USER MOD reduce.3.24.130724 H: found=0, std=0, add=780, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 782 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 73 TYR OH : rot 165:sc= 0.967 USER MOD Set 1.2: A 83 THR OG1 : rot -142:sc= 1.47 USER MOD Set 2.1: A 72 GLN : amide:sc= 0.71 X(o=1.4,f=1.3) USER MOD Set 2.2: A 87 SER OG : rot 168:sc= 0.646 USER MOD Set 3.1: A 47 ASN : amide:sc= 0.627 K(o=1.9,f=1.3) USER MOD Set 3.2: A 62 GLN : amide:sc= 0.696 K(o=1.9,f=0.91) USER MOD Set 3.3: A 64 TYR OH : rot 180:sc= 0.618 USER MOD Set 4.1: A 42 GLN : amide:sc= 0.31 K(o=0.62,f=-0.06) USER MOD Set 4.2: A 44 SER OG : rot 180:sc= 0.307 USER MOD Set 5.1: A 41 SER OG : rot 62:sc= 2.31 USER MOD Set 5.2: A 43 TYR OH : rot 36:sc= 0.85 USER MOD Set 5.3: A 53 THR OG1 : rot 102:sc= 1.69 USER MOD Set 6.1: A 24 ASN : amide:sc= 1.34 K(o=1.6,f=0.73) USER MOD Set 6.2: A 26 TYR OH : rot 180:sc= 0.27 USER MOD Set 7.1: A 23 THR OG1 : rot 75:sc= 0.725 USER MOD Set 7.2: A 39 THR OG1 : rot 180:sc= 0 USER MOD Set 8.1: A 16 GLN : amide:sc= 1.07 K(o=2.7,f=0.72) USER MOD Set 8.2: A 31 GLN : amide:sc= 1.64 K(o=2.7,f=-0.73) USER MOD Set 9.1: A 14 ASN : amide:sc= 0.997 K(o=2.9,f=0.65) USER MOD Set 9.2: A 29 ASN : amide:sc= 1.86 K(o=2.9,f=-0.58) USER MOD Set10.1: A 12 THR OG1 : rot -79:sc= 1.6 USER MOD Set10.2: A 15 SER OG : rot 89:sc= 1.89 USER MOD Single : A 6 ASN : amide:sc= 1.05 K(o=1.1,f=-9.6!) USER MOD Single : A 7 THR OG1 : rot 83:sc= 0.15 USER MOD Single : A 8 ASN : amide:sc= -0.149 K(o=-0.15,f=-0.68) USER MOD Single : A 9 SER OG : rot 129:sc= 1.33 USER MOD Single : A 10 GLN : amide:sc=-0.00171 K(o=-0.0017,f=-2.2!) USER MOD Single : A 17 CYS SG : rot 180:sc= -0.0261 USER MOD Single : A 19 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0603) USER MOD Single : A 20 SER OG : rot 69:sc= 1.5 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 63:sc= 1.86 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 80:sc= 1.33 USER MOD Single : A 49 LYS NZ :NH3+ -147:sc= 1.28 (180deg=0.783) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 SER OG : rot 71:sc= 1.79 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc= -0.851 K(o=-0.85,f=-0.0099) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0.996 (180deg=0.996) USER MOD Single : A 61 SER OG : rot 76:sc= 1.8 USER MOD Single : A 66 THR OG1 : rot 85:sc= 1.46 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot 66:sc= 1.3 USER MOD Single : A 74 ASN : amide:sc= 1.14 K(o=1.1,f=-0.28) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot -108:sc= 0.936 USER MOD Single : A 81 SER OG : rot 77:sc= 1.71 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 THR OG1 : rot 31:sc= 1.28 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 98:sc= 1.23 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 SER OG : rot 9:sc= 0.943 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 121 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 46 N VAL A 5 11.621 -3.007 -1.507 1.00 0.00 N ATOM 47 CA VAL A 5 12.041 -1.825 -2.243 1.00 0.00 C ATOM 48 C VAL A 5 13.565 -1.980 -2.317 1.00 0.00 C ATOM 49 O VAL A 5 14.325 -1.399 -1.539 1.00 0.00 O ATOM 50 CB VAL A 5 11.511 -0.529 -1.584 1.00 0.00 C ATOM 51 CG1 VAL A 5 11.851 0.701 -2.437 1.00 0.00 C ATOM 52 CG2 VAL A 5 9.986 -0.572 -1.381 1.00 0.00 C ATOM 0 HA VAL A 5 11.629 -1.738 -3.248 1.00 0.00 H new ATOM 0 HB VAL A 5 11.999 -0.456 -0.612 1.00 0.00 H new ATOM 0 HG11 VAL A 5 11.467 1.598 -1.951 1.00 0.00 H new ATOM 0 HG12 VAL A 5 12.933 0.781 -2.545 1.00 0.00 H new ATOM 0 HG13 VAL A 5 11.395 0.598 -3.422 1.00 0.00 H new ATOM 0 HG21 VAL A 5 9.655 0.356 -0.916 1.00 0.00 H new ATOM 0 HG22 VAL A 5 9.494 -0.690 -2.346 1.00 0.00 H new ATOM 0 HG23 VAL A 5 9.728 -1.413 -0.737 1.00 0.00 H new ATOM 62 N ASN A 6 13.992 -2.911 -3.175 1.00 0.00 N ATOM 63 CA ASN A 6 15.393 -3.263 -3.380 1.00 0.00 C ATOM 64 C ASN A 6 16.046 -2.149 -4.199 1.00 0.00 C ATOM 65 O ASN A 6 15.642 -1.910 -5.341 1.00 0.00 O ATOM 66 CB ASN A 6 15.475 -4.625 -4.100 1.00 0.00 C ATOM 67 CG ASN A 6 16.908 -5.104 -4.329 1.00 0.00 C ATOM 68 OD1 ASN A 6 17.824 -4.320 -4.540 1.00 0.00 O ATOM 69 ND2 ASN A 6 17.150 -6.401 -4.275 1.00 0.00 N ATOM 0 H ASN A 6 13.354 -3.452 -3.759 1.00 0.00 H new ATOM 0 HA ASN A 6 15.921 -3.359 -2.431 1.00 0.00 H new ATOM 0 HB2 ASN A 6 14.940 -5.371 -3.513 1.00 0.00 H new ATOM 0 HB3 ASN A 6 14.966 -4.551 -5.061 1.00 0.00 H new ATOM 0 HD21 ASN A 6 18.100 -6.749 -4.409 1.00 0.00 H new ATOM 0 HD22 ASN A 6 16.387 -7.055 -4.099 1.00 0.00 H new ATOM 76 N THR A 7 17.035 -1.462 -3.624 1.00 0.00 N ATOM 77 CA THR A 7 17.767 -0.404 -4.313 1.00 0.00 C ATOM 78 C THR A 7 18.891 -1.026 -5.159 1.00 0.00 C ATOM 79 O THR A 7 18.939 -0.815 -6.373 1.00 0.00 O ATOM 80 CB THR A 7 18.310 0.602 -3.279 1.00 0.00 C ATOM 81 OG1 THR A 7 17.306 0.970 -2.351 1.00 0.00 O ATOM 82 CG2 THR A 7 18.842 1.879 -3.933 1.00 0.00 C ATOM 0 H THR A 7 17.349 -1.625 -2.667 1.00 0.00 H new ATOM 0 HA THR A 7 17.105 0.139 -4.988 1.00 0.00 H new ATOM 0 HB THR A 7 19.130 0.095 -2.770 1.00 0.00 H new ATOM 0 HG1 THR A 7 17.244 0.289 -1.649 1.00 0.00 H new ATOM 0 HG21 THR A 7 19.213 2.555 -3.163 1.00 0.00 H new ATOM 0 HG22 THR A 7 19.653 1.627 -4.616 1.00 0.00 H new ATOM 0 HG23 THR A 7 18.039 2.366 -4.487 1.00 0.00 H new ATOM 90 N ASN A 8 19.788 -1.797 -4.527 1.00 0.00 N ATOM 91 CA ASN A 8 20.943 -2.458 -5.143 1.00 0.00 C ATOM 92 C ASN A 8 21.436 -3.525 -4.161 1.00 0.00 C ATOM 93 O ASN A 8 22.583 -3.507 -3.712 1.00 0.00 O ATOM 94 CB ASN A 8 22.049 -1.438 -5.482 1.00 0.00 C ATOM 95 CG ASN A 8 23.251 -2.104 -6.156 1.00 0.00 C ATOM 96 OD1 ASN A 8 23.112 -3.054 -6.923 1.00 0.00 O ATOM 97 ND2 ASN A 8 24.456 -1.618 -5.900 1.00 0.00 N ATOM 0 H ASN A 8 19.723 -1.984 -3.526 1.00 0.00 H new ATOM 0 HA ASN A 8 20.661 -2.924 -6.087 1.00 0.00 H new ATOM 0 HB2 ASN A 8 21.644 -0.668 -6.139 1.00 0.00 H new ATOM 0 HB3 ASN A 8 22.375 -0.939 -4.569 1.00 0.00 H new ATOM 0 HD21 ASN A 8 25.277 -2.032 -6.341 1.00 0.00 H new ATOM 0 HD22 ASN A 8 24.563 -0.829 -5.262 1.00 0.00 H new ATOM 104 N SER A 9 20.526 -4.404 -3.757 1.00 0.00 N ATOM 105 CA SER A 9 20.694 -5.343 -2.659 1.00 0.00 C ATOM 106 C SER A 9 20.476 -6.787 -3.099 1.00 0.00 C ATOM 107 O SER A 9 19.962 -7.047 -4.192 1.00 0.00 O ATOM 108 CB SER A 9 19.669 -4.949 -1.593 1.00 0.00 C ATOM 109 OG SER A 9 19.854 -3.578 -1.275 1.00 0.00 O ATOM 0 H SER A 9 19.613 -4.483 -4.206 1.00 0.00 H new ATOM 0 HA SER A 9 21.714 -5.295 -2.278 1.00 0.00 H new ATOM 0 HB2 SER A 9 18.657 -5.120 -1.960 1.00 0.00 H new ATOM 0 HB3 SER A 9 19.793 -5.565 -0.702 1.00 0.00 H new ATOM 0 HG SER A 9 18.996 -3.108 -1.341 1.00 0.00 H new ATOM 115 N GLN A 10 20.828 -7.725 -2.220 1.00 0.00 N ATOM 116 CA GLN A 10 20.759 -9.152 -2.457 1.00 0.00 C ATOM 117 C GLN A 10 19.952 -9.772 -1.321 1.00 0.00 C ATOM 118 O GLN A 10 20.189 -9.494 -0.145 1.00 0.00 O ATOM 119 CB GLN A 10 22.199 -9.685 -2.576 1.00 0.00 C ATOM 120 CG GLN A 10 22.443 -11.119 -2.087 1.00 0.00 C ATOM 121 CD GLN A 10 21.733 -12.209 -2.900 1.00 0.00 C ATOM 122 OE1 GLN A 10 20.910 -11.943 -3.772 1.00 0.00 O ATOM 123 NE2 GLN A 10 22.036 -13.468 -2.633 1.00 0.00 N ATOM 0 H GLN A 10 21.181 -7.495 -1.291 1.00 0.00 H new ATOM 0 HA GLN A 10 20.252 -9.412 -3.386 1.00 0.00 H new ATOM 0 HB2 GLN A 10 22.499 -9.626 -3.622 1.00 0.00 H new ATOM 0 HB3 GLN A 10 22.856 -9.018 -2.018 1.00 0.00 H new ATOM 0 HG2 GLN A 10 23.515 -11.315 -2.103 1.00 0.00 H new ATOM 0 HG3 GLN A 10 22.121 -11.193 -1.048 1.00 0.00 H new ATOM 0 HE21 GLN A 10 22.720 -13.685 -1.908 1.00 0.00 H new ATOM 0 HE22 GLN A 10 21.586 -14.222 -3.152 1.00 0.00 H new ATOM 132 N ILE A 11 19.024 -10.641 -1.707 1.00 0.00 N ATOM 133 CA ILE A 11 18.057 -11.333 -0.867 1.00 0.00 C ATOM 134 C ILE A 11 18.186 -12.805 -1.264 1.00 0.00 C ATOM 135 O ILE A 11 17.996 -13.147 -2.436 1.00 0.00 O ATOM 136 CB ILE A 11 16.617 -10.799 -1.118 1.00 0.00 C ATOM 137 CG1 ILE A 11 16.504 -9.267 -1.302 1.00 0.00 C ATOM 138 CG2 ILE A 11 15.664 -11.294 -0.013 1.00 0.00 C ATOM 139 CD1 ILE A 11 16.843 -8.437 -0.069 1.00 0.00 C ATOM 0 H ILE A 11 18.922 -10.898 -2.689 1.00 0.00 H new ATOM 0 HA ILE A 11 18.245 -11.180 0.196 1.00 0.00 H new ATOM 0 HB ILE A 11 16.320 -11.213 -2.082 1.00 0.00 H new ATOM 0 HG12 ILE A 11 17.164 -8.966 -2.116 1.00 0.00 H new ATOM 0 HG13 ILE A 11 15.487 -9.029 -1.612 1.00 0.00 H new ATOM 0 HG21 ILE A 11 14.660 -10.913 -0.201 1.00 0.00 H new ATOM 0 HG22 ILE A 11 15.644 -12.384 -0.011 1.00 0.00 H new ATOM 0 HG23 ILE A 11 16.013 -10.936 0.956 1.00 0.00 H new ATOM 0 HD11 ILE A 11 16.733 -7.378 -0.302 1.00 0.00 H new ATOM 0 HD12 ILE A 11 16.168 -8.702 0.745 1.00 0.00 H new ATOM 0 HD13 ILE A 11 17.871 -8.637 0.233 1.00 0.00 H new ATOM 151 N THR A 12 18.571 -13.664 -0.322 1.00 0.00 N ATOM 152 CA THR A 12 18.774 -15.086 -0.615 1.00 0.00 C ATOM 153 C THR A 12 17.432 -15.807 -0.826 1.00 0.00 C ATOM 154 O THR A 12 16.367 -15.290 -0.477 1.00 0.00 O ATOM 155 CB THR A 12 19.638 -15.750 0.472 1.00 0.00 C ATOM 156 OG1 THR A 12 19.250 -15.314 1.754 1.00 0.00 O ATOM 157 CG2 THR A 12 21.122 -15.420 0.301 1.00 0.00 C ATOM 0 H THR A 12 18.749 -13.404 0.648 1.00 0.00 H new ATOM 0 HA THR A 12 19.323 -15.171 -1.553 1.00 0.00 H new ATOM 0 HB THR A 12 19.488 -16.825 0.369 1.00 0.00 H new ATOM 0 HG1 THR A 12 19.629 -14.427 1.926 1.00 0.00 H new ATOM 0 HG21 THR A 12 21.696 -15.908 1.088 1.00 0.00 H new ATOM 0 HG22 THR A 12 21.464 -15.775 -0.671 1.00 0.00 H new ATOM 0 HG23 THR A 12 21.264 -14.341 0.364 1.00 0.00 H new ATOM 165 N ALA A 13 17.487 -17.026 -1.377 1.00 0.00 N ATOM 166 CA ALA A 13 16.327 -17.807 -1.804 1.00 0.00 C ATOM 167 C ALA A 13 15.297 -18.069 -0.697 1.00 0.00 C ATOM 168 O ALA A 13 14.121 -18.269 -1.007 1.00 0.00 O ATOM 169 CB ALA A 13 16.823 -19.149 -2.348 1.00 0.00 C ATOM 0 H ALA A 13 18.370 -17.508 -1.542 1.00 0.00 H new ATOM 0 HA ALA A 13 15.813 -17.216 -2.562 1.00 0.00 H new ATOM 0 HB1 ALA A 13 15.972 -19.747 -2.672 1.00 0.00 H new ATOM 0 HB2 ALA A 13 17.488 -18.975 -3.194 1.00 0.00 H new ATOM 0 HB3 ALA A 13 17.364 -19.681 -1.565 1.00 0.00 H new ATOM 175 N ASN A 14 15.723 -18.085 0.573 1.00 0.00 N ATOM 176 CA ASN A 14 14.852 -18.372 1.722 1.00 0.00 C ATOM 177 C ASN A 14 14.713 -17.161 2.653 1.00 0.00 C ATOM 178 O ASN A 14 14.089 -17.242 3.714 1.00 0.00 O ATOM 179 CB ASN A 14 15.349 -19.622 2.465 1.00 0.00 C ATOM 180 CG ASN A 14 14.294 -20.150 3.439 1.00 0.00 C ATOM 181 OD1 ASN A 14 13.170 -20.459 3.047 1.00 0.00 O ATOM 182 ND2 ASN A 14 14.625 -20.296 4.709 1.00 0.00 N ATOM 0 H ASN A 14 16.691 -17.897 0.835 1.00 0.00 H new ATOM 0 HA ASN A 14 13.850 -18.580 1.347 1.00 0.00 H new ATOM 0 HB2 ASN A 14 15.602 -20.399 1.744 1.00 0.00 H new ATOM 0 HB3 ASN A 14 16.262 -19.384 3.010 1.00 0.00 H new ATOM 0 HD21 ASN A 14 13.946 -20.668 5.373 1.00 0.00 H new ATOM 0 HD22 ASN A 14 15.559 -20.037 5.025 1.00 0.00 H new ATOM 189 N SER A 15 15.308 -16.031 2.277 1.00 0.00 N ATOM 190 CA SER A 15 15.069 -14.763 2.940 1.00 0.00 C ATOM 191 C SER A 15 13.736 -14.189 2.457 1.00 0.00 C ATOM 192 O SER A 15 13.175 -14.643 1.453 1.00 0.00 O ATOM 193 CB SER A 15 16.207 -13.808 2.604 1.00 0.00 C ATOM 194 OG SER A 15 17.369 -14.232 3.277 1.00 0.00 O ATOM 0 H SER A 15 15.969 -15.975 1.502 1.00 0.00 H new ATOM 0 HA SER A 15 15.025 -14.902 4.020 1.00 0.00 H new ATOM 0 HB2 SER A 15 16.379 -13.790 1.528 1.00 0.00 H new ATOM 0 HB3 SER A 15 15.948 -12.792 2.902 1.00 0.00 H new ATOM 0 HG SER A 15 17.856 -14.872 2.717 1.00 0.00 H new ATOM 200 N GLN A 16 13.256 -13.147 3.134 1.00 0.00 N ATOM 201 CA GLN A 16 12.116 -12.354 2.703 1.00 0.00 C ATOM 202 C GLN A 16 12.419 -10.889 2.999 1.00 0.00 C ATOM 203 O GLN A 16 13.125 -10.573 3.959 1.00 0.00 O ATOM 204 CB GLN A 16 10.829 -12.782 3.433 1.00 0.00 C ATOM 205 CG GLN A 16 10.339 -14.188 3.052 1.00 0.00 C ATOM 206 CD GLN A 16 9.084 -14.566 3.838 1.00 0.00 C ATOM 207 OE1 GLN A 16 7.963 -14.513 3.334 1.00 0.00 O ATOM 208 NE2 GLN A 16 9.244 -14.948 5.094 1.00 0.00 N ATOM 0 H GLN A 16 13.660 -12.828 4.014 1.00 0.00 H new ATOM 0 HA GLN A 16 11.953 -12.506 1.636 1.00 0.00 H new ATOM 0 HB2 GLN A 16 11.003 -12.747 4.508 1.00 0.00 H new ATOM 0 HB3 GLN A 16 10.041 -12.061 3.214 1.00 0.00 H new ATOM 0 HG2 GLN A 16 10.127 -14.225 1.983 1.00 0.00 H new ATOM 0 HG3 GLN A 16 11.127 -14.916 3.247 1.00 0.00 H new ATOM 0 HE21 GLN A 16 10.179 -14.988 5.500 1.00 0.00 H new ATOM 0 HE22 GLN A 16 8.432 -15.203 5.657 1.00 0.00 H new ATOM 217 N CYS A 17 11.835 -10.009 2.189 1.00 0.00 N ATOM 218 CA CYS A 17 11.805 -8.574 2.395 1.00 0.00 C ATOM 219 C CYS A 17 10.360 -8.163 2.116 1.00 0.00 C ATOM 220 O CYS A 17 9.865 -8.368 1.003 1.00 0.00 O ATOM 221 CB CYS A 17 12.821 -7.919 1.458 1.00 0.00 C ATOM 222 SG CYS A 17 12.830 -6.110 1.487 1.00 0.00 S ATOM 0 H CYS A 17 11.351 -10.294 1.338 1.00 0.00 H new ATOM 0 HA CYS A 17 12.085 -8.260 3.401 1.00 0.00 H new ATOM 0 HB2 CYS A 17 13.817 -8.277 1.719 1.00 0.00 H new ATOM 0 HB3 CYS A 17 12.620 -8.250 0.439 1.00 0.00 H new ATOM 0 HG CYS A 17 13.728 -5.667 0.658 1.00 0.00 H new ATOM 227 N VAL A 18 9.667 -7.617 3.116 1.00 0.00 N ATOM 228 CA VAL A 18 8.222 -7.382 3.071 1.00 0.00 C ATOM 229 C VAL A 18 7.971 -5.940 3.502 1.00 0.00 C ATOM 230 O VAL A 18 8.378 -5.547 4.598 1.00 0.00 O ATOM 231 CB VAL A 18 7.503 -8.418 3.971 1.00 0.00 C ATOM 232 CG1 VAL A 18 5.977 -8.329 3.845 1.00 0.00 C ATOM 233 CG2 VAL A 18 7.922 -9.866 3.652 1.00 0.00 C ATOM 0 H VAL A 18 10.098 -7.321 3.992 1.00 0.00 H new ATOM 0 HA VAL A 18 7.820 -7.512 2.066 1.00 0.00 H new ATOM 0 HB VAL A 18 7.806 -8.169 4.988 1.00 0.00 H new ATOM 0 HG11 VAL A 18 5.514 -9.073 4.493 1.00 0.00 H new ATOM 0 HG12 VAL A 18 5.645 -7.334 4.141 1.00 0.00 H new ATOM 0 HG13 VAL A 18 5.686 -8.517 2.812 1.00 0.00 H new ATOM 0 HG21 VAL A 18 7.390 -10.552 4.310 1.00 0.00 H new ATOM 0 HG22 VAL A 18 7.678 -10.095 2.615 1.00 0.00 H new ATOM 0 HG23 VAL A 18 8.996 -9.976 3.805 1.00 0.00 H new ATOM 243 N LYS A 19 7.362 -5.140 2.616 1.00 0.00 N ATOM 244 CA LYS A 19 7.181 -3.678 2.702 1.00 0.00 C ATOM 245 C LYS A 19 8.453 -2.877 3.011 1.00 0.00 C ATOM 246 O LYS A 19 8.378 -1.661 3.174 1.00 0.00 O ATOM 247 CB LYS A 19 6.071 -3.321 3.716 1.00 0.00 C ATOM 248 CG LYS A 19 4.764 -4.111 3.592 1.00 0.00 C ATOM 249 CD LYS A 19 4.102 -3.973 2.210 1.00 0.00 C ATOM 250 CE LYS A 19 2.858 -4.858 2.042 1.00 0.00 C ATOM 251 NZ LYS A 19 3.175 -6.309 2.087 1.00 0.00 N ATOM 0 H LYS A 19 6.954 -5.519 1.761 1.00 0.00 H new ATOM 0 HA LYS A 19 6.887 -3.379 1.696 1.00 0.00 H new ATOM 0 HB2 LYS A 19 6.466 -3.467 4.722 1.00 0.00 H new ATOM 0 HB3 LYS A 19 5.842 -2.260 3.614 1.00 0.00 H new ATOM 0 HG2 LYS A 19 4.963 -5.164 3.789 1.00 0.00 H new ATOM 0 HG3 LYS A 19 4.067 -3.770 4.357 1.00 0.00 H new ATOM 0 HD2 LYS A 19 3.823 -2.931 2.051 1.00 0.00 H new ATOM 0 HD3 LYS A 19 4.829 -4.230 1.439 1.00 0.00 H new ATOM 0 HE2 LYS A 19 2.141 -4.623 2.829 1.00 0.00 H new ATOM 0 HE3 LYS A 19 2.377 -4.625 1.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 2.328 -6.857 1.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 3.937 -6.519 1.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 3.482 -6.568 3.046 1.00 0.00 H new ATOM 265 N SER A 20 9.610 -3.524 3.096 1.00 0.00 N ATOM 266 CA SER A 20 10.832 -2.935 3.603 1.00 0.00 C ATOM 267 C SER A 20 11.729 -2.475 2.462 1.00 0.00 C ATOM 268 O SER A 20 11.617 -2.956 1.332 1.00 0.00 O ATOM 269 CB SER A 20 11.505 -3.977 4.498 1.00 0.00 C ATOM 270 OG SER A 20 10.645 -4.303 5.582 1.00 0.00 O ATOM 0 H SER A 20 9.721 -4.496 2.806 1.00 0.00 H new ATOM 0 HA SER A 20 10.621 -2.040 4.189 1.00 0.00 H new ATOM 0 HB2 SER A 20 11.734 -4.873 3.921 1.00 0.00 H new ATOM 0 HB3 SER A 20 12.451 -3.590 4.875 1.00 0.00 H new ATOM 0 HG SER A 20 9.869 -4.799 5.246 1.00 0.00 H new ATOM 276 N THR A 21 12.641 -1.561 2.770 1.00 0.00 N ATOM 277 CA THR A 21 13.581 -0.996 1.817 1.00 0.00 C ATOM 278 C THR A 21 14.945 -1.608 2.109 1.00 0.00 C ATOM 279 O THR A 21 15.304 -1.806 3.273 1.00 0.00 O ATOM 280 CB THR A 21 13.574 0.540 1.938 1.00 0.00 C ATOM 281 OG1 THR A 21 12.241 1.019 1.865 1.00 0.00 O ATOM 282 CG2 THR A 21 14.394 1.228 0.841 1.00 0.00 C ATOM 0 H THR A 21 12.748 -1.185 3.712 1.00 0.00 H new ATOM 0 HA THR A 21 13.310 -1.225 0.787 1.00 0.00 H new ATOM 0 HB THR A 21 14.029 0.779 2.899 1.00 0.00 H new ATOM 0 HG1 THR A 21 12.240 1.996 1.944 1.00 0.00 H new ATOM 0 HG21 THR A 21 14.352 2.308 0.979 1.00 0.00 H new ATOM 0 HG22 THR A 21 15.430 0.895 0.899 1.00 0.00 H new ATOM 0 HG23 THR A 21 13.984 0.970 -0.135 1.00 0.00 H new ATOM 290 N ALA A 22 15.708 -1.896 1.056 1.00 0.00 N ATOM 291 CA ALA A 22 17.034 -2.469 1.160 1.00 0.00 C ATOM 292 C ALA A 22 17.961 -1.579 0.351 1.00 0.00 C ATOM 293 O ALA A 22 17.961 -1.634 -0.882 1.00 0.00 O ATOM 294 CB ALA A 22 17.020 -3.930 0.696 1.00 0.00 C ATOM 0 H ALA A 22 15.410 -1.732 0.094 1.00 0.00 H new ATOM 0 HA ALA A 22 17.391 -2.502 2.190 1.00 0.00 H new ATOM 0 HB1 ALA A 22 18.023 -4.348 0.780 1.00 0.00 H new ATOM 0 HB2 ALA A 22 16.335 -4.503 1.320 1.00 0.00 H new ATOM 0 HB3 ALA A 22 16.692 -3.979 -0.342 1.00 0.00 H new ATOM 300 N THR A 23 18.723 -0.745 1.045 1.00 0.00 N ATOM 301 CA THR A 23 19.567 0.280 0.448 1.00 0.00 C ATOM 302 C THR A 23 21.002 -0.264 0.397 1.00 0.00 C ATOM 303 O THR A 23 21.810 0.003 1.288 1.00 0.00 O ATOM 304 CB THR A 23 19.403 1.620 1.203 1.00 0.00 C ATOM 305 OG1 THR A 23 18.085 1.788 1.696 1.00 0.00 O ATOM 306 CG2 THR A 23 19.741 2.814 0.304 1.00 0.00 C ATOM 0 H THR A 23 18.772 -0.763 2.064 1.00 0.00 H new ATOM 0 HA THR A 23 19.272 0.507 -0.576 1.00 0.00 H new ATOM 0 HB THR A 23 20.099 1.584 2.041 1.00 0.00 H new ATOM 0 HG1 THR A 23 17.954 1.216 2.481 1.00 0.00 H new ATOM 0 HG21 THR A 23 19.615 3.740 0.866 1.00 0.00 H new ATOM 0 HG22 THR A 23 20.774 2.733 -0.036 1.00 0.00 H new ATOM 0 HG23 THR A 23 19.075 2.820 -0.559 1.00 0.00 H new ATOM 314 N ASN A 24 21.289 -1.073 -0.631 1.00 0.00 N ATOM 315 CA ASN A 24 22.503 -1.876 -0.782 1.00 0.00 C ATOM 316 C ASN A 24 22.793 -2.712 0.463 1.00 0.00 C ATOM 317 O ASN A 24 23.647 -2.371 1.278 1.00 0.00 O ATOM 318 CB ASN A 24 23.708 -1.054 -1.271 1.00 0.00 C ATOM 319 CG ASN A 24 24.958 -1.931 -1.383 1.00 0.00 C ATOM 320 OD1 ASN A 24 25.979 -1.662 -0.756 1.00 0.00 O ATOM 321 ND2 ASN A 24 24.917 -2.991 -2.174 1.00 0.00 N ATOM 0 H ASN A 24 20.648 -1.189 -1.416 1.00 0.00 H new ATOM 0 HA ASN A 24 22.312 -2.590 -1.583 1.00 0.00 H new ATOM 0 HB2 ASN A 24 23.482 -0.611 -2.241 1.00 0.00 H new ATOM 0 HB3 ASN A 24 23.896 -0.232 -0.581 1.00 0.00 H new ATOM 0 HD21 ASN A 24 25.737 -3.591 -2.266 1.00 0.00 H new ATOM 0 HD22 ASN A 24 24.065 -3.208 -2.692 1.00 0.00 H new ATOM 328 N CYS A 25 22.060 -3.813 0.612 1.00 0.00 N ATOM 329 CA CYS A 25 22.154 -4.719 1.744 1.00 0.00 C ATOM 330 C CYS A 25 22.274 -6.155 1.251 1.00 0.00 C ATOM 331 O CYS A 25 22.028 -6.446 0.078 1.00 0.00 O ATOM 332 CB CYS A 25 20.922 -4.560 2.635 1.00 0.00 C ATOM 333 SG CYS A 25 20.849 -2.976 3.498 1.00 0.00 S ATOM 0 H CYS A 25 21.364 -4.104 -0.075 1.00 0.00 H new ATOM 0 HA CYS A 25 23.042 -4.477 2.327 1.00 0.00 H new ATOM 0 HB2 CYS A 25 20.026 -4.672 2.024 1.00 0.00 H new ATOM 0 HB3 CYS A 25 20.910 -5.365 3.370 1.00 0.00 H new ATOM 338 N TYR A 26 22.619 -7.055 2.165 1.00 0.00 N ATOM 339 CA TYR A 26 22.895 -8.450 1.877 1.00 0.00 C ATOM 340 C TYR A 26 22.151 -9.238 2.945 1.00 0.00 C ATOM 341 O TYR A 26 22.439 -9.090 4.136 1.00 0.00 O ATOM 342 CB TYR A 26 24.415 -8.679 1.896 1.00 0.00 C ATOM 343 CG TYR A 26 25.194 -7.698 1.030 1.00 0.00 C ATOM 344 CD1 TYR A 26 25.299 -7.903 -0.359 1.00 0.00 C ATOM 345 CD2 TYR A 26 25.755 -6.542 1.611 1.00 0.00 C ATOM 346 CE1 TYR A 26 25.951 -6.954 -1.167 1.00 0.00 C ATOM 347 CE2 TYR A 26 26.414 -5.592 0.810 1.00 0.00 C ATOM 348 CZ TYR A 26 26.513 -5.794 -0.587 1.00 0.00 C ATOM 349 OH TYR A 26 27.146 -4.882 -1.378 1.00 0.00 O ATOM 0 H TYR A 26 22.716 -6.824 3.154 1.00 0.00 H new ATOM 0 HA TYR A 26 22.560 -8.769 0.890 1.00 0.00 H new ATOM 0 HB2 TYR A 26 24.772 -8.605 2.923 1.00 0.00 H new ATOM 0 HB3 TYR A 26 24.625 -9.694 1.558 1.00 0.00 H new ATOM 0 HD1 TYR A 26 24.878 -8.792 -0.805 1.00 0.00 H new ATOM 0 HD2 TYR A 26 25.678 -6.385 2.677 1.00 0.00 H new ATOM 0 HE1 TYR A 26 26.022 -7.112 -2.233 1.00 0.00 H new ATOM 0 HE2 TYR A 26 26.844 -4.710 1.261 1.00 0.00 H new ATOM 0 HH TYR A 26 27.475 -4.142 -0.826 1.00 0.00 H new ATOM 359 N ILE A 27 21.155 -10.018 2.528 1.00 0.00 N ATOM 360 CA ILE A 27 20.203 -10.656 3.423 1.00 0.00 C ATOM 361 C ILE A 27 20.314 -12.167 3.199 1.00 0.00 C ATOM 362 O ILE A 27 19.935 -12.685 2.144 1.00 0.00 O ATOM 363 CB ILE A 27 18.810 -10.019 3.169 1.00 0.00 C ATOM 364 CG1 ILE A 27 18.885 -8.492 3.450 1.00 0.00 C ATOM 365 CG2 ILE A 27 17.705 -10.677 4.001 1.00 0.00 C ATOM 366 CD1 ILE A 27 17.553 -7.738 3.523 1.00 0.00 C ATOM 0 H ILE A 27 20.988 -10.225 1.543 1.00 0.00 H new ATOM 0 HA ILE A 27 20.398 -10.498 4.484 1.00 0.00 H new ATOM 0 HB ILE A 27 18.546 -10.187 2.125 1.00 0.00 H new ATOM 0 HG12 ILE A 27 19.411 -8.345 4.393 1.00 0.00 H new ATOM 0 HG13 ILE A 27 19.494 -8.032 2.671 1.00 0.00 H new ATOM 0 HG21 ILE A 27 16.751 -10.195 3.786 1.00 0.00 H new ATOM 0 HG22 ILE A 27 17.641 -11.736 3.749 1.00 0.00 H new ATOM 0 HG23 ILE A 27 17.935 -10.570 5.061 1.00 0.00 H new ATOM 0 HD11 ILE A 27 17.742 -6.683 3.724 1.00 0.00 H new ATOM 0 HD12 ILE A 27 17.026 -7.838 2.574 1.00 0.00 H new ATOM 0 HD13 ILE A 27 16.942 -8.156 4.323 1.00 0.00 H new ATOM 378 N ASP A 28 20.884 -12.860 4.188 1.00 0.00 N ATOM 379 CA ASP A 28 21.199 -14.285 4.177 1.00 0.00 C ATOM 380 C ASP A 28 20.277 -14.994 5.165 1.00 0.00 C ATOM 381 O ASP A 28 20.318 -14.695 6.356 1.00 0.00 O ATOM 382 CB ASP A 28 22.667 -14.505 4.561 1.00 0.00 C ATOM 383 CG ASP A 28 22.955 -15.998 4.796 1.00 0.00 C ATOM 384 OD1 ASP A 28 22.766 -16.805 3.859 1.00 0.00 O ATOM 385 OD2 ASP A 28 23.402 -16.368 5.904 1.00 0.00 O ATOM 0 H ASP A 28 21.152 -12.414 5.065 1.00 0.00 H new ATOM 0 HA ASP A 28 21.047 -14.692 3.177 1.00 0.00 H new ATOM 0 HB2 ASP A 28 23.315 -14.126 3.771 1.00 0.00 H new ATOM 0 HB3 ASP A 28 22.900 -13.939 5.463 1.00 0.00 H new ATOM 390 N ASN A 29 19.435 -15.908 4.676 1.00 0.00 N ATOM 391 CA ASN A 29 18.382 -16.619 5.416 1.00 0.00 C ATOM 392 C ASN A 29 17.602 -15.747 6.422 1.00 0.00 C ATOM 393 O ASN A 29 17.204 -16.229 7.485 1.00 0.00 O ATOM 394 CB ASN A 29 18.965 -17.884 6.080 1.00 0.00 C ATOM 395 CG ASN A 29 17.862 -18.890 6.407 1.00 0.00 C ATOM 396 OD1 ASN A 29 17.136 -19.315 5.516 1.00 0.00 O ATOM 397 ND2 ASN A 29 17.702 -19.325 7.645 1.00 0.00 N ATOM 0 H ASN A 29 19.470 -16.190 3.696 1.00 0.00 H new ATOM 0 HA ASN A 29 17.633 -16.910 4.679 1.00 0.00 H new ATOM 0 HB2 ASN A 29 19.696 -18.344 5.415 1.00 0.00 H new ATOM 0 HB3 ASN A 29 19.493 -17.609 6.993 1.00 0.00 H new ATOM 0 HD21 ASN A 29 16.977 -20.011 7.855 1.00 0.00 H new ATOM 0 HD22 ASN A 29 18.304 -18.975 8.390 1.00 0.00 H new ATOM 404 N SER A 30 17.389 -14.463 6.121 1.00 0.00 N ATOM 405 CA SER A 30 16.864 -13.486 7.068 1.00 0.00 C ATOM 406 C SER A 30 15.515 -12.932 6.614 1.00 0.00 C ATOM 407 O SER A 30 15.187 -12.914 5.427 1.00 0.00 O ATOM 408 CB SER A 30 17.897 -12.379 7.287 1.00 0.00 C ATOM 409 OG SER A 30 19.058 -12.893 7.899 1.00 0.00 O ATOM 0 H SER A 30 17.580 -14.071 5.199 1.00 0.00 H new ATOM 0 HA SER A 30 16.683 -13.981 8.022 1.00 0.00 H new ATOM 0 HB2 SER A 30 18.156 -11.922 6.332 1.00 0.00 H new ATOM 0 HB3 SER A 30 17.469 -11.594 7.910 1.00 0.00 H new ATOM 0 HG SER A 30 19.481 -13.545 7.302 1.00 0.00 H new ATOM 415 N GLN A 31 14.723 -12.471 7.579 1.00 0.00 N ATOM 416 CA GLN A 31 13.327 -12.113 7.387 1.00 0.00 C ATOM 417 C GLN A 31 13.160 -10.640 7.770 1.00 0.00 C ATOM 418 O GLN A 31 13.041 -10.308 8.955 1.00 0.00 O ATOM 419 CB GLN A 31 12.427 -13.073 8.198 1.00 0.00 C ATOM 420 CG GLN A 31 12.804 -14.571 8.109 1.00 0.00 C ATOM 421 CD GLN A 31 12.842 -15.139 6.686 1.00 0.00 C ATOM 422 OE1 GLN A 31 11.964 -14.864 5.874 1.00 0.00 O ATOM 423 NE2 GLN A 31 13.832 -15.953 6.351 1.00 0.00 N ATOM 0 H GLN A 31 15.045 -12.334 8.537 1.00 0.00 H new ATOM 0 HA GLN A 31 13.019 -12.222 6.347 1.00 0.00 H new ATOM 0 HB2 GLN A 31 12.453 -12.771 9.245 1.00 0.00 H new ATOM 0 HB3 GLN A 31 11.398 -12.954 7.858 1.00 0.00 H new ATOM 0 HG2 GLN A 31 13.782 -14.713 8.569 1.00 0.00 H new ATOM 0 HG3 GLN A 31 12.089 -15.147 8.696 1.00 0.00 H new ATOM 0 HE21 GLN A 31 14.559 -16.178 7.030 1.00 0.00 H new ATOM 0 HE22 GLN A 31 13.867 -16.355 5.414 1.00 0.00 H new ATOM 432 N LEU A 32 13.225 -9.759 6.772 1.00 0.00 N ATOM 433 CA LEU A 32 13.098 -8.313 6.921 1.00 0.00 C ATOM 434 C LEU A 32 11.643 -7.944 6.642 1.00 0.00 C ATOM 435 O LEU A 32 11.144 -8.247 5.557 1.00 0.00 O ATOM 436 CB LEU A 32 14.041 -7.639 5.907 1.00 0.00 C ATOM 437 CG LEU A 32 14.053 -6.105 6.014 1.00 0.00 C ATOM 438 CD1 LEU A 32 14.637 -5.676 7.361 1.00 0.00 C ATOM 439 CD2 LEU A 32 14.863 -5.487 4.869 1.00 0.00 C ATOM 0 H LEU A 32 13.373 -10.045 5.804 1.00 0.00 H new ATOM 0 HA LEU A 32 13.368 -7.982 7.924 1.00 0.00 H new ATOM 0 HB2 LEU A 32 15.053 -8.015 6.057 1.00 0.00 H new ATOM 0 HB3 LEU A 32 13.742 -7.924 4.898 1.00 0.00 H new ATOM 0 HG LEU A 32 13.026 -5.748 5.941 1.00 0.00 H new ATOM 0 HD11 LEU A 32 14.641 -4.588 7.426 1.00 0.00 H new ATOM 0 HD12 LEU A 32 14.030 -6.086 8.168 1.00 0.00 H new ATOM 0 HD13 LEU A 32 15.658 -6.048 7.450 1.00 0.00 H new ATOM 0 HD21 LEU A 32 14.858 -4.401 4.965 1.00 0.00 H new ATOM 0 HD22 LEU A 32 15.890 -5.850 4.912 1.00 0.00 H new ATOM 0 HD23 LEU A 32 14.418 -5.769 3.915 1.00 0.00 H new ATOM 451 N VAL A 33 10.942 -7.319 7.587 1.00 0.00 N ATOM 452 CA VAL A 33 9.498 -7.135 7.477 1.00 0.00 C ATOM 453 C VAL A 33 9.035 -5.779 8.029 1.00 0.00 C ATOM 454 O VAL A 33 9.765 -5.099 8.759 1.00 0.00 O ATOM 455 CB VAL A 33 8.771 -8.325 8.165 1.00 0.00 C ATOM 456 CG1 VAL A 33 9.055 -9.687 7.507 1.00 0.00 C ATOM 457 CG2 VAL A 33 9.111 -8.465 9.656 1.00 0.00 C ATOM 0 H VAL A 33 11.352 -6.932 8.437 1.00 0.00 H new ATOM 0 HA VAL A 33 9.233 -7.125 6.420 1.00 0.00 H new ATOM 0 HB VAL A 33 7.718 -8.071 8.043 1.00 0.00 H new ATOM 0 HG11 VAL A 33 8.514 -10.469 8.041 1.00 0.00 H new ATOM 0 HG12 VAL A 33 8.728 -9.664 6.468 1.00 0.00 H new ATOM 0 HG13 VAL A 33 10.124 -9.894 7.546 1.00 0.00 H new ATOM 0 HG21 VAL A 33 8.570 -9.314 10.074 1.00 0.00 H new ATOM 0 HG22 VAL A 33 10.183 -8.625 9.771 1.00 0.00 H new ATOM 0 HG23 VAL A 33 8.821 -7.555 10.182 1.00 0.00 H new ATOM 467 N ASP A 34 7.777 -5.445 7.716 1.00 0.00 N ATOM 468 CA ASP A 34 7.002 -4.334 8.269 1.00 0.00 C ATOM 469 C ASP A 34 7.720 -2.989 8.146 1.00 0.00 C ATOM 470 O ASP A 34 8.047 -2.350 9.141 1.00 0.00 O ATOM 471 CB ASP A 34 6.572 -4.672 9.704 1.00 0.00 C ATOM 472 CG ASP A 34 5.628 -3.633 10.329 1.00 0.00 C ATOM 473 OD1 ASP A 34 4.830 -2.991 9.607 1.00 0.00 O ATOM 474 OD2 ASP A 34 5.615 -3.548 11.579 1.00 0.00 O ATOM 0 H ASP A 34 7.243 -5.977 7.028 1.00 0.00 H new ATOM 0 HA ASP A 34 6.099 -4.208 7.671 1.00 0.00 H new ATOM 0 HB2 ASP A 34 6.080 -5.644 9.706 1.00 0.00 H new ATOM 0 HB3 ASP A 34 7.461 -4.763 10.328 1.00 0.00 H new ATOM 479 N THR A 35 7.989 -2.566 6.911 1.00 0.00 N ATOM 480 CA THR A 35 8.644 -1.309 6.592 1.00 0.00 C ATOM 481 C THR A 35 9.934 -1.040 7.386 1.00 0.00 C ATOM 482 O THR A 35 10.143 0.044 7.940 1.00 0.00 O ATOM 483 CB THR A 35 7.629 -0.155 6.591 1.00 0.00 C ATOM 484 OG1 THR A 35 6.371 -0.578 6.078 1.00 0.00 O ATOM 485 CG2 THR A 35 8.153 0.970 5.691 1.00 0.00 C ATOM 0 H THR A 35 7.747 -3.110 6.083 1.00 0.00 H new ATOM 0 HA THR A 35 9.022 -1.393 5.573 1.00 0.00 H new ATOM 0 HB THR A 35 7.501 0.186 7.618 1.00 0.00 H new ATOM 0 HG1 THR A 35 5.743 0.174 6.090 1.00 0.00 H new ATOM 0 HG21 THR A 35 7.439 1.793 5.684 1.00 0.00 H new ATOM 0 HG22 THR A 35 9.111 1.324 6.072 1.00 0.00 H new ATOM 0 HG23 THR A 35 8.282 0.594 4.676 1.00 0.00 H new ATOM 493 N SER A 36 10.797 -2.049 7.483 1.00 0.00 N ATOM 494 CA SER A 36 12.144 -1.844 7.964 1.00 0.00 C ATOM 495 C SER A 36 12.894 -1.146 6.822 1.00 0.00 C ATOM 496 O SER A 36 12.480 -1.209 5.658 1.00 0.00 O ATOM 497 CB SER A 36 12.786 -3.189 8.273 1.00 0.00 C ATOM 498 OG SER A 36 12.129 -3.829 9.344 1.00 0.00 O ATOM 0 H SER A 36 10.579 -3.013 7.233 1.00 0.00 H new ATOM 0 HA SER A 36 12.167 -1.248 8.877 1.00 0.00 H new ATOM 0 HB2 SER A 36 12.751 -3.825 7.388 1.00 0.00 H new ATOM 0 HB3 SER A 36 13.838 -3.046 8.521 1.00 0.00 H new ATOM 0 HG SER A 36 11.310 -4.257 9.017 1.00 0.00 H new ATOM 504 N ILE A 37 13.999 -0.477 7.126 1.00 0.00 N ATOM 505 CA ILE A 37 14.752 0.284 6.135 1.00 0.00 C ATOM 506 C ILE A 37 16.234 -0.023 6.377 1.00 0.00 C ATOM 507 O ILE A 37 16.862 0.509 7.296 1.00 0.00 O ATOM 508 CB ILE A 37 14.343 1.783 6.167 1.00 0.00 C ATOM 509 CG1 ILE A 37 12.869 1.969 5.724 1.00 0.00 C ATOM 510 CG2 ILE A 37 15.284 2.637 5.293 1.00 0.00 C ATOM 511 CD1 ILE A 37 12.369 3.419 5.719 1.00 0.00 C ATOM 0 H ILE A 37 14.398 -0.446 8.064 1.00 0.00 H new ATOM 0 HA ILE A 37 14.528 -0.006 5.109 1.00 0.00 H new ATOM 0 HB ILE A 37 14.434 2.126 7.197 1.00 0.00 H new ATOM 0 HG12 ILE A 37 12.753 1.557 4.721 1.00 0.00 H new ATOM 0 HG13 ILE A 37 12.230 1.383 6.385 1.00 0.00 H new ATOM 0 HG21 ILE A 37 14.973 3.681 5.335 1.00 0.00 H new ATOM 0 HG22 ILE A 37 16.305 2.548 5.663 1.00 0.00 H new ATOM 0 HG23 ILE A 37 15.240 2.287 4.262 1.00 0.00 H new ATOM 0 HD11 ILE A 37 11.329 3.444 5.395 1.00 0.00 H new ATOM 0 HD12 ILE A 37 12.446 3.834 6.724 1.00 0.00 H new ATOM 0 HD13 ILE A 37 12.976 4.011 5.034 1.00 0.00 H new ATOM 523 N CYS A 38 16.778 -0.945 5.584 1.00 0.00 N ATOM 524 CA CYS A 38 18.156 -1.378 5.699 1.00 0.00 C ATOM 525 C CYS A 38 19.026 -0.429 4.886 1.00 0.00 C ATOM 526 O CYS A 38 18.615 -0.039 3.787 1.00 0.00 O ATOM 527 CB CYS A 38 18.262 -2.803 5.141 1.00 0.00 C ATOM 528 SG CYS A 38 19.924 -3.505 5.222 1.00 0.00 S ATOM 0 H CYS A 38 16.263 -1.413 4.838 1.00 0.00 H new ATOM 0 HA CYS A 38 18.486 -1.371 6.738 1.00 0.00 H new ATOM 0 HB2 CYS A 38 17.579 -3.449 5.692 1.00 0.00 H new ATOM 0 HB3 CYS A 38 17.930 -2.801 4.103 1.00 0.00 H new ATOM 533 N THR A 39 20.239 -0.135 5.355 1.00 0.00 N ATOM 534 CA THR A 39 21.237 0.577 4.568 1.00 0.00 C ATOM 535 C THR A 39 22.595 -0.051 4.858 1.00 0.00 C ATOM 536 O THR A 39 22.974 -0.194 6.020 1.00 0.00 O ATOM 537 CB THR A 39 21.231 2.090 4.882 1.00 0.00 C ATOM 538 OG1 THR A 39 19.922 2.626 4.858 1.00 0.00 O ATOM 539 CG2 THR A 39 22.105 2.894 3.913 1.00 0.00 C ATOM 0 H THR A 39 20.554 -0.385 6.292 1.00 0.00 H new ATOM 0 HA THR A 39 21.007 0.488 3.506 1.00 0.00 H new ATOM 0 HB THR A 39 21.645 2.179 5.886 1.00 0.00 H new ATOM 0 HG1 THR A 39 19.957 3.584 5.062 1.00 0.00 H new ATOM 0 HG21 THR A 39 22.065 3.950 4.178 1.00 0.00 H new ATOM 0 HG22 THR A 39 23.135 2.543 3.975 1.00 0.00 H new ATOM 0 HG23 THR A 39 21.737 2.761 2.896 1.00 0.00 H new ATOM 547 N ARG A 40 23.339 -0.417 3.812 1.00 0.00 N ATOM 548 CA ARG A 40 24.724 -0.917 3.871 1.00 0.00 C ATOM 549 C ARG A 40 24.938 -2.099 4.831 1.00 0.00 C ATOM 550 O ARG A 40 26.075 -2.343 5.239 1.00 0.00 O ATOM 551 CB ARG A 40 25.687 0.254 4.171 1.00 0.00 C ATOM 552 CG ARG A 40 25.838 1.253 3.012 1.00 0.00 C ATOM 553 CD ARG A 40 26.745 2.428 3.411 1.00 0.00 C ATOM 554 NE ARG A 40 28.082 1.975 3.840 1.00 0.00 N ATOM 555 CZ ARG A 40 29.205 1.925 3.117 1.00 0.00 C ATOM 556 NH1 ARG A 40 29.254 2.381 1.867 1.00 0.00 N ATOM 557 NH2 ARG A 40 30.277 1.398 3.690 1.00 0.00 N ATOM 0 H ARG A 40 22.982 -0.373 2.858 1.00 0.00 H new ATOM 0 HA ARG A 40 24.948 -1.332 2.888 1.00 0.00 H new ATOM 0 HB2 ARG A 40 25.331 0.787 5.052 1.00 0.00 H new ATOM 0 HB3 ARG A 40 26.668 -0.151 4.418 1.00 0.00 H new ATOM 0 HG2 ARG A 40 26.256 0.746 2.142 1.00 0.00 H new ATOM 0 HG3 ARG A 40 24.857 1.629 2.721 1.00 0.00 H new ATOM 0 HD2 ARG A 40 26.847 3.110 2.567 1.00 0.00 H new ATOM 0 HD3 ARG A 40 26.276 2.989 4.219 1.00 0.00 H new ATOM 0 HE ARG A 40 28.159 1.661 4.808 1.00 0.00 H new ATOM 0 HH11 ARG A 40 28.420 2.782 1.437 1.00 0.00 H new ATOM 0 HH12 ARG A 40 30.125 2.330 1.339 1.00 0.00 H new ATOM 0 HH21 ARG A 40 30.224 1.050 4.647 1.00 0.00 H new ATOM 0 HH22 ARG A 40 31.155 1.340 3.174 1.00 0.00 H new ATOM 571 N SER A 41 23.894 -2.838 5.215 1.00 0.00 N ATOM 572 CA SER A 41 24.000 -3.814 6.294 1.00 0.00 C ATOM 573 C SER A 41 23.985 -5.260 5.804 1.00 0.00 C ATOM 574 O SER A 41 23.503 -5.575 4.710 1.00 0.00 O ATOM 575 CB SER A 41 22.900 -3.558 7.325 1.00 0.00 C ATOM 576 OG SER A 41 22.965 -2.221 7.807 1.00 0.00 O ATOM 0 H SER A 41 22.968 -2.777 4.793 1.00 0.00 H new ATOM 0 HA SER A 41 24.974 -3.680 6.764 1.00 0.00 H new ATOM 0 HB2 SER A 41 21.924 -3.741 6.876 1.00 0.00 H new ATOM 0 HB3 SER A 41 23.004 -4.255 8.156 1.00 0.00 H new ATOM 0 HG SER A 41 22.818 -1.598 7.065 1.00 0.00 H new ATOM 582 N GLN A 42 24.506 -6.130 6.666 1.00 0.00 N ATOM 583 CA GLN A 42 24.496 -7.579 6.528 1.00 0.00 C ATOM 584 C GLN A 42 23.474 -8.111 7.523 1.00 0.00 C ATOM 585 O GLN A 42 23.598 -7.829 8.716 1.00 0.00 O ATOM 586 CB GLN A 42 25.897 -8.120 6.874 1.00 0.00 C ATOM 587 CG GLN A 42 26.014 -9.655 6.854 1.00 0.00 C ATOM 588 CD GLN A 42 25.748 -10.270 5.477 1.00 0.00 C ATOM 589 OE1 GLN A 42 26.373 -9.901 4.485 1.00 0.00 O ATOM 590 NE2 GLN A 42 24.833 -11.220 5.379 1.00 0.00 N ATOM 0 H GLN A 42 24.969 -5.825 7.522 1.00 0.00 H new ATOM 0 HA GLN A 42 24.241 -7.886 5.514 1.00 0.00 H new ATOM 0 HB2 GLN A 42 26.617 -7.705 6.169 1.00 0.00 H new ATOM 0 HB3 GLN A 42 26.177 -7.760 7.864 1.00 0.00 H new ATOM 0 HG2 GLN A 42 27.013 -9.940 7.183 1.00 0.00 H new ATOM 0 HG3 GLN A 42 25.310 -10.075 7.573 1.00 0.00 H new ATOM 0 HE21 GLN A 42 24.319 -11.520 6.207 1.00 0.00 H new ATOM 0 HE22 GLN A 42 24.641 -11.652 4.475 1.00 0.00 H new ATOM 599 N TYR A 43 22.519 -8.919 7.070 1.00 0.00 N ATOM 600 CA TYR A 43 21.614 -9.660 7.942 1.00 0.00 C ATOM 601 C TYR A 43 21.861 -11.136 7.656 1.00 0.00 C ATOM 602 O TYR A 43 21.928 -11.521 6.486 1.00 0.00 O ATOM 603 CB TYR A 43 20.145 -9.288 7.671 1.00 0.00 C ATOM 604 CG TYR A 43 19.737 -7.821 7.782 1.00 0.00 C ATOM 605 CD1 TYR A 43 20.456 -6.894 8.564 1.00 0.00 C ATOM 606 CD2 TYR A 43 18.588 -7.384 7.097 1.00 0.00 C ATOM 607 CE1 TYR A 43 20.048 -5.552 8.658 1.00 0.00 C ATOM 608 CE2 TYR A 43 18.171 -6.047 7.190 1.00 0.00 C ATOM 609 CZ TYR A 43 18.882 -5.127 7.988 1.00 0.00 C ATOM 610 OH TYR A 43 18.429 -3.847 8.089 1.00 0.00 O ATOM 0 H TYR A 43 22.351 -9.079 6.077 1.00 0.00 H new ATOM 0 HA TYR A 43 21.801 -9.421 8.989 1.00 0.00 H new ATOM 0 HB2 TYR A 43 19.896 -9.627 6.665 1.00 0.00 H new ATOM 0 HB3 TYR A 43 19.525 -9.859 8.362 1.00 0.00 H new ATOM 0 HD1 TYR A 43 21.335 -7.220 9.100 1.00 0.00 H new ATOM 0 HD2 TYR A 43 18.024 -8.082 6.496 1.00 0.00 H new ATOM 0 HE1 TYR A 43 20.625 -4.849 9.241 1.00 0.00 H new ATOM 0 HE2 TYR A 43 17.298 -5.720 6.645 1.00 0.00 H new ATOM 0 HH TYR A 43 19.191 -3.232 8.129 1.00 0.00 H new ATOM 620 N SER A 44 22.017 -11.945 8.701 1.00 0.00 N ATOM 621 CA SER A 44 22.405 -13.340 8.584 1.00 0.00 C ATOM 622 C SER A 44 21.616 -14.160 9.604 1.00 0.00 C ATOM 623 O SER A 44 21.764 -13.961 10.811 1.00 0.00 O ATOM 624 CB SER A 44 23.915 -13.475 8.818 1.00 0.00 C ATOM 625 OG SER A 44 24.653 -12.648 7.930 1.00 0.00 O ATOM 0 H SER A 44 21.874 -11.642 9.664 1.00 0.00 H new ATOM 0 HA SER A 44 22.182 -13.713 7.584 1.00 0.00 H new ATOM 0 HB2 SER A 44 24.151 -13.207 9.848 1.00 0.00 H new ATOM 0 HB3 SER A 44 24.214 -14.514 8.683 1.00 0.00 H new ATOM 0 HG SER A 44 25.612 -12.755 8.104 1.00 0.00 H new ATOM 631 N ASP A 45 20.794 -15.087 9.113 1.00 0.00 N ATOM 632 CA ASP A 45 19.878 -15.943 9.872 1.00 0.00 C ATOM 633 C ASP A 45 19.085 -15.176 10.947 1.00 0.00 C ATOM 634 O ASP A 45 18.919 -15.646 12.075 1.00 0.00 O ATOM 635 CB ASP A 45 20.639 -17.163 10.414 1.00 0.00 C ATOM 636 CG ASP A 45 19.677 -18.254 10.908 1.00 0.00 C ATOM 637 OD1 ASP A 45 18.766 -18.632 10.138 1.00 0.00 O ATOM 638 OD2 ASP A 45 19.871 -18.795 12.021 1.00 0.00 O ATOM 0 H ASP A 45 20.746 -15.273 8.111 1.00 0.00 H new ATOM 0 HA ASP A 45 19.107 -16.310 9.194 1.00 0.00 H new ATOM 0 HB2 ASP A 45 21.281 -17.569 9.632 1.00 0.00 H new ATOM 0 HB3 ASP A 45 21.290 -16.853 11.232 1.00 0.00 H new ATOM 643 N ALA A 46 18.619 -13.969 10.609 1.00 0.00 N ATOM 644 CA ALA A 46 18.042 -13.003 11.538 1.00 0.00 C ATOM 645 C ALA A 46 16.608 -12.613 11.157 1.00 0.00 C ATOM 646 O ALA A 46 16.131 -12.924 10.065 1.00 0.00 O ATOM 647 CB ALA A 46 18.948 -11.765 11.544 1.00 0.00 C ATOM 0 H ALA A 46 18.636 -13.630 9.647 1.00 0.00 H new ATOM 0 HA ALA A 46 17.984 -13.452 12.529 1.00 0.00 H new ATOM 0 HB1 ALA A 46 18.543 -11.021 12.231 1.00 0.00 H new ATOM 0 HB2 ALA A 46 19.950 -12.049 11.866 1.00 0.00 H new ATOM 0 HB3 ALA A 46 18.995 -11.344 10.540 1.00 0.00 H new ATOM 653 N ASN A 47 15.930 -11.868 12.031 1.00 0.00 N ATOM 654 CA ASN A 47 14.641 -11.243 11.741 1.00 0.00 C ATOM 655 C ASN A 47 14.682 -9.799 12.208 1.00 0.00 C ATOM 656 O ASN A 47 15.229 -9.494 13.267 1.00 0.00 O ATOM 657 CB ASN A 47 13.487 -12.007 12.400 1.00 0.00 C ATOM 658 CG ASN A 47 12.197 -11.191 12.504 1.00 0.00 C ATOM 659 OD1 ASN A 47 11.714 -10.927 13.598 1.00 0.00 O ATOM 660 ND2 ASN A 47 11.611 -10.764 11.395 1.00 0.00 N ATOM 0 H ASN A 47 16.267 -11.680 12.975 1.00 0.00 H new ATOM 0 HA ASN A 47 14.462 -11.272 10.666 1.00 0.00 H new ATOM 0 HB2 ASN A 47 13.289 -12.914 11.829 1.00 0.00 H new ATOM 0 HB3 ASN A 47 13.792 -12.319 13.399 1.00 0.00 H new ATOM 0 HD21 ASN A 47 10.754 -10.213 11.450 1.00 0.00 H new ATOM 0 HD22 ASN A 47 12.017 -10.986 10.486 1.00 0.00 H new ATOM 667 N VAL A 48 14.112 -8.916 11.399 1.00 0.00 N ATOM 668 CA VAL A 48 14.163 -7.476 11.594 1.00 0.00 C ATOM 669 C VAL A 48 12.768 -6.941 11.263 1.00 0.00 C ATOM 670 O VAL A 48 12.240 -7.254 10.193 1.00 0.00 O ATOM 671 CB VAL A 48 15.279 -6.889 10.700 1.00 0.00 C ATOM 672 CG1 VAL A 48 15.391 -5.367 10.854 1.00 0.00 C ATOM 673 CG2 VAL A 48 16.669 -7.494 10.972 1.00 0.00 C ATOM 0 H VAL A 48 13.588 -9.190 10.568 1.00 0.00 H new ATOM 0 HA VAL A 48 14.410 -7.189 12.616 1.00 0.00 H new ATOM 0 HB VAL A 48 14.978 -7.150 9.685 1.00 0.00 H new ATOM 0 HG11 VAL A 48 16.187 -4.994 10.209 1.00 0.00 H new ATOM 0 HG12 VAL A 48 14.446 -4.902 10.571 1.00 0.00 H new ATOM 0 HG13 VAL A 48 15.620 -5.122 11.891 1.00 0.00 H new ATOM 0 HG21 VAL A 48 17.402 -7.035 10.308 1.00 0.00 H new ATOM 0 HG22 VAL A 48 16.951 -7.307 12.008 1.00 0.00 H new ATOM 0 HG23 VAL A 48 16.640 -8.569 10.792 1.00 0.00 H new ATOM 683 N LYS A 49 12.164 -6.163 12.169 1.00 0.00 N ATOM 684 CA LYS A 49 10.790 -5.677 12.038 1.00 0.00 C ATOM 685 C LYS A 49 10.763 -4.186 12.334 1.00 0.00 C ATOM 686 O LYS A 49 11.231 -3.763 13.396 1.00 0.00 O ATOM 687 CB LYS A 49 9.864 -6.452 12.995 1.00 0.00 C ATOM 688 CG LYS A 49 8.380 -6.074 12.820 1.00 0.00 C ATOM 689 CD LYS A 49 7.471 -6.846 13.789 1.00 0.00 C ATOM 690 CE LYS A 49 5.972 -6.688 13.479 1.00 0.00 C ATOM 691 NZ LYS A 49 5.455 -5.313 13.698 1.00 0.00 N ATOM 0 H LYS A 49 12.624 -5.851 13.024 1.00 0.00 H new ATOM 0 HA LYS A 49 10.431 -5.840 11.022 1.00 0.00 H new ATOM 0 HB2 LYS A 49 9.985 -7.522 12.825 1.00 0.00 H new ATOM 0 HB3 LYS A 49 10.166 -6.257 14.024 1.00 0.00 H new ATOM 0 HG2 LYS A 49 8.257 -5.003 12.983 1.00 0.00 H new ATOM 0 HG3 LYS A 49 8.073 -6.278 11.794 1.00 0.00 H new ATOM 0 HD2 LYS A 49 7.732 -7.904 13.755 1.00 0.00 H new ATOM 0 HD3 LYS A 49 7.662 -6.503 14.806 1.00 0.00 H new ATOM 0 HE2 LYS A 49 5.793 -6.972 12.442 1.00 0.00 H new ATOM 0 HE3 LYS A 49 5.407 -7.382 14.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 4.467 -5.361 14.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 6.032 -4.836 14.420 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 5.503 -4.778 12.807 1.00 0.00 H new ATOM 705 N LYS A 50 10.184 -3.412 11.414 1.00 0.00 N ATOM 706 CA LYS A 50 10.093 -1.954 11.428 1.00 0.00 C ATOM 707 C LYS A 50 11.323 -1.292 12.057 1.00 0.00 C ATOM 708 O LYS A 50 11.198 -0.500 12.991 1.00 0.00 O ATOM 709 CB LYS A 50 8.758 -1.549 12.083 1.00 0.00 C ATOM 710 CG LYS A 50 8.324 -0.122 11.715 1.00 0.00 C ATOM 711 CD LYS A 50 6.939 0.172 12.305 1.00 0.00 C ATOM 712 CE LYS A 50 6.419 1.570 11.938 1.00 0.00 C ATOM 713 NZ LYS A 50 7.194 2.669 12.573 1.00 0.00 N ATOM 0 H LYS A 50 9.739 -3.813 10.589 1.00 0.00 H new ATOM 0 HA LYS A 50 10.094 -1.579 10.405 1.00 0.00 H new ATOM 0 HB2 LYS A 50 7.981 -2.250 11.778 1.00 0.00 H new ATOM 0 HB3 LYS A 50 8.851 -1.628 13.166 1.00 0.00 H new ATOM 0 HG2 LYS A 50 9.050 0.597 12.094 1.00 0.00 H new ATOM 0 HG3 LYS A 50 8.299 -0.009 10.631 1.00 0.00 H new ATOM 0 HD2 LYS A 50 6.232 -0.578 11.951 1.00 0.00 H new ATOM 0 HD3 LYS A 50 6.985 0.080 13.390 1.00 0.00 H new ATOM 0 HE2 LYS A 50 6.452 1.690 10.855 1.00 0.00 H new ATOM 0 HE3 LYS A 50 5.374 1.652 12.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 6.795 3.586 12.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 7.143 2.577 13.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 8.187 2.614 12.269 1.00 0.00 H new ATOM 727 N SER A 51 12.516 -1.647 11.588 1.00 0.00 N ATOM 728 CA SER A 51 13.774 -1.206 12.175 1.00 0.00 C ATOM 729 C SER A 51 14.638 -0.614 11.071 1.00 0.00 C ATOM 730 O SER A 51 14.401 -0.874 9.891 1.00 0.00 O ATOM 731 CB SER A 51 14.449 -2.391 12.865 1.00 0.00 C ATOM 732 OG SER A 51 13.693 -2.813 13.986 1.00 0.00 O ATOM 0 H SER A 51 12.636 -2.257 10.779 1.00 0.00 H new ATOM 0 HA SER A 51 13.611 -0.437 12.930 1.00 0.00 H new ATOM 0 HB2 SER A 51 14.556 -3.216 12.161 1.00 0.00 H new ATOM 0 HB3 SER A 51 15.453 -2.110 13.182 1.00 0.00 H new ATOM 0 HG SER A 51 12.866 -3.242 13.680 1.00 0.00 H new ATOM 738 N VAL A 52 15.627 0.197 11.434 1.00 0.00 N ATOM 739 CA VAL A 52 16.388 0.994 10.484 1.00 0.00 C ATOM 740 C VAL A 52 17.865 0.724 10.742 1.00 0.00 C ATOM 741 O VAL A 52 18.285 0.698 11.901 1.00 0.00 O ATOM 742 CB VAL A 52 16.009 2.487 10.618 1.00 0.00 C ATOM 743 CG1 VAL A 52 16.702 3.342 9.546 1.00 0.00 C ATOM 744 CG2 VAL A 52 14.489 2.710 10.499 1.00 0.00 C ATOM 0 H VAL A 52 15.923 0.319 12.402 1.00 0.00 H new ATOM 0 HA VAL A 52 16.160 0.721 9.454 1.00 0.00 H new ATOM 0 HB VAL A 52 16.343 2.791 11.610 1.00 0.00 H new ATOM 0 HG11 VAL A 52 16.413 4.386 9.670 1.00 0.00 H new ATOM 0 HG12 VAL A 52 17.783 3.250 9.650 1.00 0.00 H new ATOM 0 HG13 VAL A 52 16.402 2.998 8.556 1.00 0.00 H new ATOM 0 HG21 VAL A 52 14.268 3.773 10.599 1.00 0.00 H new ATOM 0 HG22 VAL A 52 14.145 2.358 9.527 1.00 0.00 H new ATOM 0 HG23 VAL A 52 13.977 2.157 11.287 1.00 0.00 H new ATOM 754 N THR A 53 18.665 0.529 9.695 1.00 0.00 N ATOM 755 CA THR A 53 20.087 0.256 9.872 1.00 0.00 C ATOM 756 C THR A 53 20.914 1.115 8.928 1.00 0.00 C ATOM 757 O THR A 53 20.445 1.485 7.850 1.00 0.00 O ATOM 758 CB THR A 53 20.405 -1.246 9.732 1.00 0.00 C ATOM 759 OG1 THR A 53 20.297 -1.718 8.406 1.00 0.00 O ATOM 760 CG2 THR A 53 19.478 -2.128 10.560 1.00 0.00 C ATOM 0 H THR A 53 18.355 0.555 8.724 1.00 0.00 H new ATOM 0 HA THR A 53 20.362 0.528 10.891 1.00 0.00 H new ATOM 0 HB THR A 53 21.434 -1.317 10.085 1.00 0.00 H new ATOM 0 HG1 THR A 53 21.191 -1.800 8.014 1.00 0.00 H new ATOM 0 HG21 THR A 53 19.751 -3.174 10.421 1.00 0.00 H new ATOM 0 HG22 THR A 53 19.572 -1.866 11.614 1.00 0.00 H new ATOM 0 HG23 THR A 53 18.448 -1.976 10.238 1.00 0.00 H new ATOM 768 N THR A 54 22.144 1.415 9.340 1.00 0.00 N ATOM 769 CA THR A 54 23.167 2.032 8.523 1.00 0.00 C ATOM 770 C THR A 54 24.472 1.313 8.864 1.00 0.00 C ATOM 771 O THR A 54 24.969 1.436 9.985 1.00 0.00 O ATOM 772 CB THR A 54 23.242 3.548 8.795 1.00 0.00 C ATOM 773 OG1 THR A 54 21.972 4.164 8.674 1.00 0.00 O ATOM 774 CG2 THR A 54 24.188 4.247 7.811 1.00 0.00 C ATOM 0 H THR A 54 22.460 1.224 10.291 1.00 0.00 H new ATOM 0 HA THR A 54 22.951 1.937 7.459 1.00 0.00 H new ATOM 0 HB THR A 54 23.612 3.652 9.815 1.00 0.00 H new ATOM 0 HG1 THR A 54 22.055 5.124 8.854 1.00 0.00 H new ATOM 0 HG21 THR A 54 24.218 5.314 8.031 1.00 0.00 H new ATOM 0 HG22 THR A 54 25.190 3.828 7.909 1.00 0.00 H new ATOM 0 HG23 THR A 54 23.830 4.096 6.793 1.00 0.00 H new ATOM 782 N ASP A 55 25.010 0.577 7.888 1.00 0.00 N ATOM 783 CA ASP A 55 26.287 -0.139 7.943 1.00 0.00 C ATOM 784 C ASP A 55 26.381 -0.998 9.211 1.00 0.00 C ATOM 785 O ASP A 55 27.154 -0.718 10.130 1.00 0.00 O ATOM 786 CB ASP A 55 27.455 0.836 7.720 1.00 0.00 C ATOM 787 CG ASP A 55 28.705 0.133 7.169 1.00 0.00 C ATOM 788 OD1 ASP A 55 29.200 -0.849 7.764 1.00 0.00 O ATOM 789 OD2 ASP A 55 29.197 0.585 6.109 1.00 0.00 O ATOM 0 H ASP A 55 24.541 0.458 6.990 1.00 0.00 H new ATOM 0 HA ASP A 55 26.352 -0.855 7.124 1.00 0.00 H new ATOM 0 HB2 ASP A 55 27.145 1.618 7.026 1.00 0.00 H new ATOM 0 HB3 ASP A 55 27.702 1.325 8.662 1.00 0.00 H new ATOM 794 N CYS A 56 25.517 -2.015 9.290 1.00 0.00 N ATOM 795 CA CYS A 56 25.286 -2.814 10.485 1.00 0.00 C ATOM 796 C CYS A 56 25.514 -4.293 10.166 1.00 0.00 C ATOM 797 O CYS A 56 25.503 -4.688 8.996 1.00 0.00 O ATOM 798 CB CYS A 56 23.843 -2.552 10.948 1.00 0.00 C ATOM 799 SG CYS A 56 23.413 -3.132 12.608 1.00 0.00 S ATOM 0 H CYS A 56 24.945 -2.309 8.498 1.00 0.00 H new ATOM 0 HA CYS A 56 25.977 -2.543 11.283 1.00 0.00 H new ATOM 0 HB2 CYS A 56 23.659 -1.479 10.903 1.00 0.00 H new ATOM 0 HB3 CYS A 56 23.165 -3.022 10.236 1.00 0.00 H new ATOM 804 N ASN A 57 25.658 -5.133 11.192 1.00 0.00 N ATOM 805 CA ASN A 57 25.672 -6.582 11.047 1.00 0.00 C ATOM 806 C ASN A 57 24.638 -7.114 12.016 1.00 0.00 C ATOM 807 O ASN A 57 24.705 -6.774 13.193 1.00 0.00 O ATOM 808 CB ASN A 57 27.053 -7.163 11.382 1.00 0.00 C ATOM 809 CG ASN A 57 27.021 -8.691 11.362 1.00 0.00 C ATOM 810 OD1 ASN A 57 27.298 -9.306 10.338 1.00 0.00 O ATOM 811 ND2 ASN A 57 26.668 -9.345 12.461 1.00 0.00 N ATOM 0 H ASN A 57 25.769 -4.819 12.156 1.00 0.00 H new ATOM 0 HA ASN A 57 25.450 -6.867 10.019 1.00 0.00 H new ATOM 0 HB2 ASN A 57 27.788 -6.801 10.663 1.00 0.00 H new ATOM 0 HB3 ASN A 57 27.370 -6.815 12.365 1.00 0.00 H new ATOM 0 HD21 ASN A 57 26.626 -10.364 12.457 1.00 0.00 H new ATOM 0 HD22 ASN A 57 26.439 -8.829 13.310 1.00 0.00 H new ATOM 818 N ILE A 58 23.729 -7.964 11.558 1.00 0.00 N ATOM 819 CA ILE A 58 22.698 -8.563 12.394 1.00 0.00 C ATOM 820 C ILE A 58 22.877 -10.067 12.211 1.00 0.00 C ATOM 821 O ILE A 58 22.454 -10.600 11.184 1.00 0.00 O ATOM 822 CB ILE A 58 21.285 -8.072 11.994 1.00 0.00 C ATOM 823 CG1 ILE A 58 21.143 -6.539 11.869 1.00 0.00 C ATOM 824 CG2 ILE A 58 20.234 -8.626 12.967 1.00 0.00 C ATOM 825 CD1 ILE A 58 21.227 -5.735 13.165 1.00 0.00 C ATOM 0 H ILE A 58 23.687 -8.261 10.583 1.00 0.00 H new ATOM 0 HA ILE A 58 22.794 -8.280 13.442 1.00 0.00 H new ATOM 0 HB ILE A 58 21.116 -8.461 10.990 1.00 0.00 H new ATOM 0 HG12 ILE A 58 21.920 -6.179 11.194 1.00 0.00 H new ATOM 0 HG13 ILE A 58 20.185 -6.323 11.396 1.00 0.00 H new ATOM 0 HG21 ILE A 58 19.245 -8.273 12.674 1.00 0.00 H new ATOM 0 HG22 ILE A 58 20.253 -9.716 12.941 1.00 0.00 H new ATOM 0 HG23 ILE A 58 20.457 -8.283 13.977 1.00 0.00 H new ATOM 0 HD11 ILE A 58 21.113 -4.674 12.943 1.00 0.00 H new ATOM 0 HD12 ILE A 58 20.433 -6.052 13.842 1.00 0.00 H new ATOM 0 HD13 ILE A 58 22.195 -5.905 13.637 1.00 0.00 H new ATOM 837 N ASP A 59 23.528 -10.756 13.153 1.00 0.00 N ATOM 838 CA ASP A 59 23.769 -12.191 13.026 1.00 0.00 C ATOM 839 C ASP A 59 22.902 -12.911 14.046 1.00 0.00 C ATOM 840 O ASP A 59 22.925 -12.550 15.220 1.00 0.00 O ATOM 841 CB ASP A 59 25.255 -12.485 13.243 1.00 0.00 C ATOM 842 CG ASP A 59 25.503 -13.989 13.369 1.00 0.00 C ATOM 843 OD1 ASP A 59 25.449 -14.706 12.345 1.00 0.00 O ATOM 844 OD2 ASP A 59 25.768 -14.459 14.494 1.00 0.00 O ATOM 0 H ASP A 59 23.896 -10.341 14.009 1.00 0.00 H new ATOM 0 HA ASP A 59 23.508 -12.542 12.028 1.00 0.00 H new ATOM 0 HB2 ASP A 59 25.834 -12.086 12.410 1.00 0.00 H new ATOM 0 HB3 ASP A 59 25.602 -11.979 14.144 1.00 0.00 H new ATOM 849 N LYS A 60 22.123 -13.905 13.614 1.00 0.00 N ATOM 850 CA LYS A 60 21.307 -14.788 14.460 1.00 0.00 C ATOM 851 C LYS A 60 20.405 -14.033 15.453 1.00 0.00 C ATOM 852 O LYS A 60 20.074 -14.573 16.510 1.00 0.00 O ATOM 853 CB LYS A 60 22.216 -15.828 15.150 1.00 0.00 C ATOM 854 CG LYS A 60 23.003 -16.689 14.148 1.00 0.00 C ATOM 855 CD LYS A 60 24.010 -17.602 14.862 1.00 0.00 C ATOM 856 CE LYS A 60 25.010 -18.214 13.868 1.00 0.00 C ATOM 857 NZ LYS A 60 26.026 -17.232 13.411 1.00 0.00 N ATOM 0 H LYS A 60 22.038 -14.129 12.622 1.00 0.00 H new ATOM 0 HA LYS A 60 20.606 -15.313 13.811 1.00 0.00 H new ATOM 0 HB2 LYS A 60 22.916 -15.313 15.808 1.00 0.00 H new ATOM 0 HB3 LYS A 60 21.606 -16.476 15.779 1.00 0.00 H new ATOM 0 HG2 LYS A 60 22.310 -17.295 13.565 1.00 0.00 H new ATOM 0 HG3 LYS A 60 23.530 -16.043 13.446 1.00 0.00 H new ATOM 0 HD2 LYS A 60 24.549 -17.032 15.619 1.00 0.00 H new ATOM 0 HD3 LYS A 60 23.477 -18.398 15.382 1.00 0.00 H new ATOM 0 HE2 LYS A 60 25.512 -19.061 14.336 1.00 0.00 H new ATOM 0 HE3 LYS A 60 24.469 -18.602 13.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 26.677 -17.692 12.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 25.552 -16.435 12.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 26.562 -16.880 14.230 1.00 0.00 H new ATOM 871 N SER A 61 20.018 -12.794 15.142 1.00 0.00 N ATOM 872 CA SER A 61 19.350 -11.900 16.081 1.00 0.00 C ATOM 873 C SER A 61 17.913 -11.603 15.647 1.00 0.00 C ATOM 874 O SER A 61 17.518 -11.873 14.511 1.00 0.00 O ATOM 875 CB SER A 61 20.174 -10.613 16.228 1.00 0.00 C ATOM 876 OG SER A 61 21.467 -10.888 16.739 1.00 0.00 O ATOM 0 H SER A 61 20.163 -12.382 14.220 1.00 0.00 H new ATOM 0 HA SER A 61 19.285 -12.390 17.053 1.00 0.00 H new ATOM 0 HB2 SER A 61 20.260 -10.121 15.259 1.00 0.00 H new ATOM 0 HB3 SER A 61 19.657 -9.921 16.893 1.00 0.00 H new ATOM 0 HG SER A 61 22.022 -11.280 16.032 1.00 0.00 H new ATOM 882 N GLN A 62 17.138 -11.020 16.559 1.00 0.00 N ATOM 883 CA GLN A 62 15.757 -10.609 16.370 1.00 0.00 C ATOM 884 C GLN A 62 15.698 -9.138 16.777 1.00 0.00 C ATOM 885 O GLN A 62 16.147 -8.782 17.869 1.00 0.00 O ATOM 886 CB GLN A 62 14.832 -11.487 17.222 1.00 0.00 C ATOM 887 CG GLN A 62 14.694 -12.909 16.657 1.00 0.00 C ATOM 888 CD GLN A 62 13.941 -13.835 17.615 1.00 0.00 C ATOM 889 OE1 GLN A 62 14.472 -14.845 18.070 1.00 0.00 O ATOM 890 NE2 GLN A 62 12.701 -13.523 17.958 1.00 0.00 N ATOM 0 H GLN A 62 17.479 -10.813 17.498 1.00 0.00 H new ATOM 0 HA GLN A 62 15.423 -10.726 15.339 1.00 0.00 H new ATOM 0 HB2 GLN A 62 15.220 -11.539 18.239 1.00 0.00 H new ATOM 0 HB3 GLN A 62 13.847 -11.024 17.279 1.00 0.00 H new ATOM 0 HG2 GLN A 62 14.169 -12.871 15.702 1.00 0.00 H new ATOM 0 HG3 GLN A 62 15.685 -13.319 16.460 1.00 0.00 H new ATOM 0 HE21 GLN A 62 12.263 -12.684 17.579 1.00 0.00 H new ATOM 0 HE22 GLN A 62 12.184 -14.122 18.602 1.00 0.00 H new ATOM 899 N VAL A 63 15.169 -8.289 15.903 1.00 0.00 N ATOM 900 CA VAL A 63 15.243 -6.840 16.027 1.00 0.00 C ATOM 901 C VAL A 63 13.855 -6.260 15.765 1.00 0.00 C ATOM 902 O VAL A 63 13.229 -6.618 14.764 1.00 0.00 O ATOM 903 CB VAL A 63 16.281 -6.331 15.000 1.00 0.00 C ATOM 904 CG1 VAL A 63 16.477 -4.816 15.083 1.00 0.00 C ATOM 905 CG2 VAL A 63 17.653 -7.015 15.136 1.00 0.00 C ATOM 0 H VAL A 63 14.666 -8.597 15.071 1.00 0.00 H new ATOM 0 HA VAL A 63 15.555 -6.530 17.024 1.00 0.00 H new ATOM 0 HB VAL A 63 15.862 -6.592 14.028 1.00 0.00 H new ATOM 0 HG11 VAL A 63 17.215 -4.503 14.344 1.00 0.00 H new ATOM 0 HG12 VAL A 63 15.529 -4.315 14.884 1.00 0.00 H new ATOM 0 HG13 VAL A 63 16.827 -4.548 16.080 1.00 0.00 H new ATOM 0 HG21 VAL A 63 18.336 -6.613 14.387 1.00 0.00 H new ATOM 0 HG22 VAL A 63 18.056 -6.828 16.131 1.00 0.00 H new ATOM 0 HG23 VAL A 63 17.541 -8.089 14.986 1.00 0.00 H new ATOM 915 N TYR A 64 13.383 -5.357 16.629 1.00 0.00 N ATOM 916 CA TYR A 64 12.045 -4.776 16.532 1.00 0.00 C ATOM 917 C TYR A 64 12.121 -3.287 16.851 1.00 0.00 C ATOM 918 O TYR A 64 12.695 -2.932 17.881 1.00 0.00 O ATOM 919 CB TYR A 64 11.106 -5.469 17.537 1.00 0.00 C ATOM 920 CG TYR A 64 11.085 -6.987 17.464 1.00 0.00 C ATOM 921 CD1 TYR A 64 12.002 -7.742 18.220 1.00 0.00 C ATOM 922 CD2 TYR A 64 10.165 -7.644 16.629 1.00 0.00 C ATOM 923 CE1 TYR A 64 12.016 -9.142 18.123 1.00 0.00 C ATOM 924 CE2 TYR A 64 10.169 -9.046 16.525 1.00 0.00 C ATOM 925 CZ TYR A 64 11.102 -9.804 17.271 1.00 0.00 C ATOM 926 OH TYR A 64 11.122 -11.164 17.175 1.00 0.00 O ATOM 0 H TYR A 64 13.924 -5.008 17.420 1.00 0.00 H new ATOM 0 HA TYR A 64 11.658 -4.917 15.523 1.00 0.00 H new ATOM 0 HB2 TYR A 64 11.398 -5.174 18.545 1.00 0.00 H new ATOM 0 HB3 TYR A 64 10.093 -5.100 17.377 1.00 0.00 H new ATOM 0 HD1 TYR A 64 12.698 -7.242 18.877 1.00 0.00 H new ATOM 0 HD2 TYR A 64 9.449 -7.067 16.063 1.00 0.00 H new ATOM 0 HE1 TYR A 64 12.726 -9.715 18.700 1.00 0.00 H new ATOM 0 HE2 TYR A 64 9.462 -9.543 15.877 1.00 0.00 H new ATOM 0 HH TYR A 64 10.429 -11.458 16.548 1.00 0.00 H new ATOM 936 N LEU A 65 11.508 -2.410 16.042 1.00 0.00 N ATOM 937 CA LEU A 65 11.409 -0.965 16.319 1.00 0.00 C ATOM 938 C LEU A 65 12.757 -0.330 16.729 1.00 0.00 C ATOM 939 O LEU A 65 12.786 0.603 17.535 1.00 0.00 O ATOM 940 CB LEU A 65 10.305 -0.719 17.375 1.00 0.00 C ATOM 941 CG LEU A 65 8.875 -1.050 16.910 1.00 0.00 C ATOM 942 CD1 LEU A 65 7.932 -1.085 18.119 1.00 0.00 C ATOM 943 CD2 LEU A 65 8.358 -0.017 15.906 1.00 0.00 C ATOM 0 H LEU A 65 11.062 -2.685 15.167 1.00 0.00 H new ATOM 0 HA LEU A 65 11.133 -0.464 15.391 1.00 0.00 H new ATOM 0 HB2 LEU A 65 10.530 -1.314 18.260 1.00 0.00 H new ATOM 0 HB3 LEU A 65 10.339 0.328 17.678 1.00 0.00 H new ATOM 0 HG LEU A 65 8.902 -2.024 16.422 1.00 0.00 H new ATOM 0 HD11 LEU A 65 6.921 -1.320 17.785 1.00 0.00 H new ATOM 0 HD12 LEU A 65 8.269 -1.848 18.821 1.00 0.00 H new ATOM 0 HD13 LEU A 65 7.935 -0.112 18.611 1.00 0.00 H new ATOM 0 HD21 LEU A 65 7.346 -0.282 15.599 1.00 0.00 H new ATOM 0 HD22 LEU A 65 8.350 0.969 16.370 1.00 0.00 H new ATOM 0 HD23 LEU A 65 9.009 -0.001 15.032 1.00 0.00 H new ATOM 955 N THR A 66 13.878 -0.827 16.203 1.00 0.00 N ATOM 956 CA THR A 66 15.222 -0.487 16.663 1.00 0.00 C ATOM 957 C THR A 66 16.012 0.213 15.548 1.00 0.00 C ATOM 958 O THR A 66 15.671 0.111 14.367 1.00 0.00 O ATOM 959 CB THR A 66 15.850 -1.791 17.202 1.00 0.00 C ATOM 960 OG1 THR A 66 15.211 -2.124 18.422 1.00 0.00 O ATOM 961 CG2 THR A 66 17.358 -1.799 17.466 1.00 0.00 C ATOM 0 H THR A 66 13.875 -1.491 15.429 1.00 0.00 H new ATOM 0 HA THR A 66 15.221 0.241 17.474 1.00 0.00 H new ATOM 0 HB THR A 66 15.699 -2.505 16.393 1.00 0.00 H new ATOM 0 HG1 THR A 66 14.388 -2.623 18.235 1.00 0.00 H new ATOM 0 HG21 THR A 66 17.657 -2.778 17.841 1.00 0.00 H new ATOM 0 HG22 THR A 66 17.891 -1.587 16.539 1.00 0.00 H new ATOM 0 HG23 THR A 66 17.602 -1.037 18.207 1.00 0.00 H new ATOM 969 N THR A 67 17.071 0.934 15.920 1.00 0.00 N ATOM 970 CA THR A 67 17.912 1.690 15.003 1.00 0.00 C ATOM 971 C THR A 67 19.372 1.283 15.234 1.00 0.00 C ATOM 972 O THR A 67 19.823 1.255 16.380 1.00 0.00 O ATOM 973 CB THR A 67 17.674 3.197 15.215 1.00 0.00 C ATOM 974 OG1 THR A 67 16.293 3.506 15.135 1.00 0.00 O ATOM 975 CG2 THR A 67 18.402 4.047 14.166 1.00 0.00 C ATOM 0 H THR A 67 17.371 1.007 16.892 1.00 0.00 H new ATOM 0 HA THR A 67 17.663 1.471 13.965 1.00 0.00 H new ATOM 0 HB THR A 67 18.064 3.430 16.206 1.00 0.00 H new ATOM 0 HG1 THR A 67 16.164 4.467 15.274 1.00 0.00 H new ATOM 0 HG21 THR A 67 18.206 5.103 14.354 1.00 0.00 H new ATOM 0 HG22 THR A 67 19.474 3.860 14.227 1.00 0.00 H new ATOM 0 HG23 THR A 67 18.043 3.783 13.171 1.00 0.00 H new ATOM 983 N CYS A 68 20.116 0.997 14.162 1.00 0.00 N ATOM 984 CA CYS A 68 21.516 0.590 14.226 1.00 0.00 C ATOM 985 C CYS A 68 22.355 1.517 13.354 1.00 0.00 C ATOM 986 O CYS A 68 22.024 1.717 12.184 1.00 0.00 O ATOM 987 CB CYS A 68 21.670 -0.855 13.725 1.00 0.00 C ATOM 988 SG CYS A 68 23.385 -1.447 13.743 1.00 0.00 S ATOM 0 H CYS A 68 19.753 1.044 13.210 1.00 0.00 H new ATOM 0 HA CYS A 68 21.855 0.648 15.260 1.00 0.00 H new ATOM 0 HB2 CYS A 68 21.060 -1.513 14.344 1.00 0.00 H new ATOM 0 HB3 CYS A 68 21.281 -0.923 12.709 1.00 0.00 H new ATOM 993 N THR A 69 23.472 2.009 13.888 1.00 0.00 N ATOM 994 CA THR A 69 24.451 2.795 13.152 1.00 0.00 C ATOM 995 C THR A 69 25.831 2.224 13.478 1.00 0.00 C ATOM 996 O THR A 69 26.244 2.227 14.641 1.00 0.00 O ATOM 997 CB THR A 69 24.325 4.281 13.547 1.00 0.00 C ATOM 998 OG1 THR A 69 22.981 4.724 13.452 1.00 0.00 O ATOM 999 CG2 THR A 69 25.177 5.183 12.649 1.00 0.00 C ATOM 0 H THR A 69 23.724 1.867 14.866 1.00 0.00 H new ATOM 0 HA THR A 69 24.287 2.740 12.076 1.00 0.00 H new ATOM 0 HB THR A 69 24.676 4.351 14.577 1.00 0.00 H new ATOM 0 HG1 THR A 69 22.929 5.668 13.709 1.00 0.00 H new ATOM 0 HG21 THR A 69 25.060 6.221 12.960 1.00 0.00 H new ATOM 0 HG22 THR A 69 26.225 4.895 12.733 1.00 0.00 H new ATOM 0 HG23 THR A 69 24.853 5.076 11.614 1.00 0.00 H new ATOM 1007 N GLY A 70 26.544 1.717 12.470 1.00 0.00 N ATOM 1008 CA GLY A 70 27.936 1.293 12.608 1.00 0.00 C ATOM 1009 C GLY A 70 28.145 0.229 13.689 1.00 0.00 C ATOM 1010 O GLY A 70 29.190 0.240 14.342 1.00 0.00 O ATOM 0 H GLY A 70 26.168 1.589 11.530 1.00 0.00 H new ATOM 0 HA2 GLY A 70 28.285 0.902 11.652 1.00 0.00 H new ATOM 0 HA3 GLY A 70 28.551 2.162 12.841 1.00 0.00 H new ATOM 1014 N SER A 71 27.159 -0.643 13.922 1.00 0.00 N ATOM 1015 CA SER A 71 27.142 -1.569 15.050 1.00 0.00 C ATOM 1016 C SER A 71 26.903 -3.007 14.580 1.00 0.00 C ATOM 1017 O SER A 71 26.618 -3.259 13.407 1.00 0.00 O ATOM 1018 CB SER A 71 26.102 -1.116 16.088 1.00 0.00 C ATOM 1019 OG SER A 71 26.380 0.193 16.542 1.00 0.00 O ATOM 0 H SER A 71 26.339 -0.724 13.321 1.00 0.00 H new ATOM 0 HA SER A 71 28.120 -1.557 15.532 1.00 0.00 H new ATOM 0 HB2 SER A 71 25.105 -1.149 15.648 1.00 0.00 H new ATOM 0 HB3 SER A 71 26.101 -1.805 16.932 1.00 0.00 H new ATOM 0 HG SER A 71 26.274 0.826 15.801 1.00 0.00 H new ATOM 1025 N GLN A 72 27.046 -3.966 15.490 1.00 0.00 N ATOM 1026 CA GLN A 72 27.068 -5.386 15.193 1.00 0.00 C ATOM 1027 C GLN A 72 26.293 -6.107 16.289 1.00 0.00 C ATOM 1028 O GLN A 72 26.596 -5.933 17.469 1.00 0.00 O ATOM 1029 CB GLN A 72 28.546 -5.819 15.117 1.00 0.00 C ATOM 1030 CG GLN A 72 28.785 -7.334 15.189 1.00 0.00 C ATOM 1031 CD GLN A 72 30.238 -7.699 14.870 1.00 0.00 C ATOM 1032 OE1 GLN A 72 30.508 -8.468 13.950 1.00 0.00 O ATOM 1033 NE2 GLN A 72 31.208 -7.168 15.600 1.00 0.00 N ATOM 0 H GLN A 72 27.153 -3.765 16.484 1.00 0.00 H new ATOM 0 HA GLN A 72 26.595 -5.630 14.242 1.00 0.00 H new ATOM 0 HB2 GLN A 72 28.971 -5.444 14.186 1.00 0.00 H new ATOM 0 HB3 GLN A 72 29.091 -5.342 15.932 1.00 0.00 H new ATOM 0 HG2 GLN A 72 28.531 -7.695 16.186 1.00 0.00 H new ATOM 0 HG3 GLN A 72 28.121 -7.840 14.488 1.00 0.00 H new ATOM 0 HE21 GLN A 72 30.981 -6.530 16.363 1.00 0.00 H new ATOM 0 HE22 GLN A 72 32.181 -7.397 15.399 1.00 0.00 H new ATOM 1042 N TYR A 73 25.321 -6.935 15.911 1.00 0.00 N ATOM 1043 CA TYR A 73 24.599 -7.804 16.828 1.00 0.00 C ATOM 1044 C TYR A 73 24.979 -9.237 16.480 1.00 0.00 C ATOM 1045 O TYR A 73 25.118 -9.561 15.295 1.00 0.00 O ATOM 1046 CB TYR A 73 23.076 -7.649 16.679 1.00 0.00 C ATOM 1047 CG TYR A 73 22.450 -6.271 16.832 1.00 0.00 C ATOM 1048 CD1 TYR A 73 23.157 -5.163 17.342 1.00 0.00 C ATOM 1049 CD2 TYR A 73 21.113 -6.102 16.424 1.00 0.00 C ATOM 1050 CE1 TYR A 73 22.572 -3.887 17.344 1.00 0.00 C ATOM 1051 CE2 TYR A 73 20.514 -4.831 16.436 1.00 0.00 C ATOM 1052 CZ TYR A 73 21.249 -3.711 16.879 1.00 0.00 C ATOM 1053 OH TYR A 73 20.671 -2.480 16.850 1.00 0.00 O ATOM 0 H TYR A 73 25.011 -7.020 14.943 1.00 0.00 H new ATOM 0 HA TYR A 73 24.861 -7.543 17.853 1.00 0.00 H new ATOM 0 HB2 TYR A 73 22.803 -8.025 15.693 1.00 0.00 H new ATOM 0 HB3 TYR A 73 22.607 -8.305 17.412 1.00 0.00 H new ATOM 0 HD1 TYR A 73 24.155 -5.297 17.733 1.00 0.00 H new ATOM 0 HD2 TYR A 73 20.542 -6.959 16.098 1.00 0.00 H new ATOM 0 HE1 TYR A 73 23.134 -3.037 17.702 1.00 0.00 H new ATOM 0 HE2 TYR A 73 19.492 -4.712 16.107 1.00 0.00 H new ATOM 0 HH TYR A 73 19.868 -2.509 16.289 1.00 0.00 H new ATOM 1063 N ASN A 74 25.100 -10.095 17.491 1.00 0.00 N ATOM 1064 CA ASN A 74 25.247 -11.534 17.318 1.00 0.00 C ATOM 1065 C ASN A 74 24.403 -12.240 18.383 1.00 0.00 C ATOM 1066 O ASN A 74 24.692 -12.129 19.575 1.00 0.00 O ATOM 1067 CB ASN A 74 26.730 -11.941 17.436 1.00 0.00 C ATOM 1068 CG ASN A 74 26.918 -13.381 17.923 1.00 0.00 C ATOM 1069 OD1 ASN A 74 27.394 -13.612 19.031 1.00 0.00 O ATOM 1070 ND2 ASN A 74 26.553 -14.383 17.141 1.00 0.00 N ATOM 0 H ASN A 74 25.098 -9.803 18.468 1.00 0.00 H new ATOM 0 HA ASN A 74 24.902 -11.827 16.326 1.00 0.00 H new ATOM 0 HB2 ASN A 74 27.211 -11.826 16.465 1.00 0.00 H new ATOM 0 HB3 ASN A 74 27.234 -11.262 18.124 1.00 0.00 H new ATOM 0 HD21 ASN A 74 26.667 -15.346 17.459 1.00 0.00 H new ATOM 0 HD22 ASN A 74 26.157 -14.193 16.220 1.00 0.00 H new ATOM 1077 N GLY A 75 23.388 -12.994 17.965 1.00 0.00 N ATOM 1078 CA GLY A 75 22.574 -13.820 18.843 1.00 0.00 C ATOM 1079 C GLY A 75 21.804 -13.018 19.893 1.00 0.00 C ATOM 1080 O GLY A 75 21.790 -13.434 21.054 1.00 0.00 O ATOM 0 H GLY A 75 23.106 -13.046 16.986 1.00 0.00 H new ATOM 0 HA2 GLY A 75 21.866 -14.389 18.240 1.00 0.00 H new ATOM 0 HA3 GLY A 75 23.216 -14.542 19.347 1.00 0.00 H new ATOM 1084 N ILE A 76 21.193 -11.881 19.535 1.00 0.00 N ATOM 1085 CA ILE A 76 20.500 -11.018 20.495 1.00 0.00 C ATOM 1086 C ILE A 76 19.017 -10.871 20.138 1.00 0.00 C ATOM 1087 O ILE A 76 18.609 -11.092 18.999 1.00 0.00 O ATOM 1088 CB ILE A 76 21.216 -9.649 20.682 1.00 0.00 C ATOM 1089 CG1 ILE A 76 20.722 -8.529 19.735 1.00 0.00 C ATOM 1090 CG2 ILE A 76 22.752 -9.787 20.603 1.00 0.00 C ATOM 1091 CD1 ILE A 76 21.383 -7.169 19.998 1.00 0.00 C ATOM 0 H ILE A 76 21.166 -11.536 18.575 1.00 0.00 H new ATOM 0 HA ILE A 76 20.544 -11.508 21.468 1.00 0.00 H new ATOM 0 HB ILE A 76 20.939 -9.334 21.688 1.00 0.00 H new ATOM 0 HG12 ILE A 76 20.915 -8.825 18.704 1.00 0.00 H new ATOM 0 HG13 ILE A 76 19.642 -8.426 19.840 1.00 0.00 H new ATOM 0 HG21 ILE A 76 23.213 -8.808 20.739 1.00 0.00 H new ATOM 0 HG22 ILE A 76 23.097 -10.462 21.386 1.00 0.00 H new ATOM 0 HG23 ILE A 76 23.032 -10.188 19.629 1.00 0.00 H new ATOM 0 HD11 ILE A 76 20.990 -6.432 19.298 1.00 0.00 H new ATOM 0 HD12 ILE A 76 21.168 -6.851 21.018 1.00 0.00 H new ATOM 0 HD13 ILE A 76 22.461 -7.257 19.865 1.00 0.00 H new ATOM 1103 N TYR A 77 18.221 -10.431 21.106 1.00 0.00 N ATOM 1104 CA TYR A 77 16.841 -10.015 20.947 1.00 0.00 C ATOM 1105 C TYR A 77 16.830 -8.560 21.403 1.00 0.00 C ATOM 1106 O TYR A 77 17.252 -8.273 22.526 1.00 0.00 O ATOM 1107 CB TYR A 77 15.936 -10.906 21.811 1.00 0.00 C ATOM 1108 CG TYR A 77 14.451 -10.596 21.708 1.00 0.00 C ATOM 1109 CD1 TYR A 77 13.905 -9.488 22.388 1.00 0.00 C ATOM 1110 CD2 TYR A 77 13.607 -11.437 20.957 1.00 0.00 C ATOM 1111 CE1 TYR A 77 12.529 -9.212 22.308 1.00 0.00 C ATOM 1112 CE2 TYR A 77 12.226 -11.177 20.886 1.00 0.00 C ATOM 1113 CZ TYR A 77 11.680 -10.058 21.555 1.00 0.00 C ATOM 1114 OH TYR A 77 10.342 -9.815 21.476 1.00 0.00 O ATOM 0 H TYR A 77 18.542 -10.353 22.071 1.00 0.00 H new ATOM 0 HA TYR A 77 16.468 -10.107 19.927 1.00 0.00 H new ATOM 0 HB2 TYR A 77 16.096 -11.946 21.527 1.00 0.00 H new ATOM 0 HB3 TYR A 77 16.242 -10.809 22.853 1.00 0.00 H new ATOM 0 HD1 TYR A 77 14.548 -8.848 22.974 1.00 0.00 H new ATOM 0 HD2 TYR A 77 14.022 -12.285 20.433 1.00 0.00 H new ATOM 0 HE1 TYR A 77 12.120 -8.354 22.821 1.00 0.00 H new ATOM 0 HE2 TYR A 77 11.582 -11.833 20.319 1.00 0.00 H new ATOM 0 HH TYR A 77 9.918 -10.498 20.916 1.00 0.00 H new ATOM 1124 N ILE A 78 16.398 -7.631 20.553 1.00 0.00 N ATOM 1125 CA ILE A 78 16.460 -6.209 20.861 1.00 0.00 C ATOM 1126 C ILE A 78 15.184 -5.527 20.379 1.00 0.00 C ATOM 1127 O ILE A 78 14.764 -5.725 19.232 1.00 0.00 O ATOM 1128 CB ILE A 78 17.773 -5.594 20.323 1.00 0.00 C ATOM 1129 CG1 ILE A 78 17.861 -4.099 20.695 1.00 0.00 C ATOM 1130 CG2 ILE A 78 17.970 -5.814 18.814 1.00 0.00 C ATOM 1131 CD1 ILE A 78 19.269 -3.508 20.527 1.00 0.00 C ATOM 0 H ILE A 78 15.998 -7.843 19.639 1.00 0.00 H new ATOM 0 HA ILE A 78 16.497 -6.047 21.938 1.00 0.00 H new ATOM 0 HB ILE A 78 18.593 -6.123 20.808 1.00 0.00 H new ATOM 0 HG12 ILE A 78 17.163 -3.537 20.075 1.00 0.00 H new ATOM 0 HG13 ILE A 78 17.543 -3.971 21.730 1.00 0.00 H new ATOM 0 HG21 ILE A 78 18.909 -5.359 18.499 1.00 0.00 H new ATOM 0 HG22 ILE A 78 17.996 -6.883 18.603 1.00 0.00 H new ATOM 0 HG23 ILE A 78 17.144 -5.356 18.269 1.00 0.00 H new ATOM 0 HD11 ILE A 78 19.257 -2.454 20.806 1.00 0.00 H new ATOM 0 HD12 ILE A 78 19.968 -4.045 21.168 1.00 0.00 H new ATOM 0 HD13 ILE A 78 19.582 -3.604 19.487 1.00 0.00 H new ATOM 1143 N ARG A 79 14.561 -4.727 21.254 1.00 0.00 N ATOM 1144 CA ARG A 79 13.361 -3.978 20.894 1.00 0.00 C ATOM 1145 C ARG A 79 13.452 -2.514 21.300 1.00 0.00 C ATOM 1146 O ARG A 79 13.997 -2.184 22.359 1.00 0.00 O ATOM 1147 CB ARG A 79 12.083 -4.645 21.437 1.00 0.00 C ATOM 1148 CG ARG A 79 12.020 -4.762 22.973 1.00 0.00 C ATOM 1149 CD ARG A 79 10.585 -4.723 23.507 1.00 0.00 C ATOM 1150 NE ARG A 79 9.989 -3.382 23.335 1.00 0.00 N ATOM 1151 CZ ARG A 79 8.977 -2.859 24.035 1.00 0.00 C ATOM 1152 NH1 ARG A 79 8.365 -3.557 24.990 1.00 0.00 N ATOM 1153 NH2 ARG A 79 8.595 -1.619 23.757 1.00 0.00 N ATOM 0 H ARG A 79 14.872 -4.585 22.215 1.00 0.00 H new ATOM 0 HA ARG A 79 13.295 -3.998 19.806 1.00 0.00 H new ATOM 0 HB2 ARG A 79 11.219 -4.076 21.094 1.00 0.00 H new ATOM 0 HB3 ARG A 79 11.999 -5.643 21.006 1.00 0.00 H new ATOM 0 HG2 ARG A 79 12.494 -5.693 23.283 1.00 0.00 H new ATOM 0 HG3 ARG A 79 12.592 -3.949 23.420 1.00 0.00 H new ATOM 0 HD2 ARG A 79 9.979 -5.463 22.984 1.00 0.00 H new ATOM 0 HD3 ARG A 79 10.579 -4.994 24.563 1.00 0.00 H new ATOM 0 HE ARG A 79 10.392 -2.794 22.606 1.00 0.00 H new ATOM 0 HH11 ARG A 79 8.666 -4.509 25.199 1.00 0.00 H new ATOM 0 HH12 ARG A 79 7.595 -3.140 25.513 1.00 0.00 H new ATOM 0 HH21 ARG A 79 9.071 -1.091 23.025 1.00 0.00 H new ATOM 0 HH22 ARG A 79 7.826 -1.194 24.275 1.00 0.00 H new ATOM 1167 N SER A 80 12.841 -1.649 20.493 1.00 0.00 N ATOM 1168 CA SER A 80 12.622 -0.239 20.795 1.00 0.00 C ATOM 1169 C SER A 80 13.913 0.504 21.191 1.00 0.00 C ATOM 1170 O SER A 80 13.856 1.428 22.006 1.00 0.00 O ATOM 1171 CB SER A 80 11.530 -0.147 21.873 1.00 0.00 C ATOM 1172 OG SER A 80 10.434 -1.017 21.598 1.00 0.00 O ATOM 0 H SER A 80 12.473 -1.921 19.581 1.00 0.00 H new ATOM 0 HA SER A 80 12.288 0.272 19.892 1.00 0.00 H new ATOM 0 HB2 SER A 80 11.957 -0.397 22.844 1.00 0.00 H new ATOM 0 HB3 SER A 80 11.170 0.880 21.938 1.00 0.00 H new ATOM 0 HG SER A 80 9.658 -0.487 21.321 1.00 0.00 H new ATOM 1178 N SER A 81 15.073 0.109 20.653 1.00 0.00 N ATOM 1179 CA SER A 81 16.378 0.578 21.119 1.00 0.00 C ATOM 1180 C SER A 81 17.206 1.232 20.004 1.00 0.00 C ATOM 1181 O SER A 81 16.804 1.242 18.838 1.00 0.00 O ATOM 1182 CB SER A 81 17.106 -0.616 21.749 1.00 0.00 C ATOM 1183 OG SER A 81 16.408 -1.080 22.895 1.00 0.00 O ATOM 0 H SER A 81 15.130 -0.550 19.876 1.00 0.00 H new ATOM 0 HA SER A 81 16.235 1.365 21.860 1.00 0.00 H new ATOM 0 HB2 SER A 81 17.194 -1.421 21.020 1.00 0.00 H new ATOM 0 HB3 SER A 81 18.119 -0.326 22.027 1.00 0.00 H new ATOM 0 HG SER A 81 15.628 -1.602 22.614 1.00 0.00 H new ATOM 1189 N THR A 82 18.371 1.781 20.352 1.00 0.00 N ATOM 1190 CA THR A 82 19.288 2.428 19.419 1.00 0.00 C ATOM 1191 C THR A 82 20.713 1.975 19.748 1.00 0.00 C ATOM 1192 O THR A 82 21.073 1.886 20.924 1.00 0.00 O ATOM 1193 CB THR A 82 19.130 3.958 19.521 1.00 0.00 C ATOM 1194 OG1 THR A 82 17.785 4.344 19.294 1.00 0.00 O ATOM 1195 CG2 THR A 82 20.001 4.709 18.506 1.00 0.00 C ATOM 0 H THR A 82 18.709 1.787 21.314 1.00 0.00 H new ATOM 0 HA THR A 82 19.065 2.145 18.390 1.00 0.00 H new ATOM 0 HB THR A 82 19.447 4.220 20.531 1.00 0.00 H new ATOM 0 HG1 THR A 82 17.708 5.318 19.365 1.00 0.00 H new ATOM 0 HG21 THR A 82 19.851 5.782 18.622 1.00 0.00 H new ATOM 0 HG22 THR A 82 21.050 4.469 18.679 1.00 0.00 H new ATOM 0 HG23 THR A 82 19.722 4.410 17.496 1.00 0.00 H new ATOM 1203 N THR A 83 21.542 1.709 18.738 1.00 0.00 N ATOM 1204 CA THR A 83 22.908 1.239 18.937 1.00 0.00 C ATOM 1205 C THR A 83 23.843 2.003 18.000 1.00 0.00 C ATOM 1206 O THR A 83 23.555 2.115 16.802 1.00 0.00 O ATOM 1207 CB THR A 83 22.968 -0.282 18.721 1.00 0.00 C ATOM 1208 OG1 THR A 83 22.509 -0.622 17.429 1.00 0.00 O ATOM 1209 CG2 THR A 83 22.092 -1.041 19.722 1.00 0.00 C ATOM 0 H THR A 83 21.282 1.815 17.757 1.00 0.00 H new ATOM 0 HA THR A 83 23.236 1.431 19.959 1.00 0.00 H new ATOM 0 HB THR A 83 24.012 -0.564 18.855 1.00 0.00 H new ATOM 0 HG1 THR A 83 21.988 -1.451 17.474 1.00 0.00 H new ATOM 0 HG21 THR A 83 22.166 -2.112 19.531 1.00 0.00 H new ATOM 0 HG22 THR A 83 22.431 -0.829 20.736 1.00 0.00 H new ATOM 0 HG23 THR A 83 21.055 -0.723 19.612 1.00 0.00 H new ATOM 1217 N THR A 84 24.953 2.515 18.533 1.00 0.00 N ATOM 1218 CA THR A 84 25.898 3.336 17.792 1.00 0.00 C ATOM 1219 C THR A 84 27.320 2.852 18.094 1.00 0.00 C ATOM 1220 O THR A 84 27.724 2.782 19.258 1.00 0.00 O ATOM 1221 CB THR A 84 25.701 4.820 18.161 1.00 0.00 C ATOM 1222 OG1 THR A 84 24.331 5.186 18.135 1.00 0.00 O ATOM 1223 CG2 THR A 84 26.445 5.741 17.189 1.00 0.00 C ATOM 0 H THR A 84 25.220 2.366 19.506 1.00 0.00 H new ATOM 0 HA THR A 84 25.727 3.243 16.720 1.00 0.00 H new ATOM 0 HB THR A 84 26.099 4.937 19.169 1.00 0.00 H new ATOM 0 HG1 THR A 84 24.240 6.132 18.375 1.00 0.00 H new ATOM 0 HG21 THR A 84 26.285 6.780 17.478 1.00 0.00 H new ATOM 0 HG22 THR A 84 27.511 5.516 17.219 1.00 0.00 H new ATOM 0 HG23 THR A 84 26.069 5.583 16.178 1.00 0.00 H new ATOM 1231 N GLY A 85 28.086 2.545 17.043 1.00 0.00 N ATOM 1232 CA GLY A 85 29.493 2.181 17.127 1.00 0.00 C ATOM 1233 C GLY A 85 29.788 1.068 18.131 1.00 0.00 C ATOM 1234 O GLY A 85 30.762 1.195 18.873 1.00 0.00 O ATOM 0 H GLY A 85 27.730 2.544 16.087 1.00 0.00 H new ATOM 0 HA2 GLY A 85 29.836 1.867 16.141 1.00 0.00 H new ATOM 0 HA3 GLY A 85 30.071 3.064 17.399 1.00 0.00 H new ATOM 1238 N THR A 86 28.985 0.004 18.214 1.00 0.00 N ATOM 1239 CA THR A 86 29.127 -0.998 19.272 1.00 0.00 C ATOM 1240 C THR A 86 28.928 -2.419 18.732 1.00 0.00 C ATOM 1241 O THR A 86 28.275 -2.618 17.708 1.00 0.00 O ATOM 1242 CB THR A 86 28.170 -0.608 20.418 1.00 0.00 C ATOM 1243 OG1 THR A 86 28.311 -1.425 21.563 1.00 0.00 O ATOM 1244 CG2 THR A 86 26.685 -0.598 20.041 1.00 0.00 C ATOM 0 H THR A 86 28.227 -0.186 17.558 1.00 0.00 H new ATOM 0 HA THR A 86 30.142 -1.010 19.670 1.00 0.00 H new ATOM 0 HB THR A 86 28.479 0.414 20.640 1.00 0.00 H new ATOM 0 HG1 THR A 86 29.241 -1.726 21.638 1.00 0.00 H new ATOM 0 HG21 THR A 86 26.091 -0.313 20.909 1.00 0.00 H new ATOM 0 HG22 THR A 86 26.519 0.118 19.236 1.00 0.00 H new ATOM 0 HG23 THR A 86 26.387 -1.593 19.709 1.00 0.00 H new ATOM 1252 N SER A 87 29.472 -3.418 19.428 1.00 0.00 N ATOM 1253 CA SER A 87 29.197 -4.825 19.175 1.00 0.00 C ATOM 1254 C SER A 87 28.475 -5.372 20.402 1.00 0.00 C ATOM 1255 O SER A 87 28.841 -5.034 21.531 1.00 0.00 O ATOM 1256 CB SER A 87 30.490 -5.592 18.892 1.00 0.00 C ATOM 1257 OG SER A 87 31.081 -5.131 17.691 1.00 0.00 O ATOM 0 H SER A 87 30.126 -3.265 20.195 1.00 0.00 H new ATOM 0 HA SER A 87 28.572 -4.944 18.290 1.00 0.00 H new ATOM 0 HB2 SER A 87 31.186 -5.463 19.721 1.00 0.00 H new ATOM 0 HB3 SER A 87 30.279 -6.659 18.816 1.00 0.00 H new ATOM 0 HG SER A 87 31.992 -5.484 17.618 1.00 0.00 H new ATOM 1263 N ILE A 88 27.445 -6.187 20.188 1.00 0.00 N ATOM 1264 CA ILE A 88 26.530 -6.655 21.218 1.00 0.00 C ATOM 1265 C ILE A 88 26.305 -8.143 20.939 1.00 0.00 C ATOM 1266 O ILE A 88 25.884 -8.517 19.838 1.00 0.00 O ATOM 1267 CB ILE A 88 25.220 -5.829 21.185 1.00 0.00 C ATOM 1268 CG1 ILE A 88 25.486 -4.303 21.248 1.00 0.00 C ATOM 1269 CG2 ILE A 88 24.305 -6.262 22.339 1.00 0.00 C ATOM 1270 CD1 ILE A 88 24.223 -3.441 21.351 1.00 0.00 C ATOM 0 H ILE A 88 27.220 -6.550 19.262 1.00 0.00 H new ATOM 0 HA ILE A 88 26.931 -6.526 22.223 1.00 0.00 H new ATOM 0 HB ILE A 88 24.727 -6.027 20.233 1.00 0.00 H new ATOM 0 HG12 ILE A 88 26.124 -4.094 22.106 1.00 0.00 H new ATOM 0 HG13 ILE A 88 26.041 -4.007 20.358 1.00 0.00 H new ATOM 0 HG21 ILE A 88 23.385 -5.679 22.312 1.00 0.00 H new ATOM 0 HG22 ILE A 88 24.067 -7.321 22.237 1.00 0.00 H new ATOM 0 HG23 ILE A 88 24.813 -6.095 23.289 1.00 0.00 H new ATOM 0 HD11 ILE A 88 24.503 -2.388 21.390 1.00 0.00 H new ATOM 0 HD12 ILE A 88 23.591 -3.616 20.481 1.00 0.00 H new ATOM 0 HD13 ILE A 88 23.676 -3.704 22.256 1.00 0.00 H new ATOM 1282 N SER A 89 26.594 -8.984 21.930 1.00 0.00 N ATOM 1283 CA SER A 89 26.649 -10.430 21.775 1.00 0.00 C ATOM 1284 C SER A 89 26.083 -11.138 23.008 1.00 0.00 C ATOM 1285 O SER A 89 25.912 -10.532 24.070 1.00 0.00 O ATOM 1286 CB SER A 89 28.110 -10.850 21.536 1.00 0.00 C ATOM 1287 OG SER A 89 28.702 -10.135 20.460 1.00 0.00 O ATOM 0 H SER A 89 26.800 -8.671 22.879 1.00 0.00 H new ATOM 0 HA SER A 89 26.038 -10.721 20.921 1.00 0.00 H new ATOM 0 HB2 SER A 89 28.688 -10.682 22.444 1.00 0.00 H new ATOM 0 HB3 SER A 89 28.150 -11.919 21.326 1.00 0.00 H new ATOM 0 HG SER A 89 29.629 -10.430 20.342 1.00 0.00 H new ATOM 1321 N CYS A 93 21.426 -12.586 24.538 1.00 0.00 N ATOM 1322 CA CYS A 93 21.338 -11.195 24.955 1.00 0.00 C ATOM 1323 C CYS A 93 19.931 -10.688 24.667 1.00 0.00 C ATOM 1324 O CYS A 93 19.362 -10.979 23.616 1.00 0.00 O ATOM 1325 CB CYS A 93 22.392 -10.367 24.209 1.00 0.00 C ATOM 1326 SG CYS A 93 22.214 -8.568 24.365 1.00 0.00 S ATOM 0 HA CYS A 93 21.534 -11.102 26.023 1.00 0.00 H new ATOM 0 HB2 CYS A 93 23.379 -10.651 24.574 1.00 0.00 H new ATOM 0 HB3 CYS A 93 22.355 -10.629 23.152 1.00 0.00 H new ATOM 1331 N SER A 94 19.399 -9.899 25.590 1.00 0.00 N ATOM 1332 CA SER A 94 18.063 -9.345 25.543 1.00 0.00 C ATOM 1333 C SER A 94 18.196 -7.872 25.913 1.00 0.00 C ATOM 1334 O SER A 94 18.819 -7.570 26.930 1.00 0.00 O ATOM 1335 CB SER A 94 17.210 -10.112 26.556 1.00 0.00 C ATOM 1336 OG SER A 94 17.052 -11.470 26.175 1.00 0.00 O ATOM 0 H SER A 94 19.913 -9.619 26.425 1.00 0.00 H new ATOM 0 HA SER A 94 17.590 -9.431 24.565 1.00 0.00 H new ATOM 0 HB2 SER A 94 17.676 -10.060 27.540 1.00 0.00 H new ATOM 0 HB3 SER A 94 16.231 -9.640 26.642 1.00 0.00 H new ATOM 0 HG SER A 94 16.504 -11.935 26.841 1.00 0.00 H new ATOM 1342 N ILE A 95 17.656 -6.963 25.097 1.00 0.00 N ATOM 1343 CA ILE A 95 17.720 -5.515 25.297 1.00 0.00 C ATOM 1344 C ILE A 95 16.339 -4.940 24.965 1.00 0.00 C ATOM 1345 O ILE A 95 15.738 -5.307 23.949 1.00 0.00 O ATOM 1346 CB ILE A 95 18.839 -4.890 24.418 1.00 0.00 C ATOM 1347 CG1 ILE A 95 20.235 -5.348 24.897 1.00 0.00 C ATOM 1348 CG2 ILE A 95 18.786 -3.348 24.422 1.00 0.00 C ATOM 1349 CD1 ILE A 95 21.412 -4.859 24.044 1.00 0.00 C ATOM 0 H ILE A 95 17.146 -7.224 24.253 1.00 0.00 H new ATOM 0 HA ILE A 95 17.973 -5.276 26.330 1.00 0.00 H new ATOM 0 HB ILE A 95 18.666 -5.239 23.400 1.00 0.00 H new ATOM 0 HG12 ILE A 95 20.381 -5.003 25.921 1.00 0.00 H new ATOM 0 HG13 ILE A 95 20.253 -6.438 24.922 1.00 0.00 H new ATOM 0 HG21 ILE A 95 19.586 -2.955 23.795 1.00 0.00 H new ATOM 0 HG22 ILE A 95 17.823 -3.016 24.033 1.00 0.00 H new ATOM 0 HG23 ILE A 95 18.911 -2.982 25.441 1.00 0.00 H new ATOM 0 HD11 ILE A 95 22.346 -5.234 24.463 1.00 0.00 H new ATOM 0 HD12 ILE A 95 21.299 -5.226 23.024 1.00 0.00 H new ATOM 0 HD13 ILE A 95 21.429 -3.769 24.038 1.00 0.00 H new ATOM 1361 N SER A 96 15.873 -3.985 25.769 1.00 0.00 N ATOM 1362 CA SER A 96 14.642 -3.260 25.495 1.00 0.00 C ATOM 1363 C SER A 96 14.809 -1.789 25.854 1.00 0.00 C ATOM 1364 O SER A 96 15.465 -1.468 26.851 1.00 0.00 O ATOM 1365 CB SER A 96 13.471 -3.851 26.296 1.00 0.00 C ATOM 1366 OG SER A 96 13.351 -5.254 26.119 1.00 0.00 O ATOM 0 H SER A 96 16.341 -3.695 26.628 1.00 0.00 H new ATOM 0 HA SER A 96 14.424 -3.353 24.431 1.00 0.00 H new ATOM 0 HB2 SER A 96 13.610 -3.631 27.354 1.00 0.00 H new ATOM 0 HB3 SER A 96 12.543 -3.368 25.989 1.00 0.00 H new ATOM 0 HG SER A 96 12.596 -5.587 26.647 1.00 0.00 H new ATOM 1372 N THR A 97 14.172 -0.925 25.057 1.00 0.00 N ATOM 1373 CA THR A 97 14.003 0.506 25.327 1.00 0.00 C ATOM 1374 C THR A 97 15.300 1.211 25.780 1.00 0.00 C ATOM 1375 O THR A 97 15.281 2.042 26.691 1.00 0.00 O ATOM 1376 CB THR A 97 12.769 0.716 26.245 1.00 0.00 C ATOM 1377 OG1 THR A 97 12.671 -0.226 27.298 1.00 0.00 O ATOM 1378 CG2 THR A 97 11.467 0.580 25.446 1.00 0.00 C ATOM 0 H THR A 97 13.745 -1.213 24.176 1.00 0.00 H new ATOM 0 HA THR A 97 13.789 1.020 24.390 1.00 0.00 H new ATOM 0 HB THR A 97 12.907 1.715 26.659 1.00 0.00 H new ATOM 0 HG1 THR A 97 13.036 0.163 28.120 1.00 0.00 H new ATOM 0 HG21 THR A 97 10.615 0.731 26.109 1.00 0.00 H new ATOM 0 HG22 THR A 97 11.447 1.328 24.653 1.00 0.00 H new ATOM 0 HG23 THR A 97 11.412 -0.416 25.006 1.00 0.00 H new ATOM 1386 N CYS A 98 16.436 0.886 25.152 1.00 0.00 N ATOM 1387 CA CYS A 98 17.764 1.301 25.590 1.00 0.00 C ATOM 1388 C CYS A 98 18.511 2.015 24.460 1.00 0.00 C ATOM 1389 O CYS A 98 18.159 1.885 23.287 1.00 0.00 O ATOM 1390 CB CYS A 98 18.537 0.047 26.027 1.00 0.00 C ATOM 1391 SG CYS A 98 20.051 0.388 26.962 1.00 0.00 S ATOM 0 H CYS A 98 16.453 0.315 24.307 1.00 0.00 H new ATOM 0 HA CYS A 98 17.675 2.000 26.421 1.00 0.00 H new ATOM 0 HB2 CYS A 98 17.881 -0.575 26.636 1.00 0.00 H new ATOM 0 HB3 CYS A 98 18.795 -0.533 25.141 1.00 0.00 H new ATOM 1396 N THR A 99 19.585 2.726 24.795 1.00 0.00 N ATOM 1397 CA THR A 99 20.523 3.275 23.830 1.00 0.00 C ATOM 1398 C THR A 99 21.902 2.775 24.257 1.00 0.00 C ATOM 1399 O THR A 99 22.208 2.755 25.450 1.00 0.00 O ATOM 1400 CB THR A 99 20.402 4.806 23.789 1.00 0.00 C ATOM 1401 OG1 THR A 99 19.087 5.182 23.419 1.00 0.00 O ATOM 1402 CG2 THR A 99 21.373 5.443 22.788 1.00 0.00 C ATOM 0 H THR A 99 19.828 2.938 25.763 1.00 0.00 H new ATOM 0 HA THR A 99 20.324 2.950 22.809 1.00 0.00 H new ATOM 0 HB THR A 99 20.646 5.162 24.790 1.00 0.00 H new ATOM 0 HG1 THR A 99 19.020 6.159 23.398 1.00 0.00 H new ATOM 0 HG21 THR A 99 21.247 6.526 22.798 1.00 0.00 H new ATOM 0 HG22 THR A 99 22.397 5.194 23.066 1.00 0.00 H new ATOM 0 HG23 THR A 99 21.166 5.063 21.788 1.00 0.00 H new ATOM 1410 N ILE A 100 22.731 2.341 23.307 1.00 0.00 N ATOM 1411 CA ILE A 100 24.065 1.828 23.580 1.00 0.00 C ATOM 1412 C ILE A 100 25.009 2.529 22.608 1.00 0.00 C ATOM 1413 O ILE A 100 24.766 2.525 21.399 1.00 0.00 O ATOM 1414 CB ILE A 100 24.128 0.281 23.469 1.00 0.00 C ATOM 1415 CG1 ILE A 100 23.096 -0.464 24.356 1.00 0.00 C ATOM 1416 CG2 ILE A 100 25.531 -0.207 23.885 1.00 0.00 C ATOM 1417 CD1 ILE A 100 21.747 -0.746 23.683 1.00 0.00 C ATOM 0 H ILE A 100 22.488 2.338 22.316 1.00 0.00 H new ATOM 0 HA ILE A 100 24.360 2.040 24.608 1.00 0.00 H new ATOM 0 HB ILE A 100 23.896 0.053 22.429 1.00 0.00 H new ATOM 0 HG12 ILE A 100 23.531 -1.411 24.676 1.00 0.00 H new ATOM 0 HG13 ILE A 100 22.920 0.126 25.256 1.00 0.00 H new ATOM 0 HG21 ILE A 100 25.576 -1.293 23.807 1.00 0.00 H new ATOM 0 HG22 ILE A 100 26.280 0.235 23.228 1.00 0.00 H new ATOM 0 HG23 ILE A 100 25.730 0.092 24.914 1.00 0.00 H new ATOM 0 HD11 ILE A 100 21.094 -1.269 24.382 1.00 0.00 H new ATOM 0 HD12 ILE A 100 21.283 0.196 23.389 1.00 0.00 H new ATOM 0 HD13 ILE A 100 21.903 -1.365 22.800 1.00 0.00 H new ATOM 1429 N THR A 101 26.095 3.089 23.130 1.00 0.00 N ATOM 1430 CA THR A 101 27.071 3.839 22.357 1.00 0.00 C ATOM 1431 C THR A 101 28.445 3.307 22.755 1.00 0.00 C ATOM 1432 O THR A 101 28.793 3.334 23.936 1.00 0.00 O ATOM 1433 CB THR A 101 26.900 5.345 22.633 1.00 0.00 C ATOM 1434 OG1 THR A 101 25.556 5.732 22.401 1.00 0.00 O ATOM 1435 CG2 THR A 101 27.810 6.192 21.737 1.00 0.00 C ATOM 0 H THR A 101 26.323 3.031 24.122 1.00 0.00 H new ATOM 0 HA THR A 101 26.941 3.714 21.282 1.00 0.00 H new ATOM 0 HB THR A 101 27.173 5.515 23.674 1.00 0.00 H new ATOM 0 HG1 THR A 101 25.456 6.690 22.580 1.00 0.00 H new ATOM 0 HG21 THR A 101 27.661 7.248 21.961 1.00 0.00 H new ATOM 0 HG22 THR A 101 28.851 5.926 21.920 1.00 0.00 H new ATOM 0 HG23 THR A 101 27.567 6.005 20.691 1.00 0.00 H new ATOM 1443 N ARG A 102 29.205 2.783 21.786 1.00 0.00 N ATOM 1444 CA ARG A 102 30.531 2.174 21.978 1.00 0.00 C ATOM 1445 C ARG A 102 30.617 1.295 23.239 1.00 0.00 C ATOM 1446 O ARG A 102 31.560 1.406 24.022 1.00 0.00 O ATOM 1447 CB ARG A 102 31.636 3.247 21.905 1.00 0.00 C ATOM 1448 CG ARG A 102 31.586 4.095 20.619 1.00 0.00 C ATOM 1449 CD ARG A 102 32.932 4.765 20.318 1.00 0.00 C ATOM 1450 NE ARG A 102 33.933 3.789 19.839 1.00 0.00 N ATOM 1451 CZ ARG A 102 35.253 3.825 20.066 1.00 0.00 C ATOM 1452 NH1 ARG A 102 35.795 4.795 20.800 1.00 0.00 N ATOM 1453 NH2 ARG A 102 36.028 2.879 19.551 1.00 0.00 N ATOM 0 H ARG A 102 28.905 2.770 20.811 1.00 0.00 H new ATOM 0 HA ARG A 102 30.696 1.481 21.153 1.00 0.00 H new ATOM 0 HB2 ARG A 102 31.549 3.906 22.769 1.00 0.00 H new ATOM 0 HB3 ARG A 102 32.609 2.760 21.972 1.00 0.00 H new ATOM 0 HG2 ARG A 102 31.300 3.462 19.779 1.00 0.00 H new ATOM 0 HG3 ARG A 102 30.815 4.859 20.719 1.00 0.00 H new ATOM 0 HD2 ARG A 102 32.792 5.542 19.566 1.00 0.00 H new ATOM 0 HD3 ARG A 102 33.304 5.256 21.218 1.00 0.00 H new ATOM 0 HE ARG A 102 33.584 3.010 19.280 1.00 0.00 H new ATOM 0 HH11 ARG A 102 35.203 5.524 21.198 1.00 0.00 H new ATOM 0 HH12 ARG A 102 36.802 4.809 20.964 1.00 0.00 H new ATOM 0 HH21 ARG A 102 35.618 2.134 18.988 1.00 0.00 H new ATOM 0 HH22 ARG A 102 37.034 2.897 19.718 1.00 0.00 H new ATOM 1467 N GLY A 103 29.625 0.424 23.449 1.00 0.00 N ATOM 1468 CA GLY A 103 29.631 -0.567 24.521 1.00 0.00 C ATOM 1469 C GLY A 103 29.080 -0.042 25.848 1.00 0.00 C ATOM 1470 O GLY A 103 29.010 -0.808 26.808 1.00 0.00 O ATOM 0 H GLY A 103 28.786 0.390 22.870 1.00 0.00 H new ATOM 0 HA2 GLY A 103 29.042 -1.430 24.209 1.00 0.00 H new ATOM 0 HA3 GLY A 103 30.652 -0.917 24.675 1.00 0.00 H new ATOM 1474 N VAL A 104 28.668 1.228 25.919 1.00 0.00 N ATOM 1475 CA VAL A 104 28.143 1.855 27.127 1.00 0.00 C ATOM 1476 C VAL A 104 26.641 2.031 26.907 1.00 0.00 C ATOM 1477 O VAL A 104 26.220 2.822 26.059 1.00 0.00 O ATOM 1478 CB VAL A 104 28.883 3.183 27.409 1.00 0.00 C ATOM 1479 CG1 VAL A 104 28.416 3.805 28.733 1.00 0.00 C ATOM 1480 CG2 VAL A 104 30.408 2.984 27.481 1.00 0.00 C ATOM 0 H VAL A 104 28.693 1.859 25.118 1.00 0.00 H new ATOM 0 HA VAL A 104 28.305 1.243 28.014 1.00 0.00 H new ATOM 0 HB VAL A 104 28.646 3.849 26.579 1.00 0.00 H new ATOM 0 HG11 VAL A 104 28.953 4.738 28.906 1.00 0.00 H new ATOM 0 HG12 VAL A 104 27.346 4.006 28.683 1.00 0.00 H new ATOM 0 HG13 VAL A 104 28.617 3.113 29.551 1.00 0.00 H new ATOM 0 HG21 VAL A 104 30.891 3.941 27.681 1.00 0.00 H new ATOM 0 HG22 VAL A 104 30.646 2.283 28.281 1.00 0.00 H new ATOM 0 HG23 VAL A 104 30.768 2.587 26.532 1.00 0.00 H new ATOM 1490 N ALA A 105 25.832 1.251 27.629 1.00 0.00 N ATOM 1491 CA ALA A 105 24.387 1.428 27.668 1.00 0.00 C ATOM 1492 C ALA A 105 24.047 2.674 28.493 1.00 0.00 C ATOM 1493 O ALA A 105 24.738 2.978 29.471 1.00 0.00 O ATOM 1494 CB ALA A 105 23.739 0.178 28.268 1.00 0.00 C ATOM 0 H ALA A 105 26.167 0.477 28.203 1.00 0.00 H new ATOM 0 HA ALA A 105 23.999 1.568 26.659 1.00 0.00 H new ATOM 0 HB1 ALA A 105 22.657 0.308 28.298 1.00 0.00 H new ATOM 0 HB2 ALA A 105 23.983 -0.689 27.654 1.00 0.00 H new ATOM 0 HB3 ALA A 105 24.114 0.023 29.280 1.00 0.00 H new ATOM 1548 N ALA A 110 14.621 3.301 31.637 1.00 0.00 N ATOM 1549 CA ALA A 110 13.960 2.725 30.471 1.00 0.00 C ATOM 1550 C ALA A 110 14.793 1.594 29.854 1.00 0.00 C ATOM 1551 O ALA A 110 14.215 0.656 29.305 1.00 0.00 O ATOM 1552 CB ALA A 110 13.710 3.821 29.430 1.00 0.00 C ATOM 0 HA ALA A 110 13.010 2.299 30.793 1.00 0.00 H new ATOM 0 HB1 ALA A 110 13.216 3.390 28.559 1.00 0.00 H new ATOM 0 HB2 ALA A 110 13.075 4.595 29.861 1.00 0.00 H new ATOM 0 HB3 ALA A 110 14.661 4.259 29.128 1.00 0.00 H new ATOM 1558 N CYS A 111 16.126 1.651 29.962 1.00 0.00 N ATOM 1559 CA CYS A 111 16.993 0.620 29.418 1.00 0.00 C ATOM 1560 C CYS A 111 16.810 -0.661 30.229 1.00 0.00 C ATOM 1561 O CYS A 111 17.077 -0.671 31.435 1.00 0.00 O ATOM 1562 CB CYS A 111 18.462 1.066 29.480 1.00 0.00 C ATOM 1563 SG CYS A 111 19.625 -0.184 28.865 1.00 0.00 S ATOM 0 H CYS A 111 16.623 2.411 30.427 1.00 0.00 H new ATOM 0 HA CYS A 111 16.729 0.442 28.375 1.00 0.00 H new ATOM 0 HB2 CYS A 111 18.581 1.979 28.897 1.00 0.00 H new ATOM 0 HB3 CYS A 111 18.716 1.311 30.511 1.00 0.00 H new ATOM 1568 N LYS A 112 16.397 -1.746 29.572 1.00 0.00 N ATOM 1569 CA LYS A 112 16.391 -3.088 30.150 1.00 0.00 C ATOM 1570 C LYS A 112 17.436 -3.890 29.397 1.00 0.00 C ATOM 1571 O LYS A 112 17.588 -3.727 28.183 1.00 0.00 O ATOM 1572 CB LYS A 112 15.034 -3.798 30.021 1.00 0.00 C ATOM 1573 CG LYS A 112 13.801 -2.917 30.222 1.00 0.00 C ATOM 1574 CD LYS A 112 13.708 -2.232 31.592 1.00 0.00 C ATOM 1575 CE LYS A 112 12.526 -1.260 31.555 1.00 0.00 C ATOM 1576 NZ LYS A 112 12.367 -0.516 32.828 1.00 0.00 N ATOM 0 H LYS A 112 16.053 -1.716 28.612 1.00 0.00 H new ATOM 0 HA LYS A 112 16.599 -3.009 31.217 1.00 0.00 H new ATOM 0 HB2 LYS A 112 14.975 -4.252 29.032 1.00 0.00 H new ATOM 0 HB3 LYS A 112 14.999 -4.610 30.747 1.00 0.00 H new ATOM 0 HG2 LYS A 112 13.792 -2.150 29.448 1.00 0.00 H new ATOM 0 HG3 LYS A 112 12.910 -3.527 30.077 1.00 0.00 H new ATOM 0 HD2 LYS A 112 13.568 -2.972 32.380 1.00 0.00 H new ATOM 0 HD3 LYS A 112 14.632 -1.700 31.816 1.00 0.00 H new ATOM 0 HE2 LYS A 112 12.667 -0.552 30.738 1.00 0.00 H new ATOM 0 HE3 LYS A 112 11.611 -1.813 31.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 11.554 0.129 32.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 12.206 -1.188 33.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 13.229 0.034 33.019 1.00 0.00 H new ATOM 1590 N ILE A 113 18.117 -4.775 30.110 1.00 0.00 N ATOM 1591 CA ILE A 113 19.108 -5.680 29.556 1.00 0.00 C ATOM 1592 C ILE A 113 19.146 -6.979 30.361 1.00 0.00 C ATOM 1593 O ILE A 113 18.839 -6.971 31.557 1.00 0.00 O ATOM 1594 CB ILE A 113 20.460 -4.943 29.497 1.00 0.00 C ATOM 1595 CG1 ILE A 113 21.454 -5.701 28.593 1.00 0.00 C ATOM 1596 CG2 ILE A 113 21.076 -4.640 30.877 1.00 0.00 C ATOM 1597 CD1 ILE A 113 22.544 -4.792 28.018 1.00 0.00 C ATOM 0 H ILE A 113 17.991 -4.885 31.116 1.00 0.00 H new ATOM 0 HA ILE A 113 18.851 -5.975 28.539 1.00 0.00 H new ATOM 0 HB ILE A 113 20.250 -3.968 29.058 1.00 0.00 H new ATOM 0 HG12 ILE A 113 21.920 -6.503 29.166 1.00 0.00 H new ATOM 0 HG13 ILE A 113 20.909 -6.170 27.774 1.00 0.00 H new ATOM 0 HG21 ILE A 113 22.025 -4.121 30.746 1.00 0.00 H new ATOM 0 HG22 ILE A 113 20.394 -4.011 31.450 1.00 0.00 H new ATOM 0 HG23 ILE A 113 21.245 -5.574 31.413 1.00 0.00 H new ATOM 0 HD11 ILE A 113 23.214 -5.380 27.390 1.00 0.00 H new ATOM 0 HD12 ILE A 113 22.084 -4.005 27.420 1.00 0.00 H new ATOM 0 HD13 ILE A 113 23.111 -4.343 28.834 1.00 0.00 H new ATOM 1609 N SER A 114 19.526 -8.094 29.734 1.00 0.00 N ATOM 1610 CA SER A 114 19.820 -9.365 30.392 1.00 0.00 C ATOM 1611 C SER A 114 20.713 -10.218 29.481 1.00 0.00 C ATOM 1612 O SER A 114 20.648 -10.091 28.255 1.00 0.00 O ATOM 1613 CB SER A 114 18.512 -10.121 30.689 1.00 0.00 C ATOM 1614 OG SER A 114 17.721 -9.437 31.646 1.00 0.00 O ATOM 0 H SER A 114 19.641 -8.137 28.721 1.00 0.00 H new ATOM 0 HA SER A 114 20.337 -9.170 31.331 1.00 0.00 H new ATOM 0 HB2 SER A 114 17.944 -10.243 29.767 1.00 0.00 H new ATOM 0 HB3 SER A 114 18.744 -11.121 31.055 1.00 0.00 H new ATOM 0 HG SER A 114 18.103 -8.550 31.813 1.00 0.00 H new ATOM 1620 N GLY A 115 21.516 -11.099 30.092 1.00 0.00 N ATOM 1621 CA GLY A 115 22.291 -12.151 29.432 1.00 0.00 C ATOM 1622 C GLY A 115 23.175 -11.655 28.291 1.00 0.00 C ATOM 1623 O GLY A 115 23.300 -12.351 27.281 1.00 0.00 O ATOM 0 H GLY A 115 21.647 -11.095 31.104 1.00 0.00 H new ATOM 0 HA2 GLY A 115 22.918 -12.645 30.174 1.00 0.00 H new ATOM 0 HA3 GLY A 115 21.604 -12.903 29.044 1.00 0.00 H new ATOM 1627 N CYS A 116 23.765 -10.463 28.424 1.00 0.00 N ATOM 1628 CA CYS A 116 24.442 -9.783 27.327 1.00 0.00 C ATOM 1629 C CYS A 116 25.895 -9.436 27.653 1.00 0.00 C ATOM 1630 O CYS A 116 26.255 -9.255 28.821 1.00 0.00 O ATOM 1631 CB CYS A 116 23.656 -8.506 27.002 1.00 0.00 C ATOM 1632 SG CYS A 116 23.896 -7.929 25.311 1.00 0.00 S ATOM 0 H CYS A 116 23.784 -9.944 29.302 1.00 0.00 H new ATOM 0 HA CYS A 116 24.472 -10.456 26.470 1.00 0.00 H new ATOM 0 HB2 CYS A 116 22.594 -8.689 27.168 1.00 0.00 H new ATOM 0 HB3 CYS A 116 23.956 -7.718 27.693 1.00 0.00 H new ATOM 1637 N SER A 117 26.695 -9.266 26.600 1.00 0.00 N ATOM 1638 CA SER A 117 28.053 -8.738 26.621 1.00 0.00 C ATOM 1639 C SER A 117 28.139 -7.688 25.509 1.00 0.00 C ATOM 1640 O SER A 117 27.558 -7.879 24.436 1.00 0.00 O ATOM 1641 CB SER A 117 29.055 -9.879 26.393 1.00 0.00 C ATOM 1642 OG SER A 117 28.902 -10.904 27.367 1.00 0.00 O ATOM 0 H SER A 117 26.392 -9.508 25.657 1.00 0.00 H new ATOM 0 HA SER A 117 28.294 -8.284 27.582 1.00 0.00 H new ATOM 0 HB2 SER A 117 28.912 -10.297 25.397 1.00 0.00 H new ATOM 0 HB3 SER A 117 30.071 -9.487 26.432 1.00 0.00 H new ATOM 0 HG SER A 117 29.552 -11.618 27.196 1.00 0.00 H new ATOM 1648 N LEU A 118 28.818 -6.564 25.760 1.00 0.00 N ATOM 1649 CA LEU A 118 28.827 -5.404 24.868 1.00 0.00 C ATOM 1650 C LEU A 118 30.246 -4.848 24.794 1.00 0.00 C ATOM 1651 O LEU A 118 30.983 -4.913 25.785 1.00 0.00 O ATOM 1652 CB LEU A 118 27.856 -4.294 25.332 1.00 0.00 C ATOM 1653 CG LEU A 118 26.427 -4.754 25.698 1.00 0.00 C ATOM 1654 CD1 LEU A 118 26.302 -5.096 27.192 1.00 0.00 C ATOM 1655 CD2 LEU A 118 25.400 -3.665 25.374 1.00 0.00 C ATOM 0 H LEU A 118 29.383 -6.434 26.599 1.00 0.00 H new ATOM 0 HA LEU A 118 28.490 -5.734 23.886 1.00 0.00 H new ATOM 0 HB2 LEU A 118 28.290 -3.798 26.200 1.00 0.00 H new ATOM 0 HB3 LEU A 118 27.785 -3.547 24.541 1.00 0.00 H new ATOM 0 HG LEU A 118 26.231 -5.647 25.104 1.00 0.00 H new ATOM 0 HD11 LEU A 118 25.282 -5.415 27.408 1.00 0.00 H new ATOM 0 HD12 LEU A 118 26.994 -5.901 27.440 1.00 0.00 H new ATOM 0 HD13 LEU A 118 26.541 -4.215 27.788 1.00 0.00 H new ATOM 0 HD21 LEU A 118 24.403 -4.014 25.641 1.00 0.00 H new ATOM 0 HD22 LEU A 118 25.633 -2.764 25.942 1.00 0.00 H new ATOM 0 HD23 LEU A 118 25.432 -3.440 24.308 1.00 0.00 H new ATOM 1667 N SER A 119 30.608 -4.262 23.652 1.00 0.00 N ATOM 1668 CA SER A 119 31.957 -3.793 23.361 1.00 0.00 C ATOM 1669 C SER A 119 31.905 -2.547 22.473 1.00 0.00 C ATOM 1670 O SER A 119 30.921 -2.312 21.761 1.00 0.00 O ATOM 1671 CB SER A 119 32.741 -4.904 22.641 1.00 0.00 C ATOM 1672 OG SER A 119 32.739 -6.124 23.371 1.00 0.00 O ATOM 0 H SER A 119 29.953 -4.098 22.887 1.00 0.00 H new ATOM 0 HA SER A 119 32.454 -3.539 24.297 1.00 0.00 H new ATOM 0 HB2 SER A 119 32.307 -5.072 21.655 1.00 0.00 H new ATOM 0 HB3 SER A 119 33.769 -4.578 22.485 1.00 0.00 H new ATOM 0 HG SER A 119 33.246 -6.802 22.877 1.00 0.00 H new ATOM 1678 N ALA A 120 32.973 -1.748 22.506 1.00 0.00 N ATOM 1679 CA ALA A 120 33.168 -0.654 21.567 1.00 0.00 C ATOM 1680 C ALA A 120 33.568 -1.229 20.207 1.00 0.00 C ATOM 1681 O ALA A 120 34.377 -2.159 20.136 1.00 0.00 O ATOM 1682 CB ALA A 120 34.266 0.284 22.083 1.00 0.00 C ATOM 0 H ALA A 120 33.725 -1.846 23.188 1.00 0.00 H new ATOM 0 HA ALA A 120 32.242 -0.088 21.465 1.00 0.00 H new ATOM 0 HB1 ALA A 120 34.408 1.101 21.376 1.00 0.00 H new ATOM 0 HB2 ALA A 120 33.973 0.689 23.052 1.00 0.00 H new ATOM 0 HB3 ALA A 120 35.198 -0.271 22.188 1.00 0.00 H new ATOM 1688 N MET A 121 33.013 -0.664 19.134 1.00 0.00 N ATOM 1689 CA MET A 121 33.452 -0.942 17.775 1.00 0.00 C ATOM 1690 C MET A 121 34.836 -0.320 17.611 1.00 0.00 C ATOM 1691 O MET A 121 35.759 -1.013 17.139 1.00 0.00 O ATOM 1692 CB MET A 121 32.436 -0.347 16.795 1.00 0.00 C ATOM 1693 CG MET A 121 32.740 -0.660 15.328 1.00 0.00 C ATOM 1694 SD MET A 121 32.654 -2.422 14.900 1.00 0.00 S ATOM 1695 CE MET A 121 32.975 -2.309 13.120 1.00 0.00 C ATOM 1696 OXT MET A 121 35.000 0.863 17.987 1.00 0.00 O ATOM 0 H MET A 121 32.243 0.002 19.189 1.00 0.00 H new ATOM 0 HA MET A 121 33.515 -2.011 17.573 1.00 0.00 H new ATOM 0 HB2 MET A 121 31.444 -0.725 17.040 1.00 0.00 H new ATOM 0 HB3 MET A 121 32.407 0.734 16.928 1.00 0.00 H new ATOM 0 HG2 MET A 121 32.038 -0.112 14.700 1.00 0.00 H new ATOM 0 HG3 MET A 121 33.737 -0.290 15.090 1.00 0.00 H new ATOM 0 HE1 MET A 121 32.960 -3.308 12.683 1.00 0.00 H new ATOM 0 HE2 MET A 121 32.206 -1.696 12.650 1.00 0.00 H new ATOM 0 HE3 MET A 121 33.952 -1.855 12.955 1.00 0.00 H new