 22.851 9.698 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -15.472 21.556 10.845 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -14.416 21.440 9.451 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -13.490 22.976 11.147 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -13.821 23.815 9.645 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -14.655 25.188 11.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -16.038 24.430 10.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -15.379 23.905 12.165 1.00 0.00 H new ATOM 768 N GLU A 51 -18.660 23.789 7.852 1.00 0.00 N ATOM 769 CA GLU A 51 -18.954 25.104 7.294 1.00 0.00 C ATOM 770 C GLU A 51 -17.667 25.828 6.966 1.00 0.00 C ATOM 771 O GLU A 51 -17.563 26.488 5.933 1.00 0.00 O ATOM 772 CB GLU A 51 -19.801 25.930 8.265 1.00 0.00 C ATOM 773 CG GLU A 51 -20.664 26.976 7.580 1.00 0.00 C ATOM 774 CD GLU A 51 -19.935 28.291 7.377 1.00 0.00 C ATOM 775 OE1 GLU A 51 -19.170 28.691 8.281 1.00 0.00 O ATOM 776 OE2 GLU A 51 -20.128 28.920 6.316 1.00 0.00 O ATOM 0 H GLU A 51 -18.636 23.761 8.871 1.00 0.00 H new ATOM 0 HA GLU A 51 -19.526 24.970 6.376 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -20.443 25.259 8.836 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -19.142 26.425 8.978 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -20.993 26.594 6.614 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -21.560 27.150 8.176 1.00 0.00 H new ATOM 783 N ASP A 52 -16.666 25.674 7.825 1.00 0.00 N ATOM 784 CA ASP A 52 -15.381 26.294 7.566 1.00 0.00 C ATOM 785 C ASP A 52 -14.542 25.397 6.678 1.00 0.00 C ATOM 786 O ASP A 52 -13.346 25.621 6.504 1.00 0.00 O ATOM 787 CB ASP A 52 -14.623 26.612 8.851 1.00 0.00 C ATOM 788 CG ASP A 52 -15.506 27.246 9.908 1.00 0.00 C ATOM 789 OD1 ASP A 52 -16.538 27.844 9.539 1.00 0.00 O ATOM 790 OD2 ASP A 52 -15.166 27.143 11.106 1.00 0.00 O ATOM 0 H ASP A 52 -16.720 25.135 8.689 1.00 0.00 H new ATOM 0 HA ASP A 52 -15.573 27.240 7.059 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -14.189 25.695 9.248 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -13.796 27.284 8.623 1.00 0.00 H new ATOM 795 N ALA A 53 -15.193 24.401 6.080 1.00 0.00 N ATOM 796 CA ALA A 53 -14.528 23.491 5.165 1.00 0.00 C ATOM 797 C ALA A 53 -14.292 24.212 3.852 1.00 0.00 C ATOM 798 O ALA A 53 -14.543 23.689 2.769 1.00 0.00 O ATOM 799 CB ALA A 53 -15.357 22.233 4.959 1.00 0.00 C ATOM 0 H ALA A 53 -16.185 24.208 6.217 1.00 0.00 H new ATOM 0 HA ALA A 53 -13.571 23.180 5.584 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -14.840 21.565 4.270 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -15.498 21.729 5.915 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -16.328 22.501 4.544 1.00 0.00 H new ATOM 805 N THR A 54 -13.828 25.439 3.986 1.00 0.00 N ATOM 806 CA THR A 54 -13.552 26.307 2.867 1.00 0.00 C ATOM 807 C THR A 54 -12.171 26.032 2.298 1.00 0.00 C ATOM 808 O THR A 54 -11.859 24.914 1.895 1.00 0.00 O ATOM 809 CB THR A 54 -13.708 27.762 3.327 1.00 0.00 C ATOM 810 OG1 THR A 54 -12.613 28.156 4.135 1.00 0.00 O ATOM 811 CG2 THR A 54 -14.974 27.997 4.128 1.00 0.00 C ATOM 0 H THR A 54 -13.630 25.864 4.892 1.00 0.00 H new ATOM 0 HA THR A 54 -14.261 26.116 2.061 1.00 0.00 H new ATOM 0 HB THR A 54 -13.754 28.353 2.412 1.00 0.00 H new ATOM 0 HG1 THR A 54 -12.732 29.087 4.416 1.00 0.00 H new ATOM 0 HG21 THR A 54 -15.028 29.044 4.425 1.00 0.00 H new ATOM 0 HG22 THR A 54 -15.842 27.748 3.518 1.00 0.00 H new ATOM 0 HG23 THR A 54 -14.964 27.368 5.018 1.00 0.00 H new ATOM 819 N GLU A 55 -11.364 27.054 2.260 1.00 0.00 N ATOM 820 CA GLU A 55 -10.010 26.948 1.731 1.00 0.00 C ATOM 821 C GLU A 55 -9.011 26.536 2.813 1.00 0.00 C ATOM 822 O GLU A 55 -7.869 26.194 2.509 1.00 0.00 O ATOM 823 CB GLU A 55 -9.581 28.277 1.109 1.00 0.00 C ATOM 824 CG GLU A 55 -8.712 28.118 -0.128 1.00 0.00 C ATOM 825 CD GLU A 55 -9.009 29.160 -1.187 1.00 0.00 C ATOM 826 OE1 GLU A 55 -9.943 28.945 -1.987 1.00 0.00 O ATOM 827 OE2 GLU A 55 -8.307 30.193 -1.217 1.00 0.00 O ATOM 0 H GLU A 55 -11.613 27.986 2.591 1.00 0.00 H new ATOM 0 HA GLU A 55 -10.016 26.172 0.965 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -10.471 28.850 0.847 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -9.036 28.858 1.853 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -7.663 28.186 0.159 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -8.864 27.124 -0.549 1.00 0.00 H new ATOM 834 N GLU A 56 -9.429 26.594 4.075 1.00 0.00 N ATOM 835 CA GLU A 56 -8.542 26.245 5.180 1.00 0.00 C ATOM 836 C GLU A 56 -8.723 24.799 5.664 1.00 0.00 C ATOM 837 O GLU A 56 -7.743 24.078 5.844 1.00 0.00 O ATOM 838 CB GLU A 56 -8.742 27.218 6.348 1.00 0.00 C ATOM 839 CG GLU A 56 -9.951 26.906 7.219 1.00 0.00 C ATOM 840 CD GLU A 56 -10.192 27.960 8.282 1.00 0.00 C ATOM 841 OE1 GLU A 56 -10.812 28.995 7.960 1.00 0.00 O ATOM 842 OE2 GLU A 56 -9.760 27.751 9.434 1.00 0.00 O ATOM 0 H GLU A 56 -10.368 26.877 4.356 1.00 0.00 H new ATOM 0 HA GLU A 56 -7.524 26.326 4.800 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -7.847 27.209 6.971 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -8.845 28.228 5.951 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -10.836 26.822 6.589 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -9.808 25.938 7.699 1.00 0.00 H new ATOM 849 N GLU A 57 -9.966 24.398 5.923 1.00 0.00 N ATOM 850 CA GLU A 57 -10.242 23.056 6.446 1.00 0.00 C ATOM 851 C GLU A 57 -10.128 21.950 5.396 1.00 0.00 C ATOM 852 O GLU A 57 -9.664 20.852 5.704 1.00 0.00 O ATOM 853 CB GLU A 57 -11.631 23.017 7.082 1.00 0.00 C ATOM 854 CG GLU A 57 -11.609 22.754 8.577 1.00 0.00 C ATOM 855 CD GLU A 57 -11.201 23.975 9.379 1.00 0.00 C ATOM 856 OE1 GLU A 57 -11.488 25.104 8.928 1.00 0.00 O ATOM 857 OE2 GLU A 57 -10.594 23.802 10.457 1.00 0.00 O ATOM 0 H GLU A 57 -10.794 24.976 5.782 1.00 0.00 H new ATOM 0 HA GLU A 57 -9.473 22.858 7.192 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -12.133 23.966 6.896 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -12.223 22.243 6.594 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -12.597 22.426 8.899 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -10.918 21.938 8.788 1.00 0.00 H new ATOM 864 N ILE A 58 -10.562 22.219 4.171 1.00 0.00 N ATOM 865 CA ILE A 58 -10.508 21.209 3.117 1.00 0.00 C ATOM 866 C ILE A 58 -9.097 20.680 2.933 1.00 0.00 C ATOM 867 O ILE A 58 -8.816 19.524 3.234 1.00 0.00 O ATOM 868 CB ILE A 58 -11.015 21.764 1.779 1.00 0.00 C ATOM 869 CG1 ILE A 58 -12.432 22.303 1.945 1.00 0.00 C ATOM 870 CG2 ILE A 58 -10.974 20.693 0.695 1.00 0.00 C ATOM 871 CD1 ILE A 58 -13.453 21.232 2.256 1.00 0.00 C ATOM 0 H ILE A 58 -10.951 23.117 3.883 1.00 0.00 H new ATOM 0 HA ILE A 58 -11.159 20.393 3.431 1.00 0.00 H new ATOM 0 HB ILE A 58 -10.360 22.578 1.470 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -12.439 23.043 2.745 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -12.725 22.819 1.031 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -11.338 21.111 -0.243 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -9.949 20.347 0.564 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -11.606 19.854 0.988 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -14.438 21.687 2.361 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -13.475 20.504 1.445 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -13.184 20.732 3.186 1.00 0.00 H new ATOM 883 N ASN A 59 -8.210 21.536 2.443 1.00 0.00 N ATOM 884 CA ASN A 59 -6.817 21.141 2.227 1.00 0.00 C ATOM 885 C ASN A 59 -6.272 20.459 3.475 1.00 0.00 C ATOM 886 O ASN A 59 -5.569 19.451 3.393 1.00 0.00 O ATOM 887 CB ASN A 59 -5.931 22.344 1.862 1.00 0.00 C ATOM 888 CG ASN A 59 -6.594 23.683 2.118 1.00 0.00 C ATOM 889 OD1 ASN A 59 -7.693 23.945 1.628 1.00 0.00 O ATOM 890 ND2 ASN A 59 -5.928 24.537 2.885 1.00 0.00 N ATOM 0 H ASN A 59 -8.423 22.500 2.188 1.00 0.00 H new ATOM 0 HA ASN A 59 -6.797 20.446 1.388 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -5.005 22.290 2.435 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -5.658 22.278 0.809 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -6.324 25.454 3.090 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -5.020 24.276 3.269 1.00 0.00 H new ATOM 897 N LEU A 60 -6.620 21.010 4.631 1.00 0.00 N ATOM 898 CA LEU A 60 -6.188 20.453 5.903 1.00 0.00 C ATOM 899 C LEU A 60 -6.780 19.061 6.096 1.00 0.00 C ATOM 900 O LEU A 60 -6.143 18.178 6.670 1.00 0.00 O ATOM 901 CB LEU A 60 -6.612 21.365 7.058 1.00 0.00 C ATOM 902 CG LEU A 60 -5.798 22.653 7.203 1.00 0.00 C ATOM 903 CD1 LEU A 60 -6.468 23.600 8.188 1.00 0.00 C ATOM 904 CD2 LEU A 60 -4.378 22.337 7.647 1.00 0.00 C ATOM 0 H LEU A 60 -7.202 21.844 4.712 1.00 0.00 H new ATOM 0 HA LEU A 60 -5.101 20.379 5.896 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -7.661 21.630 6.925 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -6.541 20.802 7.989 1.00 0.00 H new ATOM 0 HG LEU A 60 -5.754 23.144 6.231 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -5.875 24.510 8.278 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -7.466 23.851 7.830 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -6.543 23.118 9.163 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -3.813 23.264 7.745 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -4.403 21.824 8.608 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -3.899 21.697 6.906 1.00 0.00 H new ATOM 916 N ALA A 61 -8.007 18.873 5.613 1.00 0.00 N ATOM 917 CA ALA A 61 -8.687 17.589 5.736 1.00 0.00 C ATOM 918 C ALA A 61 -8.368 16.661 4.562 1.00 0.00 C ATOM 919 O ALA A 61 -8.561 15.448 4.650 1.00 0.00 O ATOM 920 CB ALA A 61 -10.186 17.810 5.835 1.00 0.00 C ATOM 0 H ALA A 61 -8.548 19.593 5.134 1.00 0.00 H new ATOM 0 HA ALA A 61 -8.327 17.105 6.644 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -10.690 16.848 5.927 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -10.407 18.420 6.711 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -10.539 18.320 4.939 1.00 0.00 H new ATOM 926 N LYS A 62 -7.890 17.237 3.463 1.00 0.00 N ATOM 927 CA LYS A 62 -7.557 16.466 2.272 1.00 0.00 C ATOM 928 C LYS A 62 -6.090 16.033 2.283 1.00 0.00 C ATOM 929 O LYS A 62 -5.720 15.043 1.651 1.00 0.00 O ATOM 930 CB LYS A 62 -7.858 17.294 1.013 1.00 0.00 C ATOM 931 CG LYS A 62 -6.680 18.114 0.507 1.00 0.00 C ATOM 932 CD LYS A 62 -5.848 17.334 -0.497 1.00 0.00 C ATOM 933 CE LYS A 62 -5.011 18.258 -1.365 1.00 0.00 C ATOM 934 NZ LYS A 62 -3.904 18.891 -0.598 1.00 0.00 N ATOM 0 H LYS A 62 -7.724 18.239 3.374 1.00 0.00 H new ATOM 0 HA LYS A 62 -8.171 15.565 2.266 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -8.185 16.622 0.220 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -8.690 17.966 1.225 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -7.046 19.031 0.044 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -6.053 18.410 1.348 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -5.195 16.640 0.032 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -6.505 16.736 -1.129 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -4.597 17.694 -2.201 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -5.649 19.034 -1.789 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -3.358 19.513 -1.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -4.299 19.450 0.185 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -3.280 18.152 -0.215 1.00 0.00 H new ATOM 948 N GLU A 63 -5.262 16.794 2.993 1.00 0.00 N ATOM 949 CA GLU A 63 -3.831 16.514 3.082 1.00 0.00 C ATOM 950 C GLU A 63 -3.543 15.028 3.290 1.00 0.00 C ATOM 951 O GLU A 63 -2.829 14.411 2.499 1.00 0.00 O ATOM 952 CB GLU A 63 -3.208 17.323 4.222 1.00 0.00 C ATOM 953 CG GLU A 63 -2.728 18.703 3.797 1.00 0.00 C ATOM 954 CD GLU A 63 -1.374 19.054 4.382 1.00 0.00 C ATOM 955 OE1 GLU A 63 -1.210 18.936 5.614 1.00 0.00 O ATOM 956 OE2 GLU A 63 -0.478 19.448 3.606 1.00 0.00 O ATOM 0 H GLU A 63 -5.560 17.616 3.519 1.00 0.00 H new ATOM 0 HA GLU A 63 -3.386 16.807 2.131 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -3.941 17.432 5.022 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -2.367 16.766 4.635 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -2.672 18.745 2.709 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -3.459 19.450 4.108 1.00 0.00 H new ATOM 963 N SER A 64 -4.087 14.460 4.362 1.00 0.00 N ATOM 964 CA SER A 64 -3.865 13.054 4.670 1.00 0.00 C ATOM 965 C SER A 64 -4.991 12.173 4.139 1.00 0.00 C ATOM 966 O SER A 64 -4.808 10.976 3.961 1.00 0.00 O ATOM 967 CB SER A 64 -3.726 12.861 6.180 1.00 0.00 C ATOM 968 OG SER A 64 -2.913 11.740 6.479 1.00 0.00 O ATOM 0 H SER A 64 -4.682 14.951 5.029 1.00 0.00 H new ATOM 0 HA SER A 64 -2.942 12.752 4.176 1.00 0.00 H new ATOM 0 HB2 SER A 64 -3.294 13.757 6.626 1.00 0.00 H new ATOM 0 HB3 SER A 64 -4.712 12.728 6.625 1.00 0.00 H new ATOM 0 HG SER A 64 -2.839 11.640 7.451 1.00 0.00 H new ATOM 974 N LEU A 65 -6.152 12.761 3.882 1.00 0.00 N ATOM 975 CA LEU A 65 -7.286 12.003 3.375 1.00 0.00 C ATOM 976 C LEU A 65 -7.044 11.558 1.939 1.00 0.00 C ATOM 977 O LEU A 65 -7.741 10.688 1.421 1.00 0.00 O ATOM 978 CB LEU A 65 -8.563 12.838 3.465 1.00 0.00 C ATOM 979 CG LEU A 65 -9.763 12.282 2.698 1.00 0.00 C ATOM 980 CD1 LEU A 65 -10.249 10.986 3.329 1.00 0.00 C ATOM 981 CD2 LEU A 65 -10.879 13.310 2.653 1.00 0.00 C ATOM 0 H LEU A 65 -6.332 13.756 4.016 1.00 0.00 H new ATOM 0 HA LEU A 65 -7.404 11.112 3.991 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -8.839 12.938 4.515 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -8.349 13.840 3.095 1.00 0.00 H new ATOM 0 HG LEU A 65 -9.452 12.064 1.676 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -11.103 10.606 2.769 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -9.446 10.249 3.310 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -10.546 11.173 4.361 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -11.728 12.902 2.104 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -11.188 13.556 3.669 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -10.524 14.211 2.154 1.00 0.00 H new ATOM 993 N GLU A 66 -6.054 12.166 1.304 1.00 0.00 N ATOM 994 CA GLU A 66 -5.713 11.839 -0.068 1.00 0.00 C ATOM 995 C GLU A 66 -4.579 10.818 -0.128 1.00 0.00 C ATOM 996 O GLU A 66 -4.513 10.003 -1.048 1.00 0.00 O ATOM 997 CB GLU A 66 -5.327 13.104 -0.840 1.00 0.00 C ATOM 998 CG GLU A 66 -4.030 13.740 -0.366 1.00 0.00 C ATOM 999 CD GLU A 66 -2.991 13.841 -1.466 1.00 0.00 C ATOM 1000 OE1 GLU A 66 -3.378 14.097 -2.625 1.00 0.00 O ATOM 1001 OE2 GLU A 66 -1.791 13.662 -1.168 1.00 0.00 O ATOM 0 H GLU A 66 -5.471 12.892 1.721 1.00 0.00 H new ATOM 0 HA GLU A 66 -6.593 11.396 -0.534 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -5.235 12.859 -1.898 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -6.132 13.833 -0.750 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -4.240 14.737 0.023 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -3.624 13.155 0.459 1.00 0.00 H new ATOM 1008 N GLY A 67 -3.680 10.879 0.853 1.00 0.00 N ATOM 1009 CA GLY A 67 -2.554 9.965 0.887 1.00 0.00 C ATOM 1010 C GLY A 67 -2.704 8.875 1.932 1.00 0.00 C ATOM 1011 O GLY A 67 -1.955 7.898 1.925 1.00 0.00 O ATOM 0 H GLY A 67 -3.713 11.546 1.624 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -2.437 9.506 -0.094 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -1.642 10.528 1.086 1.00 0.00 H new ATOM 1015 N ALA A 68 -3.675 9.032 2.826 1.00 0.00 N ATOM 1016 CA ALA A 68 -3.916 8.043 3.865 1.00 0.00 C ATOM 1017 C ALA A 68 -4.688 6.872 3.289 1.00 0.00 C ATOM 1018 O ALA A 68 -4.386 5.714 3.576 1.00 0.00 O ATOM 1019 CB ALA A 68 -4.672 8.663 5.021 1.00 0.00 C ATOM 0 H ALA A 68 -4.305 9.834 2.850 1.00 0.00 H new ATOM 0 HA ALA A 68 -2.958 7.683 4.241 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -4.844 7.909 5.789 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -4.088 9.482 5.440 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -5.629 9.045 4.667 1.00 0.00 H new ATOM 1025 N ILE A 69 -5.658 7.179 2.430 1.00 0.00 N ATOM 1026 CA ILE A 69 -6.433 6.138 1.772 1.00 0.00 C ATOM 1027 C ILE A 69 -5.465 5.283 1.004 1.00 0.00 C ATOM 1028 O ILE A 69 -5.522 4.053 1.016 1.00 0.00 O ATOM 1029 CB ILE A 69 -7.460 6.680 0.744 1.00 0.00 C ATOM 1030 CG1 ILE A 69 -7.084 8.088 0.271 1.00 0.00 C ATOM 1031 CG2 ILE A 69 -8.864 6.648 1.308 1.00 0.00 C ATOM 1032 CD1 ILE A 69 -8.086 8.692 -0.691 1.00 0.00 C ATOM 0 H ILE A 69 -5.922 8.131 2.177 1.00 0.00 H new ATOM 0 HA ILE A 69 -6.985 5.606 2.547 1.00 0.00 H new ATOM 0 HB ILE A 69 -7.436 6.024 -0.126 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -6.988 8.740 1.139 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -6.107 8.052 -0.211 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -9.563 7.034 0.566 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -9.132 5.622 1.560 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -8.910 7.266 2.205 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -7.755 9.688 -0.983 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -8.166 8.062 -1.577 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -9.060 8.761 -0.206 1.00 0.00 H new ATOM 1044 N ALA A 70 -4.556 5.985 0.345 1.00 0.00 N ATOM 1045 CA ALA A 70 -3.523 5.360 -0.443 1.00 0.00 C ATOM 1046 C ALA A 70 -2.810 4.275 0.362 1.00 0.00 C ATOM 1047 O ALA A 70 -2.229 3.347 -0.202 1.00 0.00 O ATOM 1048 CB ALA A 70 -2.559 6.427 -0.921 1.00 0.00 C ATOM 0 H ALA A 70 -4.520 7.004 0.346 1.00 0.00 H new ATOM 0 HA ALA A 70 -3.965 4.871 -1.311 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -1.773 5.966 -1.519 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -3.095 7.156 -1.528 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -2.115 6.928 -0.061 1.00 0.00 H new ATOM 1054 N ARG A 71 -2.873 4.395 1.689 1.00 0.00 N ATOM 1055 CA ARG A 71 -2.254 3.426 2.581 1.00 0.00 C ATOM 1056 C ARG A 71 -3.210 2.270 2.871 1.00 0.00 C ATOM 1057 O ARG A 71 -2.890 1.112 2.605 1.00 0.00 O ATOM 1058 CB ARG A 71 -1.831 4.101 3.888 1.00 0.00 C ATOM 1059 CG ARG A 71 -0.391 3.818 4.280 1.00 0.00 C ATOM 1060 CD ARG A 71 0.584 4.639 3.450 1.00 0.00 C ATOM 1061 NE ARG A 71 1.928 4.633 4.020 1.00 0.00 N ATOM 1062 CZ ARG A 71 2.868 5.525 3.711 1.00 0.00 C ATOM 1063 NH1 ARG A 71 2.614 6.493 2.840 1.00 0.00 N ATOM 1064 NH2 ARG A 71 4.066 5.446 4.275 1.00 0.00 N ATOM 0 H ARG A 71 -3.350 5.159 2.167 1.00 0.00 H new ATOM 0 HA ARG A 71 -1.368 3.025 2.088 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -1.968 5.178 3.792 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -2.489 3.767 4.690 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -0.250 4.043 5.337 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -0.179 2.757 4.149 1.00 0.00 H new ATOM 0 HD2 ARG A 71 0.619 4.243 2.435 1.00 0.00 H new ATOM 0 HD3 ARG A 71 0.225 5.666 3.379 1.00 0.00 H new ATOM 0 HE ARG A 71 2.161 3.904 4.694 1.00 0.00 H new ATOM 0 HH11 ARG A 71 1.695 6.557 2.403 1.00 0.00 H new ATOM 0 HH12 ARG A 71 3.338 7.173 2.608 1.00 0.00 H new ATOM 0 HH21 ARG A 71 4.267 4.703 4.944 1.00 0.00 H new ATOM 0 HH22 ARG A 71 4.787 6.128 4.039 1.00 0.00 H new ATOM 1078 N PHE A 72 -4.387 2.586 3.423 1.00 0.00 N ATOM 1079 CA PHE A 72 -5.374 1.565 3.746 1.00 0.00 C ATOM 1080 C PHE A 72 -5.640 0.645 2.561 1.00 0.00 C ATOM 1081 O PHE A 72 -5.847 -0.557 2.734 1.00 0.00 O ATOM 1082 CB PHE A 72 -6.677 2.218 4.197 1.00 0.00 C ATOM 1083 CG PHE A 72 -7.524 1.313 5.037 1.00 0.00 C ATOM 1084 CD1 PHE A 72 -6.970 0.588 6.078 1.00 0.00 C ATOM 1085 CD2 PHE A 72 -8.874 1.185 4.785 1.00 0.00 C ATOM 1086 CE1 PHE A 72 -7.754 -0.248 6.850 1.00 0.00 C ATOM 1087 CE2 PHE A 72 -9.657 0.358 5.553 1.00 0.00 C ATOM 1088 CZ PHE A 72 -9.101 -0.362 6.587 1.00 0.00 C ATOM 0 H PHE A 72 -4.673 3.538 3.652 1.00 0.00 H new ATOM 0 HA PHE A 72 -4.970 0.960 4.557 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -6.448 3.121 4.763 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -7.245 2.527 3.320 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -5.915 0.677 6.289 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -9.321 1.742 3.974 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -7.311 -0.811 7.658 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -10.713 0.272 5.345 1.00 0.00 H new ATOM 0 HZ PHE A 72 -9.718 -1.013 7.189 1.00 0.00 H new ATOM 1098 N ASN A 73 -5.634 1.209 1.361 1.00 0.00 N ATOM 1099 CA ASN A 73 -5.872 0.426 0.157 1.00 0.00 C ATOM 1100 C ASN A 73 -4.806 -0.650 0.003 1.00 0.00 C ATOM 1101 O ASN A 73 -5.082 -1.752 -0.473 1.00 0.00 O ATOM 1102 CB ASN A 73 -5.886 1.335 -1.074 1.00 0.00 C ATOM 1103 CG ASN A 73 -7.133 2.196 -1.143 1.00 0.00 C ATOM 1104 OD1 ASN A 73 -8.246 1.688 -1.277 1.00 0.00 O ATOM 1105 ND2 ASN A 73 -6.952 3.509 -1.050 1.00 0.00 N ATOM 0 H ASN A 73 -5.468 2.202 1.196 1.00 0.00 H new ATOM 0 HA ASN A 73 -6.845 -0.058 0.246 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -5.005 1.977 -1.058 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -5.819 0.724 -1.974 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -7.754 4.138 -1.089 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -6.011 3.888 -0.940 1.00 0.00 H new ATOM 1112 N SER A 74 -3.585 -0.321 0.410 1.00 0.00 N ATOM 1113 CA SER A 74 -2.469 -1.257 0.321 1.00 0.00 C ATOM 1114 C SER A 74 -2.058 -1.766 1.703 1.00 0.00 C ATOM 1115 O SER A 74 -0.869 -1.905 1.990 1.00 0.00 O ATOM 1116 CB SER A 74 -1.275 -0.593 -0.366 1.00 0.00 C ATOM 1117 OG SER A 74 -1.118 0.748 0.066 1.00 0.00 O ATOM 0 H SER A 74 -3.342 0.587 0.805 1.00 0.00 H new ATOM 0 HA SER A 74 -2.797 -2.111 -0.272 1.00 0.00 H new ATOM 0 HB2 SER A 74 -0.367 -1.157 -0.150 1.00 0.00 H new ATOM 0 HB3 SER A 74 -1.414 -0.616 -1.447 1.00 0.00 H new ATOM 0 HG SER A 74 -1.809 1.308 -0.346 1.00 0.00 H new ATOM 1123 N LEU A 75 -3.040 -2.042 2.556 1.00 0.00 N ATOM 1124 CA LEU A 75 -2.758 -2.533 3.904 1.00 0.00 C ATOM 1125 C LEU A 75 -3.329 -3.939 4.121 1.00 0.00 C ATOM 1126 O LEU A 75 -2.824 -4.700 4.946 1.00 0.00 O ATOM 1127 CB LEU A 75 -3.312 -1.558 4.950 1.00 0.00 C ATOM 1128 CG LEU A 75 -2.258 -0.654 5.601 1.00 0.00 C ATOM 1129 CD1 LEU A 75 -2.820 0.733 5.884 1.00 0.00 C ATOM 1130 CD2 LEU A 75 -1.728 -1.287 6.879 1.00 0.00 C ATOM 0 H LEU A 75 -4.032 -1.936 2.342 1.00 0.00 H new ATOM 0 HA LEU A 75 -1.676 -2.597 4.019 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -4.068 -0.931 4.478 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -3.814 -2.130 5.731 1.00 0.00 H new ATOM 0 HG LEU A 75 -1.432 -0.543 4.899 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -2.049 1.351 6.345 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -3.142 1.193 4.950 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -3.671 0.650 6.560 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -0.981 -0.632 7.327 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -2.550 -1.434 7.580 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -1.273 -2.250 6.647 1.00 0.00 H new ATOM 1142 N LEU A 76 -4.366 -4.278 3.363 1.00 0.00 N ATOM 1143 CA LEU A 76 -5.011 -5.592 3.443 1.00 0.00 C ATOM 1144 C LEU A 76 -4.190 -6.640 2.710 1.00 0.00 C ATOM 1145 O LEU A 76 -4.700 -7.352 1.843 1.00 0.00 O ATOM 1146 CB LEU A 76 -6.412 -5.524 2.824 1.00 0.00 C ATOM 1147 CG LEU A 76 -6.530 -4.715 1.520 1.00 0.00 C ATOM 1148 CD1 LEU A 76 -6.822 -3.252 1.826 1.00 0.00 C ATOM 1149 CD2 LEU A 76 -5.273 -4.850 0.652 1.00 0.00 C ATOM 0 H LEU A 76 -4.786 -3.653 2.675 1.00 0.00 H new ATOM 0 HA LEU A 76 -5.085 -5.872 4.494 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -6.753 -6.541 2.630 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -7.093 -5.094 3.559 1.00 0.00 H new ATOM 0 HG LEU A 76 -7.363 -5.125 0.950 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -6.902 -2.694 0.893 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -7.760 -3.176 2.376 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -6.013 -2.838 2.428 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -5.395 -4.265 -0.259 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -4.408 -4.484 1.205 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -5.121 -5.898 0.392 1.00 0.00 H new ATOM 1161 N ILE A 77 -2.910 -6.705 3.029 1.00 0.00 N ATOM 1162 CA ILE A 77 -2.015 -7.637 2.360 1.00 0.00 C ATOM 1163 C ILE A 77 -2.137 -7.433 0.874 1.00 0.00 C ATOM 1164 O ILE A 77 -2.576 -8.324 0.144 1.00 0.00 O ATOM 1165 CB ILE A 77 -2.323 -9.107 2.707 1.00 0.00 C ATOM 1166 CG1 ILE A 77 -2.628 -9.265 4.200 1.00 0.00 C ATOM 1167 CG2 ILE A 77 -1.157 -9.992 2.301 1.00 0.00 C ATOM 1168 CD1 ILE A 77 -1.589 -8.657 5.117 1.00 0.00 C ATOM 0 H ILE A 77 -2.467 -6.127 3.743 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.000 -7.436 2.703 1.00 0.00 H new ATOM 0 HB ILE A 77 -3.208 -9.416 2.151 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -3.594 -8.807 4.412 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -2.721 -10.327 4.429 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -1.383 -11.029 2.550 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -0.990 -9.905 1.227 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -0.259 -9.679 2.834 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -1.883 -8.814 6.155 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -0.624 -9.131 4.938 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -1.511 -7.588 4.920 1.00 0.00 H new ATOM 1180 N GLU A 78 -1.765 -6.226 0.446 1.00 0.00 N ATOM 1181 CA GLU A 78 -1.835 -5.834 -0.952 1.00 0.00 C ATOM 1182 C GLU A 78 -2.011 -7.040 -1.853 1.00 0.00 C ATOM 1183 O GLU A 78 -1.232 -7.992 -1.811 1.00 0.00 O ATOM 1184 CB GLU A 78 -0.600 -5.030 -1.350 1.00 0.00 C ATOM 1185 CG GLU A 78 -0.914 -3.571 -1.634 1.00 0.00 C ATOM 1186 CD GLU A 78 -0.616 -3.177 -3.067 1.00 0.00 C ATOM 1187 OE1 GLU A 78 0.337 -3.735 -3.651 1.00 0.00 O ATOM 1188 OE2 GLU A 78 -1.333 -2.308 -3.606 1.00 0.00 O ATOM 0 H GLU A 78 -1.407 -5.497 1.063 1.00 0.00 H new ATOM 0 HA GLU A 78 -2.711 -5.197 -1.078 1.00 0.00 H new ATOM 0 HB2 GLU A 78 0.139 -5.089 -0.551 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -0.149 -5.479 -2.235 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -1.966 -3.382 -1.421 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -0.334 -2.941 -0.960 1.00 0.00 H new ATOM 1195 N GLU A 79 -3.067 -6.989 -2.641 1.00 0.00 N ATOM 1196 CA GLU A 79 -3.427 -8.060 -3.560 1.00 0.00 C ATOM 1197 C GLU A 79 -2.203 -8.751 -4.179 1.00 0.00 C ATOM 1198 O GLU A 79 -2.289 -9.908 -4.590 1.00 0.00 O ATOM 1199 CB GLU A 79 -4.351 -7.497 -4.638 1.00 0.00 C ATOM 1200 CG GLU A 79 -5.431 -6.579 -4.071 1.00 0.00 C ATOM 1201 CD GLU A 79 -6.800 -6.848 -4.666 1.00 0.00 C ATOM 1202 OE1 GLU A 79 -7.241 -8.017 -4.634 1.00 0.00 O ATOM 1203 OE2 GLU A 79 -7.430 -5.892 -5.164 1.00 0.00 O ATOM 0 H GLU A 79 -3.708 -6.196 -2.664 1.00 0.00 H new ATOM 0 HA GLU A 79 -3.947 -8.834 -2.995 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -3.757 -6.945 -5.367 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -4.824 -8.321 -5.171 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -5.478 -6.705 -2.989 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -5.155 -5.541 -4.259 1.00 0.00 H new ATOM 1210 N SER A 80 -1.067 -8.055 -4.235 1.00 0.00 N ATOM 1211 CA SER A 80 0.146 -8.640 -4.795 1.00 0.00 C ATOM 1212 C SER A 80 1.405 -8.220 -4.024 1.00 0.00 C ATOM 1213 O SER A 80 2.441 -7.954 -4.635 1.00 0.00 O ATOM 1214 CB SER A 80 0.286 -8.249 -6.267 1.00 0.00 C ATOM 1215 OG SER A 80 1.465 -8.797 -6.831 1.00 0.00 O ATOM 0 H SER A 80 -0.964 -7.096 -3.903 1.00 0.00 H new ATOM 0 HA SER A 80 0.053 -9.722 -4.706 1.00 0.00 H new ATOM 0 HB2 SER A 80 -0.584 -8.599 -6.824 1.00 0.00 H new ATOM 0 HB3 SER A 80 0.307 -7.163 -6.358 1.00 0.00 H new ATOM 0 HG SER A 80 2.245 -8.479 -6.331 1.00 0.00 H new ATOM 1221 N THR A 81 1.334 -8.163 -2.687 1.00 0.00 N ATOM 1222 CA THR A 81 2.503 -7.778 -1.895 1.00 0.00 C ATOM 1223 C THR A 81 3.374 -8.984 -1.549 1.00 0.00 C ATOM 1224 O THR A 81 4.460 -8.827 -0.989 1.00 0.00 O ATOM 1225 CB THR A 81 2.067 -7.067 -0.617 1.00 0.00 C ATOM 1226 OG1 THR A 81 3.165 -6.881 0.257 1.00 0.00 O ATOM 1227 CG2 THR A 81 0.991 -7.813 0.138 1.00 0.00 C ATOM 0 H THR A 81 0.497 -8.374 -2.143 1.00 0.00 H new ATOM 0 HA THR A 81 3.100 -7.097 -2.502 1.00 0.00 H new ATOM 0 HB THR A 81 1.662 -6.108 -0.941 1.00 0.00 H new ATOM 0 HG1 THR A 81 3.986 -7.193 -0.178 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.724 -7.256 1.036 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.111 -7.922 -0.496 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.361 -8.799 0.419 1.00 0.00 H new ATOM 1235 N GLY A 82 2.909 -10.183 -1.889 1.00 0.00 N ATOM 1236 CA GLY A 82 3.681 -11.378 -1.607 1.00 0.00 C ATOM 1237 C GLY A 82 5.077 -11.313 -2.200 1.00 0.00 C ATOM 1238 O GLY A 82 5.988 -11.998 -1.734 1.00 0.00 O ATOM 0 H GLY A 82 2.015 -10.347 -2.353 1.00 0.00 H new ATOM 0 HA2 GLY A 82 3.753 -11.516 -0.528 1.00 0.00 H new ATOM 0 HA3 GLY A 82 3.159 -12.248 -2.006 1.00 0.00 H new ATOM 1242 N ASP A 83 5.242 -10.487 -3.231 1.00 0.00 N ATOM 1243 CA ASP A 83 6.536 -10.333 -3.888 1.00 0.00 C ATOM 1244 C ASP A 83 7.430 -9.370 -3.113 1.00 0.00 C ATOM 1245 O ASP A 83 7.597 -8.212 -3.497 1.00 0.00 O ATOM 1246 CB ASP A 83 6.346 -9.832 -5.321 1.00 0.00 C ATOM 1247 CG ASP A 83 7.414 -10.353 -6.262 1.00 0.00 C ATOM 1248 OD1 ASP A 83 7.678 -11.573 -6.242 1.00 0.00 O ATOM 1249 OD2 ASP A 83 7.985 -9.541 -7.020 1.00 0.00 O ATOM 0 H ASP A 83 4.496 -9.915 -3.628 1.00 0.00 H new ATOM 0 HA ASP A 83 7.022 -11.308 -3.913 1.00 0.00 H new ATOM 0 HB2 ASP A 83 5.365 -10.139 -5.683 1.00 0.00 H new ATOM 0 HB3 ASP A 83 6.361 -8.742 -5.327 1.00 0.00 H new ATOM 1254 N PHE A 84 8.001 -9.862 -2.021 1.00 0.00 N ATOM 1255 CA PHE A 84 8.883 -9.060 -1.180 1.00 0.00 C ATOM 1256 C PHE A 84 10.260 -8.914 -1.809 1.00 0.00 C ATOM 1257 O PHE A 84 10.872 -7.848 -1.754 1.00 0.00 O ATOM 1258 CB PHE A 84 9.032 -9.711 0.193 1.00 0.00 C ATOM 1259 CG PHE A 84 7.798 -9.656 1.049 1.00 0.00 C ATOM 1260 CD1 PHE A 84 6.736 -8.819 0.733 1.00 0.00 C ATOM 1261 CD2 PHE A 84 7.707 -10.442 2.183 1.00 0.00 C ATOM 1262 CE1 PHE A 84 5.613 -8.774 1.534 1.00 0.00 C ATOM 1263 CE2 PHE A 84 6.586 -10.399 2.987 1.00 0.00 C ATOM 1264 CZ PHE A 84 5.540 -9.565 2.663 1.00 0.00 C ATOM 0 H PHE A 84 7.868 -10.819 -1.695 1.00 0.00 H new ATOM 0 HA PHE A 84 8.435 -8.071 -1.078 1.00 0.00 H new ATOM 0 HB2 PHE A 84 9.318 -10.754 0.057 1.00 0.00 H new ATOM 0 HB3 PHE A 84 9.849 -9.224 0.725 1.00 0.00 H new ATOM 0 HD1 PHE A 84 6.789 -8.197 -0.148 1.00 0.00 H new ATOM 0 HD2 PHE A 84 8.524 -11.098 2.443 1.00 0.00 H new ATOM 0 HE1 PHE A 84 4.792 -8.121 1.278 1.00 0.00 H new ATOM 0 HE2 PHE A 84 6.530 -11.019 3.869 1.00 0.00 H new ATOM 0 HZ PHE A 84 4.663 -9.529 3.292 1.00 0.00 H new ATOM 1274 N ASN A 85 10.747 -9.995 -2.398 1.00 0.00 N ATOM 1275 CA ASN A 85 12.061 -9.992 -3.021 1.00 0.00 C ATOM 1276 C ASN A 85 12.141 -8.949 -4.130 1.00 0.00 C ATOM 1277 O ASN A 85 13.231 -8.555 -4.545 1.00 0.00 O ATOM 1278 CB ASN A 85 12.372 -11.377 -3.587 1.00 0.00 C ATOM 1279 CG ASN A 85 13.791 -11.814 -3.290 1.00 0.00 C ATOM 1280 OD1 ASN A 85 14.043 -12.975 -2.967 1.00 0.00 O ATOM 1281 ND2 ASN A 85 14.727 -10.881 -3.398 1.00 0.00 N ATOM 0 H ASN A 85 10.252 -10.885 -2.458 1.00 0.00 H new ATOM 0 HA ASN A 85 12.798 -9.737 -2.259 1.00 0.00 H new ATOM 0 HB2 ASN A 85 11.675 -12.103 -3.168 1.00 0.00 H new ATOM 0 HB3 ASN A 85 12.215 -11.370 -4.666 1.00 0.00 H new ATOM 0 HD21 ASN A 85 15.702 -11.113 -3.210 1.00 0.00 H new ATOM 0 HD22 ASN A 85 14.472 -9.931 -3.669 1.00 0.00 H new ATOM 1288 N GLY A 86 10.984 -8.509 -4.610 1.00 0.00 N ATOM 1289 CA GLY A 86 10.951 -7.524 -5.671 1.00 0.00 C ATOM 1290 C GLY A 86 11.447 -8.084 -6.989 1.00 0.00 C ATOM 1291 O GLY A 86 11.486 -7.378 -7.997 1.00 0.00 O ATOM 0 H GLY A 86 10.069 -8.818 -4.282 1.00 0.00 H new ATOM 0 HA2 GLY A 86 9.931 -7.159 -5.794 1.00 0.00 H new ATOM 0 HA3 GLY A 86 11.564 -6.668 -5.389 1.00 0.00 H new ATOM 1295 N ASN A 87 11.828 -9.359 -6.980 1.00 0.00 N ATOM 1296 CA ASN A 87 12.326 -10.013 -8.186 1.00 0.00 C ATOM 1297 C ASN A 87 11.199 -10.723 -8.934 1.00 0.00 C ATOM 1298 O ASN A 87 11.290 -10.946 -10.142 1.00 0.00 O ATOM 1299 CB ASN A 87 13.433 -11.011 -7.836 1.00 0.00 C ATOM 1300 CG ASN A 87 12.957 -12.109 -6.907 1.00 0.00 C ATOM 1301 OD1 ASN A 87 11.763 -12.238 -6.638 1.00 0.00 O ATOM 1302 ND2 ASN A 87 13.892 -12.912 -6.412 1.00 0.00 N ATOM 0 H ASN A 87 11.801 -9.957 -6.154 1.00 0.00 H new ATOM 0 HA ASN A 87 12.736 -9.242 -8.838 1.00 0.00 H new ATOM 0 HB2 ASN A 87 13.817 -11.458 -8.753 1.00 0.00 H new ATOM 0 HB3 ASN A 87 14.262 -10.479 -7.369 1.00 0.00 H new ATOM 0 HD21 ASN A 87 13.631 -13.671 -5.783 1.00 0.00 H new ATOM 0 HD22 ASN A 87 14.871 -12.770 -6.661 1.00 0.00 H new ATOM 1309 N GLY A 88 10.138 -11.074 -8.214 1.00 0.00 N ATOM 1310 CA GLY A 88 9.013 -11.750 -8.834 1.00 0.00 C ATOM 1311 C GLY A 88 8.967 -13.230 -8.503 1.00 0.00 C ATOM 1312 O GLY A 88 8.629 -14.052 -9.355 1.00 0.00 O ATOM 0 H GLY A 88 10.037 -10.903 -7.214 1.00 0.00 H new ATOM 0 HA2 GLY A 88 8.086 -11.279 -8.507 1.00 0.00 H new ATOM 0 HA3 GLY A 88 9.070 -11.625 -9.915 1.00 0.00 H new ATOM 1316 N LYS A 89 9.304 -13.571 -7.263 1.00 0.00 N ATOM 1317 CA LYS A 89 9.297 -14.962 -6.823 1.00 0.00 C ATOM 1318 C LYS A 89 9.202 -15.048 -5.304 1.00 0.00 C ATOM 1319 O LYS A 89 9.982 -14.419 -4.588 1.00 0.00 O ATOM 1320 CB LYS A 89 10.553 -15.685 -7.312 1.00 0.00 C ATOM 1321 CG LYS A 89 11.843 -14.950 -6.990 1.00 0.00 C ATOM 1322 CD LYS A 89 13.010 -15.914 -6.837 1.00 0.00 C ATOM 1323 CE LYS A 89 13.120 -16.434 -5.413 1.00 0.00 C ATOM 1324 NZ LYS A 89 13.521 -17.868 -5.375 1.00 0.00 N ATOM 0 H LYS A 89 9.585 -12.903 -6.545 1.00 0.00 H new ATOM 0 HA LYS A 89 8.422 -15.448 -7.253 1.00 0.00 H new ATOM 0 HB2 LYS A 89 10.589 -16.678 -6.863 1.00 0.00 H new ATOM 0 HB3 LYS A 89 10.484 -15.825 -8.391 1.00 0.00 H new ATOM 0 HG2 LYS A 89 12.063 -14.234 -7.782 1.00 0.00 H new ATOM 0 HG3 LYS A 89 11.718 -14.379 -6.070 1.00 0.00 H new ATOM 0 HD2 LYS A 89 12.883 -16.752 -7.523 1.00 0.00 H new ATOM 0 HD3 LYS A 89 13.937 -15.412 -7.115 1.00 0.00 H new ATOM 0 HE2 LYS A 89 13.850 -15.838 -4.864 1.00 0.00 H new ATOM 0 HE3 LYS A 89 12.163 -16.311 -4.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 13.519 -18.203 -4.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 12.849 -18.431 -5.934 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 14.476 -17.972 -5.774 1.00 0.00 H new ATOM 1338 N ILE A 90 8.242 -15.827 -4.819 1.00 0.00 N ATOM 1339 CA ILE A 90 8.045 -15.990 -3.382 1.00 0.00 C ATOM 1340 C ILE A 90 8.588 -17.332 -2.904 1.00 0.00 C ATOM 1341 O ILE A 90 8.087 -18.388 -3.287 1.00 0.00 O ATOM 1342 CB ILE A 90 6.554 -15.883 -2.992 1.00 0.00 C ATOM 1343 CG1 ILE A 90 5.778 -15.053 -4.019 1.00 0.00 C ATOM 1344 CG2 ILE A 90 6.416 -15.272 -1.605 1.00 0.00 C ATOM 1345 CD1 ILE A 90 6.381 -13.688 -4.271 1.00 0.00 C ATOM 0 H ILE A 90 7.589 -16.355 -5.398 1.00 0.00 H new ATOM 0 HA ILE A 90 8.593 -15.182 -2.898 1.00 0.00 H new ATOM 0 HB ILE A 90 6.131 -16.888 -2.979 1.00 0.00 H new ATOM 0 HG12 ILE A 90 5.735 -15.602 -4.960 1.00 0.00 H new ATOM 0 HG13 ILE A 90 4.751 -14.930 -3.674 1.00 0.00 H new ATOM 0 HG21 ILE A 90 5.361 -15.202 -1.342 1.00 0.00 H new ATOM 0 HG22 ILE A 90 6.930 -15.900 -0.878 1.00 0.00 H new ATOM 0 HG23 ILE A 90 6.858 -14.276 -1.601 1.00 0.00 H new ATOM 0 HD11 ILE A 90 5.780 -13.155 -5.008 1.00 0.00 H new ATOM 0 HD12 ILE A 90 6.400 -13.121 -3.340 1.00 0.00 H new ATOM 0 HD13 ILE A 90 7.398 -13.803 -4.646 1.00 0.00 H new ATOM 1357 N ASP A 91 9.617 -17.281 -2.064 1.00 0.00 N ATOM 1358 CA ASP A 91 10.231 -18.492 -1.530 1.00 0.00 C ATOM 1359 C ASP A 91 11.368 -18.145 -0.576 1.00 0.00 C ATOM 1360 O ASP A 91 11.297 -18.431 0.620 1.00 0.00 O ATOM 1361 CB ASP A 91 10.752 -19.373 -2.668 1.00 0.00 C ATOM 1362 CG ASP A 91 9.803 -20.508 -3.000 1.00 0.00 C ATOM 1363 OD1 ASP A 91 9.613 -21.393 -2.141 1.00 0.00 O ATOM 1364 OD2 ASP A 91 9.253 -20.512 -4.122 1.00 0.00 O ATOM 0 H ASP A 91 10.043 -16.414 -1.738 1.00 0.00 H new ATOM 0 HA ASP A 91 9.470 -19.043 -0.977 1.00 0.00 H new ATOM 0 HB2 ASP A 91 10.907 -18.761 -3.556 1.00 0.00 H new ATOM 0 HB3 ASP A 91 11.723 -19.784 -2.391 1.00 0.00 H new ATOM 1369 N ILE A 92 12.412 -17.521 -1.109 1.00 0.00 N ATOM 1370 CA ILE A 92 13.558 -17.129 -0.297 1.00 0.00 C ATOM 1371 C ILE A 92 13.296 -15.799 0.395 1.00 0.00 C ATOM 1372 O ILE A 92 13.891 -15.499 1.429 1.00 0.00 O ATOM 1373 CB ILE A 92 14.844 -17.031 -1.139 1.00 0.00 C ATOM 1374 CG1 ILE A 92 16.010 -16.501 -0.289 1.00 0.00 C ATOM 1375 CG2 ILE A 92 14.615 -16.162 -2.368 1.00 0.00 C ATOM 1376 CD1 ILE A 92 16.092 -14.988 -0.213 1.00 0.00 C ATOM 0 H ILE A 92 12.489 -17.276 -2.096 1.00 0.00 H new ATOM 0 HA ILE A 92 13.701 -17.905 0.456 1.00 0.00 H new ATOM 0 HB ILE A 92 15.110 -18.031 -1.482 1.00 0.00 H new ATOM 0 HG12 ILE A 92 15.918 -16.899 0.721 1.00 0.00 H new ATOM 0 HG13 ILE A 92 16.945 -16.883 -0.698 1.00 0.00 H new ATOM 0 HG21 ILE A 92 15.535 -16.105 -2.950 1.00 0.00 H new ATOM 0 HG22 ILE A 92 13.825 -16.598 -2.980 1.00 0.00 H new ATOM 0 HG23 ILE A 92 14.321 -15.160 -2.055 1.00 0.00 H new ATOM 0 HD11 ILE A 92 16.942 -14.700 0.406 1.00 0.00 H new ATOM 0 HD12 ILE A 92 16.218 -14.580 -1.216 1.00 0.00 H new ATOM 0 HD13 ILE A 92 15.175 -14.595 0.226 1.00 0.00 H new ATOM 1388 N GLY A 93 12.388 -15.009 -0.172 1.00 0.00 N ATOM 1389 CA GLY A 93 12.054 -13.731 0.418 1.00 0.00 C ATOM 1390 C GLY A 93 11.149 -13.874 1.632 1.00 0.00 C ATOM 1391 O GLY A 93 10.565 -12.897 2.098 1.00 0.00 O ATOM 0 H GLY A 93 11.880 -15.233 -1.028 1.00 0.00 H new ATOM 0 HA2 GLY A 93 12.970 -13.217 0.709 1.00 0.00 H new ATOM 0 HA3 GLY A 93 11.562 -13.107 -0.328 1.00 0.00 H new ATOM 1395 N ASP A 94 11.033 -15.098 2.142 1.00 0.00 N ATOM 1396 CA ASP A 94 10.198 -15.373 3.301 1.00 0.00 C ATOM 1397 C ASP A 94 11.035 -15.392 4.575 1.00 0.00 C ATOM 1398 O ASP A 94 10.680 -14.767 5.575 1.00 0.00 O ATOM 1399 CB ASP A 94 9.482 -16.718 3.117 1.00 0.00 C ATOM 1400 CG ASP A 94 9.009 -17.327 4.426 1.00 0.00 C ATOM 1401 OD1 ASP A 94 8.694 -16.558 5.360 1.00 0.00 O ATOM 1402 OD2 ASP A 94 8.954 -18.571 4.516 1.00 0.00 O ATOM 0 H ASP A 94 11.511 -15.917 1.766 1.00 0.00 H new ATOM 0 HA ASP A 94 9.455 -14.581 3.393 1.00 0.00 H new ATOM 0 HB2 ASP A 94 8.625 -16.579 2.458 1.00 0.00 H new ATOM 0 HB3 ASP A 94 10.156 -17.416 2.621 1.00 0.00 H new ATOM 1407 N LEU A 95 12.139 -16.129 4.535 1.00 0.00 N ATOM 1408 CA LEU A 95 13.016 -16.248 5.696 1.00 0.00 C ATOM 1409 C LEU A 95 14.327 -15.491 5.500 1.00 0.00 C ATOM 1410 O LEU A 95 15.360 -15.883 6.044 1.00 0.00 O ATOM 1411 CB LEU A 95 13.309 -17.722 5.984 1.00 0.00 C ATOM 1412 CG LEU A 95 12.143 -18.509 6.583 1.00 0.00 C ATOM 1413 CD1 LEU A 95 12.364 -20.004 6.413 1.00 0.00 C ATOM 1414 CD2 LEU A 95 11.964 -18.159 8.053 1.00 0.00 C ATOM 0 H LEU A 95 12.448 -16.652 3.715 1.00 0.00 H new ATOM 0 HA LEU A 95 12.497 -15.803 6.545 1.00 0.00 H new ATOM 0 HB2 LEU A 95 13.614 -18.204 5.055 1.00 0.00 H new ATOM 0 HB3 LEU A 95 14.156 -17.781 6.667 1.00 0.00 H new ATOM 0 HG LEU A 95 11.233 -18.234 6.050 1.00 0.00 H new ATOM 0 HD11 LEU A 95 11.524 -20.547 6.845 1.00 0.00 H new ATOM 0 HD12 LEU A 95 12.443 -20.242 5.352 1.00 0.00 H new ATOM 0 HD13 LEU A 95 13.284 -20.296 6.919 1.00 0.00 H new ATOM 0 HD21 LEU A 95 11.130 -18.728 8.464 1.00 0.00 H new ATOM 0 HD22 LEU A 95 12.875 -18.405 8.599 1.00 0.00 H new ATOM 0 HD23 LEU A 95 11.759 -17.093 8.151 1.00 0.00 H new ATOM 1426 N ALA A 96 14.293 -14.412 4.723 1.00 0.00 N ATOM 1427 CA ALA A 96 15.503 -13.632 4.477 1.00 0.00 C ATOM 1428 C ALA A 96 15.202 -12.196 4.046 1.00 0.00 C ATOM 1429 O ALA A 96 15.969 -11.282 4.350 1.00 0.00 O ATOM 1430 CB ALA A 96 16.362 -14.323 3.429 1.00 0.00 C ATOM 0 H ALA A 96 13.455 -14.061 4.259 1.00 0.00 H new ATOM 0 HA ALA A 96 16.045 -13.574 5.421 1.00 0.00 H new ATOM 0 HB1 ALA A 96 17.262 -13.735 3.251 1.00 0.00 H new ATOM 0 HB2 ALA A 96 16.641 -15.315 3.784 1.00 0.00 H new ATOM 0 HB3 ALA A 96 15.799 -14.415 2.500 1.00 0.00 H new ATOM 1436 N MET A 97 14.107 -11.999 3.319 1.00 0.00 N ATOM 1437 CA MET A 97 13.750 -10.667 2.836 1.00 0.00 C ATOM 1438 C MET A 97 13.015 -9.841 3.888 1.00 0.00 C ATOM 1439 O MET A 97 13.567 -8.895 4.450 1.00 0.00 O ATOM 1440 CB MET A 97 12.866 -10.770 1.591 1.00 0.00 C ATOM 1441 CG MET A 97 13.618 -10.741 0.271 1.00 0.00 C ATOM 1442 SD MET A 97 14.756 -9.347 0.135 1.00 0.00 S ATOM 1443 CE MET A 97 13.736 -8.165 -0.741 1.00 0.00 C ATOM 0 H MET A 97 13.455 -12.737 3.052 1.00 0.00 H new ATOM 0 HA MET A 97 14.687 -10.164 2.599 1.00 0.00 H new ATOM 0 HB2 MET A 97 12.292 -11.695 1.646 1.00 0.00 H new ATOM 0 HB3 MET A 97 12.149 -9.949 1.603 1.00 0.00 H new ATOM 0 HG2 MET A 97 14.176 -11.670 0.157 1.00 0.00 H new ATOM 0 HG3 MET A 97 12.900 -10.698 -0.548 1.00 0.00 H new ATOM 0 HE1 MET A 97 13.859 -7.178 -0.295 1.00 0.00 H new ATOM 0 HE2 MET A 97 14.037 -8.130 -1.788 1.00 0.00 H new ATOM 0 HE3 MET A 97 12.691 -8.466 -0.674 1.00 0.00 H new ATOM 1453 N VAL A 98 11.747 -10.173 4.104 1.00 0.00 N ATOM 1454 CA VAL A 98 10.909 -9.431 5.035 1.00 0.00 C ATOM 1455 C VAL A 98 11.303 -9.606 6.504 1.00 0.00 C ATOM 1456 O VAL A 98 11.712 -8.641 7.149 1.00 0.00 O ATOM 1457 CB VAL A 98 9.413 -9.774 4.846 1.00 0.00 C ATOM 1458 CG1 VAL A 98 9.154 -11.269 4.965 1.00 0.00 C ATOM 1459 CG2 VAL A 98 8.561 -8.999 5.835 1.00 0.00 C ATOM 0 H VAL A 98 11.277 -10.953 3.645 1.00 0.00 H new ATOM 0 HA VAL A 98 11.076 -8.382 4.790 1.00 0.00 H new ATOM 0 HB VAL A 98 9.133 -9.477 3.835 1.00 0.00 H new ATOM 0 HG11 VAL A 98 8.091 -11.466 4.826 1.00 0.00 H new ATOM 0 HG12 VAL A 98 9.724 -11.799 4.202 1.00 0.00 H new ATOM 0 HG13 VAL A 98 9.461 -11.614 5.952 1.00 0.00 H new ATOM 0 HG21 VAL A 98 7.511 -9.253 5.688 1.00 0.00 H new ATOM 0 HG22 VAL A 98 8.858 -9.257 6.852 1.00 0.00 H new ATOM 0 HG23 VAL A 98 8.702 -7.930 5.677 1.00 0.00 H new ATOM 1469 N SER A 99 11.160 -10.813 7.050 1.00 0.00 N ATOM 1470 CA SER A 99 11.477 -11.038 8.456 1.00 0.00 C ATOM 1471 C SER A 99 12.880 -10.567 8.819 1.00 0.00 C ATOM 1472 O SER A 99 13.191 -10.379 9.995 1.00 0.00 O ATOM 1473 CB SER A 99 11.306 -12.503 8.840 1.00 0.00 C ATOM 1474 OG SER A 99 12.402 -13.284 8.394 1.00 0.00 O ATOM 0 H SER A 99 10.832 -11.638 6.548 1.00 0.00 H new ATOM 0 HA SER A 99 10.766 -10.439 9.026 1.00 0.00 H new ATOM 0 HB2 SER A 99 11.212 -12.589 9.923 1.00 0.00 H new ATOM 0 HB3 SER A 99 10.382 -12.889 8.409 1.00 0.00 H new ATOM 0 HG SER A 99 12.266 -14.219 8.656 1.00 0.00 H new ATOM 1480 N LYS A 100 13.728 -10.375 7.818 1.00 0.00 N ATOM 1481 CA LYS A 100 15.088 -9.928 8.070 1.00 0.00 C ATOM 1482 C LYS A 100 15.103 -8.494 8.573 1.00 0.00 C ATOM 1483 O LYS A 100 15.973 -8.110 9.357 1.00 0.00 O ATOM 1484 CB LYS A 100 15.939 -10.064 6.802 1.00 0.00 C ATOM 1485 CG LYS A 100 17.270 -9.320 6.856 1.00 0.00 C ATOM 1486 CD LYS A 100 17.134 -7.860 6.434 1.00 0.00 C ATOM 1487 CE LYS A 100 16.428 -7.718 5.094 1.00 0.00 C ATOM 1488 NZ LYS A 100 16.906 -8.720 4.103 1.00 0.00 N ATOM 0 H LYS A 100 13.500 -10.520 6.834 1.00 0.00 H new ATOM 0 HA LYS A 100 15.517 -10.562 8.846 1.00 0.00 H new ATOM 0 HB2 LYS A 100 16.134 -11.121 6.621 1.00 0.00 H new ATOM 0 HB3 LYS A 100 15.365 -9.696 5.952 1.00 0.00 H new ATOM 0 HG2 LYS A 100 17.670 -9.368 7.869 1.00 0.00 H new ATOM 0 HG3 LYS A 100 17.989 -9.818 6.206 1.00 0.00 H new ATOM 0 HD2 LYS A 100 16.579 -7.312 7.196 1.00 0.00 H new ATOM 0 HD3 LYS A 100 18.123 -7.407 6.372 1.00 0.00 H new ATOM 0 HE2 LYS A 100 15.353 -7.833 5.236 1.00 0.00 H new ATOM 0 HE3 LYS A 100 16.592 -6.714 4.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 16.797 -8.337 3.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 17.909 -8.932 4.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 16.347 -9.592 4.194 1.00 0.00 H new ATOM 1502 N ASN A 101 14.139 -7.708 8.129 1.00 0.00 N ATOM 1503 CA ASN A 101 14.047 -6.322 8.546 1.00 0.00 C ATOM 1504 C ASN A 101 13.238 -6.213 9.827 1.00 0.00 C ATOM 1505 O ASN A 101 13.701 -5.654 10.821 1.00 0.00 O ATOM 1506 CB ASN A 101 13.397 -5.485 7.443 1.00 0.00 C ATOM 1507 CG ASN A 101 14.184 -5.520 6.149 1.00 0.00 C ATOM 1508 OD1 ASN A 101 15.230 -4.883 6.026 1.00 0.00 O ATOM 1509 ND2 ASN A 101 13.682 -6.269 5.173 1.00 0.00 N ATOM 0 H ASN A 101 13.410 -8.006 7.481 1.00 0.00 H new ATOM 0 HA ASN A 101 15.052 -5.943 8.732 1.00 0.00 H new ATOM 0 HB2 ASN A 101 12.387 -5.852 7.260 1.00 0.00 H new ATOM 0 HB3 ASN A 101 13.305 -4.453 7.781 1.00 0.00 H new ATOM 0 HD21 ASN A 101 14.167 -6.333 4.278 1.00 0.00 H new ATOM 0 HD22 ASN A 101 12.812 -6.780 5.319 1.00 0.00 H new ATOM 1516 N ILE A 102 12.015 -6.739 9.775 1.00 0.00 N ATOM 1517 CA ILE A 102 11.084 -6.706 10.900 1.00 0.00 C ATOM 1518 C ILE A 102 11.217 -5.413 11.687 1.00 0.00 C ATOM 1519 O ILE A 102 12.111 -5.253 12.518 1.00 0.00 O ATOM 1520 CB ILE A 102 11.243 -7.923 11.838 1.00 0.00 C ATOM 1521 CG1 ILE A 102 10.960 -9.217 11.067 1.00 0.00 C ATOM 1522 CG2 ILE A 102 10.318 -7.803 13.048 1.00 0.00 C ATOM 1523 CD1 ILE A 102 9.482 -9.570 10.940 1.00 0.00 C ATOM 0 H ILE A 102 11.641 -7.202 8.947 1.00 0.00 H new ATOM 0 HA ILE A 102 10.083 -6.755 10.471 1.00 0.00 H new ATOM 0 HB ILE A 102 12.269 -7.948 12.204 1.00 0.00 H new ATOM 0 HG12 ILE A 102 11.386 -9.130 10.068 1.00 0.00 H new ATOM 0 HG13 ILE A 102 11.475 -10.040 11.563 1.00 0.00 H new ATOM 0 HG21 ILE A 102 10.448 -8.672 13.693 1.00 0.00 H new ATOM 0 HG22 ILE A 102 10.562 -6.898 13.604 1.00 0.00 H new ATOM 0 HG23 ILE A 102 9.283 -7.754 12.711 1.00 0.00 H new ATOM 0 HD11 ILE A 102 9.377 -10.499 10.380 1.00 0.00 H new ATOM 0 HD12 ILE A 102 9.051 -9.694 11.933 1.00 0.00 H new ATOM 0 HD13 ILE A 102 8.961 -8.769 10.415 1.00 0.00 H new ATOM 1535 N GLY A 103 10.309 -4.499 11.406 1.00 0.00 N ATOM 1536 CA GLY A 103 10.314 -3.212 12.074 1.00 0.00 C ATOM 1537 C GLY A 103 11.563 -2.414 11.754 1.00 0.00 C ATOM 1538 O GLY A 103 12.172 -1.817 12.642 1.00 0.00 O ATOM 0 H GLY A 103 9.562 -4.622 10.723 1.00 0.00 H new ATOM 0 HA2 GLY A 103 9.433 -2.644 11.774 1.00 0.00 H new ATOM 0 HA3 GLY A 103 10.245 -3.362 13.151 1.00 0.00 H new ATOM 1542 N SER A 104 11.948 -2.414 10.482 1.00 0.00 N ATOM 1543 CA SER A 104 13.139 -1.695 10.041 1.00 0.00 C ATOM 1544 C SER A 104 12.889 -0.191 9.974 1.00 0.00 C ATOM 1545 O SER A 104 13.801 0.607 10.183 1.00 0.00 O ATOM 1546 CB SER A 104 13.588 -2.212 8.672 1.00 0.00 C ATOM 1547 OG SER A 104 14.319 -1.225 7.962 1.00 0.00 O ATOM 0 H SER A 104 11.452 -2.904 9.737 1.00 0.00 H new ATOM 0 HA SER A 104 13.928 -1.873 10.772 1.00 0.00 H new ATOM 0 HB2 SER A 104 14.205 -3.101 8.801 1.00 0.00 H new ATOM 0 HB3 SER A 104 12.716 -2.511 8.090 1.00 0.00 H new ATOM 0 HG SER A 104 14.594 -1.584 7.092 1.00 0.00 H new ATOM 1553 N THR A 105 11.652 0.190 9.674 1.00 0.00 N ATOM 1554 CA THR A 105 11.293 1.600 9.571 1.00 0.00 C ATOM 1555 C THR A 105 11.990 2.247 8.379 1.00 0.00 C ATOM 1556 O THR A 105 12.299 3.439 8.399 1.00 0.00 O ATOM 1557 CB THR A 105 11.660 2.343 10.858 1.00 0.00 C ATOM 1558 OG1 THR A 105 11.751 1.442 11.948 1.00 0.00 O ATOM 1559 CG2 THR A 105 10.663 3.418 11.234 1.00 0.00 C ATOM 0 H THR A 105 10.883 -0.456 9.498 1.00 0.00 H new ATOM 0 HA THR A 105 10.215 1.665 9.423 1.00 0.00 H new ATOM 0 HB THR A 105 12.621 2.816 10.654 1.00 0.00 H new ATOM 0 HG1 THR A 105 11.988 1.935 12.761 1.00 0.00 H new ATOM 0 HG21 THR A 105 10.983 3.905 12.155 1.00 0.00 H new ATOM 0 HG22 THR A 105 10.605 4.156 10.434 1.00 0.00 H new ATOM 0 HG23 THR A 105 9.682 2.968 11.384 1.00 0.00 H new ATOM 1567 N THR A 106 12.233 1.451 7.342 1.00 0.00 N ATOM 1568 CA THR A 106 12.893 1.941 6.138 1.00 0.00 C ATOM 1569 C THR A 106 12.392 1.197 4.904 1.00 0.00 C ATOM 1570 O THR A 106 12.063 1.810 3.889 1.00 0.00 O ATOM 1571 CB THR A 106 14.408 1.785 6.263 1.00 0.00 C ATOM 1572 OG1 THR A 106 14.888 2.445 7.421 1.00 0.00 O ATOM 1573 CG2 THR A 106 15.167 2.336 5.074 1.00 0.00 C ATOM 0 H THR A 106 11.982 0.463 7.312 1.00 0.00 H new ATOM 0 HA THR A 106 12.653 2.998 6.025 1.00 0.00 H new ATOM 0 HB THR A 106 14.583 0.711 6.320 1.00 0.00 H new ATOM 0 HG1 THR A 106 15.859 2.332 7.483 1.00 0.00 H new ATOM 0 HG21 THR A 106 16.237 2.193 5.227 1.00 0.00 H new ATOM 0 HG22 THR A 106 14.857 1.812 4.170 1.00 0.00 H new ATOM 0 HG23 THR A 106 14.955 3.400 4.968 1.00 0.00 H new ATOM 1581 N ASN A 107 12.335 -0.128 5.000 1.00 0.00 N ATOM 1582 CA ASN A 107 11.873 -0.954 3.890 1.00 0.00 C ATOM 1583 C ASN A 107 10.395 -1.297 4.044 1.00 0.00 C ATOM 1584 O ASN A 107 10.037 -2.280 4.690 1.00 0.00 O ATOM 1585 CB ASN A 107 12.698 -2.239 3.799 1.00 0.00 C ATOM 1586 CG ASN A 107 12.652 -2.857 2.415 1.00 0.00 C ATOM 1587 OD1 ASN A 107 13.664 -2.919 1.716 1.00 0.00 O ATOM 1588 ND2 ASN A 107 11.474 -3.319 2.011 1.00 0.00 N ATOM 0 H ASN A 107 12.602 -0.652 5.833 1.00 0.00 H new ATOM 0 HA ASN A 107 12.003 -0.383 2.971 1.00 0.00 H new ATOM 0 HB2 ASN A 107 13.733 -2.023 4.063 1.00 0.00 H new ATOM 0 HB3 ASN A 107 12.326 -2.959 4.528 1.00 0.00 H new ATOM 0 HD21 ASN A 107 11.382 -3.746 1.089 1.00 0.00 H new ATOM 0 HD22 ASN A 107 10.661 -3.247 2.623 1.00 0.00 H new ATOM 1595 N THR A 108 9.542 -0.475 3.442 1.00 0.00 N ATOM 1596 CA THR A 108 8.100 -0.683 3.504 1.00 0.00 C ATOM 1597 C THR A 108 7.605 -1.530 2.330 1.00 0.00 C ATOM 1598 O THR A 108 6.412 -1.816 2.221 1.00 0.00 O ATOM 1599 CB THR A 108 7.381 0.664 3.509 1.00 0.00 C ATOM 1600 OG1 THR A 108 7.438 1.269 2.228 1.00 0.00 O ATOM 1601 CG2 THR A 108 7.963 1.640 4.506 1.00 0.00 C ATOM 0 H THR A 108 9.826 0.344 2.904 1.00 0.00 H new ATOM 0 HA THR A 108 7.878 -1.221 4.425 1.00 0.00 H new ATOM 0 HB THR A 108 6.352 0.446 3.793 1.00 0.00 H new ATOM 0 HG1 THR A 108 6.970 2.130 2.252 1.00 0.00 H new ATOM 0 HG21 THR A 108 7.410 2.578 4.462 1.00 0.00 H new ATOM 0 HG22 THR A 108 7.889 1.222 5.510 1.00 0.00 H new ATOM 0 HG23 THR A 108 9.010 1.825 4.266 1.00 0.00 H new ATOM 1609 N SER A 109 8.521 -1.911 1.444 1.00 0.00 N ATOM 1610 CA SER A 109 8.174 -2.703 0.269 1.00 0.00 C ATOM 1611 C SER A 109 7.721 -4.116 0.635 1.00 0.00 C ATOM 1612 O SER A 109 6.817 -4.664 0.006 1.00 0.00 O ATOM 1613 CB SER A 109 9.365 -2.776 -0.687 1.00 0.00 C ATOM 1614 OG SER A 109 10.186 -1.627 -0.568 1.00 0.00 O ATOM 0 H SER A 109 9.512 -1.683 1.518 1.00 0.00 H new ATOM 0 HA SER A 109 7.337 -2.204 -0.219 1.00 0.00 H new ATOM 0 HB2 SER A 109 9.952 -3.670 -0.474 1.00 0.00 H new ATOM 0 HB3 SER A 109 9.007 -2.866 -1.713 1.00 0.00 H new ATOM 0 HG SER A 109 10.941 -1.699 -1.188 1.00 0.00 H new ATOM 1620 N LEU A 110 8.358 -4.715 1.638 1.00 0.00 N ATOM 1621 CA LEU A 110 8.007 -6.074 2.047 1.00 0.00 C ATOM 1622 C LEU A 110 6.988 -6.080 3.179 1.00 0.00 C ATOM 1623 O LEU A 110 6.876 -7.063 3.911 1.00 0.00 O ATOM 1624 CB LEU A 110 9.246 -6.868 2.482 1.00 0.00 C ATOM 1625 CG LEU A 110 10.597 -6.310 2.027 1.00 0.00 C ATOM 1626 CD1 LEU A 110 11.401 -5.834 3.229 1.00 0.00 C ATOM 1627 CD2 LEU A 110 11.366 -7.366 1.242 1.00 0.00 C ATOM 0 H LEU A 110 9.111 -4.288 2.177 1.00 0.00 H new ATOM 0 HA LEU A 110 7.564 -6.552 1.173 1.00 0.00 H new ATOM 0 HB2 LEU A 110 9.249 -6.930 3.570 1.00 0.00 H new ATOM 0 HB3 LEU A 110 9.151 -7.886 2.105 1.00 0.00 H new ATOM 0 HG LEU A 110 10.425 -5.456 1.372 1.00 0.00 H new ATOM 0 HD11 LEU A 110 12.360 -5.439 2.892 1.00 0.00 H new ATOM 0 HD12 LEU A 110 10.849 -5.051 3.749 1.00 0.00 H new ATOM 0 HD13 LEU A 110 11.571 -6.670 3.907 1.00 0.00 H new ATOM 0 HD21 LEU A 110 12.325 -6.957 0.924 1.00 0.00 H new ATOM 0 HD22 LEU A 110 11.535 -8.238 1.874 1.00 0.00 H new ATOM 0 HD23 LEU A 110 10.789 -7.660 0.365 1.00 0.00 H new ATOM 1639 N ASP A 111 6.237 -4.995 3.320 1.00 0.00 N ATOM 1640 CA ASP A 111 5.237 -4.903 4.350 1.00 0.00 C ATOM 1641 C ASP A 111 3.864 -4.990 3.717 1.00 0.00 C ATOM 1642 O ASP A 111 3.362 -4.007 3.172 1.00 0.00 O ATOM 1643 CB ASP A 111 5.374 -3.588 5.122 1.00 0.00 C ATOM 1644 CG ASP A 111 6.816 -3.211 5.405 1.00 0.00 C ATOM 1645 OD1 ASP A 111 7.639 -3.262 4.468 1.00 0.00 O ATOM 1646 OD2 ASP A 111 7.121 -2.865 6.565 1.00 0.00 O ATOM 0 H ASP A 111 6.310 -4.169 2.726 1.00 0.00 H new ATOM 0 HA ASP A 111 5.373 -5.725 5.052 1.00 0.00 H new ATOM 0 HB2 ASP A 111 4.901 -2.788 4.552 1.00 0.00 H new ATOM 0 HB3 ASP A 111 4.834 -3.670 6.065 1.00 0.00 H new ATOM 1651 N LEU A 112 3.251 -6.165 3.794 1.00 0.00 N ATOM 1652 CA LEU A 112 1.920 -6.361 3.228 1.00 0.00 C ATOM 1653 C LEU A 112 0.997 -5.223 3.660 1.00 0.00 C ATOM 1654 O LEU A 112 -0.022 -4.949 3.027 1.00 0.00 O ATOM 1655 CB LEU A 112 1.344 -7.711 3.668 1.00 0.00 C ATOM 1656 CG LEU A 112 2.320 -8.888 3.614 1.00 0.00 C ATOM 1657 CD1 LEU A 112 1.844 -10.036 4.496 1.00 0.00 C ATOM 1658 CD2 LEU A 112 2.503 -9.359 2.180 1.00 0.00 C ATOM 0 H LEU A 112 3.650 -6.992 4.239 1.00 0.00 H new ATOM 0 HA LEU A 112 1.997 -6.359 2.141 1.00 0.00 H new ATOM 0 HB2 LEU A 112 0.974 -7.614 4.689 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.485 -7.943 3.038 1.00 0.00 H new ATOM 0 HG LEU A 112 3.282 -8.547 3.996 1.00 0.00 H new ATOM 0 HD11 LEU A 112 2.557 -10.859 4.438 1.00 0.00 H new ATOM 0 HD12 LEU A 112 1.767 -9.694 5.528 1.00 0.00 H new ATOM 0 HD13 LEU A 112 0.867 -10.377 4.153 1.00 0.00 H new ATOM 0 HD21 LEU A 112 3.200 -10.197 2.158 1.00 0.00 H new ATOM 0 HD22 LEU A 112 1.542 -9.676 1.776 1.00 0.00 H new ATOM 0 HD23 LEU A 112 2.899 -8.542 1.576 1.00 0.00 H new ATOM 1670 N ASN A 113 1.387 -4.561 4.746 1.00 0.00 N ATOM 1671 CA ASN A 113 0.647 -3.444 5.296 1.00 0.00 C ATOM 1672 C ASN A 113 1.252 -2.121 4.849 1.00 0.00 C ATOM 1673 O ASN A 113 0.550 -1.129 4.671 1.00 0.00 O ATOM 1674 CB ASN A 113 0.712 -3.518 6.812 1.00 0.00 C ATOM 1675 CG ASN A 113 -0.577 -4.028 7.426 1.00 0.00 C ATOM 1676 OD1 ASN A 113 -1.240 -4.902 6.869 1.00 0.00 O ATOM 1677 ND2 ASN A 113 -0.938 -3.480 8.580 1.00 0.00 N ATOM 0 H ASN A 113 2.232 -4.791 5.268 1.00 0.00 H new ATOM 0 HA ASN A 113 -0.383 -3.498 4.945 1.00 0.00 H new ATOM 0 HB2 ASN A 113 1.533 -4.172 7.105 1.00 0.00 H new ATOM 0 HB3 ASN A 113 0.934 -2.528 7.211 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -1.797 -3.781 9.041 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -0.357 -2.758 9.006 1.00 0.00 H new ATOM 1684 N LYS A 114 2.572 -2.112 4.714 1.00 0.00 N ATOM 1685 CA LYS A 114 3.297 -0.908 4.337 1.00 0.00 C ATOM 1686 C LYS A 114 3.171 0.123 5.447 1.00 0.00 C ATOM 1687 O LYS A 114 3.106 1.325 5.193 1.00 0.00 O ATOM 1688 CB LYS A 114 2.771 -0.331 3.023 1.00 0.00 C ATOM 1689 CG LYS A 114 3.138 -1.161 1.802 1.00 0.00 C ATOM 1690 CD LYS A 114 1.908 -1.559 1.002 1.00 0.00 C ATOM 1691 CE LYS A 114 1.526 -3.009 1.253 1.00 0.00 C ATOM 1692 NZ LYS A 114 2.524 -3.954 0.680 1.00 0.00 N ATOM 0 H LYS A 114 3.164 -2.930 4.861 1.00 0.00 H new ATOM 0 HA LYS A 114 4.346 -1.167 4.190 1.00 0.00 H new ATOM 0 HB2 LYS A 114 1.686 -0.247 3.082 1.00 0.00 H new ATOM 0 HB3 LYS A 114 3.163 0.678 2.897 1.00 0.00 H new ATOM 0 HG2 LYS A 114 3.817 -0.593 1.166 1.00 0.00 H new ATOM 0 HG3 LYS A 114 3.672 -2.057 2.118 1.00 0.00 H new ATOM 0 HD2 LYS A 114 1.074 -0.910 1.269 1.00 0.00 H new ATOM 0 HD3 LYS A 114 2.100 -1.411 -0.061 1.00 0.00 H new ATOM 0 HE2 LYS A 114 1.438 -3.181 2.326 1.00 0.00 H new ATOM 0 HE3 LYS A 114 0.547 -3.207 0.817 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 2.066 -4.867 0.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 2.905 -3.562 -0.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 3.299 -4.094 1.359 1.00 0.00 H new ATOM 1706 N ASP A 115 3.135 -0.364 6.686 1.00 0.00 N ATOM 1707 CA ASP A 115 3.013 0.508 7.843 1.00 0.00 C ATOM 1708 C ASP A 115 4.369 1.100 8.229 1.00 0.00 C ATOM 1709 O ASP A 115 4.466 1.877 9.178 1.00 0.00 O ATOM 1710 CB ASP A 115 2.409 -0.261 9.024 1.00 0.00 C ATOM 1711 CG ASP A 115 2.261 0.601 10.263 1.00 0.00 C ATOM 1712 OD1 ASP A 115 1.616 1.667 10.172 1.00 0.00 O ATOM 1713 OD2 ASP A 115 2.790 0.209 11.325 1.00 0.00 O ATOM 0 H ASP A 115 3.189 -1.358 6.910 1.00 0.00 H new ATOM 0 HA ASP A 115 2.348 1.331 7.581 1.00 0.00 H new ATOM 0 HB2 ASP A 115 1.432 -0.651 8.738 1.00 0.00 H new ATOM 0 HB3 ASP A 115 3.040 -1.119 9.256 1.00 0.00 H new ATOM 1718 N GLY A 116 5.416 0.731 7.489 1.00 0.00 N ATOM 1719 CA GLY A 116 6.742 1.244 7.780 1.00 0.00 C ATOM 1720 C GLY A 116 7.446 0.435 8.848 1.00 0.00 C ATOM 1721 O GLY A 116 8.190 0.978 9.664 1.00 0.00 O ATOM 0 H GLY A 116 5.367 0.089 6.698 1.00 0.00 H new ATOM 0 HA2 GLY A 116 7.340 1.238 6.869 1.00 0.00 H new ATOM 0 HA3 GLY A 116 6.665 2.282 8.104 1.00 0.00 H new ATOM 1725 N SER A 117 7.201 -0.867 8.842 1.00 0.00 N ATOM 1726 CA SER A 117 7.807 -1.768 9.819 1.00 0.00 C ATOM 1727 C SER A 117 7.397 -3.191 9.548 1.00 0.00 C ATOM 1728 O SER A 117 6.226 -3.547 9.683 1.00 0.00 O ATOM 1729 CB SER A 117 7.386 -1.389 11.241 1.00 0.00 C ATOM 1730 OG SER A 117 8.417 -0.684 11.911 1.00 0.00 O ATOM 0 H SER A 117 6.586 -1.327 8.171 1.00 0.00 H new ATOM 0 HA SER A 117 8.889 -1.677 9.729 1.00 0.00 H new ATOM 0 HB2 SER A 117 6.486 -0.775 11.205 1.00 0.00 H new ATOM 0 HB3 SER A 117 7.135 -2.290 11.801 1.00 0.00 H new ATOM 0 HG SER A 117 8.678 0.097 11.380 1.00 0.00 H new ATOM 1736 N ILE A 118 8.363 -4.015 9.192 1.00 0.00 N ATOM 1737 CA ILE A 118 8.075 -5.399 8.942 1.00 0.00 C ATOM 1738 C ILE A 118 7.658 -6.063 10.234 1.00 0.00 C ATOM 1739 O ILE A 118 8.458 -6.287 11.139 1.00 0.00 O ATOM 1740 CB ILE A 118 9.261 -6.137 8.301 1.00 0.00 C ATOM 1741 CG1 ILE A 118 9.401 -5.725 6.837 1.00 0.00 C ATOM 1742 CG2 ILE A 118 9.081 -7.642 8.424 1.00 0.00 C ATOM 1743 CD1 ILE A 118 8.096 -5.740 6.076 1.00 0.00 C ATOM 0 H ILE A 118 9.340 -3.748 9.072 1.00 0.00 H new ATOM 0 HA ILE A 118 7.257 -5.451 8.223 1.00 0.00 H new ATOM 0 HB ILE A 118 10.175 -5.863 8.828 1.00 0.00 H new ATOM 0 HG12 ILE A 118 9.828 -4.723 6.790 1.00 0.00 H new ATOM 0 HG13 ILE A 118 10.106 -6.395 6.346 1.00 0.00 H new ATOM 0 HG21 ILE A 118 9.930 -8.149 7.965 1.00 0.00 H new ATOM 0 HG22 ILE A 118 9.021 -7.916 9.477 1.00 0.00 H new ATOM 0 HG23 ILE A 118 8.163 -7.941 7.918 1.00 0.00 H new ATOM 0 HD11 ILE A 118 8.273 -5.437 5.044 1.00 0.00 H new ATOM 0 HD12 ILE A 118 7.677 -6.746 6.092 1.00 0.00 H new ATOM 0 HD13 ILE A 118 7.395 -5.048 6.542 1.00 0.00 H new ATOM 1755 N ASP A 119 6.383 -6.332 10.323 1.00 0.00 N ATOM 1756 CA ASP A 119 5.827 -6.938 11.525 1.00 0.00 C ATOM 1757 C ASP A 119 4.893 -8.106 11.201 1.00 0.00 C ATOM 1758 O ASP A 119 5.108 -8.833 10.232 1.00 0.00 O ATOM 1759 CB ASP A 119 5.113 -5.870 12.354 1.00 0.00 C ATOM 1760 CG ASP A 119 5.257 -6.100 13.847 1.00 0.00 C ATOM 1761 OD1 ASP A 119 6.388 -6.379 14.297 1.00 0.00 O ATOM 1762 OD2 ASP A 119 4.239 -6.002 14.564 1.00 0.00 O ATOM 0 H ASP A 119 5.703 -6.146 9.586 1.00 0.00 H new ATOM 0 HA ASP A 119 6.648 -7.353 12.109 1.00 0.00 H new ATOM 0 HB2 ASP A 119 5.515 -4.889 12.100 1.00 0.00 H new ATOM 0 HB3 ASP A 119 4.055 -5.858 12.092 1.00 0.00 H new ATOM 1767 N GLU A 120 3.874 -8.297 12.032 1.00 0.00 N ATOM 1768 CA GLU A 120 2.926 -9.393 11.848 1.00 0.00 C ATOM 1769 C GLU A 120 2.060 -9.198 10.604 1.00 0.00 C ATOM 1770 O GLU A 120 1.425 -10.140 10.131 1.00 0.00 O ATOM 1771 CB GLU A 120 2.036 -9.533 13.084 1.00 0.00 C ATOM 1772 CG GLU A 120 2.756 -10.119 14.288 1.00 0.00 C ATOM 1773 CD GLU A 120 1.832 -10.912 15.190 1.00 0.00 C ATOM 1774 OE1 GLU A 120 0.756 -11.332 14.716 1.00 0.00 O ATOM 1775 OE2 GLU A 120 2.184 -11.113 16.372 1.00 0.00 O ATOM 0 H GLU A 120 3.682 -7.707 12.841 1.00 0.00 H new ATOM 0 HA GLU A 120 3.506 -10.305 11.709 1.00 0.00 H new ATOM 0 HB2 GLU A 120 1.640 -8.553 13.349 1.00 0.00 H new ATOM 0 HB3 GLU A 120 1.183 -10.165 12.838 1.00 0.00 H new ATOM 0 HG2 GLU A 120 3.565 -10.764 13.945 1.00 0.00 H new ATOM 0 HG3 GLU A 120 3.213 -9.313 14.861 1.00 0.00 H new ATOM 1782 N TYR A 121 2.035 -7.980 10.080 1.00 0.00 N ATOM 1783 CA TYR A 121 1.242 -7.678 8.893 1.00 0.00 C ATOM 1784 C TYR A 121 1.921 -8.196 7.628 1.00 0.00 C ATOM 1785 O TYR A 121 1.269 -8.375 6.604 1.00 0.00 O ATOM 1786 CB TYR A 121 1.000 -6.167 8.753 1.00 0.00 C ATOM 1787 CG TYR A 121 1.576 -5.323 9.868 1.00 0.00 C ATOM 1788 CD1 TYR A 121 1.060 -5.390 11.157 1.00 0.00 C ATOM 1789 CD2 TYR A 121 2.637 -4.458 9.631 1.00 0.00 C ATOM 1790 CE1 TYR A 121 1.586 -4.619 12.176 1.00 0.00 C ATOM 1791 CE2 TYR A 121 3.168 -3.684 10.645 1.00 0.00 C ATOM 1792 CZ TYR A 121 2.639 -3.768 11.915 1.00 0.00 C ATOM 1793 OH TYR A 121 3.165 -2.999 12.928 1.00 0.00 O ATOM 0 H TYR A 121 2.553 -7.186 10.456 1.00 0.00 H new ATOM 0 HA TYR A 121 0.283 -8.182 9.016 1.00 0.00 H new ATOM 0 HB2 TYR A 121 1.425 -5.832 7.807 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -0.074 -5.989 8.700 1.00 0.00 H new ATOM 0 HD1 TYR A 121 0.235 -6.055 11.365 1.00 0.00 H new ATOM 0 HD2 TYR A 121 3.054 -4.389 8.637 1.00 0.00 H new ATOM 0 HE1 TYR A 121 1.174 -4.683 13.172 1.00 0.00 H new ATOM 0 HE2 TYR A 121 3.993 -3.017 10.444 1.00 0.00 H new ATOM 0 HH TYR A 121 3.902 -2.456 12.578 1.00 0.00 H new ATOM 1803 N GLU A 122 3.235 -8.410 7.698 1.00 0.00 N ATOM 1804 CA GLU A 122 4.000 -8.884 6.540 1.00 0.00 C ATOM 1805 C GLU A 122 4.130 -10.408 6.504 1.00 0.00 C ATOM 1806 O GLU A 122 4.476 -10.984 5.472 1.00 0.00 O ATOM 1807 CB GLU A 122 5.396 -8.260 6.506 1.00 0.00 C ATOM 1808 CG GLU A 122 5.627 -7.191 7.553 1.00 0.00 C ATOM 1809 CD GLU A 122 4.744 -5.975 7.357 1.00 0.00 C ATOM 1810 OE1 GLU A 122 3.719 -6.092 6.653 1.00 0.00 O ATOM 1811 OE2 GLU A 122 5.079 -4.905 7.906 1.00 0.00 O ATOM 0 H GLU A 122 3.792 -8.264 8.540 1.00 0.00 H new ATOM 0 HA GLU A 122 3.437 -8.571 5.661 1.00 0.00 H new ATOM 0 HB2 GLU A 122 6.137 -9.048 6.639 1.00 0.00 H new ATOM 0 HB3 GLU A 122 5.564 -7.828 5.519 1.00 0.00 H new ATOM 0 HG2 GLU A 122 5.444 -7.612 8.542 1.00 0.00 H new ATOM 0 HG3 GLU A 122 6.672 -6.883 7.527 1.00 0.00 H new ATOM 1818 N ILE A 123 3.877 -11.049 7.632 1.00 0.00 N ATOM 1819 CA ILE A 123 3.993 -12.504 7.731 1.00 0.00 C ATOM 1820 C ILE A 123 2.717 -13.219 7.289 1.00 0.00 C ATOM 1821 O ILE A 123 2.759 -14.378 6.879 1.00 0.00 O ATOM 1822 CB ILE A 123 4.331 -12.945 9.169 1.00 0.00 C ATOM 1823 CG1 ILE A 123 5.382 -12.017 9.783 1.00 0.00 C ATOM 1824 CG2 ILE A 123 4.819 -14.386 9.181 1.00 0.00 C ATOM 1825 CD1 ILE A 123 6.649 -11.908 8.962 1.00 0.00 C ATOM 0 H ILE A 123 3.589 -10.589 8.496 1.00 0.00 H new ATOM 0 HA ILE A 123 4.804 -12.785 7.059 1.00 0.00 H new ATOM 0 HB ILE A 123 3.425 -12.882 9.771 1.00 0.00 H new ATOM 0 HG12 ILE A 123 4.951 -11.023 9.904 1.00 0.00 H new ATOM 0 HG13 ILE A 123 5.635 -12.378 10.780 1.00 0.00 H new ATOM 0 HG21 ILE A 123 5.053 -14.682 10.203 1.00 0.00 H new ATOM 0 HG22 ILE A 123 4.040 -15.037 8.784 1.00 0.00 H new ATOM 0 HG23 ILE A 123 5.713 -14.472 8.564 1.00 0.00 H new ATOM 0 HD11 ILE A 123 7.347 -11.234 9.458 1.00 0.00 H new ATOM 0 HD12 ILE A 123 7.104 -12.893 8.863 1.00 0.00 H new ATOM 0 HD13 ILE A 123 6.409 -11.518 7.973 1.00 0.00 H new ATOM 1837 N SER A 124 1.583 -12.531 7.383 1.00 0.00 N ATOM 1838 CA SER A 124 0.293 -13.110 7.002 1.00 0.00 C ATOM 1839 C SER A 124 0.373 -13.858 5.669 1.00 0.00 C ATOM 1840 O SER A 124 0.127 -15.063 5.604 1.00 0.00 O ATOM 1841 CB SER A 124 -0.772 -12.015 6.916 1.00 0.00 C ATOM 1842 OG SER A 124 -0.320 -10.812 7.514 1.00 0.00 O ATOM 0 H SER A 124 1.528 -11.570 7.720 1.00 0.00 H new ATOM 0 HA SER A 124 0.019 -13.830 7.773 1.00 0.00 H new ATOM 0 HB2 SER A 124 -1.026 -11.832 5.872 1.00 0.00 H new ATOM 0 HB3 SER A 124 -1.683 -12.350 7.411 1.00 0.00 H new ATOM 0 HG SER A 124 -0.563 -10.807 8.463 1.00 0.00 H new ATOM 1848 N PHE A 125 0.708 -13.129 4.611 1.00 0.00 N ATOM 1849 CA PHE A 125 0.811 -13.704 3.272 1.00 0.00 C ATOM 1850 C PHE A 125 1.868 -14.802 3.216 1.00 0.00 C ATOM 1851 O PHE A 125 1.549 -15.972 3.014 1.00 0.00 O ATOM 1852 CB PHE A 125 1.149 -12.609 2.259 1.00 0.00 C ATOM 1853 CG PHE A 125 0.872 -12.996 0.835 1.00 0.00 C ATOM 1854 CD1 PHE A 125 1.742 -13.827 0.147 1.00 0.00 C ATOM 1855 CD2 PHE A 125 -0.256 -12.526 0.183 1.00 0.00 C ATOM 1856 CE1 PHE A 125 1.490 -14.183 -1.164 1.00 0.00 C ATOM 1857 CE2 PHE A 125 -0.514 -12.879 -1.128 1.00 0.00 C ATOM 1858 CZ PHE A 125 0.360 -13.709 -1.803 1.00 0.00 C ATOM 0 H PHE A 125 0.915 -12.131 4.654 1.00 0.00 H new ATOM 0 HA PHE A 125 -0.153 -14.149 3.024 1.00 0.00 H new ATOM 0 HB2 PHE A 125 0.576 -11.714 2.501 1.00 0.00 H new ATOM 0 HB3 PHE A 125 2.203 -12.349 2.357 1.00 0.00 H new ATOM 0 HD1 PHE A 125 2.627 -14.200 0.641 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -0.942 -11.876 0.705 1.00 0.00 H new ATOM 0 HE1 PHE A 125 2.176 -14.831 -1.689 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -1.398 -12.506 -1.624 1.00 0.00 H new ATOM 0 HZ PHE A 125 0.161 -13.987 -2.827 1.00 0.00 H new ATOM 1868 N ILE A 126 3.127 -14.408 3.386 1.00 0.00 N ATOM 1869 CA ILE A 126 4.252 -15.345 3.349 1.00 0.00 C ATOM 1870 C ILE A 126 3.923 -16.663 4.044 1.00 0.00 C ATOM 1871 O ILE A 126 3.798 -17.699 3.391 1.00 0.00 O ATOM 1872 CB ILE A 126 5.511 -14.734 3.999 1.00 0.00 C ATOM 1873 CG1 ILE A 126 5.755 -13.308 3.495 1.00 0.00 C ATOM 1874 CG2 ILE A 126 6.723 -15.604 3.722 1.00 0.00 C ATOM 1875 CD1 ILE A 126 5.778 -13.182 1.985 1.00 0.00 C ATOM 0 H ILE A 126 3.398 -13.439 3.552 1.00 0.00 H new ATOM 0 HA ILE A 126 4.448 -15.546 2.296 1.00 0.00 H new ATOM 0 HB ILE A 126 5.347 -14.690 5.076 1.00 0.00 H new ATOM 0 HG12 ILE A 126 4.977 -12.656 3.892 1.00 0.00 H new ATOM 0 HG13 ILE A 126 6.705 -12.951 3.893 1.00 0.00 H new ATOM 0 HG21 ILE A 126 7.603 -15.160 4.187 1.00 0.00 H new ATOM 0 HG22 ILE A 126 6.558 -16.600 4.134 1.00 0.00 H new ATOM 0 HG23 ILE A 126 6.879 -15.678 2.646 1.00 0.00 H new ATOM 0 HD11 ILE A 126 5.956 -12.143 1.709 1.00 0.00 H new ATOM 0 HD12 ILE A 126 6.574 -13.806 1.580 1.00 0.00 H new ATOM 0 HD13 ILE A 126 4.820 -13.507 1.578 1.00 0.00 H new ATOM 1887 N ASN A 127 3.783 -16.620 5.367 1.00 0.00 N ATOM 1888 CA ASN A 127 3.473 -17.815 6.154 1.00 0.00 C ATOM 1889 C ASN A 127 2.484 -18.732 5.435 1.00 0.00 C ATOM 1890 O ASN A 127 2.537 -19.952 5.585 1.00 0.00 O ATOM 1891 CB ASN A 127 2.907 -17.418 7.519 1.00 0.00 C ATOM 1892 CG ASN A 127 3.989 -17.250 8.567 1.00 0.00 C ATOM 1893 OD1 ASN A 127 5.178 -17.221 8.250 1.00 0.00 O ATOM 1894 ND2 ASN A 127 3.582 -17.140 9.825 1.00 0.00 N ATOM 0 H ASN A 127 3.879 -15.768 5.920 1.00 0.00 H new ATOM 0 HA ASN A 127 4.404 -18.365 6.288 1.00 0.00 H new ATOM 0 HB2 ASN A 127 2.352 -16.485 7.422 1.00 0.00 H new ATOM 0 HB3 ASN A 127 2.199 -18.177 7.850 1.00 0.00 H new ATOM 0 HD21 ASN A 127 4.265 -17.026 10.574 1.00 0.00 H new ATOM 0 HD22 ASN A 127 2.586 -17.169 10.043 1.00 0.00 H new ATOM 1901 N HIS A 128 1.578 -18.140 4.661 1.00 0.00 N ATOM 1902 CA HIS A 128 0.581 -18.917 3.934 1.00 0.00 C ATOM 1903 C HIS A 128 1.040 -19.248 2.516 1.00 0.00 C ATOM 1904 O HIS A 128 1.026 -20.410 2.109 1.00 0.00 O ATOM 1905 CB HIS A 128 -0.751 -18.166 3.891 1.00 0.00 C ATOM 1906 CG HIS A 128 -1.656 -18.485 5.041 1.00 0.00 C ATOM 1907 ND1 HIS A 128 -1.339 -18.194 6.351 1.00 0.00 N ATOM 1908 CD2 HIS A 128 -2.875 -19.072 5.072 1.00 0.00 C ATOM 1909 CE1 HIS A 128 -2.323 -18.590 7.139 1.00 0.00 C ATOM 1910 NE2 HIS A 128 -3.267 -19.125 6.388 1.00 0.00 N ATOM 0 H HIS A 128 1.514 -17.131 4.522 1.00 0.00 H new ATOM 0 HA HIS A 128 0.449 -19.858 4.468 1.00 0.00 H new ATOM 0 HB2 HIS A 128 -0.554 -17.094 3.881 1.00 0.00 H new ATOM 0 HB3 HIS A 128 -1.263 -18.405 2.959 1.00 0.00 H new ATOM 0 HD2 HIS A 128 -3.435 -19.432 4.221 1.00 0.00 H new ATOM 0 HE1 HIS A 128 -2.350 -18.492 8.214 1.00 0.00 H new ATOM 0 HE2 HIS A 128 -4.146 -19.515 6.729 1.00 0.00 H new ATOM 1919 N ARG A 129 1.439 -18.222 1.765 1.00 0.00 N ATOM 1920 CA ARG A 129 1.896 -18.406 0.387 1.00 0.00 C ATOM 1921 C ARG A 129 2.822 -19.613 0.267 1.00 0.00 C ATOM 1922 O ARG A 129 2.871 -20.272 -0.772 1.00 0.00 O ATOM 1923 CB ARG A 129 2.617 -17.149 -0.102 1.00 0.00 C ATOM 1924 CG ARG A 129 2.989 -17.196 -1.576 1.00 0.00 C ATOM 1925 CD ARG A 129 1.754 -17.296 -2.457 1.00 0.00 C ATOM 1926 NE ARG A 129 2.099 -17.363 -3.876 1.00 0.00 N ATOM 1927 CZ ARG A 129 1.262 -17.780 -4.824 1.00 0.00 C ATOM 1928 NH1 ARG A 129 0.033 -18.168 -4.509 1.00 0.00 N ATOM 1929 NH2 ARG A 129 1.656 -17.809 -6.089 1.00 0.00 N ATOM 0 H ARG A 129 1.455 -17.254 2.087 1.00 0.00 H new ATOM 0 HA ARG A 129 1.019 -18.585 -0.235 1.00 0.00 H new ATOM 0 HB2 ARG A 129 1.980 -16.282 0.076 1.00 0.00 H new ATOM 0 HB3 ARG A 129 3.522 -17.006 0.488 1.00 0.00 H new ATOM 0 HG2 ARG A 129 3.554 -16.302 -1.839 1.00 0.00 H new ATOM 0 HG3 ARG A 129 3.640 -18.050 -1.761 1.00 0.00 H new ATOM 0 HD2 ARG A 129 1.182 -18.182 -2.181 1.00 0.00 H new ATOM 0 HD3 ARG A 129 1.111 -16.433 -2.280 1.00 0.00 H new ATOM 0 HE ARG A 129 3.036 -17.073 -4.156 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -0.275 -18.148 -3.537 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -0.604 -18.487 -5.239 1.00 0.00 H new ATOM 0 HH21 ARG A 129 2.600 -17.512 -6.336 1.00 0.00 H new ATOM 0 HH22 ARG A 129 1.015 -18.128 -6.816 1.00 0.00 H new ATOM 1943 N ILE A 130 3.551 -19.897 1.339 1.00 0.00 N ATOM 1944 CA ILE A 130 4.472 -21.023 1.365 1.00 0.00 C ATOM 1945 C ILE A 130 3.760 -22.299 1.810 1.00 0.00 C ATOM 1946 O ILE A 130 3.936 -23.360 1.212 1.00 0.00 O ATOM 1947 CB ILE A 130 5.658 -20.739 2.310 1.00 0.00 C ATOM 1948 CG1 ILE A 130 6.479 -19.562 1.786 1.00 0.00 C ATOM 1949 CG2 ILE A 130 6.535 -21.974 2.474 1.00 0.00 C ATOM 1950 CD1 ILE A 130 6.285 -18.305 2.597 1.00 0.00 C ATOM 0 H ILE A 130 3.521 -19.359 2.205 1.00 0.00 H new ATOM 0 HA ILE A 130 4.850 -21.163 0.352 1.00 0.00 H new ATOM 0 HB ILE A 130 5.260 -20.480 3.291 1.00 0.00 H new ATOM 0 HG12 ILE A 130 7.535 -19.832 1.790 1.00 0.00 H new ATOM 0 HG13 ILE A 130 6.204 -19.366 0.750 1.00 0.00 H new ATOM 0 HG21 ILE A 130 7.363 -21.746 3.145 1.00 0.00 H new ATOM 0 HG22 ILE A 130 5.943 -22.788 2.892 1.00 0.00 H new ATOM 0 HG23 ILE A 130 6.927 -22.273 1.502 1.00 0.00 H new ATOM 0 HD11 ILE A 130 6.893 -17.504 2.177 1.00 0.00 H new ATOM 0 HD12 ILE A 130 5.235 -18.014 2.572 1.00 0.00 H new ATOM 0 HD13 ILE A 130 6.587 -18.487 3.628 1.00 0.00 H new