USER MOD reduce.3.24.130724 H: found=0, std=0, add=1092, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1091 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 87 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 126 MET CE :methyl 142:sc= -2.7! (180deg=-4.12!) USER MOD Set 2.1: A 19 ASN : amide:sc= -1.47 K(o=-1.5,f=-2.7!) USER MOD Set 2.2: A 90 TYR OH : rot 23:sc= 0.00786 USER MOD Set 3.1: A 24 THR OG1 : rot 180:sc= -0.693 USER MOD Set 3.2: A 25 HIS : no HD1:sc= -0.0207 K(o=-0.71,f=-1.3) USER MOD Set 4.1: A 11 TYR OH : rot -4:sc= 0.195 USER MOD Set 4.2: A 45 THR OG1 : rot 180:sc= -0.666 USER MOD Single : A 1 GLY N :NH3+ 153:sc= 0 (180deg=-0.333) USER MOD Single : A 3 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 HIS : no HD1:sc= -0.0914 X(o=-0.091,f=-0.32) USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=-0.061) USER MOD Single : A 7 SER OG : rot 180:sc=-0.00926 USER MOD Single : A 14 ASN : amide:sc= 0 K(o=0,f=-0.76) USER MOD Single : A 15 TYR OH : rot 180:sc= -0.24 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 HIS : no HD1:sc= -0.427 X(o=-0.43,f=-0.37) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=-0.002) USER MOD Single : A 30 ASN : amide:sc= -0.0218 X(o=-0.022,f=0) USER MOD Single : A 31 CYS SG : rot -88:sc= 0.999 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 ASN : amide:sc= -1.71 K(o=-1.7,f=-6.7!) USER MOD Single : A 43 SER OG : rot 150:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot -56:sc= 1.18 USER MOD Single : A 48 HIS : no HD1:sc= -0.14 K(o=-0.14,f=-0.74) USER MOD Single : A 50 CYS SG : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 THR OG1 : rot 46:sc= 0.662 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 CYS SG : rot 137:sc= -0.175 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 164:sc=-0.00939 (180deg=-0.139) USER MOD Single : A 71 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 SER OG : rot 180:sc= 0.0403 USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 TYR OH : rot -56:sc= 1.11 USER MOD Single : A 95 GLN : amide:sc= -6.32! C(o=-6.3!,f=-6.1!) USER MOD Single : A 96 SER OG : rot 180:sc= -0.0594 USER MOD Single : A 97 HIS : no HE2:sc= -2.53 K(o=-2.5,f=-5.1!) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 118 HIS : no HD1:sc= -1.72 K(o=-1.7,f=-2.5) USER MOD Single : A 125 THR OG1 : rot -59:sc= -4.55! USER MOD Single : A 148 MET CE :methyl -155:sc= -0.0415 (180deg=-0.37) USER MOD Single : A 150 GLN : amide:sc=-0.00169 X(o=-0.0017,f=-0.044) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 18.859 0.184 13.887 1.00 0.00 N ATOM 2 CA GLY A 1 19.609 -0.698 12.950 1.00 0.00 C ATOM 3 C GLY A 1 19.008 -2.088 12.855 1.00 0.00 C ATOM 4 O GLY A 1 18.272 -2.384 11.914 1.00 0.00 O ATOM 0 H1 GLY A 1 19.500 0.906 14.272 1.00 0.00 H new ATOM 0 H2 GLY A 1 18.080 0.649 13.378 1.00 0.00 H new ATOM 0 H3 GLY A 1 18.472 -0.386 14.666 1.00 0.00 H new ATOM 0 HA2 GLY A 1 19.622 -0.243 11.960 1.00 0.00 H new ATOM 0 HA3 GLY A 1 20.645 -0.775 13.279 1.00 0.00 H new ATOM 10 N PRO A 2 19.303 -2.970 13.825 1.00 0.00 N ATOM 11 CA PRO A 2 18.777 -4.339 13.834 1.00 0.00 C ATOM 12 C PRO A 2 17.279 -4.382 14.113 1.00 0.00 C ATOM 13 O PRO A 2 16.581 -5.295 13.672 1.00 0.00 O ATOM 14 CB PRO A 2 19.552 -5.011 14.970 1.00 0.00 C ATOM 15 CG PRO A 2 19.943 -3.894 15.875 1.00 0.00 C ATOM 16 CD PRO A 2 20.172 -2.703 14.987 1.00 0.00 C ATOM 0 HA PRO A 2 18.901 -4.829 12.868 1.00 0.00 H new ATOM 0 HB2 PRO A 2 18.936 -5.744 15.490 1.00 0.00 H new ATOM 0 HB3 PRO A 2 20.427 -5.540 14.593 1.00 0.00 H new ATOM 0 HG2 PRO A 2 19.160 -3.691 16.606 1.00 0.00 H new ATOM 0 HG3 PRO A 2 20.845 -4.143 16.435 1.00 0.00 H new ATOM 0 HD2 PRO A 2 19.901 -1.772 15.486 1.00 0.00 H new ATOM 0 HD3 PRO A 2 21.218 -2.615 14.694 1.00 0.00 H new ATOM 24 N TYR A 3 16.791 -3.388 14.848 1.00 0.00 N ATOM 25 CA TYR A 3 15.375 -3.312 15.187 1.00 0.00 C ATOM 26 C TYR A 3 14.657 -2.298 14.300 1.00 0.00 C ATOM 27 O TYR A 3 14.985 -1.111 14.306 1.00 0.00 O ATOM 28 CB TYR A 3 15.201 -2.932 16.658 1.00 0.00 C ATOM 29 CG TYR A 3 13.961 -3.521 17.293 1.00 0.00 C ATOM 30 CD1 TYR A 3 13.992 -4.774 17.893 1.00 0.00 C ATOM 31 CD2 TYR A 3 12.759 -2.825 17.291 1.00 0.00 C ATOM 32 CE1 TYR A 3 12.861 -5.315 18.474 1.00 0.00 C ATOM 33 CE2 TYR A 3 11.624 -3.359 17.871 1.00 0.00 C ATOM 34 CZ TYR A 3 11.680 -4.603 18.460 1.00 0.00 C ATOM 35 OH TYR A 3 10.551 -5.139 19.036 1.00 0.00 O ATOM 0 H TYR A 3 17.355 -2.624 15.220 1.00 0.00 H new ATOM 0 HA TYR A 3 14.933 -4.294 15.018 1.00 0.00 H new ATOM 0 HB2 TYR A 3 16.077 -3.263 17.216 1.00 0.00 H new ATOM 0 HB3 TYR A 3 15.161 -1.846 16.742 1.00 0.00 H new ATOM 0 HD1 TYR A 3 14.915 -5.334 17.905 1.00 0.00 H new ATOM 0 HD2 TYR A 3 12.711 -1.850 16.828 1.00 0.00 H new ATOM 0 HE1 TYR A 3 12.902 -6.290 18.937 1.00 0.00 H new ATOM 0 HE2 TYR A 3 10.698 -2.804 17.863 1.00 0.00 H new ATOM 0 HH TYR A 3 9.805 -4.510 18.941 1.00 0.00 H new ATOM 45 N GLY A 4 13.676 -2.775 13.541 1.00 0.00 N ATOM 46 CA GLY A 4 12.927 -1.897 12.660 1.00 0.00 C ATOM 47 C GLY A 4 11.448 -2.233 12.628 1.00 0.00 C ATOM 48 O GLY A 4 11.044 -3.324 13.028 1.00 0.00 O ATOM 0 H GLY A 4 13.386 -3.753 13.520 1.00 0.00 H new ATOM 0 HA2 GLY A 4 13.055 -0.865 12.986 1.00 0.00 H new ATOM 0 HA3 GLY A 4 13.334 -1.966 11.651 1.00 0.00 H new ATOM 52 N HIS A 5 10.641 -1.292 12.149 1.00 0.00 N ATOM 53 CA HIS A 5 9.199 -1.493 12.065 1.00 0.00 C ATOM 54 C HIS A 5 8.522 -0.305 11.390 1.00 0.00 C ATOM 55 O HIS A 5 7.605 -0.475 10.587 1.00 0.00 O ATOM 56 CB HIS A 5 8.610 -1.705 13.461 1.00 0.00 C ATOM 57 CG HIS A 5 7.231 -2.285 13.448 1.00 0.00 C ATOM 58 ND1 HIS A 5 6.688 -2.912 12.345 1.00 0.00 N ATOM 59 CD2 HIS A 5 6.278 -2.333 14.409 1.00 0.00 C ATOM 60 CE1 HIS A 5 5.464 -3.318 12.629 1.00 0.00 C ATOM 61 NE2 HIS A 5 5.192 -2.980 13.876 1.00 0.00 N ATOM 0 H HIS A 5 10.961 -0.383 11.813 1.00 0.00 H new ATOM 0 HA HIS A 5 9.016 -2.383 11.462 1.00 0.00 H new ATOM 0 HB2 HIS A 5 9.267 -2.365 14.027 1.00 0.00 H new ATOM 0 HB3 HIS A 5 8.588 -0.750 13.986 1.00 0.00 H new ATOM 0 HD2 HIS A 5 6.358 -1.935 15.410 1.00 0.00 H new ATOM 0 HE1 HIS A 5 4.799 -3.838 11.956 1.00 0.00 H new ATOM 0 HE2 HIS A 5 4.316 -3.169 14.364 1.00 0.00 H new ATOM 70 N GLN A 6 8.981 0.897 11.721 1.00 0.00 N ATOM 71 CA GLN A 6 8.420 2.115 11.147 1.00 0.00 C ATOM 72 C GLN A 6 8.856 2.283 9.694 1.00 0.00 C ATOM 73 O GLN A 6 9.572 3.226 9.355 1.00 0.00 O ATOM 74 CB GLN A 6 8.846 3.334 11.968 1.00 0.00 C ATOM 75 CG GLN A 6 10.350 3.560 11.983 1.00 0.00 C ATOM 76 CD GLN A 6 10.917 3.616 13.389 1.00 0.00 C ATOM 77 OE1 GLN A 6 11.245 2.588 13.980 1.00 0.00 O ATOM 78 NE2 GLN A 6 11.035 4.823 13.932 1.00 0.00 N ATOM 0 H GLN A 6 9.740 1.054 12.384 1.00 0.00 H new ATOM 0 HA GLN A 6 7.333 2.033 11.172 1.00 0.00 H new ATOM 0 HB2 GLN A 6 8.357 4.222 11.566 1.00 0.00 H new ATOM 0 HB3 GLN A 6 8.495 3.213 12.993 1.00 0.00 H new ATOM 0 HG2 GLN A 6 10.840 2.759 11.429 1.00 0.00 H new ATOM 0 HG3 GLN A 6 10.579 4.492 11.465 1.00 0.00 H new ATOM 0 HE21 GLN A 6 10.751 5.649 13.406 1.00 0.00 H new ATOM 0 HE22 GLN A 6 11.410 4.923 14.875 1.00 0.00 H new ATOM 87 N SER A 7 8.420 1.363 8.841 1.00 0.00 N ATOM 88 CA SER A 7 8.765 1.408 7.424 1.00 0.00 C ATOM 89 C SER A 7 7.521 1.619 6.567 1.00 0.00 C ATOM 90 O SER A 7 7.562 2.325 5.559 1.00 0.00 O ATOM 91 CB SER A 7 9.472 0.117 7.008 1.00 0.00 C ATOM 92 OG SER A 7 8.557 -0.961 6.920 1.00 0.00 O ATOM 0 H SER A 7 7.827 0.577 9.106 1.00 0.00 H new ATOM 0 HA SER A 7 9.439 2.250 7.267 1.00 0.00 H new ATOM 0 HB2 SER A 7 9.962 0.261 6.045 1.00 0.00 H new ATOM 0 HB3 SER A 7 10.252 -0.123 7.730 1.00 0.00 H new ATOM 0 HG SER A 7 9.034 -1.774 6.651 1.00 0.00 H new ATOM 98 N GLY A 8 6.415 1.002 6.974 1.00 0.00 N ATOM 99 CA GLY A 8 5.176 1.135 6.232 1.00 0.00 C ATOM 100 C GLY A 8 4.938 -0.027 5.288 1.00 0.00 C ATOM 101 O GLY A 8 5.256 0.054 4.102 1.00 0.00 O ATOM 0 H GLY A 8 6.356 0.413 7.804 1.00 0.00 H new ATOM 0 HA2 GLY A 8 4.343 1.207 6.931 1.00 0.00 H new ATOM 0 HA3 GLY A 8 5.195 2.064 5.662 1.00 0.00 H new ATOM 105 N ALA A 9 4.377 -1.110 5.815 1.00 0.00 N ATOM 106 CA ALA A 9 4.097 -2.294 5.011 1.00 0.00 C ATOM 107 C ALA A 9 2.910 -3.071 5.570 1.00 0.00 C ATOM 108 O ALA A 9 2.554 -2.924 6.739 1.00 0.00 O ATOM 109 CB ALA A 9 5.328 -3.186 4.938 1.00 0.00 C ATOM 0 H ALA A 9 4.107 -1.192 6.795 1.00 0.00 H new ATOM 0 HA ALA A 9 3.840 -1.966 4.004 1.00 0.00 H new ATOM 0 HB1 ALA A 9 5.104 -4.066 4.335 1.00 0.00 H new ATOM 0 HB2 ALA A 9 6.151 -2.634 4.484 1.00 0.00 H new ATOM 0 HB3 ALA A 9 5.612 -3.498 5.943 1.00 0.00 H new ATOM 115 N VAL A 10 2.302 -3.897 4.726 1.00 0.00 N ATOM 116 CA VAL A 10 1.155 -4.701 5.132 1.00 0.00 C ATOM 117 C VAL A 10 1.562 -6.153 5.367 1.00 0.00 C ATOM 118 O VAL A 10 1.981 -6.846 4.439 1.00 0.00 O ATOM 119 CB VAL A 10 0.038 -4.657 4.069 1.00 0.00 C ATOM 120 CG1 VAL A 10 -1.186 -5.431 4.535 1.00 0.00 C ATOM 121 CG2 VAL A 10 -0.327 -3.217 3.739 1.00 0.00 C ATOM 0 H VAL A 10 2.585 -4.028 3.755 1.00 0.00 H new ATOM 0 HA VAL A 10 0.779 -4.276 6.062 1.00 0.00 H new ATOM 0 HB VAL A 10 0.411 -5.133 3.162 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -1.959 -5.385 3.768 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -0.913 -6.471 4.713 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -1.564 -4.992 5.458 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -1.116 -3.205 2.987 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -0.677 -2.714 4.641 1.00 0.00 H new ATOM 0 HG23 VAL A 10 0.550 -2.699 3.352 1.00 0.00 H new ATOM 131 N TYR A 11 1.437 -6.612 6.609 1.00 0.00 N ATOM 132 CA TYR A 11 1.794 -7.986 6.949 1.00 0.00 C ATOM 133 C TYR A 11 0.542 -8.839 7.127 1.00 0.00 C ATOM 134 O TYR A 11 -0.256 -8.605 8.033 1.00 0.00 O ATOM 135 CB TYR A 11 2.623 -7.995 8.239 1.00 0.00 C ATOM 136 CG TYR A 11 3.017 -9.375 8.720 1.00 0.00 C ATOM 137 CD1 TYR A 11 2.069 -10.260 9.222 1.00 0.00 C ATOM 138 CD2 TYR A 11 4.343 -9.788 8.682 1.00 0.00 C ATOM 139 CE1 TYR A 11 2.431 -11.516 9.668 1.00 0.00 C ATOM 140 CE2 TYR A 11 4.712 -11.043 9.129 1.00 0.00 C ATOM 141 CZ TYR A 11 3.753 -11.902 9.620 1.00 0.00 C ATOM 142 OH TYR A 11 4.115 -13.152 10.069 1.00 0.00 O ATOM 0 H TYR A 11 1.093 -6.057 7.393 1.00 0.00 H new ATOM 0 HA TYR A 11 2.383 -8.408 6.135 1.00 0.00 H new ATOM 0 HB2 TYR A 11 3.527 -7.407 8.079 1.00 0.00 H new ATOM 0 HB3 TYR A 11 2.055 -7.498 9.025 1.00 0.00 H new ATOM 0 HD1 TYR A 11 1.032 -9.960 9.264 1.00 0.00 H new ATOM 0 HD2 TYR A 11 5.097 -9.118 8.297 1.00 0.00 H new ATOM 0 HE1 TYR A 11 1.682 -12.192 10.052 1.00 0.00 H new ATOM 0 HE2 TYR A 11 5.747 -11.349 9.094 1.00 0.00 H new ATOM 0 HH TYR A 11 3.331 -13.605 10.444 1.00 0.00 H new ATOM 152 N VAL A 12 0.380 -9.835 6.259 1.00 0.00 N ATOM 153 CA VAL A 12 -0.770 -10.729 6.328 1.00 0.00 C ATOM 154 C VAL A 12 -0.342 -12.186 6.506 1.00 0.00 C ATOM 155 O VAL A 12 0.242 -12.785 5.603 1.00 0.00 O ATOM 156 CB VAL A 12 -1.664 -10.591 5.080 1.00 0.00 C ATOM 157 CG1 VAL A 12 -2.866 -11.520 5.169 1.00 0.00 C ATOM 158 CG2 VAL A 12 -2.111 -9.148 4.918 1.00 0.00 C ATOM 0 H VAL A 12 1.030 -10.042 5.501 1.00 0.00 H new ATOM 0 HA VAL A 12 -1.348 -10.433 7.204 1.00 0.00 H new ATOM 0 HB VAL A 12 -1.084 -10.879 4.203 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -3.482 -11.405 4.277 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -2.523 -12.552 5.242 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -3.455 -11.270 6.051 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -2.742 -9.060 4.034 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -2.675 -8.841 5.799 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -1.237 -8.507 4.805 1.00 0.00 H new ATOM 168 N GLY A 13 -0.648 -12.753 7.669 1.00 0.00 N ATOM 169 CA GLY A 13 -0.302 -14.140 7.940 1.00 0.00 C ATOM 170 C GLY A 13 1.153 -14.466 7.650 1.00 0.00 C ATOM 171 O GLY A 13 2.058 -13.805 8.159 1.00 0.00 O ATOM 0 H GLY A 13 -1.130 -12.277 8.431 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -0.515 -14.362 8.986 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -0.939 -14.790 7.340 1.00 0.00 H new ATOM 175 N ASN A 14 1.375 -15.495 6.834 1.00 0.00 N ATOM 176 CA ASN A 14 2.728 -15.920 6.480 1.00 0.00 C ATOM 177 C ASN A 14 3.224 -15.221 5.215 1.00 0.00 C ATOM 178 O ASN A 14 4.183 -15.667 4.587 1.00 0.00 O ATOM 179 CB ASN A 14 2.772 -17.436 6.286 1.00 0.00 C ATOM 180 CG ASN A 14 2.884 -18.184 7.600 1.00 0.00 C ATOM 181 OD1 ASN A 14 2.346 -17.754 8.621 1.00 0.00 O ATOM 182 ND2 ASN A 14 3.588 -19.310 7.583 1.00 0.00 N ATOM 0 H ASN A 14 0.635 -16.050 6.405 1.00 0.00 H new ATOM 0 HA ASN A 14 3.388 -15.640 7.301 1.00 0.00 H new ATOM 0 HB2 ASN A 14 1.872 -17.759 5.763 1.00 0.00 H new ATOM 0 HB3 ASN A 14 3.620 -17.694 5.651 1.00 0.00 H new ATOM 0 HD21 ASN A 14 3.699 -19.855 8.438 1.00 0.00 H new ATOM 0 HD22 ASN A 14 4.017 -19.630 6.715 1.00 0.00 H new ATOM 189 N TYR A 15 2.574 -14.121 4.854 1.00 0.00 N ATOM 190 CA TYR A 15 2.951 -13.348 3.674 1.00 0.00 C ATOM 191 C TYR A 15 3.071 -11.873 4.044 1.00 0.00 C ATOM 192 O TYR A 15 2.148 -11.297 4.619 1.00 0.00 O ATOM 193 CB TYR A 15 1.899 -13.496 2.572 1.00 0.00 C ATOM 194 CG TYR A 15 2.015 -14.748 1.726 1.00 0.00 C ATOM 195 CD1 TYR A 15 3.155 -15.543 1.739 1.00 0.00 C ATOM 196 CD2 TYR A 15 0.964 -15.128 0.905 1.00 0.00 C ATOM 197 CE1 TYR A 15 3.236 -16.680 0.958 1.00 0.00 C ATOM 198 CE2 TYR A 15 1.039 -16.260 0.124 1.00 0.00 C ATOM 199 CZ TYR A 15 2.175 -17.035 0.154 1.00 0.00 C ATOM 200 OH TYR A 15 2.254 -18.167 -0.624 1.00 0.00 O ATOM 0 H TYR A 15 1.777 -13.741 5.365 1.00 0.00 H new ATOM 0 HA TYR A 15 3.907 -13.724 3.309 1.00 0.00 H new ATOM 0 HB2 TYR A 15 0.911 -13.479 3.032 1.00 0.00 H new ATOM 0 HB3 TYR A 15 1.960 -12.628 1.916 1.00 0.00 H new ATOM 0 HD1 TYR A 15 3.989 -15.268 2.368 1.00 0.00 H new ATOM 0 HD2 TYR A 15 0.069 -14.524 0.877 1.00 0.00 H new ATOM 0 HE1 TYR A 15 4.128 -17.288 0.978 1.00 0.00 H new ATOM 0 HE2 TYR A 15 0.209 -16.538 -0.509 1.00 0.00 H new ATOM 0 HH TYR A 15 1.422 -18.275 -1.130 1.00 0.00 H new ATOM 210 N LYS A 16 4.199 -11.260 3.713 1.00 0.00 N ATOM 211 CA LYS A 16 4.405 -9.850 4.018 1.00 0.00 C ATOM 212 C LYS A 16 4.642 -9.048 2.745 1.00 0.00 C ATOM 213 O LYS A 16 5.649 -9.239 2.063 1.00 0.00 O ATOM 214 CB LYS A 16 5.594 -9.679 4.968 1.00 0.00 C ATOM 215 CG LYS A 16 5.629 -8.327 5.660 1.00 0.00 C ATOM 216 CD LYS A 16 6.521 -7.344 4.918 1.00 0.00 C ATOM 217 CE LYS A 16 6.788 -6.098 5.749 1.00 0.00 C ATOM 218 NZ LYS A 16 8.125 -6.143 6.403 1.00 0.00 N ATOM 0 H LYS A 16 4.980 -11.712 3.237 1.00 0.00 H new ATOM 0 HA LYS A 16 3.504 -9.474 4.502 1.00 0.00 H new ATOM 0 HB2 LYS A 16 5.561 -10.464 5.724 1.00 0.00 H new ATOM 0 HB3 LYS A 16 6.519 -9.815 4.408 1.00 0.00 H new ATOM 0 HG2 LYS A 16 4.618 -7.925 5.726 1.00 0.00 H new ATOM 0 HG3 LYS A 16 5.991 -8.449 6.681 1.00 0.00 H new ATOM 0 HD2 LYS A 16 7.466 -7.826 4.668 1.00 0.00 H new ATOM 0 HD3 LYS A 16 6.049 -7.061 3.977 1.00 0.00 H new ATOM 0 HE2 LYS A 16 6.725 -5.216 5.112 1.00 0.00 H new ATOM 0 HE3 LYS A 16 6.015 -5.997 6.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 8.269 -5.276 6.960 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 8.177 -6.970 7.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 8.865 -6.214 5.676 1.00 0.00 H new ATOM 232 N VAL A 17 3.717 -8.142 2.427 1.00 0.00 N ATOM 233 CA VAL A 17 3.860 -7.319 1.232 1.00 0.00 C ATOM 234 C VAL A 17 4.398 -5.937 1.597 1.00 0.00 C ATOM 235 O VAL A 17 3.801 -5.215 2.397 1.00 0.00 O ATOM 236 CB VAL A 17 2.526 -7.198 0.435 1.00 0.00 C ATOM 237 CG1 VAL A 17 1.576 -8.339 0.774 1.00 0.00 C ATOM 238 CG2 VAL A 17 1.834 -5.859 0.667 1.00 0.00 C ATOM 0 H VAL A 17 2.874 -7.963 2.972 1.00 0.00 H new ATOM 0 HA VAL A 17 4.577 -7.817 0.580 1.00 0.00 H new ATOM 0 HB VAL A 17 2.790 -7.259 -0.621 1.00 0.00 H new ATOM 0 HG11 VAL A 17 0.655 -8.227 0.203 1.00 0.00 H new ATOM 0 HG12 VAL A 17 2.045 -9.290 0.523 1.00 0.00 H new ATOM 0 HG13 VAL A 17 1.347 -8.317 1.839 1.00 0.00 H new ATOM 0 HG21 VAL A 17 0.910 -5.823 0.091 1.00 0.00 H new ATOM 0 HG22 VAL A 17 1.606 -5.746 1.727 1.00 0.00 H new ATOM 0 HG23 VAL A 17 2.492 -5.050 0.350 1.00 0.00 H new ATOM 248 N VAL A 18 5.535 -5.582 1.008 1.00 0.00 N ATOM 249 CA VAL A 18 6.165 -4.293 1.270 1.00 0.00 C ATOM 250 C VAL A 18 6.656 -3.643 -0.021 1.00 0.00 C ATOM 251 O VAL A 18 6.858 -4.319 -1.030 1.00 0.00 O ATOM 252 CB VAL A 18 7.351 -4.443 2.246 1.00 0.00 C ATOM 253 CG1 VAL A 18 8.413 -5.361 1.663 1.00 0.00 C ATOM 254 CG2 VAL A 18 7.951 -3.088 2.584 1.00 0.00 C ATOM 0 H VAL A 18 6.040 -6.170 0.345 1.00 0.00 H new ATOM 0 HA VAL A 18 5.407 -3.654 1.723 1.00 0.00 H new ATOM 0 HB VAL A 18 6.974 -4.889 3.166 1.00 0.00 H new ATOM 0 HG11 VAL A 18 9.240 -5.453 2.367 1.00 0.00 H new ATOM 0 HG12 VAL A 18 7.982 -6.345 1.479 1.00 0.00 H new ATOM 0 HG13 VAL A 18 8.779 -4.944 0.725 1.00 0.00 H new ATOM 0 HG21 VAL A 18 8.785 -3.221 3.273 1.00 0.00 H new ATOM 0 HG22 VAL A 18 8.307 -2.610 1.671 1.00 0.00 H new ATOM 0 HG23 VAL A 18 7.192 -2.460 3.050 1.00 0.00 H new ATOM 264 N ASN A 19 6.863 -2.332 0.023 1.00 0.00 N ATOM 265 CA ASN A 19 7.352 -1.596 -1.137 1.00 0.00 C ATOM 266 C ASN A 19 8.712 -2.133 -1.569 1.00 0.00 C ATOM 267 O ASN A 19 9.541 -2.488 -0.731 1.00 0.00 O ATOM 268 CB ASN A 19 7.456 -0.103 -0.816 1.00 0.00 C ATOM 269 CG ASN A 19 6.115 0.507 -0.459 1.00 0.00 C ATOM 270 OD1 ASN A 19 5.402 1.018 -1.322 1.00 0.00 O ATOM 271 ND2 ASN A 19 5.763 0.456 0.821 1.00 0.00 N ATOM 0 H ASN A 19 6.700 -1.757 0.849 1.00 0.00 H new ATOM 0 HA ASN A 19 6.644 -1.730 -1.955 1.00 0.00 H new ATOM 0 HB2 ASN A 19 8.149 0.040 0.013 1.00 0.00 H new ATOM 0 HB3 ASN A 19 7.874 0.422 -1.675 1.00 0.00 H new ATOM 0 HD21 ASN A 19 4.871 0.850 1.121 1.00 0.00 H new ATOM 0 HD22 ASN A 19 6.385 0.023 1.504 1.00 0.00 H new ATOM 278 N ARG A 20 8.939 -2.202 -2.878 1.00 0.00 N ATOM 279 CA ARG A 20 10.202 -2.708 -3.404 1.00 0.00 C ATOM 280 C ARG A 20 11.378 -1.919 -2.839 1.00 0.00 C ATOM 281 O ARG A 20 12.358 -2.497 -2.371 1.00 0.00 O ATOM 282 CB ARG A 20 10.209 -2.634 -4.933 1.00 0.00 C ATOM 283 CG ARG A 20 11.175 -3.609 -5.586 1.00 0.00 C ATOM 284 CD ARG A 20 11.272 -3.373 -7.085 1.00 0.00 C ATOM 285 NE ARG A 20 12.240 -4.266 -7.719 1.00 0.00 N ATOM 286 CZ ARG A 20 13.556 -4.073 -7.692 1.00 0.00 C ATOM 287 NH1 ARG A 20 14.067 -3.023 -7.060 1.00 0.00 N ATOM 288 NH2 ARG A 20 14.365 -4.931 -8.298 1.00 0.00 N ATOM 0 H ARG A 20 8.268 -1.915 -3.591 1.00 0.00 H new ATOM 0 HA ARG A 20 10.305 -3.749 -3.099 1.00 0.00 H new ATOM 0 HB2 ARG A 20 9.203 -2.831 -5.302 1.00 0.00 H new ATOM 0 HB3 ARG A 20 10.468 -1.620 -5.238 1.00 0.00 H new ATOM 0 HG2 ARG A 20 12.162 -3.503 -5.135 1.00 0.00 H new ATOM 0 HG3 ARG A 20 10.846 -4.631 -5.397 1.00 0.00 H new ATOM 0 HD2 ARG A 20 10.292 -3.520 -7.539 1.00 0.00 H new ATOM 0 HD3 ARG A 20 11.558 -2.338 -7.271 1.00 0.00 H new ATOM 0 HE ARG A 20 11.885 -5.086 -8.211 1.00 0.00 H new ATOM 0 HH11 ARG A 20 13.450 -2.359 -6.592 1.00 0.00 H new ATOM 0 HH12 ARG A 20 15.077 -2.880 -7.043 1.00 0.00 H new ATOM 0 HH21 ARG A 20 13.978 -5.739 -8.785 1.00 0.00 H new ATOM 0 HH22 ARG A 20 15.374 -4.783 -8.277 1.00 0.00 H new ATOM 302 N HIS A 21 11.270 -0.597 -2.865 1.00 0.00 N ATOM 303 CA HIS A 21 12.326 0.257 -2.337 1.00 0.00 C ATOM 304 C HIS A 21 12.412 0.143 -0.814 1.00 0.00 C ATOM 305 O HIS A 21 13.336 0.673 -0.197 1.00 0.00 O ATOM 306 CB HIS A 21 12.084 1.713 -2.740 1.00 0.00 C ATOM 307 CG HIS A 21 13.313 2.405 -3.243 1.00 0.00 C ATOM 308 ND1 HIS A 21 14.591 1.982 -2.944 1.00 0.00 N ATOM 309 CD2 HIS A 21 13.456 3.499 -4.030 1.00 0.00 C ATOM 310 CE1 HIS A 21 15.466 2.785 -3.525 1.00 0.00 C ATOM 311 NE2 HIS A 21 14.803 3.711 -4.190 1.00 0.00 N ATOM 0 H HIS A 21 10.467 -0.095 -3.244 1.00 0.00 H new ATOM 0 HA HIS A 21 13.273 -0.076 -2.761 1.00 0.00 H new ATOM 0 HB2 HIS A 21 11.316 1.745 -3.513 1.00 0.00 H new ATOM 0 HB3 HIS A 21 11.694 2.260 -1.881 1.00 0.00 H new ATOM 0 HD2 HIS A 21 12.659 4.093 -4.452 1.00 0.00 H new ATOM 0 HE1 HIS A 21 16.541 2.698 -3.465 1.00 0.00 H new ATOM 0 HE2 HIS A 21 15.223 4.464 -4.735 1.00 0.00 H new ATOM 320 N LEU A 22 11.442 -0.544 -0.212 1.00 0.00 N ATOM 321 CA LEU A 22 11.411 -0.718 1.235 1.00 0.00 C ATOM 322 C LEU A 22 11.693 -2.163 1.638 1.00 0.00 C ATOM 323 O LEU A 22 11.934 -2.445 2.813 1.00 0.00 O ATOM 324 CB LEU A 22 10.049 -0.290 1.783 1.00 0.00 C ATOM 325 CG LEU A 22 10.007 -0.044 3.292 1.00 0.00 C ATOM 326 CD1 LEU A 22 11.028 1.010 3.689 1.00 0.00 C ATOM 327 CD2 LEU A 22 8.610 0.373 3.724 1.00 0.00 C ATOM 0 H LEU A 22 10.668 -0.988 -0.706 1.00 0.00 H new ATOM 0 HA LEU A 22 12.195 -0.091 1.659 1.00 0.00 H new ATOM 0 HB2 LEU A 22 9.739 0.622 1.273 1.00 0.00 H new ATOM 0 HB3 LEU A 22 9.317 -1.058 1.535 1.00 0.00 H new ATOM 0 HG LEU A 22 10.260 -0.974 3.801 1.00 0.00 H new ATOM 0 HD11 LEU A 22 10.984 1.172 4.766 1.00 0.00 H new ATOM 0 HD12 LEU A 22 12.027 0.671 3.414 1.00 0.00 H new ATOM 0 HD13 LEU A 22 10.807 1.944 3.172 1.00 0.00 H new ATOM 0 HD21 LEU A 22 8.598 0.544 4.800 1.00 0.00 H new ATOM 0 HD22 LEU A 22 8.328 1.291 3.208 1.00 0.00 H new ATOM 0 HD23 LEU A 22 7.901 -0.416 3.474 1.00 0.00 H new ATOM 339 N ALA A 23 11.665 -3.082 0.673 1.00 0.00 N ATOM 340 CA ALA A 23 11.919 -4.484 0.962 1.00 0.00 C ATOM 341 C ALA A 23 13.364 -4.694 1.392 1.00 0.00 C ATOM 342 O ALA A 23 14.257 -3.953 0.987 1.00 0.00 O ATOM 343 CB ALA A 23 11.586 -5.341 -0.250 1.00 0.00 C ATOM 0 H ALA A 23 11.470 -2.878 -0.307 1.00 0.00 H new ATOM 0 HA ALA A 23 11.276 -4.789 1.787 1.00 0.00 H new ATOM 0 HB1 ALA A 23 11.781 -6.388 -0.020 1.00 0.00 H new ATOM 0 HB2 ALA A 23 10.534 -5.215 -0.506 1.00 0.00 H new ATOM 0 HB3 ALA A 23 12.204 -5.034 -1.094 1.00 0.00 H new ATOM 349 N THR A 24 13.584 -5.706 2.222 1.00 0.00 N ATOM 350 CA THR A 24 14.922 -6.017 2.709 1.00 0.00 C ATOM 351 C THR A 24 15.468 -7.257 2.008 1.00 0.00 C ATOM 352 O THR A 24 14.741 -7.950 1.298 1.00 0.00 O ATOM 353 CB THR A 24 14.905 -6.229 4.226 1.00 0.00 C ATOM 354 OG1 THR A 24 16.054 -6.942 4.647 1.00 0.00 O ATOM 355 CG2 THR A 24 13.689 -6.987 4.716 1.00 0.00 C ATOM 0 H THR A 24 12.853 -6.325 2.572 1.00 0.00 H new ATOM 0 HA THR A 24 15.575 -5.174 2.484 1.00 0.00 H new ATOM 0 HB THR A 24 14.883 -5.227 4.654 1.00 0.00 H new ATOM 0 HG1 THR A 24 16.025 -7.065 5.619 1.00 0.00 H new ATOM 0 HG21 THR A 24 13.743 -7.101 5.799 1.00 0.00 H new ATOM 0 HG22 THR A 24 12.786 -6.435 4.454 1.00 0.00 H new ATOM 0 HG23 THR A 24 13.661 -7.971 4.249 1.00 0.00 H new ATOM 363 N HIS A 25 16.754 -7.530 2.208 1.00 0.00 N ATOM 364 CA HIS A 25 17.392 -8.689 1.590 1.00 0.00 C ATOM 365 C HIS A 25 16.637 -9.971 1.926 1.00 0.00 C ATOM 366 O HIS A 25 16.631 -10.924 1.147 1.00 0.00 O ATOM 367 CB HIS A 25 18.845 -8.804 2.055 1.00 0.00 C ATOM 368 CG HIS A 25 18.985 -9.044 3.527 1.00 0.00 C ATOM 369 ND1 HIS A 25 18.860 -8.044 4.467 1.00 0.00 N ATOM 370 CD2 HIS A 25 19.236 -10.180 4.219 1.00 0.00 C ATOM 371 CE1 HIS A 25 19.031 -8.554 5.674 1.00 0.00 C ATOM 372 NE2 HIS A 25 19.259 -9.848 5.551 1.00 0.00 N ATOM 0 H HIS A 25 17.373 -6.967 2.791 1.00 0.00 H new ATOM 0 HA HIS A 25 17.372 -8.550 0.509 1.00 0.00 H new ATOM 0 HB2 HIS A 25 19.327 -9.619 1.515 1.00 0.00 H new ATOM 0 HB3 HIS A 25 19.376 -7.889 1.792 1.00 0.00 H new ATOM 0 HD2 HIS A 25 19.390 -11.164 3.801 1.00 0.00 H new ATOM 0 HE1 HIS A 25 18.991 -8.005 6.603 1.00 0.00 H new ATOM 0 HE2 HIS A 25 19.425 -10.496 6.321 1.00 0.00 H new ATOM 381 N VAL A 26 16.004 -9.985 3.094 1.00 0.00 N ATOM 382 CA VAL A 26 15.247 -11.146 3.542 1.00 0.00 C ATOM 383 C VAL A 26 13.905 -11.252 2.823 1.00 0.00 C ATOM 384 O VAL A 26 13.399 -12.355 2.601 1.00 0.00 O ATOM 385 CB VAL A 26 15.009 -11.108 5.066 1.00 0.00 C ATOM 386 CG1 VAL A 26 14.217 -9.870 5.457 1.00 0.00 C ATOM 387 CG2 VAL A 26 14.301 -12.373 5.530 1.00 0.00 C ATOM 0 H VAL A 26 16.001 -9.203 3.749 1.00 0.00 H new ATOM 0 HA VAL A 26 15.846 -12.023 3.298 1.00 0.00 H new ATOM 0 HB VAL A 26 15.978 -11.059 5.562 1.00 0.00 H new ATOM 0 HG11 VAL A 26 14.061 -9.864 6.536 1.00 0.00 H new ATOM 0 HG12 VAL A 26 14.770 -8.977 5.165 1.00 0.00 H new ATOM 0 HG13 VAL A 26 13.252 -9.881 4.951 1.00 0.00 H new ATOM 0 HG21 VAL A 26 14.142 -12.327 6.607 1.00 0.00 H new ATOM 0 HG22 VAL A 26 13.339 -12.458 5.025 1.00 0.00 H new ATOM 0 HG23 VAL A 26 14.914 -13.242 5.290 1.00 0.00 H new ATOM 397 N ASP A 27 13.327 -10.110 2.454 1.00 0.00 N ATOM 398 CA ASP A 27 12.050 -10.104 1.762 1.00 0.00 C ATOM 399 C ASP A 27 12.219 -10.710 0.385 1.00 0.00 C ATOM 400 O ASP A 27 11.413 -11.531 -0.051 1.00 0.00 O ATOM 401 CB ASP A 27 11.507 -8.673 1.648 1.00 0.00 C ATOM 402 CG ASP A 27 10.005 -8.609 1.849 1.00 0.00 C ATOM 403 OD1 ASP A 27 9.264 -8.821 0.866 1.00 0.00 O ATOM 404 OD2 ASP A 27 9.570 -8.345 2.990 1.00 0.00 O ATOM 0 H ASP A 27 13.723 -9.186 2.623 1.00 0.00 H new ATOM 0 HA ASP A 27 11.335 -10.697 2.332 1.00 0.00 H new ATOM 0 HB2 ASP A 27 11.998 -8.041 2.388 1.00 0.00 H new ATOM 0 HB3 ASP A 27 11.758 -8.269 0.667 1.00 0.00 H new ATOM 409 N TRP A 28 13.288 -10.309 -0.289 1.00 0.00 N ATOM 410 CA TRP A 28 13.579 -10.824 -1.611 1.00 0.00 C ATOM 411 C TRP A 28 14.117 -12.248 -1.545 1.00 0.00 C ATOM 412 O TRP A 28 13.908 -13.046 -2.458 1.00 0.00 O ATOM 413 CB TRP A 28 14.548 -9.902 -2.349 1.00 0.00 C ATOM 414 CG TRP A 28 13.885 -8.636 -2.788 1.00 0.00 C ATOM 415 CD1 TRP A 28 12.908 -8.508 -3.733 1.00 0.00 C ATOM 416 CD2 TRP A 28 14.135 -7.321 -2.287 1.00 0.00 C ATOM 417 NE1 TRP A 28 12.533 -7.192 -3.847 1.00 0.00 N ATOM 418 CE2 TRP A 28 13.273 -6.443 -2.969 1.00 0.00 C ATOM 419 CE3 TRP A 28 15.003 -6.801 -1.327 1.00 0.00 C ATOM 420 CZ2 TRP A 28 13.253 -5.075 -2.718 1.00 0.00 C ATOM 421 CZ3 TRP A 28 14.984 -5.444 -1.081 1.00 0.00 C ATOM 422 CH2 TRP A 28 14.113 -4.594 -1.771 1.00 0.00 C ATOM 0 H TRP A 28 13.964 -9.630 0.061 1.00 0.00 H new ATOM 0 HA TRP A 28 12.645 -10.853 -2.173 1.00 0.00 H new ATOM 0 HB2 TRP A 28 15.390 -9.665 -1.699 1.00 0.00 H new ATOM 0 HB3 TRP A 28 14.952 -10.421 -3.218 1.00 0.00 H new ATOM 0 HD1 TRP A 28 12.491 -9.322 -4.307 1.00 0.00 H new ATOM 0 HE1 TRP A 28 11.820 -6.831 -4.481 1.00 0.00 H new ATOM 0 HE3 TRP A 28 15.677 -7.449 -0.786 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 12.583 -4.417 -3.252 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 15.654 -5.030 -0.342 1.00 0.00 H new ATOM 0 HH2 TRP A 28 14.120 -3.537 -1.551 1.00 0.00 H new ATOM 433 N GLN A 29 14.808 -12.563 -0.453 1.00 0.00 N ATOM 434 CA GLN A 29 15.371 -13.894 -0.263 1.00 0.00 C ATOM 435 C GLN A 29 14.274 -14.951 -0.302 1.00 0.00 C ATOM 436 O GLN A 29 14.428 -16.001 -0.926 1.00 0.00 O ATOM 437 CB GLN A 29 16.123 -13.968 1.068 1.00 0.00 C ATOM 438 CG GLN A 29 17.628 -13.805 0.927 1.00 0.00 C ATOM 439 CD GLN A 29 18.403 -14.784 1.788 1.00 0.00 C ATOM 440 OE1 GLN A 29 18.155 -14.906 2.986 1.00 0.00 O ATOM 441 NE2 GLN A 29 19.350 -15.487 1.177 1.00 0.00 N ATOM 0 H GLN A 29 14.991 -11.914 0.313 1.00 0.00 H new ATOM 0 HA GLN A 29 16.071 -14.089 -1.076 1.00 0.00 H new ATOM 0 HB2 GLN A 29 15.743 -13.193 1.734 1.00 0.00 H new ATOM 0 HB3 GLN A 29 15.913 -14.927 1.542 1.00 0.00 H new ATOM 0 HG2 GLN A 29 17.909 -13.944 -0.117 1.00 0.00 H new ATOM 0 HG3 GLN A 29 17.907 -12.787 1.200 1.00 0.00 H new ATOM 0 HE21 GLN A 29 19.522 -15.353 0.180 1.00 0.00 H new ATOM 0 HE22 GLN A 29 19.906 -16.161 1.704 1.00 0.00 H new ATOM 450 N ASN A 30 13.162 -14.660 0.365 1.00 0.00 N ATOM 451 CA ASN A 30 12.030 -15.579 0.405 1.00 0.00 C ATOM 452 C ASN A 30 10.795 -14.936 -0.222 1.00 0.00 C ATOM 453 O ASN A 30 9.678 -15.098 0.269 1.00 0.00 O ATOM 454 CB ASN A 30 11.735 -15.992 1.849 1.00 0.00 C ATOM 455 CG ASN A 30 12.239 -17.386 2.166 1.00 0.00 C ATOM 456 OD1 ASN A 30 13.125 -17.564 3.002 1.00 0.00 O ATOM 457 ND2 ASN A 30 11.676 -18.385 1.496 1.00 0.00 N ATOM 0 H ASN A 30 13.020 -13.794 0.886 1.00 0.00 H new ATOM 0 HA ASN A 30 12.287 -16.468 -0.170 1.00 0.00 H new ATOM 0 HB2 ASN A 30 12.198 -15.278 2.530 1.00 0.00 H new ATOM 0 HB3 ASN A 30 10.660 -15.949 2.024 1.00 0.00 H new ATOM 0 HD21 ASN A 30 11.975 -19.345 1.666 1.00 0.00 H new ATOM 0 HD22 ASN A 30 10.945 -18.192 0.812 1.00 0.00 H new ATOM 464 N CYS A 31 11.007 -14.202 -1.310 1.00 0.00 N ATOM 465 CA CYS A 31 9.914 -13.529 -2.002 1.00 0.00 C ATOM 466 C CYS A 31 9.149 -14.494 -2.899 1.00 0.00 C ATOM 467 O CYS A 31 9.732 -15.171 -3.745 1.00 0.00 O ATOM 468 CB CYS A 31 10.444 -12.364 -2.838 1.00 0.00 C ATOM 469 SG CYS A 31 11.562 -12.860 -4.171 1.00 0.00 S ATOM 0 H CYS A 31 11.925 -14.058 -1.731 1.00 0.00 H new ATOM 0 HA CYS A 31 9.232 -13.147 -1.243 1.00 0.00 H new ATOM 0 HB2 CYS A 31 9.599 -11.826 -3.268 1.00 0.00 H new ATOM 0 HB3 CYS A 31 10.965 -11.667 -2.182 1.00 0.00 H new ATOM 0 HG CYS A 31 12.781 -12.905 -3.721 1.00 0.00 H new ATOM 475 N VAL A 32 7.836 -14.537 -2.712 1.00 0.00 N ATOM 476 CA VAL A 32 6.979 -15.402 -3.506 1.00 0.00 C ATOM 477 C VAL A 32 6.527 -14.688 -4.776 1.00 0.00 C ATOM 478 O VAL A 32 6.454 -15.292 -5.846 1.00 0.00 O ATOM 479 CB VAL A 32 5.739 -15.854 -2.707 1.00 0.00 C ATOM 480 CG1 VAL A 32 6.135 -16.813 -1.596 1.00 0.00 C ATOM 481 CG2 VAL A 32 5.002 -14.655 -2.135 1.00 0.00 C ATOM 0 H VAL A 32 7.342 -13.980 -2.015 1.00 0.00 H new ATOM 0 HA VAL A 32 7.563 -16.283 -3.771 1.00 0.00 H new ATOM 0 HB VAL A 32 5.069 -16.376 -3.389 1.00 0.00 H new ATOM 0 HG11 VAL A 32 5.246 -17.119 -1.045 1.00 0.00 H new ATOM 0 HG12 VAL A 32 6.615 -17.691 -2.027 1.00 0.00 H new ATOM 0 HG13 VAL A 32 6.829 -16.317 -0.917 1.00 0.00 H new ATOM 0 HG21 VAL A 32 4.131 -14.996 -1.575 1.00 0.00 H new ATOM 0 HG22 VAL A 32 5.666 -14.102 -1.471 1.00 0.00 H new ATOM 0 HG23 VAL A 32 4.679 -14.005 -2.948 1.00 0.00 H new ATOM 491 N TRP A 33 6.227 -13.395 -4.653 1.00 0.00 N ATOM 492 CA TRP A 33 5.784 -12.602 -5.798 1.00 0.00 C ATOM 493 C TRP A 33 6.411 -11.206 -5.776 1.00 0.00 C ATOM 494 O TRP A 33 6.698 -10.660 -4.711 1.00 0.00 O ATOM 495 CB TRP A 33 4.251 -12.509 -5.815 1.00 0.00 C ATOM 496 CG TRP A 33 3.714 -11.236 -6.404 1.00 0.00 C ATOM 497 CD1 TRP A 33 3.286 -11.034 -7.685 1.00 0.00 C ATOM 498 CD2 TRP A 33 3.551 -9.989 -5.726 1.00 0.00 C ATOM 499 NE1 TRP A 33 2.868 -9.733 -7.843 1.00 0.00 N ATOM 500 CE2 TRP A 33 3.023 -9.071 -6.651 1.00 0.00 C ATOM 501 CE3 TRP A 33 3.803 -9.561 -4.422 1.00 0.00 C ATOM 502 CZ2 TRP A 33 2.744 -7.748 -6.309 1.00 0.00 C ATOM 503 CZ3 TRP A 33 3.528 -8.251 -4.084 1.00 0.00 C ATOM 504 CH2 TRP A 33 3.003 -7.360 -5.026 1.00 0.00 C ATOM 0 H TRP A 33 6.282 -12.877 -3.776 1.00 0.00 H new ATOM 0 HA TRP A 33 6.115 -13.100 -6.709 1.00 0.00 H new ATOM 0 HB2 TRP A 33 3.854 -13.352 -6.380 1.00 0.00 H new ATOM 0 HB3 TRP A 33 3.882 -12.607 -4.794 1.00 0.00 H new ATOM 0 HD1 TRP A 33 3.277 -11.786 -8.460 1.00 0.00 H new ATOM 0 HE1 TRP A 33 2.503 -9.327 -8.705 1.00 0.00 H new ATOM 0 HE3 TRP A 33 4.207 -10.244 -3.689 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 2.338 -7.056 -7.032 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 3.721 -7.909 -3.078 1.00 0.00 H new ATOM 0 HH2 TRP A 33 2.798 -6.341 -4.731 1.00 0.00 H new ATOM 515 N GLU A 34 6.611 -10.635 -6.962 1.00 0.00 N ATOM 516 CA GLU A 34 7.193 -9.302 -7.088 1.00 0.00 C ATOM 517 C GLU A 34 6.666 -8.598 -8.337 1.00 0.00 C ATOM 518 O GLU A 34 6.987 -8.987 -9.461 1.00 0.00 O ATOM 519 CB GLU A 34 8.721 -9.387 -7.147 1.00 0.00 C ATOM 520 CG GLU A 34 9.323 -10.343 -6.132 1.00 0.00 C ATOM 521 CD GLU A 34 9.227 -11.792 -6.568 1.00 0.00 C ATOM 522 OE1 GLU A 34 9.574 -12.086 -7.732 1.00 0.00 O ATOM 523 OE2 GLU A 34 8.804 -12.633 -5.747 1.00 0.00 O ATOM 0 H GLU A 34 6.378 -11.077 -7.851 1.00 0.00 H new ATOM 0 HA GLU A 34 6.903 -8.724 -6.211 1.00 0.00 H new ATOM 0 HB2 GLU A 34 9.019 -9.700 -8.148 1.00 0.00 H new ATOM 0 HB3 GLU A 34 9.137 -8.392 -6.986 1.00 0.00 H new ATOM 0 HG2 GLU A 34 10.370 -10.084 -5.971 1.00 0.00 H new ATOM 0 HG3 GLU A 34 8.814 -10.220 -5.176 1.00 0.00 H new ATOM 530 N ASP A 35 5.857 -7.561 -8.135 1.00 0.00 N ATOM 531 CA ASP A 35 5.287 -6.809 -9.250 1.00 0.00 C ATOM 532 C ASP A 35 5.947 -5.439 -9.382 1.00 0.00 C ATOM 533 O ASP A 35 5.789 -4.576 -8.519 1.00 0.00 O ATOM 534 CB ASP A 35 3.779 -6.642 -9.061 1.00 0.00 C ATOM 535 CG ASP A 35 3.073 -6.268 -10.350 1.00 0.00 C ATOM 536 OD1 ASP A 35 3.752 -5.783 -11.279 1.00 0.00 O ATOM 537 OD2 ASP A 35 1.841 -6.459 -10.429 1.00 0.00 O ATOM 0 H ASP A 35 5.582 -7.223 -7.213 1.00 0.00 H new ATOM 0 HA ASP A 35 5.474 -7.371 -10.165 1.00 0.00 H new ATOM 0 HB2 ASP A 35 3.359 -7.571 -8.676 1.00 0.00 H new ATOM 0 HB3 ASP A 35 3.592 -5.873 -8.311 1.00 0.00 H new ATOM 542 N TYR A 36 6.684 -5.246 -10.472 1.00 0.00 N ATOM 543 CA TYR A 36 7.367 -3.982 -10.720 1.00 0.00 C ATOM 544 C TYR A 36 6.366 -2.859 -10.981 1.00 0.00 C ATOM 545 O TYR A 36 6.592 -1.713 -10.594 1.00 0.00 O ATOM 546 CB TYR A 36 8.326 -4.116 -11.905 1.00 0.00 C ATOM 547 CG TYR A 36 7.700 -4.754 -13.126 1.00 0.00 C ATOM 548 CD1 TYR A 36 6.996 -3.989 -14.047 1.00 0.00 C ATOM 549 CD2 TYR A 36 7.814 -6.119 -13.357 1.00 0.00 C ATOM 550 CE1 TYR A 36 6.423 -4.566 -15.164 1.00 0.00 C ATOM 551 CE2 TYR A 36 7.244 -6.705 -14.471 1.00 0.00 C ATOM 552 CZ TYR A 36 6.549 -5.924 -15.371 1.00 0.00 C ATOM 553 OH TYR A 36 5.978 -6.503 -16.481 1.00 0.00 O ATOM 0 H TYR A 36 6.823 -5.950 -11.197 1.00 0.00 H new ATOM 0 HA TYR A 36 7.940 -3.730 -9.827 1.00 0.00 H new ATOM 0 HB2 TYR A 36 8.698 -3.127 -12.173 1.00 0.00 H new ATOM 0 HB3 TYR A 36 9.188 -4.708 -11.598 1.00 0.00 H new ATOM 0 HD1 TYR A 36 6.895 -2.926 -13.887 1.00 0.00 H new ATOM 0 HD2 TYR A 36 8.357 -6.733 -12.654 1.00 0.00 H new ATOM 0 HE1 TYR A 36 5.879 -3.957 -15.871 1.00 0.00 H new ATOM 0 HE2 TYR A 36 7.342 -7.768 -14.636 1.00 0.00 H new ATOM 0 HH TYR A 36 6.160 -7.466 -16.478 1.00 0.00 H new ATOM 563 N ASN A 37 5.257 -3.196 -11.634 1.00 0.00 N ATOM 564 CA ASN A 37 4.223 -2.216 -11.938 1.00 0.00 C ATOM 565 C ASN A 37 3.595 -1.674 -10.657 1.00 0.00 C ATOM 566 O ASN A 37 2.988 -0.606 -10.656 1.00 0.00 O ATOM 567 CB ASN A 37 3.145 -2.844 -12.827 1.00 0.00 C ATOM 568 CG ASN A 37 3.137 -2.265 -14.229 1.00 0.00 C ATOM 569 OD1 ASN A 37 2.078 -2.045 -14.816 1.00 0.00 O ATOM 570 ND2 ASN A 37 4.322 -2.017 -14.775 1.00 0.00 N ATOM 0 H ASN A 37 5.053 -4.140 -11.962 1.00 0.00 H new ATOM 0 HA ASN A 37 4.686 -1.386 -12.472 1.00 0.00 H new ATOM 0 HB2 ASN A 37 3.307 -3.920 -12.883 1.00 0.00 H new ATOM 0 HB3 ASN A 37 2.168 -2.692 -12.369 1.00 0.00 H new ATOM 0 HD21 ASN A 37 4.379 -1.629 -15.717 1.00 0.00 H new ATOM 0 HD22 ASN A 37 5.176 -2.215 -14.253 1.00 0.00 H new ATOM 577 N ARG A 38 3.743 -2.416 -9.566 1.00 0.00 N ATOM 578 CA ARG A 38 3.186 -2.000 -8.285 1.00 0.00 C ATOM 579 C ARG A 38 4.288 -1.720 -7.265 1.00 0.00 C ATOM 580 O ARG A 38 4.001 -1.380 -6.117 1.00 0.00 O ATOM 581 CB ARG A 38 2.243 -3.076 -7.746 1.00 0.00 C ATOM 582 CG ARG A 38 0.850 -3.022 -8.354 1.00 0.00 C ATOM 583 CD ARG A 38 0.835 -3.584 -9.766 1.00 0.00 C ATOM 584 NE ARG A 38 -0.396 -4.315 -10.051 1.00 0.00 N ATOM 585 CZ ARG A 38 -0.669 -4.880 -11.226 1.00 0.00 C ATOM 586 NH1 ARG A 38 0.202 -4.802 -12.225 1.00 0.00 N ATOM 587 NH2 ARG A 38 -1.815 -5.524 -11.402 1.00 0.00 N ATOM 0 H ARG A 38 4.242 -3.305 -9.543 1.00 0.00 H new ATOM 0 HA ARG A 38 2.629 -1.077 -8.447 1.00 0.00 H new ATOM 0 HB2 ARG A 38 2.677 -4.057 -7.938 1.00 0.00 H new ATOM 0 HB3 ARG A 38 2.163 -2.969 -6.664 1.00 0.00 H new ATOM 0 HG2 ARG A 38 0.157 -3.586 -7.730 1.00 0.00 H new ATOM 0 HG3 ARG A 38 0.498 -1.990 -8.368 1.00 0.00 H new ATOM 0 HD2 ARG A 38 0.947 -2.769 -10.482 1.00 0.00 H new ATOM 0 HD3 ARG A 38 1.690 -4.247 -9.901 1.00 0.00 H new ATOM 0 HE ARG A 38 -1.088 -4.398 -9.306 1.00 0.00 H new ATOM 0 HH11 ARG A 38 1.085 -4.308 -12.095 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -0.012 -5.236 -13.123 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -2.487 -5.587 -10.638 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -2.024 -5.957 -12.302 1.00 0.00 H new ATOM 601 N ASP A 39 5.548 -1.870 -7.681 1.00 0.00 N ATOM 602 CA ASP A 39 6.679 -1.636 -6.785 1.00 0.00 C ATOM 603 C ASP A 39 6.440 -2.324 -5.446 1.00 0.00 C ATOM 604 O ASP A 39 6.813 -1.813 -4.391 1.00 0.00 O ATOM 605 CB ASP A 39 6.893 -0.134 -6.578 1.00 0.00 C ATOM 606 CG ASP A 39 8.114 0.382 -7.316 1.00 0.00 C ATOM 607 OD1 ASP A 39 8.031 0.560 -8.549 1.00 0.00 O ATOM 608 OD2 ASP A 39 9.152 0.608 -6.660 1.00 0.00 O ATOM 0 H ASP A 39 5.808 -2.151 -8.627 1.00 0.00 H new ATOM 0 HA ASP A 39 7.576 -2.055 -7.240 1.00 0.00 H new ATOM 0 HB2 ASP A 39 6.010 0.407 -6.919 1.00 0.00 H new ATOM 0 HB3 ASP A 39 7.001 0.072 -5.513 1.00 0.00 H new ATOM 613 N LEU A 40 5.792 -3.482 -5.506 1.00 0.00 N ATOM 614 CA LEU A 40 5.472 -4.245 -4.309 1.00 0.00 C ATOM 615 C LEU A 40 5.862 -5.711 -4.477 1.00 0.00 C ATOM 616 O LEU A 40 5.902 -6.229 -5.593 1.00 0.00 O ATOM 617 CB LEU A 40 3.976 -4.125 -4.014 1.00 0.00 C ATOM 618 CG LEU A 40 3.474 -4.925 -2.812 1.00 0.00 C ATOM 619 CD1 LEU A 40 3.925 -4.275 -1.514 1.00 0.00 C ATOM 620 CD2 LEU A 40 1.957 -5.043 -2.857 1.00 0.00 C ATOM 0 H LEU A 40 5.478 -3.913 -6.375 1.00 0.00 H new ATOM 0 HA LEU A 40 6.041 -3.840 -3.472 1.00 0.00 H new ATOM 0 HB2 LEU A 40 3.739 -3.073 -3.853 1.00 0.00 H new ATOM 0 HB3 LEU A 40 3.423 -4.445 -4.897 1.00 0.00 H new ATOM 0 HG LEU A 40 3.900 -5.927 -2.856 1.00 0.00 H new ATOM 0 HD11 LEU A 40 3.559 -4.858 -0.669 1.00 0.00 H new ATOM 0 HD12 LEU A 40 5.014 -4.238 -1.485 1.00 0.00 H new ATOM 0 HD13 LEU A 40 3.526 -3.262 -1.456 1.00 0.00 H new ATOM 0 HD21 LEU A 40 1.611 -5.615 -1.996 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.514 -4.047 -2.833 1.00 0.00 H new ATOM 0 HD23 LEU A 40 1.659 -5.551 -3.774 1.00 0.00 H new ATOM 632 N LEU A 41 6.140 -6.375 -3.360 1.00 0.00 N ATOM 633 CA LEU A 41 6.519 -7.785 -3.382 1.00 0.00 C ATOM 634 C LEU A 41 6.007 -8.513 -2.142 1.00 0.00 C ATOM 635 O LEU A 41 5.760 -7.898 -1.108 1.00 0.00 O ATOM 636 CB LEU A 41 8.046 -7.961 -3.540 1.00 0.00 C ATOM 637 CG LEU A 41 8.970 -7.471 -2.398 1.00 0.00 C ATOM 638 CD1 LEU A 41 9.874 -6.351 -2.888 1.00 0.00 C ATOM 639 CD2 LEU A 41 8.205 -7.012 -1.166 1.00 0.00 C ATOM 0 H LEU A 41 6.110 -5.961 -2.428 1.00 0.00 H new ATOM 0 HA LEU A 41 6.046 -8.236 -4.254 1.00 0.00 H new ATOM 0 HB2 LEU A 41 8.243 -9.022 -3.693 1.00 0.00 H new ATOM 0 HB3 LEU A 41 8.346 -7.446 -4.453 1.00 0.00 H new ATOM 0 HG LEU A 41 9.571 -8.330 -2.101 1.00 0.00 H new ATOM 0 HD11 LEU A 41 10.516 -6.019 -2.073 1.00 0.00 H new ATOM 0 HD12 LEU A 41 10.490 -6.714 -3.710 1.00 0.00 H new ATOM 0 HD13 LEU A 41 9.264 -5.516 -3.233 1.00 0.00 H new ATOM 0 HD21 LEU A 41 8.909 -6.681 -0.403 1.00 0.00 H new ATOM 0 HD22 LEU A 41 7.546 -6.186 -1.434 1.00 0.00 H new ATOM 0 HD23 LEU A 41 7.611 -7.839 -0.777 1.00 0.00 H new ATOM 651 N VAL A 42 5.837 -9.825 -2.257 1.00 0.00 N ATOM 652 CA VAL A 42 5.351 -10.629 -1.141 1.00 0.00 C ATOM 653 C VAL A 42 6.384 -11.673 -0.755 1.00 0.00 C ATOM 654 O VAL A 42 6.857 -12.435 -1.599 1.00 0.00 O ATOM 655 CB VAL A 42 3.999 -11.322 -1.466 1.00 0.00 C ATOM 656 CG1 VAL A 42 3.668 -12.434 -0.466 1.00 0.00 C ATOM 657 CG2 VAL A 42 2.874 -10.298 -1.500 1.00 0.00 C ATOM 0 H VAL A 42 6.028 -10.354 -3.108 1.00 0.00 H new ATOM 0 HA VAL A 42 5.184 -9.952 -0.303 1.00 0.00 H new ATOM 0 HB VAL A 42 4.099 -11.782 -2.449 1.00 0.00 H new ATOM 0 HG11 VAL A 42 2.715 -12.891 -0.732 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.452 -13.191 -0.491 1.00 0.00 H new ATOM 0 HG13 VAL A 42 3.601 -12.013 0.537 1.00 0.00 H new ATOM 0 HG21 VAL A 42 1.933 -10.799 -1.729 1.00 0.00 H new ATOM 0 HG22 VAL A 42 2.798 -9.809 -0.529 1.00 0.00 H new ATOM 0 HG23 VAL A 42 3.084 -9.552 -2.267 1.00 0.00 H new ATOM 667 N SER A 43 6.714 -11.703 0.528 1.00 0.00 N ATOM 668 CA SER A 43 7.678 -12.654 1.057 1.00 0.00 C ATOM 669 C SER A 43 7.032 -13.485 2.156 1.00 0.00 C ATOM 670 O SER A 43 6.039 -13.069 2.753 1.00 0.00 O ATOM 671 CB SER A 43 8.910 -11.927 1.595 1.00 0.00 C ATOM 672 OG SER A 43 8.712 -11.499 2.931 1.00 0.00 O ATOM 0 H SER A 43 6.323 -11.072 1.228 1.00 0.00 H new ATOM 0 HA SER A 43 7.997 -13.316 0.252 1.00 0.00 H new ATOM 0 HB2 SER A 43 9.775 -12.588 1.547 1.00 0.00 H new ATOM 0 HB3 SER A 43 9.132 -11.066 0.964 1.00 0.00 H new ATOM 0 HG SER A 43 9.571 -11.488 3.402 1.00 0.00 H new ATOM 678 N THR A 44 7.581 -14.663 2.412 1.00 0.00 N ATOM 679 CA THR A 44 7.028 -15.539 3.433 1.00 0.00 C ATOM 680 C THR A 44 7.777 -15.407 4.750 1.00 0.00 C ATOM 681 O THR A 44 8.987 -15.185 4.776 1.00 0.00 O ATOM 682 CB THR A 44 7.045 -16.984 2.946 1.00 0.00 C ATOM 683 OG1 THR A 44 8.366 -17.495 2.918 1.00 0.00 O ATOM 684 CG2 THR A 44 6.459 -17.127 1.564 1.00 0.00 C ATOM 0 H THR A 44 8.402 -15.032 1.931 1.00 0.00 H new ATOM 0 HA THR A 44 5.996 -15.237 3.614 1.00 0.00 H new ATOM 0 HB THR A 44 6.435 -17.547 3.652 1.00 0.00 H new ATOM 0 HG1 THR A 44 8.351 -18.423 2.604 1.00 0.00 H new ATOM 0 HG21 THR A 44 6.493 -18.173 1.261 1.00 0.00 H new ATOM 0 HG22 THR A 44 5.424 -16.785 1.570 1.00 0.00 H new ATOM 0 HG23 THR A 44 7.036 -16.526 0.860 1.00 0.00 H new ATOM 692 N THR A 45 7.035 -15.530 5.844 1.00 0.00 N ATOM 693 CA THR A 45 7.603 -15.410 7.179 1.00 0.00 C ATOM 694 C THR A 45 7.042 -16.483 8.108 1.00 0.00 C ATOM 695 O THR A 45 6.113 -17.205 7.749 1.00 0.00 O ATOM 696 CB THR A 45 7.309 -14.018 7.745 1.00 0.00 C ATOM 697 OG1 THR A 45 7.426 -14.010 9.157 1.00 0.00 O ATOM 698 CG2 THR A 45 5.924 -13.507 7.396 1.00 0.00 C ATOM 0 H THR A 45 6.032 -15.714 5.831 1.00 0.00 H new ATOM 0 HA THR A 45 8.682 -15.550 7.109 1.00 0.00 H new ATOM 0 HB THR A 45 8.048 -13.362 7.285 1.00 0.00 H new ATOM 0 HG1 THR A 45 7.236 -13.110 9.496 1.00 0.00 H new ATOM 0 HG21 THR A 45 5.782 -12.516 7.828 1.00 0.00 H new ATOM 0 HG22 THR A 45 5.820 -13.449 6.313 1.00 0.00 H new ATOM 0 HG23 THR A 45 5.173 -14.188 7.796 1.00 0.00 H new ATOM 706 N THR A 46 7.613 -16.579 9.305 1.00 0.00 N ATOM 707 CA THR A 46 7.171 -17.563 10.288 1.00 0.00 C ATOM 708 C THR A 46 6.717 -16.880 11.573 1.00 0.00 C ATOM 709 O THR A 46 6.908 -17.407 12.669 1.00 0.00 O ATOM 710 CB THR A 46 8.297 -18.551 10.593 1.00 0.00 C ATOM 711 OG1 THR A 46 7.882 -19.502 11.557 1.00 0.00 O ATOM 712 CG2 THR A 46 9.551 -17.885 11.118 1.00 0.00 C ATOM 0 H THR A 46 8.383 -15.987 9.618 1.00 0.00 H new ATOM 0 HA THR A 46 6.325 -18.106 9.867 1.00 0.00 H new ATOM 0 HB THR A 46 8.528 -19.028 9.641 1.00 0.00 H new ATOM 0 HG1 THR A 46 7.567 -19.037 12.360 1.00 0.00 H new ATOM 0 HG21 THR A 46 10.310 -18.642 11.314 1.00 0.00 H new ATOM 0 HG22 THR A 46 9.926 -17.179 10.377 1.00 0.00 H new ATOM 0 HG23 THR A 46 9.321 -17.354 12.042 1.00 0.00 H new ATOM 720 N ALA A 47 6.115 -15.702 11.433 1.00 0.00 N ATOM 721 CA ALA A 47 5.634 -14.947 12.584 1.00 0.00 C ATOM 722 C ALA A 47 4.112 -14.847 12.580 1.00 0.00 C ATOM 723 O ALA A 47 3.453 -15.289 11.639 1.00 0.00 O ATOM 724 CB ALA A 47 6.255 -13.558 12.599 1.00 0.00 C ATOM 0 H ALA A 47 5.949 -15.250 10.534 1.00 0.00 H new ATOM 0 HA ALA A 47 5.934 -15.479 13.487 1.00 0.00 H new ATOM 0 HB1 ALA A 47 5.888 -13.005 13.463 1.00 0.00 H new ATOM 0 HB2 ALA A 47 7.340 -13.645 12.658 1.00 0.00 H new ATOM 0 HB3 ALA A 47 5.983 -13.028 11.686 1.00 0.00 H new ATOM 730 N HIS A 48 3.561 -14.264 13.640 1.00 0.00 N ATOM 731 CA HIS A 48 2.116 -14.106 13.761 1.00 0.00 C ATOM 732 C HIS A 48 1.638 -12.872 13.002 1.00 0.00 C ATOM 733 O HIS A 48 2.358 -11.879 12.898 1.00 0.00 O ATOM 734 CB HIS A 48 1.714 -14.001 15.233 1.00 0.00 C ATOM 735 CG HIS A 48 1.897 -15.276 15.996 1.00 0.00 C ATOM 736 ND1 HIS A 48 3.092 -15.961 16.042 1.00 0.00 N ATOM 737 CD2 HIS A 48 1.027 -15.992 16.747 1.00 0.00 C ATOM 738 CE1 HIS A 48 2.950 -17.043 16.787 1.00 0.00 C ATOM 739 NE2 HIS A 48 1.706 -17.083 17.227 1.00 0.00 N ATOM 0 H HIS A 48 4.093 -13.893 14.427 1.00 0.00 H new ATOM 0 HA HIS A 48 1.642 -14.985 13.324 1.00 0.00 H new ATOM 0 HB2 HIS A 48 2.303 -13.216 15.707 1.00 0.00 H new ATOM 0 HB3 HIS A 48 0.669 -13.697 15.295 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -0.009 -15.749 16.933 1.00 0.00 H new ATOM 0 HE1 HIS A 48 3.720 -17.770 17.000 1.00 0.00 H new ATOM 0 HE2 HIS A 48 1.313 -17.808 17.827 1.00 0.00 H new ATOM 748 N GLY A 49 0.420 -12.942 12.474 1.00 0.00 N ATOM 749 CA GLY A 49 -0.130 -11.824 11.731 1.00 0.00 C ATOM 750 C GLY A 49 -1.101 -11.001 12.553 1.00 0.00 C ATOM 751 O GLY A 49 -1.270 -11.239 13.750 1.00 0.00 O ATOM 0 H GLY A 49 -0.195 -13.752 12.548 1.00 0.00 H new ATOM 0 HA2 GLY A 49 0.684 -11.185 11.388 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -0.638 -12.198 10.842 1.00 0.00 H new ATOM 755 N CYS A 50 -1.740 -10.030 11.911 1.00 0.00 N ATOM 756 CA CYS A 50 -2.699 -9.166 12.589 1.00 0.00 C ATOM 757 C CYS A 50 -3.547 -8.398 11.580 1.00 0.00 C ATOM 758 O CYS A 50 -4.762 -8.280 11.737 1.00 0.00 O ATOM 759 CB CYS A 50 -1.972 -8.187 13.512 1.00 0.00 C ATOM 760 SG CYS A 50 -2.934 -7.679 14.956 1.00 0.00 S ATOM 0 H CYS A 50 -1.611 -9.821 10.921 1.00 0.00 H new ATOM 0 HA CYS A 50 -3.358 -9.796 13.186 1.00 0.00 H new ATOM 0 HB2 CYS A 50 -1.043 -8.646 13.851 1.00 0.00 H new ATOM 0 HB3 CYS A 50 -1.699 -7.300 12.940 1.00 0.00 H new ATOM 0 HG CYS A 50 -2.233 -6.854 15.676 1.00 0.00 H new ATOM 766 N ASP A 51 -2.898 -7.877 10.543 1.00 0.00 N ATOM 767 CA ASP A 51 -3.594 -7.121 9.508 1.00 0.00 C ATOM 768 C ASP A 51 -4.394 -8.048 8.600 1.00 0.00 C ATOM 769 O ASP A 51 -3.915 -9.109 8.200 1.00 0.00 O ATOM 770 CB ASP A 51 -2.594 -6.313 8.678 1.00 0.00 C ATOM 771 CG ASP A 51 -1.644 -5.505 9.540 1.00 0.00 C ATOM 772 OD1 ASP A 51 -2.111 -4.892 10.523 1.00 0.00 O ATOM 773 OD2 ASP A 51 -0.434 -5.488 9.234 1.00 0.00 O ATOM 0 H ASP A 51 -1.892 -7.965 10.397 1.00 0.00 H new ATOM 0 HA ASP A 51 -4.287 -6.437 9.998 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -2.019 -6.991 8.046 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -3.137 -5.641 8.013 1.00 0.00 H new ATOM 778 N THR A 52 -5.615 -7.637 8.275 1.00 0.00 N ATOM 779 CA THR A 52 -6.485 -8.424 7.410 1.00 0.00 C ATOM 780 C THR A 52 -6.905 -7.610 6.193 1.00 0.00 C ATOM 781 O THR A 52 -7.472 -6.525 6.329 1.00 0.00 O ATOM 782 CB THR A 52 -7.723 -8.889 8.178 1.00 0.00 C ATOM 783 OG1 THR A 52 -7.352 -9.635 9.324 1.00 0.00 O ATOM 784 CG2 THR A 52 -8.653 -9.751 7.351 1.00 0.00 C ATOM 0 H THR A 52 -6.025 -6.761 8.599 1.00 0.00 H new ATOM 0 HA THR A 52 -5.930 -9.299 7.073 1.00 0.00 H new ATOM 0 HB THR A 52 -8.250 -7.976 8.454 1.00 0.00 H new ATOM 0 HG1 THR A 52 -8.158 -9.922 9.803 1.00 0.00 H new ATOM 0 HG21 THR A 52 -9.510 -10.046 7.956 1.00 0.00 H new ATOM 0 HG22 THR A 52 -8.998 -9.187 6.484 1.00 0.00 H new ATOM 0 HG23 THR A 52 -8.122 -10.642 7.016 1.00 0.00 H new ATOM 792 N ILE A 53 -6.628 -8.134 5.005 1.00 0.00 N ATOM 793 CA ILE A 53 -6.987 -7.441 3.771 1.00 0.00 C ATOM 794 C ILE A 53 -8.486 -7.528 3.522 1.00 0.00 C ATOM 795 O ILE A 53 -9.101 -8.572 3.737 1.00 0.00 O ATOM 796 CB ILE A 53 -6.268 -7.998 2.523 1.00 0.00 C ATOM 797 CG1 ILE A 53 -4.852 -8.509 2.835 1.00 0.00 C ATOM 798 CG2 ILE A 53 -6.223 -6.930 1.441 1.00 0.00 C ATOM 799 CD1 ILE A 53 -3.778 -7.437 2.828 1.00 0.00 C ATOM 0 H ILE A 53 -6.159 -9.030 4.869 1.00 0.00 H new ATOM 0 HA ILE A 53 -6.671 -6.408 3.918 1.00 0.00 H new ATOM 0 HB ILE A 53 -6.839 -8.857 2.170 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -4.861 -8.990 3.813 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -4.587 -9.275 2.106 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -5.715 -7.325 0.561 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -7.239 -6.640 1.174 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -5.682 -6.059 1.812 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -2.813 -7.888 3.058 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -3.736 -6.971 1.844 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -4.013 -6.681 3.578 1.00 0.00 H new ATOM 811 N ALA A 54 -9.070 -6.429 3.062 1.00 0.00 N ATOM 812 CA ALA A 54 -10.496 -6.389 2.777 1.00 0.00 C ATOM 813 C ALA A 54 -10.767 -6.672 1.304 1.00 0.00 C ATOM 814 O ALA A 54 -10.184 -6.040 0.423 1.00 0.00 O ATOM 815 CB ALA A 54 -11.077 -5.041 3.174 1.00 0.00 C ATOM 0 H ALA A 54 -8.578 -5.555 2.879 1.00 0.00 H new ATOM 0 HA ALA A 54 -10.982 -7.167 3.366 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -12.145 -5.026 2.955 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -10.923 -4.879 4.241 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -10.580 -4.251 2.611 1.00 0.00 H new ATOM 821 N ARG A 55 -11.658 -7.622 1.044 1.00 0.00 N ATOM 822 CA ARG A 55 -12.012 -7.983 -0.323 1.00 0.00 C ATOM 823 C ARG A 55 -13.256 -7.224 -0.773 1.00 0.00 C ATOM 824 O ARG A 55 -14.092 -7.756 -1.502 1.00 0.00 O ATOM 825 CB ARG A 55 -12.249 -9.490 -0.429 1.00 0.00 C ATOM 826 CG ARG A 55 -12.234 -10.011 -1.857 1.00 0.00 C ATOM 827 CD ARG A 55 -10.836 -9.965 -2.452 1.00 0.00 C ATOM 828 NE ARG A 55 -10.849 -10.187 -3.896 1.00 0.00 N ATOM 829 CZ ARG A 55 -10.970 -11.385 -4.462 1.00 0.00 C ATOM 830 NH1 ARG A 55 -11.088 -12.473 -3.710 1.00 0.00 N ATOM 831 NH2 ARG A 55 -10.974 -11.498 -5.783 1.00 0.00 N ATOM 0 H ARG A 55 -12.148 -8.156 1.762 1.00 0.00 H new ATOM 0 HA ARG A 55 -11.183 -7.710 -0.976 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -11.484 -10.011 0.147 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -13.210 -9.731 0.026 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -12.605 -11.036 -1.875 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -12.911 -9.416 -2.470 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -10.382 -8.997 -2.238 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -10.213 -10.722 -1.974 1.00 0.00 H new ATOM 0 HE ARG A 55 -10.760 -9.375 -4.507 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -11.086 -12.393 -2.693 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -11.180 -13.389 -4.149 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -10.884 -10.666 -6.366 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -11.067 -12.417 -6.216 1.00 0.00 H new ATOM 845 N CYS A 56 -13.370 -5.977 -0.327 1.00 0.00 N ATOM 846 CA CYS A 56 -14.509 -5.138 -0.674 1.00 0.00 C ATOM 847 C CYS A 56 -14.153 -4.172 -1.800 1.00 0.00 C ATOM 848 O CYS A 56 -12.982 -4.007 -2.140 1.00 0.00 O ATOM 849 CB CYS A 56 -14.981 -4.361 0.553 1.00 0.00 C ATOM 850 SG CYS A 56 -13.679 -3.368 1.355 1.00 0.00 S ATOM 0 H CYS A 56 -12.684 -5.525 0.278 1.00 0.00 H new ATOM 0 HA CYS A 56 -15.315 -5.784 -1.021 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -15.797 -3.701 0.259 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -15.386 -5.064 1.281 1.00 0.00 H new ATOM 855 N GLN A 57 -15.171 -3.543 -2.379 1.00 0.00 N ATOM 856 CA GLN A 57 -14.963 -2.601 -3.472 1.00 0.00 C ATOM 857 C GLN A 57 -15.416 -1.192 -3.090 1.00 0.00 C ATOM 858 O GLN A 57 -15.814 -0.408 -3.951 1.00 0.00 O ATOM 859 CB GLN A 57 -15.713 -3.067 -4.721 1.00 0.00 C ATOM 860 CG GLN A 57 -14.866 -3.908 -5.663 1.00 0.00 C ATOM 861 CD GLN A 57 -15.649 -4.415 -6.858 1.00 0.00 C ATOM 862 OE1 GLN A 57 -16.215 -3.631 -7.620 1.00 0.00 O ATOM 863 NE2 GLN A 57 -15.685 -5.731 -7.026 1.00 0.00 N ATOM 0 H GLN A 57 -16.147 -3.669 -2.110 1.00 0.00 H new ATOM 0 HA GLN A 57 -13.894 -2.568 -3.683 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -16.585 -3.646 -4.416 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -16.082 -2.194 -5.260 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -14.021 -3.315 -6.013 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -14.455 -4.757 -5.116 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -15.201 -6.342 -6.369 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -16.197 -6.131 -7.812 1.00 0.00 H new ATOM 872 N CYS A 58 -15.353 -0.872 -1.800 1.00 0.00 N ATOM 873 CA CYS A 58 -15.756 0.449 -1.329 1.00 0.00 C ATOM 874 C CYS A 58 -14.874 1.531 -1.940 1.00 0.00 C ATOM 875 O CYS A 58 -13.658 1.532 -1.752 1.00 0.00 O ATOM 876 CB CYS A 58 -15.679 0.536 0.197 1.00 0.00 C ATOM 877 SG CYS A 58 -16.414 -0.877 1.077 1.00 0.00 S ATOM 0 H CYS A 58 -15.029 -1.504 -1.068 1.00 0.00 H new ATOM 0 HA CYS A 58 -16.788 0.607 -1.641 1.00 0.00 H new ATOM 0 HB2 CYS A 58 -14.633 0.625 0.490 1.00 0.00 H new ATOM 0 HB3 CYS A 58 -16.179 1.449 0.521 1.00 0.00 H new ATOM 882 N THR A 59 -15.492 2.455 -2.667 1.00 0.00 N ATOM 883 CA THR A 59 -14.752 3.543 -3.295 1.00 0.00 C ATOM 884 C THR A 59 -14.217 4.514 -2.248 1.00 0.00 C ATOM 885 O THR A 59 -13.374 5.356 -2.549 1.00 0.00 O ATOM 886 CB THR A 59 -15.640 4.296 -4.286 1.00 0.00 C ATOM 887 OG1 THR A 59 -15.034 5.515 -4.673 1.00 0.00 O ATOM 888 CG2 THR A 59 -17.013 4.622 -3.736 1.00 0.00 C ATOM 0 H THR A 59 -16.498 2.473 -2.835 1.00 0.00 H new ATOM 0 HA THR A 59 -13.910 3.106 -3.831 1.00 0.00 H new ATOM 0 HB THR A 59 -15.758 3.623 -5.136 1.00 0.00 H new ATOM 0 HG1 THR A 59 -14.093 5.356 -4.895 1.00 0.00 H new ATOM 0 HG21 THR A 59 -17.590 5.156 -4.491 1.00 0.00 H new ATOM 0 HG22 THR A 59 -17.528 3.698 -3.472 1.00 0.00 H new ATOM 0 HG23 THR A 59 -16.911 5.247 -2.849 1.00 0.00 H new ATOM 896 N THR A 60 -14.712 4.400 -1.017 1.00 0.00 N ATOM 897 CA THR A 60 -14.276 5.282 0.059 1.00 0.00 C ATOM 898 C THR A 60 -13.601 4.501 1.182 1.00 0.00 C ATOM 899 O THR A 60 -14.164 3.550 1.726 1.00 0.00 O ATOM 900 CB THR A 60 -15.457 6.091 0.608 1.00 0.00 C ATOM 901 OG1 THR A 60 -15.227 6.478 1.953 1.00 0.00 O ATOM 902 CG2 THR A 60 -16.775 5.347 0.564 1.00 0.00 C ATOM 0 H THR A 60 -15.411 3.709 -0.743 1.00 0.00 H new ATOM 0 HA THR A 60 -13.542 5.972 -0.358 1.00 0.00 H new ATOM 0 HB THR A 60 -15.529 6.960 -0.046 1.00 0.00 H new ATOM 0 HG1 THR A 60 -15.993 6.994 2.281 1.00 0.00 H new ATOM 0 HG21 THR A 60 -17.564 5.981 0.968 1.00 0.00 H new ATOM 0 HG22 THR A 60 -17.011 5.086 -0.468 1.00 0.00 H new ATOM 0 HG23 THR A 60 -16.699 4.437 1.160 1.00 0.00 H new ATOM 910 N GLY A 61 -12.392 4.928 1.525 1.00 0.00 N ATOM 911 CA GLY A 61 -11.636 4.291 2.586 1.00 0.00 C ATOM 912 C GLY A 61 -10.996 5.320 3.493 1.00 0.00 C ATOM 913 O GLY A 61 -11.494 6.439 3.601 1.00 0.00 O ATOM 0 H GLY A 61 -11.917 5.714 1.081 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -12.294 3.647 3.169 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -10.865 3.652 2.155 1.00 0.00 H new ATOM 917 N VAL A 62 -9.893 4.958 4.142 1.00 0.00 N ATOM 918 CA VAL A 62 -9.206 5.890 5.029 1.00 0.00 C ATOM 919 C VAL A 62 -7.690 5.780 4.896 1.00 0.00 C ATOM 920 O VAL A 62 -7.125 4.685 4.930 1.00 0.00 O ATOM 921 CB VAL A 62 -9.609 5.679 6.504 1.00 0.00 C ATOM 922 CG1 VAL A 62 -9.231 4.281 6.976 1.00 0.00 C ATOM 923 CG2 VAL A 62 -8.976 6.744 7.389 1.00 0.00 C ATOM 0 H VAL A 62 -9.460 4.037 4.072 1.00 0.00 H new ATOM 0 HA VAL A 62 -9.514 6.889 4.722 1.00 0.00 H new ATOM 0 HB VAL A 62 -10.692 5.775 6.579 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -9.525 4.157 8.018 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -9.743 3.539 6.363 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -8.153 4.145 6.885 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -9.272 6.579 8.425 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -7.891 6.687 7.308 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -9.312 7.730 7.069 1.00 0.00 H new ATOM 933 N TYR A 63 -7.041 6.931 4.743 1.00 0.00 N ATOM 934 CA TYR A 63 -5.592 6.986 4.604 1.00 0.00 C ATOM 935 C TYR A 63 -4.952 7.593 5.850 1.00 0.00 C ATOM 936 O TYR A 63 -5.564 8.412 6.535 1.00 0.00 O ATOM 937 CB TYR A 63 -5.209 7.797 3.362 1.00 0.00 C ATOM 938 CG TYR A 63 -5.523 9.274 3.472 1.00 0.00 C ATOM 939 CD1 TYR A 63 -4.737 10.111 4.255 1.00 0.00 C ATOM 940 CD2 TYR A 63 -6.600 9.833 2.792 1.00 0.00 C ATOM 941 CE1 TYR A 63 -5.016 11.460 4.359 1.00 0.00 C ATOM 942 CE2 TYR A 63 -6.884 11.182 2.891 1.00 0.00 C ATOM 943 CZ TYR A 63 -6.089 11.990 3.676 1.00 0.00 C ATOM 944 OH TYR A 63 -6.369 13.335 3.776 1.00 0.00 O ATOM 0 H TYR A 63 -7.500 7.841 4.712 1.00 0.00 H new ATOM 0 HA TYR A 63 -5.219 5.968 4.489 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -4.142 7.675 3.176 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -5.732 7.388 2.498 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -3.894 9.700 4.791 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -7.225 9.203 2.177 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -4.396 12.096 4.973 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -7.724 11.601 2.357 1.00 0.00 H new ATOM 0 HH TYR A 63 -7.157 13.546 3.232 1.00 0.00 H new ATOM 954 N PHE A 64 -3.723 7.183 6.140 1.00 0.00 N ATOM 955 CA PHE A 64 -3.004 7.684 7.307 1.00 0.00 C ATOM 956 C PHE A 64 -2.520 9.115 7.082 1.00 0.00 C ATOM 957 O PHE A 64 -1.831 9.400 6.104 1.00 0.00 O ATOM 958 CB PHE A 64 -1.815 6.776 7.627 1.00 0.00 C ATOM 959 CG PHE A 64 -1.659 6.485 9.092 1.00 0.00 C ATOM 960 CD1 PHE A 64 -1.032 7.393 9.929 1.00 0.00 C ATOM 961 CD2 PHE A 64 -2.139 5.302 9.631 1.00 0.00 C ATOM 962 CE1 PHE A 64 -0.887 7.129 11.277 1.00 0.00 C ATOM 963 CE2 PHE A 64 -1.997 5.032 10.979 1.00 0.00 C ATOM 964 CZ PHE A 64 -1.371 5.947 11.803 1.00 0.00 C ATOM 0 H PHE A 64 -3.203 6.505 5.583 1.00 0.00 H new ATOM 0 HA PHE A 64 -3.693 7.684 8.152 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -1.931 5.835 7.089 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -0.902 7.243 7.259 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -0.652 8.319 9.523 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -2.629 4.583 8.991 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -0.396 7.846 11.919 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -2.375 4.107 11.388 1.00 0.00 H new ATOM 0 HZ PHE A 64 -1.260 5.739 12.857 1.00 0.00 H new ATOM 974 N CYS A 65 -2.883 10.008 7.999 1.00 0.00 N ATOM 975 CA CYS A 65 -2.482 11.408 7.902 1.00 0.00 C ATOM 976 C CYS A 65 -1.137 11.633 8.587 1.00 0.00 C ATOM 977 O CYS A 65 -0.873 11.082 9.656 1.00 0.00 O ATOM 978 CB CYS A 65 -3.549 12.312 8.528 1.00 0.00 C ATOM 979 SG CYS A 65 -4.464 13.311 7.332 1.00 0.00 S ATOM 0 H CYS A 65 -3.453 9.788 8.816 1.00 0.00 H new ATOM 0 HA CYS A 65 -2.379 11.661 6.847 1.00 0.00 H new ATOM 0 HB2 CYS A 65 -4.254 11.693 9.083 1.00 0.00 H new ATOM 0 HB3 CYS A 65 -3.071 12.975 9.249 1.00 0.00 H new ATOM 0 HG CYS A 65 -5.729 13.294 7.630 1.00 0.00 H new ATOM 985 N ALA A 66 -0.289 12.445 7.965 1.00 0.00 N ATOM 986 CA ALA A 66 1.029 12.740 8.514 1.00 0.00 C ATOM 987 C ALA A 66 0.995 13.989 9.388 1.00 0.00 C ATOM 988 O ALA A 66 1.633 14.039 10.440 1.00 0.00 O ATOM 989 CB ALA A 66 2.041 12.909 7.391 1.00 0.00 C ATOM 0 H ALA A 66 -0.491 12.911 7.080 1.00 0.00 H new ATOM 0 HA ALA A 66 1.330 11.900 9.139 1.00 0.00 H new ATOM 0 HB1 ALA A 66 3.021 13.129 7.814 1.00 0.00 H new ATOM 0 HB2 ALA A 66 2.095 11.989 6.809 1.00 0.00 H new ATOM 0 HB3 ALA A 66 1.733 13.730 6.744 1.00 0.00 H new ATOM 995 N SER A 67 0.252 14.997 8.945 1.00 0.00 N ATOM 996 CA SER A 67 0.139 16.248 9.686 1.00 0.00 C ATOM 997 C SER A 67 -0.960 16.166 10.741 1.00 0.00 C ATOM 998 O SER A 67 -0.895 16.835 11.771 1.00 0.00 O ATOM 999 CB SER A 67 -0.143 17.407 8.728 1.00 0.00 C ATOM 1000 OG SER A 67 0.403 18.619 9.218 1.00 0.00 O ATOM 0 H SER A 67 -0.281 14.972 8.076 1.00 0.00 H new ATOM 0 HA SER A 67 1.087 16.425 10.194 1.00 0.00 H new ATOM 0 HB2 SER A 67 0.280 17.184 7.748 1.00 0.00 H new ATOM 0 HB3 SER A 67 -1.219 17.518 8.593 1.00 0.00 H new ATOM 0 HG SER A 67 0.210 19.343 8.587 1.00 0.00 H new ATOM 1006 N LYS A 68 -1.971 15.345 10.476 1.00 0.00 N ATOM 1007 CA LYS A 68 -3.085 15.181 11.402 1.00 0.00 C ATOM 1008 C LYS A 68 -2.839 14.022 12.366 1.00 0.00 C ATOM 1009 O LYS A 68 -3.399 13.987 13.461 1.00 0.00 O ATOM 1010 CB LYS A 68 -4.386 14.950 10.629 1.00 0.00 C ATOM 1011 CG LYS A 68 -5.256 16.191 10.519 1.00 0.00 C ATOM 1012 CD LYS A 68 -5.969 16.492 11.827 1.00 0.00 C ATOM 1013 CE LYS A 68 -6.350 17.959 11.929 1.00 0.00 C ATOM 1014 NZ LYS A 68 -6.186 18.481 13.315 1.00 0.00 N ATOM 0 H LYS A 68 -2.041 14.783 9.628 1.00 0.00 H new ATOM 0 HA LYS A 68 -3.172 16.097 11.987 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -4.145 14.595 9.627 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -4.955 14.160 11.119 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -4.640 17.044 10.235 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -5.991 16.051 9.727 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -6.865 15.876 11.904 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -5.325 16.223 12.664 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -5.733 18.543 11.246 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -7.385 18.088 11.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -6.456 19.485 13.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -6.794 17.941 13.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -5.193 18.382 13.608 1.00 0.00 H new ATOM 1028 N SER A 69 -2.005 13.070 11.952 1.00 0.00 N ATOM 1029 CA SER A 69 -1.700 11.909 12.784 1.00 0.00 C ATOM 1030 C SER A 69 -2.982 11.181 13.175 1.00 0.00 C ATOM 1031 O SER A 69 -3.060 10.559 14.235 1.00 0.00 O ATOM 1032 CB SER A 69 -0.938 12.340 14.039 1.00 0.00 C ATOM 1033 OG SER A 69 0.067 11.398 14.374 1.00 0.00 O ATOM 0 H SER A 69 -1.530 13.080 11.049 1.00 0.00 H new ATOM 0 HA SER A 69 -1.073 11.228 12.208 1.00 0.00 H new ATOM 0 HB2 SER A 69 -0.485 13.318 13.875 1.00 0.00 H new ATOM 0 HB3 SER A 69 -1.633 12.447 14.872 1.00 0.00 H new ATOM 0 HG SER A 69 0.540 11.697 15.178 1.00 0.00 H new ATOM 1039 N LYS A 70 -3.986 11.273 12.310 1.00 0.00 N ATOM 1040 CA LYS A 70 -5.276 10.637 12.549 1.00 0.00 C ATOM 1041 C LYS A 70 -5.763 9.914 11.301 1.00 0.00 C ATOM 1042 O LYS A 70 -5.188 10.057 10.222 1.00 0.00 O ATOM 1043 CB LYS A 70 -6.314 11.674 12.978 1.00 0.00 C ATOM 1044 CG LYS A 70 -5.887 12.513 14.170 1.00 0.00 C ATOM 1045 CD LYS A 70 -6.273 13.970 13.984 1.00 0.00 C ATOM 1046 CE LYS A 70 -7.731 14.210 14.338 1.00 0.00 C ATOM 1047 NZ LYS A 70 -7.965 14.146 15.807 1.00 0.00 N ATOM 0 H LYS A 70 -3.930 11.786 11.430 1.00 0.00 H new ATOM 0 HA LYS A 70 -5.146 9.909 13.350 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -6.523 12.335 12.137 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -7.246 11.163 13.221 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -6.351 12.124 15.076 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -4.808 12.434 14.305 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -5.638 14.598 14.609 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -6.095 14.265 12.950 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -8.039 15.186 13.964 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -8.353 13.467 13.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -8.887 14.573 16.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -7.959 13.153 16.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -7.213 14.667 16.301 1.00 0.00 H new ATOM 1061 N HIS A 71 -6.827 9.139 11.456 1.00 0.00 N ATOM 1062 CA HIS A 71 -7.396 8.396 10.339 1.00 0.00 C ATOM 1063 C HIS A 71 -8.341 9.291 9.545 1.00 0.00 C ATOM 1064 O HIS A 71 -9.349 9.768 10.068 1.00 0.00 O ATOM 1065 CB HIS A 71 -8.145 7.163 10.850 1.00 0.00 C ATOM 1066 CG HIS A 71 -7.239 6.089 11.370 1.00 0.00 C ATOM 1067 ND1 HIS A 71 -7.254 5.662 12.681 1.00 0.00 N ATOM 1068 CD2 HIS A 71 -6.288 5.353 10.748 1.00 0.00 C ATOM 1069 CE1 HIS A 71 -6.350 4.712 12.844 1.00 0.00 C ATOM 1070 NE2 HIS A 71 -5.751 4.506 11.686 1.00 0.00 N ATOM 0 H HIS A 71 -7.314 9.008 12.343 1.00 0.00 H new ATOM 0 HA HIS A 71 -6.587 8.068 9.686 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -8.830 7.466 11.642 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -8.753 6.756 10.042 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -6.005 5.420 9.708 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -6.138 4.193 13.767 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -5.009 3.827 11.515 1.00 0.00 H new ATOM 1079 N TYR A 72 -7.998 9.531 8.283 1.00 0.00 N ATOM 1080 CA TYR A 72 -8.804 10.386 7.421 1.00 0.00 C ATOM 1081 C TYR A 72 -9.481 9.578 6.314 1.00 0.00 C ATOM 1082 O TYR A 72 -8.808 9.032 5.441 1.00 0.00 O ATOM 1083 CB TYR A 72 -7.921 11.470 6.797 1.00 0.00 C ATOM 1084 CG TYR A 72 -8.174 12.857 7.342 1.00 0.00 C ATOM 1085 CD1 TYR A 72 -7.769 13.206 8.624 1.00 0.00 C ATOM 1086 CD2 TYR A 72 -8.813 13.820 6.571 1.00 0.00 C ATOM 1087 CE1 TYR A 72 -7.995 14.476 9.123 1.00 0.00 C ATOM 1088 CE2 TYR A 72 -9.044 15.090 7.061 1.00 0.00 C ATOM 1089 CZ TYR A 72 -8.634 15.413 8.338 1.00 0.00 C ATOM 1090 OH TYR A 72 -8.861 16.678 8.831 1.00 0.00 O ATOM 0 H TYR A 72 -7.167 9.145 7.835 1.00 0.00 H new ATOM 0 HA TYR A 72 -9.581 10.846 8.032 1.00 0.00 H new ATOM 0 HB2 TYR A 72 -6.875 11.211 6.961 1.00 0.00 H new ATOM 0 HB3 TYR A 72 -8.082 11.479 5.719 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -7.270 12.474 9.241 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -9.135 13.571 5.571 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -7.673 14.733 10.121 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -9.543 15.826 6.448 1.00 0.00 H new ATOM 0 HH TYR A 72 -9.320 17.216 8.152 1.00 0.00 H new ATOM 1100 N PRO A 73 -10.824 9.495 6.328 1.00 0.00 N ATOM 1101 CA PRO A 73 -11.574 8.757 5.316 1.00 0.00 C ATOM 1102 C PRO A 73 -11.698 9.545 4.014 1.00 0.00 C ATOM 1103 O PRO A 73 -12.145 10.691 4.014 1.00 0.00 O ATOM 1104 CB PRO A 73 -12.957 8.550 5.957 1.00 0.00 C ATOM 1105 CG PRO A 73 -12.872 9.138 7.332 1.00 0.00 C ATOM 1106 CD PRO A 73 -11.721 10.103 7.313 1.00 0.00 C ATOM 0 HA PRO A 73 -11.083 7.823 5.045 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -13.735 9.040 5.371 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -13.211 7.491 6.001 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -13.800 9.646 7.595 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -12.713 8.359 8.078 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -12.034 11.104 7.016 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -11.250 10.194 8.292 1.00 0.00 H new ATOM 1114 N VAL A 74 -11.290 8.930 2.907 1.00 0.00 N ATOM 1115 CA VAL A 74 -11.350 9.589 1.605 1.00 0.00 C ATOM 1116 C VAL A 74 -11.872 8.651 0.520 1.00 0.00 C ATOM 1117 O VAL A 74 -11.703 7.435 0.600 1.00 0.00 O ATOM 1118 CB VAL A 74 -9.957 10.121 1.184 1.00 0.00 C ATOM 1119 CG1 VAL A 74 -9.106 9.022 0.558 1.00 0.00 C ATOM 1120 CG2 VAL A 74 -10.095 11.295 0.230 1.00 0.00 C ATOM 0 H VAL A 74 -10.916 7.981 2.885 1.00 0.00 H new ATOM 0 HA VAL A 74 -12.042 10.425 1.710 1.00 0.00 H new ATOM 0 HB VAL A 74 -9.449 10.464 2.086 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -8.136 9.430 0.274 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -8.964 8.217 1.279 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -9.609 8.632 -0.327 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -9.105 11.653 -0.053 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -10.634 10.977 -0.662 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -10.645 12.099 0.719 1.00 0.00 H new ATOM 1130 N SER A 75 -12.480 9.232 -0.510 1.00 0.00 N ATOM 1131 CA SER A 75 -12.995 8.454 -1.628 1.00 0.00 C ATOM 1132 C SER A 75 -11.957 8.427 -2.744 1.00 0.00 C ATOM 1133 O SER A 75 -11.378 9.460 -3.084 1.00 0.00 O ATOM 1134 CB SER A 75 -14.316 9.040 -2.136 1.00 0.00 C ATOM 1135 OG SER A 75 -14.521 10.348 -1.634 1.00 0.00 O ATOM 0 H SER A 75 -12.627 10.238 -0.592 1.00 0.00 H new ATOM 0 HA SER A 75 -13.190 7.435 -1.293 1.00 0.00 H new ATOM 0 HB2 SER A 75 -14.312 9.062 -3.226 1.00 0.00 H new ATOM 0 HB3 SER A 75 -15.143 8.397 -1.833 1.00 0.00 H new ATOM 0 HG SER A 75 -15.370 10.700 -1.975 1.00 0.00 H new ATOM 1141 N PHE A 76 -11.706 7.248 -3.300 1.00 0.00 N ATOM 1142 CA PHE A 76 -10.712 7.114 -4.359 1.00 0.00 C ATOM 1143 C PHE A 76 -11.216 6.249 -5.507 1.00 0.00 C ATOM 1144 O PHE A 76 -12.215 5.538 -5.387 1.00 0.00 O ATOM 1145 CB PHE A 76 -9.393 6.529 -3.818 1.00 0.00 C ATOM 1146 CG PHE A 76 -9.433 6.090 -2.378 1.00 0.00 C ATOM 1147 CD1 PHE A 76 -10.395 5.203 -1.928 1.00 0.00 C ATOM 1148 CD2 PHE A 76 -8.498 6.573 -1.476 1.00 0.00 C ATOM 1149 CE1 PHE A 76 -10.428 4.808 -0.604 1.00 0.00 C ATOM 1150 CE2 PHE A 76 -8.523 6.183 -0.153 1.00 0.00 C ATOM 1151 CZ PHE A 76 -9.491 5.300 0.285 1.00 0.00 C ATOM 0 H PHE A 76 -12.171 6.379 -3.039 1.00 0.00 H new ATOM 0 HA PHE A 76 -10.528 8.119 -4.739 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -9.112 5.675 -4.435 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -8.608 7.276 -3.932 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -11.128 4.815 -2.619 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -7.740 7.264 -1.813 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -11.185 4.116 -0.265 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -7.788 6.567 0.539 1.00 0.00 H new ATOM 0 HZ PHE A 76 -9.516 4.995 1.321 1.00 0.00 H new ATOM 1161 N GLU A 77 -10.489 6.312 -6.615 1.00 0.00 N ATOM 1162 CA GLU A 77 -10.803 5.541 -7.808 1.00 0.00 C ATOM 1163 C GLU A 77 -9.725 4.488 -8.019 1.00 0.00 C ATOM 1164 O GLU A 77 -8.627 4.612 -7.478 1.00 0.00 O ATOM 1165 CB GLU A 77 -10.898 6.455 -9.032 1.00 0.00 C ATOM 1166 CG GLU A 77 -12.063 7.429 -8.974 1.00 0.00 C ATOM 1167 CD GLU A 77 -11.615 8.878 -8.955 1.00 0.00 C ATOM 1168 OE1 GLU A 77 -10.896 9.265 -8.010 1.00 0.00 O ATOM 1169 OE2 GLU A 77 -11.983 9.626 -9.886 1.00 0.00 O ATOM 0 H GLU A 77 -9.662 6.902 -6.711 1.00 0.00 H new ATOM 0 HA GLU A 77 -11.769 5.054 -7.675 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -9.969 7.017 -9.128 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -10.993 5.841 -9.927 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -12.711 7.265 -9.835 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -12.658 7.225 -8.083 1.00 0.00 H new ATOM 1176 N GLY A 78 -10.034 3.445 -8.781 1.00 0.00 N ATOM 1177 CA GLY A 78 -9.057 2.395 -9.007 1.00 0.00 C ATOM 1178 C GLY A 78 -8.480 2.372 -10.417 1.00 0.00 C ATOM 1179 O GLY A 78 -8.647 1.382 -11.130 1.00 0.00 O ATOM 0 H GLY A 78 -10.933 3.307 -9.242 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -8.241 2.514 -8.294 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -9.522 1.431 -8.801 1.00 0.00 H new ATOM 1183 N PRO A 79 -7.780 3.439 -10.858 1.00 0.00 N ATOM 1184 CA PRO A 79 -7.185 3.480 -12.196 1.00 0.00 C ATOM 1185 C PRO A 79 -6.055 2.466 -12.349 1.00 0.00 C ATOM 1186 O PRO A 79 -5.278 2.227 -11.415 1.00 0.00 O ATOM 1187 CB PRO A 79 -6.628 4.906 -12.321 1.00 0.00 C ATOM 1188 CG PRO A 79 -7.214 5.673 -11.186 1.00 0.00 C ATOM 1189 CD PRO A 79 -7.518 4.675 -10.107 1.00 0.00 C ATOM 0 HA PRO A 79 -7.917 3.232 -12.965 1.00 0.00 H new ATOM 0 HB2 PRO A 79 -5.539 4.906 -12.272 1.00 0.00 H new ATOM 0 HB3 PRO A 79 -6.904 5.351 -13.277 1.00 0.00 H new ATOM 0 HG2 PRO A 79 -6.516 6.430 -10.828 1.00 0.00 H new ATOM 0 HG3 PRO A 79 -8.119 6.195 -11.497 1.00 0.00 H new ATOM 0 HD2 PRO A 79 -6.681 4.558 -9.419 1.00 0.00 H new ATOM 0 HD3 PRO A 79 -8.380 4.975 -9.512 1.00 0.00 H new ATOM 1197 N GLY A 80 -5.974 1.867 -13.531 1.00 0.00 N ATOM 1198 CA GLY A 80 -4.950 0.877 -13.800 1.00 0.00 C ATOM 1199 C GLY A 80 -3.548 1.451 -13.768 1.00 0.00 C ATOM 1200 O GLY A 80 -2.901 1.470 -12.722 1.00 0.00 O ATOM 0 H GLY A 80 -6.604 2.051 -14.312 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -5.025 0.076 -13.065 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -5.132 0.431 -14.778 1.00 0.00 H new ATOM 1204 N LEU A 81 -3.068 1.904 -14.923 1.00 0.00 N ATOM 1205 CA LEU A 81 -1.724 2.460 -15.024 1.00 0.00 C ATOM 1206 C LEU A 81 -1.675 3.940 -14.656 1.00 0.00 C ATOM 1207 O LEU A 81 -2.441 4.752 -15.175 1.00 0.00 O ATOM 1208 CB LEU A 81 -1.170 2.267 -16.434 1.00 0.00 C ATOM 1209 CG LEU A 81 0.313 1.892 -16.488 1.00 0.00 C ATOM 1210 CD1 LEU A 81 1.105 2.654 -15.438 1.00 0.00 C ATOM 1211 CD2 LEU A 81 0.491 0.390 -16.316 1.00 0.00 C ATOM 0 H LEU A 81 -3.589 1.897 -15.800 1.00 0.00 H new ATOM 0 HA LEU A 81 -1.107 1.919 -14.307 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -1.747 1.489 -16.934 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -1.320 3.187 -16.999 1.00 0.00 H new ATOM 0 HG LEU A 81 0.699 2.173 -17.468 1.00 0.00 H new ATOM 0 HD11 LEU A 81 2.156 2.370 -15.497 1.00 0.00 H new ATOM 0 HD12 LEU A 81 1.008 3.725 -15.616 1.00 0.00 H new ATOM 0 HD13 LEU A 81 0.720 2.415 -14.447 1.00 0.00 H new ATOM 0 HD21 LEU A 81 1.552 0.142 -16.357 1.00 0.00 H new ATOM 0 HD22 LEU A 81 0.084 0.083 -15.353 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -0.035 -0.133 -17.115 1.00 0.00 H new ATOM 1223 N VAL A 82 -0.738 4.277 -13.775 1.00 0.00 N ATOM 1224 CA VAL A 82 -0.535 5.652 -13.340 1.00 0.00 C ATOM 1225 C VAL A 82 0.959 5.942 -13.252 1.00 0.00 C ATOM 1226 O VAL A 82 1.705 5.208 -12.603 1.00 0.00 O ATOM 1227 CB VAL A 82 -1.207 5.939 -11.979 1.00 0.00 C ATOM 1228 CG1 VAL A 82 -0.905 7.357 -11.514 1.00 0.00 C ATOM 1229 CG2 VAL A 82 -2.710 5.719 -12.080 1.00 0.00 C ATOM 0 H VAL A 82 -0.101 3.606 -13.345 1.00 0.00 H new ATOM 0 HA VAL A 82 -1.002 6.306 -14.077 1.00 0.00 H new ATOM 0 HB VAL A 82 -0.800 5.248 -11.241 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -1.389 7.536 -10.554 1.00 0.00 H new ATOM 0 HG12 VAL A 82 0.172 7.483 -11.407 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -1.282 8.069 -12.248 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -3.173 5.924 -11.115 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -3.126 6.389 -12.832 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -2.908 4.686 -12.365 1.00 0.00 H new ATOM 1239 N GLU A 83 1.397 6.998 -13.927 1.00 0.00 N ATOM 1240 CA GLU A 83 2.809 7.358 -13.942 1.00 0.00 C ATOM 1241 C GLU A 83 3.255 7.935 -12.604 1.00 0.00 C ATOM 1242 O GLU A 83 2.912 9.065 -12.256 1.00 0.00 O ATOM 1243 CB GLU A 83 3.085 8.367 -15.058 1.00 0.00 C ATOM 1244 CG GLU A 83 3.349 7.724 -16.409 1.00 0.00 C ATOM 1245 CD GLU A 83 3.370 8.732 -17.541 1.00 0.00 C ATOM 1246 OE1 GLU A 83 2.353 9.431 -17.733 1.00 0.00 O ATOM 1247 OE2 GLU A 83 4.405 8.824 -18.234 1.00 0.00 O ATOM 0 H GLU A 83 0.796 7.618 -14.470 1.00 0.00 H new ATOM 0 HA GLU A 83 3.380 6.447 -14.125 1.00 0.00 H new ATOM 0 HB2 GLU A 83 2.233 9.041 -15.146 1.00 0.00 H new ATOM 0 HB3 GLU A 83 3.945 8.976 -14.781 1.00 0.00 H new ATOM 0 HG2 GLU A 83 4.304 7.199 -16.377 1.00 0.00 H new ATOM 0 HG3 GLU A 83 2.581 6.976 -16.608 1.00 0.00 H new ATOM 1254 N VAL A 84 4.035 7.152 -11.865 1.00 0.00 N ATOM 1255 CA VAL A 84 4.547 7.584 -10.574 1.00 0.00 C ATOM 1256 C VAL A 84 5.643 8.628 -10.771 1.00 0.00 C ATOM 1257 O VAL A 84 6.702 8.336 -11.327 1.00 0.00 O ATOM 1258 CB VAL A 84 5.088 6.381 -9.764 1.00 0.00 C ATOM 1259 CG1 VAL A 84 6.096 5.589 -10.579 1.00 0.00 C ATOM 1260 CG2 VAL A 84 5.695 6.830 -8.445 1.00 0.00 C ATOM 0 H VAL A 84 4.325 6.214 -12.141 1.00 0.00 H new ATOM 0 HA VAL A 84 3.728 8.030 -10.010 1.00 0.00 H new ATOM 0 HB VAL A 84 4.244 5.729 -9.537 1.00 0.00 H new ATOM 0 HG11 VAL A 84 6.462 4.749 -9.988 1.00 0.00 H new ATOM 0 HG12 VAL A 84 5.618 5.215 -11.485 1.00 0.00 H new ATOM 0 HG13 VAL A 84 6.932 6.234 -10.849 1.00 0.00 H new ATOM 0 HG21 VAL A 84 6.065 5.961 -7.901 1.00 0.00 H new ATOM 0 HG22 VAL A 84 6.520 7.516 -8.639 1.00 0.00 H new ATOM 0 HG23 VAL A 84 4.936 7.335 -7.848 1.00 0.00 H new ATOM 1270 N GLN A 85 5.364 9.852 -10.325 1.00 0.00 N ATOM 1271 CA GLN A 85 6.306 10.959 -10.461 1.00 0.00 C ATOM 1272 C GLN A 85 7.478 10.817 -9.500 1.00 0.00 C ATOM 1273 O GLN A 85 7.339 10.262 -8.411 1.00 0.00 O ATOM 1274 CB GLN A 85 5.593 12.291 -10.217 1.00 0.00 C ATOM 1275 CG GLN A 85 4.752 12.308 -8.951 1.00 0.00 C ATOM 1276 CD GLN A 85 4.684 13.681 -8.314 1.00 0.00 C ATOM 1277 OE1 GLN A 85 5.710 14.309 -8.051 1.00 0.00 O ATOM 1278 NE2 GLN A 85 3.470 14.158 -8.060 1.00 0.00 N ATOM 0 H GLN A 85 4.489 10.101 -9.865 1.00 0.00 H new ATOM 0 HA GLN A 85 6.698 10.937 -11.478 1.00 0.00 H new ATOM 0 HB2 GLN A 85 6.336 13.086 -10.160 1.00 0.00 H new ATOM 0 HB3 GLN A 85 4.953 12.513 -11.071 1.00 0.00 H new ATOM 0 HG2 GLN A 85 3.743 11.970 -9.185 1.00 0.00 H new ATOM 0 HG3 GLN A 85 5.167 11.599 -8.234 1.00 0.00 H new ATOM 0 HE21 GLN A 85 2.646 13.605 -8.294 1.00 0.00 H new ATOM 0 HE22 GLN A 85 3.363 15.077 -7.631 1.00 0.00 H new ATOM 1287 N GLU A 86 8.638 11.325 -9.910 1.00 0.00 N ATOM 1288 CA GLU A 86 9.833 11.254 -9.081 1.00 0.00 C ATOM 1289 C GLU A 86 9.696 12.159 -7.862 1.00 0.00 C ATOM 1290 O GLU A 86 9.861 13.374 -7.957 1.00 0.00 O ATOM 1291 CB GLU A 86 11.066 11.660 -9.891 1.00 0.00 C ATOM 1292 CG GLU A 86 12.367 11.084 -9.355 1.00 0.00 C ATOM 1293 CD GLU A 86 12.590 11.409 -7.891 1.00 0.00 C ATOM 1294 OE1 GLU A 86 12.769 12.602 -7.568 1.00 0.00 O ATOM 1295 OE2 GLU A 86 12.588 10.470 -7.068 1.00 0.00 O ATOM 0 H GLU A 86 8.773 11.788 -10.809 1.00 0.00 H new ATOM 0 HA GLU A 86 9.952 10.225 -8.742 1.00 0.00 H new ATOM 0 HB2 GLU A 86 10.934 11.337 -10.923 1.00 0.00 H new ATOM 0 HB3 GLU A 86 11.139 12.747 -9.905 1.00 0.00 H new ATOM 0 HG2 GLU A 86 12.362 10.002 -9.486 1.00 0.00 H new ATOM 0 HG3 GLU A 86 13.200 11.472 -9.940 1.00 0.00 H new ATOM 1302 N SER A 87 9.397 11.557 -6.716 1.00 0.00 N ATOM 1303 CA SER A 87 9.244 12.314 -5.477 1.00 0.00 C ATOM 1304 C SER A 87 9.762 11.520 -4.279 1.00 0.00 C ATOM 1305 O SER A 87 9.755 10.290 -4.291 1.00 0.00 O ATOM 1306 CB SER A 87 7.776 12.705 -5.269 1.00 0.00 C ATOM 1307 OG SER A 87 7.380 12.552 -3.915 1.00 0.00 O ATOM 0 H SER A 87 9.256 10.552 -6.618 1.00 0.00 H new ATOM 0 HA SER A 87 9.840 13.223 -5.560 1.00 0.00 H new ATOM 0 HB2 SER A 87 7.628 13.740 -5.577 1.00 0.00 H new ATOM 0 HB3 SER A 87 7.141 12.089 -5.906 1.00 0.00 H new ATOM 0 HG SER A 87 6.440 12.811 -3.818 1.00 0.00 H new ATOM 1313 N GLU A 88 10.198 12.237 -3.246 1.00 0.00 N ATOM 1314 CA GLU A 88 10.711 11.612 -2.028 1.00 0.00 C ATOM 1315 C GLU A 88 11.822 10.607 -2.337 1.00 0.00 C ATOM 1316 O GLU A 88 13.005 10.934 -2.247 1.00 0.00 O ATOM 1317 CB GLU A 88 9.570 10.935 -1.259 1.00 0.00 C ATOM 1318 CG GLU A 88 9.797 10.885 0.244 1.00 0.00 C ATOM 1319 CD GLU A 88 8.602 11.388 1.033 1.00 0.00 C ATOM 1320 OE1 GLU A 88 7.482 10.891 0.795 1.00 0.00 O ATOM 1321 OE2 GLU A 88 8.789 12.278 1.888 1.00 0.00 O ATOM 0 H GLU A 88 10.206 13.257 -3.228 1.00 0.00 H new ATOM 0 HA GLU A 88 11.142 12.396 -1.405 1.00 0.00 H new ATOM 0 HB2 GLU A 88 8.641 11.468 -1.461 1.00 0.00 H new ATOM 0 HB3 GLU A 88 9.443 9.919 -1.633 1.00 0.00 H new ATOM 0 HG2 GLU A 88 10.017 9.859 0.540 1.00 0.00 H new ATOM 0 HG3 GLU A 88 10.672 11.484 0.496 1.00 0.00 H new ATOM 1328 N TYR A 89 11.441 9.385 -2.704 1.00 0.00 N ATOM 1329 CA TYR A 89 12.411 8.345 -3.025 1.00 0.00 C ATOM 1330 C TYR A 89 11.885 7.425 -4.124 1.00 0.00 C ATOM 1331 O TYR A 89 12.381 6.312 -4.303 1.00 0.00 O ATOM 1332 CB TYR A 89 12.752 7.527 -1.777 1.00 0.00 C ATOM 1333 CG TYR A 89 11.558 7.227 -0.899 1.00 0.00 C ATOM 1334 CD1 TYR A 89 10.442 6.575 -1.409 1.00 0.00 C ATOM 1335 CD2 TYR A 89 11.547 7.596 0.440 1.00 0.00 C ATOM 1336 CE1 TYR A 89 9.350 6.299 -0.610 1.00 0.00 C ATOM 1337 CE2 TYR A 89 10.458 7.323 1.246 1.00 0.00 C ATOM 1338 CZ TYR A 89 9.362 6.675 0.716 1.00 0.00 C ATOM 1339 OH TYR A 89 8.276 6.402 1.516 1.00 0.00 O ATOM 0 H TYR A 89 10.467 9.093 -2.786 1.00 0.00 H new ATOM 0 HA TYR A 89 13.316 8.832 -3.388 1.00 0.00 H new ATOM 0 HB2 TYR A 89 13.211 6.587 -2.084 1.00 0.00 H new ATOM 0 HB3 TYR A 89 13.495 8.068 -1.191 1.00 0.00 H new ATOM 0 HD1 TYR A 89 10.428 6.279 -2.448 1.00 0.00 H new ATOM 0 HD2 TYR A 89 12.403 8.104 0.858 1.00 0.00 H new ATOM 0 HE1 TYR A 89 8.491 5.791 -1.022 1.00 0.00 H new ATOM 0 HE2 TYR A 89 10.465 7.616 2.286 1.00 0.00 H new ATOM 0 HH TYR A 89 8.447 6.732 2.423 1.00 0.00 H new ATOM 1349 N TYR A 90 10.882 7.895 -4.861 1.00 0.00 N ATOM 1350 CA TYR A 90 10.297 7.115 -5.944 1.00 0.00 C ATOM 1351 C TYR A 90 10.719 7.686 -7.297 1.00 0.00 C ATOM 1352 O TYR A 90 10.723 8.901 -7.485 1.00 0.00 O ATOM 1353 CB TYR A 90 8.770 7.107 -5.830 1.00 0.00 C ATOM 1354 CG TYR A 90 8.206 5.794 -5.337 1.00 0.00 C ATOM 1355 CD1 TYR A 90 8.088 5.532 -3.978 1.00 0.00 C ATOM 1356 CD2 TYR A 90 7.789 4.817 -6.232 1.00 0.00 C ATOM 1357 CE1 TYR A 90 7.573 4.334 -3.523 1.00 0.00 C ATOM 1358 CE2 TYR A 90 7.272 3.615 -5.786 1.00 0.00 C ATOM 1359 CZ TYR A 90 7.166 3.379 -4.432 1.00 0.00 C ATOM 1360 OH TYR A 90 6.651 2.184 -3.984 1.00 0.00 O ATOM 0 H TYR A 90 10.458 8.813 -4.727 1.00 0.00 H new ATOM 0 HA TYR A 90 10.659 6.090 -5.867 1.00 0.00 H new ATOM 0 HB2 TYR A 90 8.461 7.903 -5.152 1.00 0.00 H new ATOM 0 HB3 TYR A 90 8.340 7.334 -6.806 1.00 0.00 H new ATOM 0 HD1 TYR A 90 8.405 6.278 -3.264 1.00 0.00 H new ATOM 0 HD2 TYR A 90 7.870 4.999 -7.293 1.00 0.00 H new ATOM 0 HE1 TYR A 90 7.489 4.146 -2.463 1.00 0.00 H new ATOM 0 HE2 TYR A 90 6.953 2.865 -6.494 1.00 0.00 H new ATOM 0 HH TYR A 90 6.310 2.296 -3.072 1.00 0.00 H new ATOM 1370 N PRO A 91 11.090 6.814 -8.254 1.00 0.00 N ATOM 1371 CA PRO A 91 11.526 7.234 -9.588 1.00 0.00 C ATOM 1372 C PRO A 91 10.363 7.471 -10.547 1.00 0.00 C ATOM 1373 O PRO A 91 9.328 6.811 -10.458 1.00 0.00 O ATOM 1374 CB PRO A 91 12.363 6.047 -10.051 1.00 0.00 C ATOM 1375 CG PRO A 91 11.715 4.864 -9.415 1.00 0.00 C ATOM 1376 CD PRO A 91 11.129 5.345 -8.108 1.00 0.00 C ATOM 0 HA PRO A 91 12.059 8.184 -9.565 1.00 0.00 H new ATOM 0 HB2 PRO A 91 12.365 5.962 -11.138 1.00 0.00 H new ATOM 0 HB3 PRO A 91 13.402 6.147 -9.737 1.00 0.00 H new ATOM 0 HG2 PRO A 91 10.938 4.454 -10.060 1.00 0.00 H new ATOM 0 HG3 PRO A 91 12.441 4.069 -9.245 1.00 0.00 H new ATOM 0 HD2 PRO A 91 10.133 4.934 -7.941 1.00 0.00 H new ATOM 0 HD3 PRO A 91 11.744 5.044 -7.260 1.00 0.00 H new ATOM 1384 N LYS A 92 10.547 8.413 -11.471 1.00 0.00 N ATOM 1385 CA LYS A 92 9.517 8.733 -12.457 1.00 0.00 C ATOM 1386 C LYS A 92 9.275 7.544 -13.383 1.00 0.00 C ATOM 1387 O LYS A 92 9.755 7.519 -14.516 1.00 0.00 O ATOM 1388 CB LYS A 92 9.928 9.956 -13.278 1.00 0.00 C ATOM 1389 CG LYS A 92 8.859 10.418 -14.255 1.00 0.00 C ATOM 1390 CD LYS A 92 8.031 11.556 -13.678 1.00 0.00 C ATOM 1391 CE LYS A 92 7.875 12.695 -14.675 1.00 0.00 C ATOM 1392 NZ LYS A 92 8.772 13.839 -14.354 1.00 0.00 N ATOM 0 H LYS A 92 11.399 8.967 -11.557 1.00 0.00 H new ATOM 0 HA LYS A 92 8.592 8.958 -11.925 1.00 0.00 H new ATOM 0 HB2 LYS A 92 10.168 10.775 -12.600 1.00 0.00 H new ATOM 0 HB3 LYS A 92 10.838 9.723 -13.831 1.00 0.00 H new ATOM 0 HG2 LYS A 92 9.329 10.743 -15.183 1.00 0.00 H new ATOM 0 HG3 LYS A 92 8.206 9.581 -14.504 1.00 0.00 H new ATOM 0 HD2 LYS A 92 7.047 11.183 -13.393 1.00 0.00 H new ATOM 0 HD3 LYS A 92 8.506 11.928 -12.770 1.00 0.00 H new ATOM 0 HE2 LYS A 92 8.095 12.332 -15.679 1.00 0.00 H new ATOM 0 HE3 LYS A 92 6.839 13.035 -14.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 8.636 14.594 -15.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 8.546 14.202 -13.406 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 9.762 13.521 -14.375 1.00 0.00 H new ATOM 1406 N ARG A 93 8.541 6.554 -12.886 1.00 0.00 N ATOM 1407 CA ARG A 93 8.250 5.350 -13.664 1.00 0.00 C ATOM 1408 C ARG A 93 6.747 5.101 -13.789 1.00 0.00 C ATOM 1409 O ARG A 93 5.930 5.911 -13.354 1.00 0.00 O ATOM 1410 CB ARG A 93 8.925 4.135 -13.022 1.00 0.00 C ATOM 1411 CG ARG A 93 10.274 3.796 -13.632 1.00 0.00 C ATOM 1412 CD ARG A 93 10.945 2.646 -12.896 1.00 0.00 C ATOM 1413 NE ARG A 93 12.166 2.207 -13.567 1.00 0.00 N ATOM 1414 CZ ARG A 93 12.781 1.055 -13.307 1.00 0.00 C ATOM 1415 NH1 ARG A 93 12.293 0.224 -12.394 1.00 0.00 N ATOM 1416 NH2 ARG A 93 13.887 0.733 -13.963 1.00 0.00 N ATOM 0 H ARG A 93 8.136 6.559 -11.950 1.00 0.00 H new ATOM 0 HA ARG A 93 8.646 5.504 -14.668 1.00 0.00 H new ATOM 0 HB2 ARG A 93 9.054 4.323 -11.956 1.00 0.00 H new ATOM 0 HB3 ARG A 93 8.266 3.272 -13.116 1.00 0.00 H new ATOM 0 HG2 ARG A 93 10.144 3.531 -14.681 1.00 0.00 H new ATOM 0 HG3 ARG A 93 10.919 4.674 -13.602 1.00 0.00 H new ATOM 0 HD2 ARG A 93 11.182 2.956 -11.878 1.00 0.00 H new ATOM 0 HD3 ARG A 93 10.251 1.809 -12.821 1.00 0.00 H new ATOM 0 HE ARG A 93 12.571 2.818 -14.276 1.00 0.00 H new ATOM 0 HH11 ARG A 93 11.442 0.466 -11.887 1.00 0.00 H new ATOM 0 HH12 ARG A 93 12.769 -0.657 -12.200 1.00 0.00 H new ATOM 0 HH21 ARG A 93 14.266 1.367 -14.666 1.00 0.00 H new ATOM 0 HH22 ARG A 93 14.359 -0.149 -13.765 1.00 0.00 H new ATOM 1430 N TYR A 94 6.398 3.965 -14.390 1.00 0.00 N ATOM 1431 CA TYR A 94 5.001 3.585 -14.581 1.00 0.00 C ATOM 1432 C TYR A 94 4.557 2.591 -13.510 1.00 0.00 C ATOM 1433 O TYR A 94 5.249 1.611 -13.236 1.00 0.00 O ATOM 1434 CB TYR A 94 4.809 2.979 -15.970 1.00 0.00 C ATOM 1435 CG TYR A 94 4.562 4.013 -17.039 1.00 0.00 C ATOM 1436 CD1 TYR A 94 5.604 4.777 -17.544 1.00 0.00 C ATOM 1437 CD2 TYR A 94 3.286 4.233 -17.536 1.00 0.00 C ATOM 1438 CE1 TYR A 94 5.381 5.732 -18.514 1.00 0.00 C ATOM 1439 CE2 TYR A 94 3.053 5.182 -18.507 1.00 0.00 C ATOM 1440 CZ TYR A 94 4.104 5.932 -18.994 1.00 0.00 C ATOM 1441 OH TYR A 94 3.876 6.882 -19.962 1.00 0.00 O ATOM 0 H TYR A 94 7.069 3.289 -14.755 1.00 0.00 H new ATOM 0 HA TYR A 94 4.386 4.481 -14.493 1.00 0.00 H new ATOM 0 HB2 TYR A 94 5.694 2.399 -16.232 1.00 0.00 H new ATOM 0 HB3 TYR A 94 3.969 2.285 -15.944 1.00 0.00 H new ATOM 0 HD1 TYR A 94 6.606 4.622 -17.172 1.00 0.00 H new ATOM 0 HD2 TYR A 94 2.461 3.650 -17.155 1.00 0.00 H new ATOM 0 HE1 TYR A 94 6.203 6.320 -18.896 1.00 0.00 H new ATOM 0 HE2 TYR A 94 2.053 5.338 -18.885 1.00 0.00 H new ATOM 0 HH TYR A 94 4.204 7.752 -19.651 1.00 0.00 H new ATOM 1451 N GLN A 95 3.400 2.851 -12.905 1.00 0.00 N ATOM 1452 CA GLN A 95 2.871 1.976 -11.862 1.00 0.00 C ATOM 1453 C GLN A 95 1.406 1.633 -12.123 1.00 0.00 C ATOM 1454 O GLN A 95 0.576 2.523 -12.309 1.00 0.00 O ATOM 1455 CB GLN A 95 3.020 2.638 -10.490 1.00 0.00 C ATOM 1456 CG GLN A 95 4.047 1.961 -9.596 1.00 0.00 C ATOM 1457 CD GLN A 95 5.241 2.848 -9.299 1.00 0.00 C ATOM 1458 OE1 GLN A 95 6.251 2.803 -10.001 1.00 0.00 O ATOM 1459 NE2 GLN A 95 5.130 3.659 -8.254 1.00 0.00 N ATOM 0 H GLN A 95 2.813 3.657 -13.118 1.00 0.00 H new ATOM 0 HA GLN A 95 3.445 1.049 -11.875 1.00 0.00 H new ATOM 0 HB2 GLN A 95 3.303 3.682 -10.628 1.00 0.00 H new ATOM 0 HB3 GLN A 95 2.053 2.633 -9.987 1.00 0.00 H new ATOM 0 HG2 GLN A 95 3.572 1.672 -8.658 1.00 0.00 H new ATOM 0 HG3 GLN A 95 4.391 1.044 -10.075 1.00 0.00 H new ATOM 0 HE21 GLN A 95 4.274 3.663 -7.700 1.00 0.00 H new ATOM 0 HE22 GLN A 95 5.901 4.278 -8.005 1.00 0.00 H new ATOM 1468 N SER A 96 1.091 0.338 -12.137 1.00 0.00 N ATOM 1469 CA SER A 96 -0.278 -0.109 -12.383 1.00 0.00 C ATOM 1470 C SER A 96 -0.987 -0.504 -11.089 1.00 0.00 C ATOM 1471 O SER A 96 -0.348 -0.821 -10.085 1.00 0.00 O ATOM 1472 CB SER A 96 -0.279 -1.293 -13.352 1.00 0.00 C ATOM 1473 OG SER A 96 -1.600 -1.732 -13.620 1.00 0.00 O ATOM 0 H SER A 96 1.761 -0.415 -11.982 1.00 0.00 H new ATOM 0 HA SER A 96 -0.822 0.727 -12.823 1.00 0.00 H new ATOM 0 HB2 SER A 96 0.208 -1.005 -14.284 1.00 0.00 H new ATOM 0 HB3 SER A 96 0.301 -2.113 -12.930 1.00 0.00 H new ATOM 0 HG SER A 96 -1.573 -2.488 -14.243 1.00 0.00 H new ATOM 1479 N HIS A 97 -2.319 -0.494 -11.132 1.00 0.00 N ATOM 1480 CA HIS A 97 -3.138 -0.861 -9.980 1.00 0.00 C ATOM 1481 C HIS A 97 -2.955 0.121 -8.822 1.00 0.00 C ATOM 1482 O HIS A 97 -2.607 -0.274 -7.707 1.00 0.00 O ATOM 1483 CB HIS A 97 -2.801 -2.285 -9.528 1.00 0.00 C ATOM 1484 CG HIS A 97 -3.991 -3.193 -9.473 1.00 0.00 C ATOM 1485 ND1 HIS A 97 -4.114 -4.218 -8.560 1.00 0.00 N ATOM 1486 CD2 HIS A 97 -5.114 -3.227 -10.229 1.00 0.00 C ATOM 1487 CE1 HIS A 97 -5.261 -4.844 -8.756 1.00 0.00 C ATOM 1488 NE2 HIS A 97 -5.887 -4.260 -9.761 1.00 0.00 N ATOM 0 H HIS A 97 -2.856 -0.234 -11.959 1.00 0.00 H new ATOM 0 HA HIS A 97 -4.183 -0.819 -10.286 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -2.062 -2.708 -10.209 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -2.339 -2.245 -8.542 1.00 0.00 H new ATOM 0 HD1 HIS A 97 -3.427 -4.456 -7.845 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -5.356 -2.565 -11.047 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -5.624 -5.689 -8.190 1.00 0.00 H new ATOM 1497 N VAL A 98 -3.201 1.402 -9.084 1.00 0.00 N ATOM 1498 CA VAL A 98 -3.068 2.422 -8.049 1.00 0.00 C ATOM 1499 C VAL A 98 -4.369 3.200 -7.878 1.00 0.00 C ATOM 1500 O VAL A 98 -5.055 3.491 -8.855 1.00 0.00 O ATOM 1501 CB VAL A 98 -1.903 3.394 -8.359 1.00 0.00 C ATOM 1502 CG1 VAL A 98 -2.242 4.334 -9.501 1.00 0.00 C ATOM 1503 CG2 VAL A 98 -1.518 4.197 -7.131 1.00 0.00 C ATOM 0 H VAL A 98 -3.491 1.756 -9.996 1.00 0.00 H new ATOM 0 HA VAL A 98 -2.843 1.908 -7.114 1.00 0.00 H new ATOM 0 HB VAL A 98 -1.054 2.781 -8.661 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -1.399 4.999 -9.687 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -2.452 3.754 -10.400 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -3.119 4.925 -9.238 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -0.698 4.871 -7.379 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -2.376 4.779 -6.793 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -1.204 3.520 -6.337 1.00 0.00 H new ATOM 1513 N LEU A 99 -4.701 3.535 -6.636 1.00 0.00 N ATOM 1514 CA LEU A 99 -5.918 4.284 -6.344 1.00 0.00 C ATOM 1515 C LEU A 99 -5.581 5.732 -6.012 1.00 0.00 C ATOM 1516 O LEU A 99 -4.519 6.013 -5.459 1.00 0.00 O ATOM 1517 CB LEU A 99 -6.676 3.641 -5.180 1.00 0.00 C ATOM 1518 CG LEU A 99 -7.546 2.441 -5.556 1.00 0.00 C ATOM 1519 CD1 LEU A 99 -6.690 1.315 -6.112 1.00 0.00 C ATOM 1520 CD2 LEU A 99 -8.344 1.963 -4.351 1.00 0.00 C ATOM 0 H LEU A 99 -4.144 3.300 -5.815 1.00 0.00 H new ATOM 0 HA LEU A 99 -6.555 4.265 -7.228 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -5.954 3.325 -4.427 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -7.309 4.398 -4.717 1.00 0.00 H new ATOM 0 HG LEU A 99 -8.247 2.752 -6.330 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -7.326 0.470 -6.374 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -6.164 1.663 -7.001 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -5.965 1.004 -5.360 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -8.958 1.109 -4.637 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -7.660 1.669 -3.555 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -8.987 2.769 -3.997 1.00 0.00 H new ATOM 1532 N LEU A 100 -6.478 6.653 -6.356 1.00 0.00 N ATOM 1533 CA LEU A 100 -6.239 8.068 -6.091 1.00 0.00 C ATOM 1534 C LEU A 100 -7.451 8.749 -5.459 1.00 0.00 C ATOM 1535 O LEU A 100 -8.577 8.613 -5.937 1.00 0.00 O ATOM 1536 CB LEU A 100 -5.840 8.785 -7.382 1.00 0.00 C ATOM 1537 CG LEU A 100 -4.333 8.979 -7.562 1.00 0.00 C ATOM 1538 CD1 LEU A 100 -4.029 9.574 -8.924 1.00 0.00 C ATOM 1539 CD2 LEU A 100 -3.779 9.869 -6.462 1.00 0.00 C ATOM 0 H LEU A 100 -7.366 6.448 -6.813 1.00 0.00 H new ATOM 0 HA LEU A 100 -5.421 8.133 -5.373 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -6.224 8.219 -8.230 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -6.324 9.761 -7.405 1.00 0.00 H new ATOM 0 HG LEU A 100 -3.852 8.003 -7.498 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -2.952 9.704 -9.032 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -4.394 8.905 -9.703 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -4.522 10.541 -9.017 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -2.706 9.998 -6.604 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -4.269 10.842 -6.500 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -3.964 9.407 -5.492 1.00 0.00 H new ATOM 1551 N ALA A 101 -7.199 9.489 -4.380 1.00 0.00 N ATOM 1552 CA ALA A 101 -8.253 10.211 -3.669 1.00 0.00 C ATOM 1553 C ALA A 101 -7.802 11.621 -3.325 1.00 0.00 C ATOM 1554 O ALA A 101 -6.626 11.860 -3.069 1.00 0.00 O ATOM 1555 CB ALA A 101 -8.639 9.481 -2.397 1.00 0.00 C ATOM 0 H ALA A 101 -6.269 9.604 -3.978 1.00 0.00 H new ATOM 0 HA ALA A 101 -9.120 10.265 -4.327 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -9.425 10.035 -1.883 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -9.002 8.484 -2.646 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -7.768 9.399 -1.746 1.00 0.00 H new ATOM 1561 N THR A 102 -8.745 12.550 -3.311 1.00 0.00 N ATOM 1562 CA THR A 102 -8.440 13.938 -2.991 1.00 0.00 C ATOM 1563 C THR A 102 -8.920 14.293 -1.588 1.00 0.00 C ATOM 1564 O THR A 102 -10.042 13.964 -1.202 1.00 0.00 O ATOM 1565 CB THR A 102 -9.089 14.861 -4.017 1.00 0.00 C ATOM 1566 OG1 THR A 102 -9.049 16.208 -3.581 1.00 0.00 O ATOM 1567 CG2 THR A 102 -10.535 14.507 -4.295 1.00 0.00 C ATOM 0 H THR A 102 -9.728 12.370 -3.517 1.00 0.00 H new ATOM 0 HA THR A 102 -7.358 14.069 -3.023 1.00 0.00 H new ATOM 0 HB THR A 102 -8.513 14.732 -4.933 1.00 0.00 H new ATOM 0 HG1 THR A 102 -9.469 16.783 -4.255 1.00 0.00 H new ATOM 0 HG21 THR A 102 -10.943 15.198 -5.032 1.00 0.00 H new ATOM 0 HG22 THR A 102 -10.593 13.489 -4.680 1.00 0.00 H new ATOM 0 HG23 THR A 102 -11.111 14.579 -3.372 1.00 0.00 H new ATOM 1575 N GLY A 103 -8.062 14.967 -0.828 1.00 0.00 N ATOM 1576 CA GLY A 103 -8.418 15.356 0.526 1.00 0.00 C ATOM 1577 C GLY A 103 -8.771 16.825 0.633 1.00 0.00 C ATOM 1578 O GLY A 103 -9.944 17.181 0.748 1.00 0.00 O ATOM 0 H GLY A 103 -7.128 15.251 -1.124 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -9.264 14.757 0.862 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -7.586 15.136 1.195 1.00 0.00 H new ATOM 1582 N PHE A 104 -7.756 17.681 0.598 1.00 0.00 N ATOM 1583 CA PHE A 104 -7.964 19.120 0.693 1.00 0.00 C ATOM 1584 C PHE A 104 -6.932 19.875 -0.138 1.00 0.00 C ATOM 1585 O PHE A 104 -7.280 20.600 -1.070 1.00 0.00 O ATOM 1586 CB PHE A 104 -7.891 19.573 2.152 1.00 0.00 C ATOM 1587 CG PHE A 104 -8.637 20.847 2.425 1.00 0.00 C ATOM 1588 CD1 PHE A 104 -8.297 22.018 1.767 1.00 0.00 C ATOM 1589 CD2 PHE A 104 -9.678 20.874 3.339 1.00 0.00 C ATOM 1590 CE1 PHE A 104 -8.982 23.193 2.015 1.00 0.00 C ATOM 1591 CE2 PHE A 104 -10.366 22.045 3.591 1.00 0.00 C ATOM 1592 CZ PHE A 104 -10.018 23.206 2.929 1.00 0.00 C ATOM 0 H PHE A 104 -6.779 17.402 0.504 1.00 0.00 H new ATOM 0 HA PHE A 104 -8.956 19.344 0.300 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -8.291 18.784 2.789 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -6.846 19.707 2.430 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -7.487 22.013 1.052 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -9.955 19.969 3.860 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -8.708 24.099 1.495 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -11.176 22.053 4.306 1.00 0.00 H new ATOM 0 HZ PHE A 104 -10.555 24.122 3.125 1.00 0.00 H new ATOM 1602 N SER A 105 -5.661 19.700 0.207 1.00 0.00 N ATOM 1603 CA SER A 105 -4.576 20.363 -0.506 1.00 0.00 C ATOM 1604 C SER A 105 -3.221 19.940 0.051 1.00 0.00 C ATOM 1605 O SER A 105 -2.558 20.705 0.751 1.00 0.00 O ATOM 1606 CB SER A 105 -4.729 21.883 -0.410 1.00 0.00 C ATOM 1607 OG SER A 105 -4.264 22.518 -1.589 1.00 0.00 O ATOM 0 H SER A 105 -5.357 19.104 0.977 1.00 0.00 H new ATOM 0 HA SER A 105 -4.627 20.065 -1.553 1.00 0.00 H new ATOM 0 HB2 SER A 105 -5.776 22.137 -0.245 1.00 0.00 H new ATOM 0 HB3 SER A 105 -4.172 22.254 0.450 1.00 0.00 H new ATOM 0 HG SER A 105 -4.374 23.488 -1.503 1.00 0.00 H new ATOM 1613 N GLU A 106 -2.814 18.714 -0.265 1.00 0.00 N ATOM 1614 CA GLU A 106 -1.538 18.187 0.205 1.00 0.00 C ATOM 1615 C GLU A 106 -1.496 18.141 1.731 1.00 0.00 C ATOM 1616 O GLU A 106 -0.985 19.057 2.374 1.00 0.00 O ATOM 1617 CB GLU A 106 -0.384 19.042 -0.322 1.00 0.00 C ATOM 1618 CG GLU A 106 0.916 18.273 -0.490 1.00 0.00 C ATOM 1619 CD GLU A 106 2.139 19.129 -0.227 1.00 0.00 C ATOM 1620 OE1 GLU A 106 2.336 20.123 -0.955 1.00 0.00 O ATOM 1621 OE2 GLU A 106 2.901 18.804 0.709 1.00 0.00 O ATOM 0 H GLU A 106 -3.350 18.068 -0.844 1.00 0.00 H new ATOM 0 HA GLU A 106 -1.432 17.171 -0.175 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -0.670 19.470 -1.283 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -0.218 19.875 0.362 1.00 0.00 H new ATOM 0 HG2 GLU A 106 0.920 17.421 0.190 1.00 0.00 H new ATOM 0 HG3 GLU A 106 0.968 17.873 -1.502 1.00 0.00 H new ATOM 1628 N PRO A 107 -2.037 17.067 2.332 1.00 0.00 N ATOM 1629 CA PRO A 107 -2.059 16.908 3.789 1.00 0.00 C ATOM 1630 C PRO A 107 -0.666 16.683 4.368 1.00 0.00 C ATOM 1631 O PRO A 107 -0.399 17.024 5.520 1.00 0.00 O ATOM 1632 CB PRO A 107 -2.932 15.667 4.001 1.00 0.00 C ATOM 1633 CG PRO A 107 -2.817 14.902 2.729 1.00 0.00 C ATOM 1634 CD PRO A 107 -2.668 15.928 1.641 1.00 0.00 C ATOM 0 HA PRO A 107 -2.436 17.800 4.289 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -2.584 15.078 4.850 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -3.967 15.941 4.206 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -1.958 14.231 2.753 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -3.699 14.284 2.564 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -2.048 15.560 0.823 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -3.632 16.202 1.212 1.00 0.00 H new ATOM 1642 N GLY A 108 0.220 16.109 3.560 1.00 0.00 N ATOM 1643 CA GLY A 108 1.575 15.850 4.010 1.00 0.00 C ATOM 1644 C GLY A 108 2.431 15.208 2.936 1.00 0.00 C ATOM 1645 O GLY A 108 2.130 15.315 1.747 1.00 0.00 O ATOM 0 H GLY A 108 0.024 15.819 2.602 1.00 0.00 H new ATOM 0 HA2 GLY A 108 2.035 16.787 4.325 1.00 0.00 H new ATOM 0 HA3 GLY A 108 1.546 15.199 4.884 1.00 0.00 H new ATOM 1649 N ASP A 109 3.501 14.541 3.355 1.00 0.00 N ATOM 1650 CA ASP A 109 4.404 13.880 2.420 1.00 0.00 C ATOM 1651 C ASP A 109 4.943 12.580 3.010 1.00 0.00 C ATOM 1652 O ASP A 109 6.074 12.183 2.732 1.00 0.00 O ATOM 1653 CB ASP A 109 5.563 14.811 2.053 1.00 0.00 C ATOM 1654 CG ASP A 109 5.747 14.943 0.554 1.00 0.00 C ATOM 1655 OD1 ASP A 109 6.183 13.958 -0.079 1.00 0.00 O ATOM 1656 OD2 ASP A 109 5.455 16.031 0.014 1.00 0.00 O ATOM 0 H ASP A 109 3.764 14.444 4.336 1.00 0.00 H new ATOM 0 HA ASP A 109 3.842 13.640 1.517 1.00 0.00 H new ATOM 0 HB2 ASP A 109 5.383 15.797 2.482 1.00 0.00 H new ATOM 0 HB3 ASP A 109 6.484 14.433 2.497 1.00 0.00 H new ATOM 1661 N ALA A 110 4.125 11.923 3.827 1.00 0.00 N ATOM 1662 CA ALA A 110 4.519 10.669 4.457 1.00 0.00 C ATOM 1663 C ALA A 110 3.310 9.941 5.033 1.00 0.00 C ATOM 1664 O ALA A 110 2.886 10.213 6.156 1.00 0.00 O ATOM 1665 CB ALA A 110 5.550 10.928 5.545 1.00 0.00 C ATOM 0 H ALA A 110 3.185 12.239 4.068 1.00 0.00 H new ATOM 0 HA ALA A 110 4.964 10.031 3.694 1.00 0.00 H new ATOM 0 HB1 ALA A 110 5.836 9.983 6.008 1.00 0.00 H new ATOM 0 HB2 ALA A 110 6.430 11.399 5.107 1.00 0.00 H new ATOM 0 HB3 ALA A 110 5.124 11.588 6.301 1.00 0.00 H new ATOM 1671 N GLY A 111 2.758 9.014 4.256 1.00 0.00 N ATOM 1672 CA GLY A 111 1.601 8.260 4.705 1.00 0.00 C ATOM 1673 C GLY A 111 1.941 6.822 5.042 1.00 0.00 C ATOM 1674 O GLY A 111 3.114 6.455 5.115 1.00 0.00 O ATOM 0 H GLY A 111 3.091 8.771 3.323 1.00 0.00 H new ATOM 0 HA2 GLY A 111 1.174 8.744 5.583 1.00 0.00 H new ATOM 0 HA3 GLY A 111 0.836 8.277 3.928 1.00 0.00 H new ATOM 1678 N GLY A 112 0.913 6.004 5.247 1.00 0.00 N ATOM 1679 CA GLY A 112 1.129 4.607 5.575 1.00 0.00 C ATOM 1680 C GLY A 112 0.436 3.665 4.610 1.00 0.00 C ATOM 1681 O GLY A 112 0.860 3.518 3.463 1.00 0.00 O ATOM 0 H GLY A 112 -0.066 6.284 5.192 1.00 0.00 H new ATOM 0 HA2 GLY A 112 2.199 4.399 5.574 1.00 0.00 H new ATOM 0 HA3 GLY A 112 0.768 4.415 6.586 1.00 0.00 H new ATOM 1685 N ILE A 113 -0.632 3.025 5.075 1.00 0.00 N ATOM 1686 CA ILE A 113 -1.385 2.088 4.248 1.00 0.00 C ATOM 1687 C ILE A 113 -2.867 2.452 4.213 1.00 0.00 C ATOM 1688 O ILE A 113 -3.417 2.953 5.194 1.00 0.00 O ATOM 1689 CB ILE A 113 -1.231 0.637 4.752 1.00 0.00 C ATOM 1690 CG1 ILE A 113 -1.844 0.483 6.148 1.00 0.00 C ATOM 1691 CG2 ILE A 113 0.236 0.233 4.764 1.00 0.00 C ATOM 1692 CD1 ILE A 113 -1.643 -0.890 6.753 1.00 0.00 C ATOM 0 H ILE A 113 -0.996 3.138 6.021 1.00 0.00 H new ATOM 0 HA ILE A 113 -0.974 2.157 3.241 1.00 0.00 H new ATOM 0 HB ILE A 113 -1.766 -0.024 4.070 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -1.408 1.230 6.811 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -2.912 0.692 6.091 1.00 0.00 H new ATOM 0 HG21 ILE A 113 0.328 -0.792 5.122 1.00 0.00 H new ATOM 0 HG22 ILE A 113 0.641 0.303 3.754 1.00 0.00 H new ATOM 0 HG23 ILE A 113 0.791 0.899 5.424 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -2.103 -0.923 7.740 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -2.104 -1.641 6.112 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -0.576 -1.095 6.843 1.00 0.00 H new ATOM 1704 N LEU A 114 -3.511 2.192 3.079 1.00 0.00 N ATOM 1705 CA LEU A 114 -4.930 2.489 2.921 1.00 0.00 C ATOM 1706 C LEU A 114 -5.770 1.316 3.416 1.00 0.00 C ATOM 1707 O LEU A 114 -5.711 0.220 2.860 1.00 0.00 O ATOM 1708 CB LEU A 114 -5.252 2.784 1.452 1.00 0.00 C ATOM 1709 CG LEU A 114 -6.738 2.756 1.087 1.00 0.00 C ATOM 1710 CD1 LEU A 114 -7.525 3.710 1.968 1.00 0.00 C ATOM 1711 CD2 LEU A 114 -6.935 3.097 -0.383 1.00 0.00 C ATOM 0 H LEU A 114 -3.073 1.777 2.257 1.00 0.00 H new ATOM 0 HA LEU A 114 -5.170 3.371 3.515 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -4.852 3.766 1.200 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -4.729 2.058 0.830 1.00 0.00 H new ATOM 0 HG LEU A 114 -7.113 1.747 1.258 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -8.579 3.675 1.692 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -7.413 3.417 3.012 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -7.149 4.724 1.833 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -7.998 3.072 -0.623 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -6.542 4.094 -0.581 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -6.407 2.370 -0.999 1.00 0.00 H new ATOM 1723 N ARG A 115 -6.542 1.550 4.473 1.00 0.00 N ATOM 1724 CA ARG A 115 -7.381 0.504 5.046 1.00 0.00 C ATOM 1725 C ARG A 115 -8.859 0.868 4.968 1.00 0.00 C ATOM 1726 O ARG A 115 -9.226 2.043 4.993 1.00 0.00 O ATOM 1727 CB ARG A 115 -6.987 0.251 6.503 1.00 0.00 C ATOM 1728 CG ARG A 115 -5.576 -0.293 6.667 1.00 0.00 C ATOM 1729 CD ARG A 115 -5.582 -1.756 7.090 1.00 0.00 C ATOM 1730 NE ARG A 115 -4.665 -2.008 8.199 1.00 0.00 N ATOM 1731 CZ ARG A 115 -4.856 -1.557 9.436 1.00 0.00 C ATOM 1732 NH1 ARG A 115 -5.928 -0.831 9.727 1.00 0.00 N ATOM 1733 NH2 ARG A 115 -3.973 -1.834 10.386 1.00 0.00 N ATOM 0 H ARG A 115 -6.604 2.451 4.948 1.00 0.00 H new ATOM 0 HA ARG A 115 -7.224 -0.404 4.463 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -7.075 1.183 7.061 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -7.692 -0.453 6.944 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -5.034 -0.188 5.727 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -5.042 0.299 7.411 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -6.592 -2.045 7.381 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -5.304 -2.380 6.241 1.00 0.00 H new ATOM 0 HE ARG A 115 -3.829 -2.562 8.014 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -6.611 -0.616 9.001 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -6.069 -0.488 10.677 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -3.148 -2.393 10.168 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -4.119 -1.488 11.334 1.00 0.00 H new ATOM 1747 N CYS A 116 -9.701 -0.155 4.881 1.00 0.00 N ATOM 1748 CA CYS A 116 -11.143 0.038 4.811 1.00 0.00 C ATOM 1749 C CYS A 116 -11.813 -0.533 6.054 1.00 0.00 C ATOM 1750 O CYS A 116 -11.222 -1.341 6.770 1.00 0.00 O ATOM 1751 CB CYS A 116 -11.710 -0.636 3.559 1.00 0.00 C ATOM 1752 SG CYS A 116 -13.332 0.011 3.031 1.00 0.00 S ATOM 0 H CYS A 116 -9.407 -1.131 4.857 1.00 0.00 H new ATOM 0 HA CYS A 116 -11.346 1.108 4.759 1.00 0.00 H new ATOM 0 HB2 CYS A 116 -10.999 -0.515 2.741 1.00 0.00 H new ATOM 0 HB3 CYS A 116 -11.802 -1.706 3.746 1.00 0.00 H new ATOM 1757 N GLU A 117 -13.050 -0.119 6.302 1.00 0.00 N ATOM 1758 CA GLU A 117 -13.796 -0.603 7.459 1.00 0.00 C ATOM 1759 C GLU A 117 -13.886 -2.129 7.451 1.00 0.00 C ATOM 1760 O GLU A 117 -14.151 -2.750 8.480 1.00 0.00 O ATOM 1761 CB GLU A 117 -15.199 0.008 7.478 1.00 0.00 C ATOM 1762 CG GLU A 117 -15.534 0.721 8.778 1.00 0.00 C ATOM 1763 CD GLU A 117 -16.831 1.501 8.698 1.00 0.00 C ATOM 1764 OE1 GLU A 117 -16.924 2.414 7.851 1.00 0.00 O ATOM 1765 OE2 GLU A 117 -17.755 1.199 9.482 1.00 0.00 O ATOM 0 H GLU A 117 -13.557 0.548 5.720 1.00 0.00 H new ATOM 0 HA GLU A 117 -13.264 -0.297 8.360 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -15.290 0.714 6.652 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -15.932 -0.780 7.306 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -15.604 -0.012 9.582 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -14.721 1.400 9.035 1.00 0.00 H new ATOM 1772 N HIS A 118 -13.668 -2.727 6.281 1.00 0.00 N ATOM 1773 CA HIS A 118 -13.731 -4.175 6.138 1.00 0.00 C ATOM 1774 C HIS A 118 -12.356 -4.817 6.333 1.00 0.00 C ATOM 1775 O HIS A 118 -12.253 -5.924 6.861 1.00 0.00 O ATOM 1776 CB HIS A 118 -14.289 -4.538 4.760 1.00 0.00 C ATOM 1777 CG HIS A 118 -15.576 -3.843 4.441 1.00 0.00 C ATOM 1778 ND1 HIS A 118 -15.661 -2.488 4.204 1.00 0.00 N ATOM 1779 CD2 HIS A 118 -16.838 -4.322 4.320 1.00 0.00 C ATOM 1780 CE1 HIS A 118 -16.915 -2.162 3.952 1.00 0.00 C ATOM 1781 NE2 HIS A 118 -17.649 -3.257 4.015 1.00 0.00 N ATOM 0 H HIS A 118 -13.446 -2.228 5.419 1.00 0.00 H new ATOM 0 HA HIS A 118 -14.393 -4.562 6.912 1.00 0.00 H new ATOM 0 HB2 HIS A 118 -13.550 -4.287 3.999 1.00 0.00 H new ATOM 0 HB3 HIS A 118 -14.444 -5.616 4.711 1.00 0.00 H new ATOM 0 HD2 HIS A 118 -17.148 -5.350 4.441 1.00 0.00 H new ATOM 0 HE1 HIS A 118 -17.278 -1.169 3.732 1.00 0.00 H new ATOM 0 HE2 HIS A 118 -18.656 -3.304 3.862 1.00 0.00 H new ATOM 1789 N GLY A 119 -11.303 -4.122 5.905 1.00 0.00 N ATOM 1790 CA GLY A 119 -9.960 -4.659 6.051 1.00 0.00 C ATOM 1791 C GLY A 119 -8.890 -3.756 5.467 1.00 0.00 C ATOM 1792 O GLY A 119 -8.950 -2.534 5.604 1.00 0.00 O ATOM 0 H GLY A 119 -11.355 -3.204 5.463 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -9.753 -4.820 7.109 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -9.910 -5.633 5.564 1.00 0.00 H new ATOM 1796 N VAL A 120 -7.908 -4.371 4.819 1.00 0.00 N ATOM 1797 CA VAL A 120 -6.802 -3.641 4.206 1.00 0.00 C ATOM 1798 C VAL A 120 -6.985 -3.524 2.696 1.00 0.00 C ATOM 1799 O VAL A 120 -7.334 -4.497 2.028 1.00 0.00 O ATOM 1800 CB VAL A 120 -5.447 -4.325 4.481 1.00 0.00 C ATOM 1801 CG1 VAL A 120 -4.300 -3.378 4.186 1.00 0.00 C ATOM 1802 CG2 VAL A 120 -5.370 -4.838 5.913 1.00 0.00 C ATOM 0 H VAL A 120 -7.854 -5.383 4.703 1.00 0.00 H new ATOM 0 HA VAL A 120 -6.803 -2.648 4.655 1.00 0.00 H new ATOM 0 HB VAL A 120 -5.363 -5.184 3.815 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -3.353 -3.880 4.386 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -4.337 -3.077 3.139 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -4.384 -2.496 4.820 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -4.404 -5.315 6.077 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -5.485 -4.004 6.605 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -6.166 -5.563 6.083 1.00 0.00 H new ATOM 1812 N ILE A 121 -6.739 -2.333 2.161 1.00 0.00 N ATOM 1813 CA ILE A 121 -6.865 -2.100 0.727 1.00 0.00 C ATOM 1814 C ILE A 121 -5.502 -2.174 0.046 1.00 0.00 C ATOM 1815 O ILE A 121 -5.238 -3.081 -0.742 1.00 0.00 O ATOM 1816 CB ILE A 121 -7.495 -0.726 0.428 1.00 0.00 C ATOM 1817 CG1 ILE A 121 -8.824 -0.569 1.188 1.00 0.00 C ATOM 1818 CG2 ILE A 121 -7.673 -0.539 -1.076 1.00 0.00 C ATOM 1819 CD1 ILE A 121 -10.059 -0.517 0.307 1.00 0.00 C ATOM 0 H ILE A 121 -6.452 -1.515 2.698 1.00 0.00 H new ATOM 0 HA ILE A 121 -7.517 -2.881 0.335 1.00 0.00 H new ATOM 0 HB ILE A 121 -6.824 0.058 0.778 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -8.928 -1.400 1.886 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -8.781 0.343 1.783 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -8.119 0.436 -1.271 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -6.702 -0.599 -1.568 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -8.325 -1.321 -1.465 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -10.946 -0.405 0.930 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -9.985 0.331 -0.374 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -10.134 -1.439 -0.269 1.00 0.00 H new ATOM 1831 N GLY A 122 -4.640 -1.210 0.358 1.00 0.00 N ATOM 1832 CA GLY A 122 -3.315 -1.180 -0.231 1.00 0.00 C ATOM 1833 C GLY A 122 -2.337 -0.343 0.572 1.00 0.00 C ATOM 1834 O GLY A 122 -2.613 0.018 1.717 1.00 0.00 O ATOM 0 H GLY A 122 -4.837 -0.449 1.009 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -2.935 -2.198 -0.312 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -3.381 -0.783 -1.244 1.00 0.00 H new ATOM 1838 N LEU A 123 -1.195 -0.034 -0.031 1.00 0.00 N ATOM 1839 CA LEU A 123 -0.168 0.766 0.630 1.00 0.00 C ATOM 1840 C LEU A 123 0.053 2.078 -0.112 1.00 0.00 C ATOM 1841 O LEU A 123 -0.365 2.231 -1.258 1.00 0.00 O ATOM 1842 CB LEU A 123 1.145 -0.017 0.713 1.00 0.00 C ATOM 1843 CG LEU A 123 1.526 -0.775 -0.559 1.00 0.00 C ATOM 1844 CD1 LEU A 123 3.039 -0.887 -0.680 1.00 0.00 C ATOM 1845 CD2 LEU A 123 0.885 -2.154 -0.568 1.00 0.00 C ATOM 0 H LEU A 123 -0.956 -0.326 -0.979 1.00 0.00 H new ATOM 0 HA LEU A 123 -0.509 0.992 1.640 1.00 0.00 H new ATOM 0 HB2 LEU A 123 1.949 0.676 0.960 1.00 0.00 H new ATOM 0 HB3 LEU A 123 1.075 -0.729 1.535 1.00 0.00 H new ATOM 0 HG LEU A 123 1.154 -0.217 -1.418 1.00 0.00 H new ATOM 0 HD11 LEU A 123 3.292 -1.429 -1.591 1.00 0.00 H new ATOM 0 HD12 LEU A 123 3.476 0.111 -0.719 1.00 0.00 H new ATOM 0 HD13 LEU A 123 3.434 -1.423 0.183 1.00 0.00 H new ATOM 0 HD21 LEU A 123 1.166 -2.680 -1.480 1.00 0.00 H new ATOM 0 HD22 LEU A 123 1.228 -2.720 0.298 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -0.199 -2.051 -0.528 1.00 0.00 H new ATOM 1857 N VAL A 124 0.707 3.028 0.547 1.00 0.00 N ATOM 1858 CA VAL A 124 0.974 4.327 -0.056 1.00 0.00 C ATOM 1859 C VAL A 124 1.924 4.206 -1.245 1.00 0.00 C ATOM 1860 O VAL A 124 2.994 3.607 -1.138 1.00 0.00 O ATOM 1861 CB VAL A 124 1.575 5.311 0.965 1.00 0.00 C ATOM 1862 CG1 VAL A 124 0.511 5.778 1.946 1.00 0.00 C ATOM 1863 CG2 VAL A 124 2.749 4.676 1.697 1.00 0.00 C ATOM 0 H VAL A 124 1.061 2.923 1.498 1.00 0.00 H new ATOM 0 HA VAL A 124 0.014 4.711 -0.401 1.00 0.00 H new ATOM 0 HB VAL A 124 1.946 6.183 0.426 1.00 0.00 H new ATOM 0 HG11 VAL A 124 0.954 6.473 2.660 1.00 0.00 H new ATOM 0 HG12 VAL A 124 -0.291 6.278 1.403 1.00 0.00 H new ATOM 0 HG13 VAL A 124 0.106 4.918 2.480 1.00 0.00 H new ATOM 0 HG21 VAL A 124 3.159 5.388 2.413 1.00 0.00 H new ATOM 0 HG22 VAL A 124 2.410 3.785 2.225 1.00 0.00 H new ATOM 0 HG23 VAL A 124 3.520 4.400 0.978 1.00 0.00 H new ATOM 1873 N THR A 125 1.528 4.787 -2.374 1.00 0.00 N ATOM 1874 CA THR A 125 2.348 4.751 -3.581 1.00 0.00 C ATOM 1875 C THR A 125 2.889 6.148 -3.899 1.00 0.00 C ATOM 1876 O THR A 125 3.976 6.509 -3.451 1.00 0.00 O ATOM 1877 CB THR A 125 1.542 4.182 -4.759 1.00 0.00 C ATOM 1878 OG1 THR A 125 1.481 2.770 -4.677 1.00 0.00 O ATOM 1879 CG2 THR A 125 2.110 4.530 -6.120 1.00 0.00 C ATOM 0 H THR A 125 0.646 5.288 -2.478 1.00 0.00 H new ATOM 0 HA THR A 125 3.200 4.093 -3.410 1.00 0.00 H new ATOM 0 HB THR A 125 0.556 4.639 -4.674 1.00 0.00 H new ATOM 0 HG1 THR A 125 2.389 2.402 -4.689 1.00 0.00 H new ATOM 0 HG21 THR A 125 1.485 4.092 -6.898 1.00 0.00 H new ATOM 0 HG22 THR A 125 2.132 5.613 -6.239 1.00 0.00 H new ATOM 0 HG23 THR A 125 3.123 4.135 -6.203 1.00 0.00 H new ATOM 1887 N MET A 126 2.135 6.932 -4.669 1.00 0.00 N ATOM 1888 CA MET A 126 2.573 8.281 -5.021 1.00 0.00 C ATOM 1889 C MET A 126 1.475 9.308 -4.763 1.00 0.00 C ATOM 1890 O MET A 126 0.357 9.175 -5.256 1.00 0.00 O ATOM 1891 CB MET A 126 3.004 8.331 -6.488 1.00 0.00 C ATOM 1892 CG MET A 126 4.327 9.039 -6.715 1.00 0.00 C ATOM 1893 SD MET A 126 5.663 8.355 -5.720 1.00 0.00 S ATOM 1894 CE MET A 126 6.452 9.866 -5.194 1.00 0.00 C ATOM 0 H MET A 126 1.231 6.661 -5.056 1.00 0.00 H new ATOM 0 HA MET A 126 3.424 8.532 -4.388 1.00 0.00 H new ATOM 0 HB2 MET A 126 3.077 7.313 -6.870 1.00 0.00 H new ATOM 0 HB3 MET A 126 2.230 8.834 -7.067 1.00 0.00 H new ATOM 0 HG2 MET A 126 4.594 8.971 -7.770 1.00 0.00 H new ATOM 0 HG3 MET A 126 4.212 10.098 -6.483 1.00 0.00 H new ATOM 0 HE1 MET A 126 6.789 9.761 -4.163 1.00 0.00 H new ATOM 0 HE2 MET A 126 7.308 10.072 -5.836 1.00 0.00 H new ATOM 0 HE3 MET A 126 5.742 10.690 -5.261 1.00 0.00 H new ATOM 1904 N GLY A 127 1.806 10.337 -3.990 1.00 0.00 N ATOM 1905 CA GLY A 127 0.840 11.376 -3.682 1.00 0.00 C ATOM 1906 C GLY A 127 1.179 12.697 -4.344 1.00 0.00 C ATOM 1907 O GLY A 127 2.348 12.993 -4.590 1.00 0.00 O ATOM 0 H GLY A 127 2.726 10.470 -3.571 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -0.150 11.055 -4.005 1.00 0.00 H new ATOM 0 HA3 GLY A 127 0.793 11.516 -2.602 1.00 0.00 H new ATOM 1911 N GLY A 128 0.154 13.492 -4.633 1.00 0.00 N ATOM 1912 CA GLY A 128 0.369 14.778 -5.269 1.00 0.00 C ATOM 1913 C GLY A 128 0.089 15.941 -4.339 1.00 0.00 C ATOM 1914 O GLY A 128 0.205 15.814 -3.120 1.00 0.00 O ATOM 0 H GLY A 128 -0.822 13.268 -4.438 1.00 0.00 H new ATOM 0 HA2 GLY A 128 1.399 14.838 -5.620 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -0.272 14.857 -6.147 1.00 0.00 H new ATOM 1918 N GLU A 129 -0.279 17.080 -4.916 1.00 0.00 N ATOM 1919 CA GLU A 129 -0.577 18.276 -4.134 1.00 0.00 C ATOM 1920 C GLU A 129 -2.071 18.383 -3.834 1.00 0.00 C ATOM 1921 O GLU A 129 -2.563 19.453 -3.475 1.00 0.00 O ATOM 1922 CB GLU A 129 -0.106 19.526 -4.879 1.00 0.00 C ATOM 1923 CG GLU A 129 1.261 19.373 -5.526 1.00 0.00 C ATOM 1924 CD GLU A 129 2.395 19.455 -4.523 1.00 0.00 C ATOM 1925 OE1 GLU A 129 2.787 20.585 -4.163 1.00 0.00 O ATOM 1926 OE2 GLU A 129 2.889 18.390 -4.097 1.00 0.00 O ATOM 0 H GLU A 129 -0.378 17.201 -5.924 1.00 0.00 H new ATOM 0 HA GLU A 129 -0.043 18.198 -3.187 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -0.836 19.776 -5.648 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -0.077 20.364 -4.182 1.00 0.00 H new ATOM 0 HG2 GLU A 129 1.308 18.415 -6.044 1.00 0.00 H new ATOM 0 HG3 GLU A 129 1.391 20.150 -6.280 1.00 0.00 H new ATOM 1933 N GLY A 130 -2.790 17.273 -3.985 1.00 0.00 N ATOM 1934 CA GLY A 130 -4.219 17.279 -3.727 1.00 0.00 C ATOM 1935 C GLY A 130 -4.825 15.886 -3.684 1.00 0.00 C ATOM 1936 O GLY A 130 -5.829 15.663 -3.007 1.00 0.00 O ATOM 0 H GLY A 130 -2.410 16.374 -4.280 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -4.408 17.780 -2.778 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -4.719 17.862 -4.500 1.00 0.00 H new ATOM 1940 N VAL A 131 -4.222 14.946 -4.410 1.00 0.00 N ATOM 1941 CA VAL A 131 -4.720 13.576 -4.449 1.00 0.00 C ATOM 1942 C VAL A 131 -3.707 12.606 -3.839 1.00 0.00 C ATOM 1943 O VAL A 131 -2.515 12.906 -3.765 1.00 0.00 O ATOM 1944 CB VAL A 131 -5.053 13.133 -5.892 1.00 0.00 C ATOM 1945 CG1 VAL A 131 -6.131 12.060 -5.891 1.00 0.00 C ATOM 1946 CG2 VAL A 131 -5.485 14.323 -6.738 1.00 0.00 C ATOM 0 H VAL A 131 -3.390 15.109 -4.977 1.00 0.00 H new ATOM 0 HA VAL A 131 -5.636 13.554 -3.859 1.00 0.00 H new ATOM 0 HB VAL A 131 -4.149 12.711 -6.332 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -6.350 11.763 -6.917 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -5.782 11.194 -5.329 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -7.035 12.453 -5.426 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -5.714 13.987 -7.749 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -6.372 14.780 -6.298 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -4.679 15.056 -6.773 1.00 0.00 H new ATOM 1956 N VAL A 132 -4.191 11.450 -3.389 1.00 0.00 N ATOM 1957 CA VAL A 132 -3.331 10.445 -2.767 1.00 0.00 C ATOM 1958 C VAL A 132 -3.262 9.167 -3.602 1.00 0.00 C ATOM 1959 O VAL A 132 -4.273 8.505 -3.818 1.00 0.00 O ATOM 1960 CB VAL A 132 -3.832 10.087 -1.347 1.00 0.00 C ATOM 1961 CG1 VAL A 132 -4.041 11.341 -0.515 1.00 0.00 C ATOM 1962 CG2 VAL A 132 -5.121 9.277 -1.408 1.00 0.00 C ATOM 0 H VAL A 132 -5.175 11.186 -3.443 1.00 0.00 H new ATOM 0 HA VAL A 132 -2.334 10.882 -2.704 1.00 0.00 H new ATOM 0 HB VAL A 132 -3.065 9.477 -0.870 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -4.393 11.064 0.479 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -3.098 11.881 -0.428 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -4.782 11.979 -0.998 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -5.450 9.040 -0.396 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -5.892 9.858 -1.913 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -4.944 8.353 -1.958 1.00 0.00 H new ATOM 1972 N GLY A 133 -2.063 8.816 -4.057 1.00 0.00 N ATOM 1973 CA GLY A 133 -1.902 7.609 -4.849 1.00 0.00 C ATOM 1974 C GLY A 133 -1.477 6.423 -4.005 1.00 0.00 C ATOM 1975 O GLY A 133 -0.409 6.441 -3.392 1.00 0.00 O ATOM 0 H GLY A 133 -1.205 9.342 -3.893 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -2.842 7.378 -5.351 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -1.159 7.784 -5.628 1.00 0.00 H new ATOM 1979 N PHE A 134 -2.316 5.393 -3.963 1.00 0.00 N ATOM 1980 CA PHE A 134 -2.020 4.200 -3.174 1.00 0.00 C ATOM 1981 C PHE A 134 -2.007 2.945 -4.041 1.00 0.00 C ATOM 1982 O PHE A 134 -2.801 2.810 -4.970 1.00 0.00 O ATOM 1983 CB PHE A 134 -3.052 4.034 -2.056 1.00 0.00 C ATOM 1984 CG PHE A 134 -3.215 5.247 -1.183 1.00 0.00 C ATOM 1985 CD1 PHE A 134 -2.144 6.086 -0.921 1.00 0.00 C ATOM 1986 CD2 PHE A 134 -4.445 5.542 -0.617 1.00 0.00 C ATOM 1987 CE1 PHE A 134 -2.296 7.195 -0.112 1.00 0.00 C ATOM 1988 CE2 PHE A 134 -4.603 6.651 0.193 1.00 0.00 C ATOM 1989 CZ PHE A 134 -3.527 7.478 0.446 1.00 0.00 C ATOM 0 H PHE A 134 -3.204 5.359 -4.464 1.00 0.00 H new ATOM 0 HA PHE A 134 -1.028 4.331 -2.742 1.00 0.00 H new ATOM 0 HB2 PHE A 134 -4.016 3.788 -2.501 1.00 0.00 H new ATOM 0 HB3 PHE A 134 -2.763 3.188 -1.433 1.00 0.00 H new ATOM 0 HD1 PHE A 134 -1.179 5.870 -1.355 1.00 0.00 H new ATOM 0 HD2 PHE A 134 -5.290 4.898 -0.811 1.00 0.00 H new ATOM 0 HE1 PHE A 134 -1.453 7.840 0.084 1.00 0.00 H new ATOM 0 HE2 PHE A 134 -5.567 6.870 0.627 1.00 0.00 H new ATOM 0 HZ PHE A 134 -3.648 8.345 1.079 1.00 0.00 H new ATOM 1999 N ALA A 135 -1.113 2.019 -3.714 1.00 0.00 N ATOM 2000 CA ALA A 135 -1.006 0.762 -4.444 1.00 0.00 C ATOM 2001 C ALA A 135 -1.926 -0.283 -3.824 1.00 0.00 C ATOM 2002 O ALA A 135 -1.701 -0.734 -2.701 1.00 0.00 O ATOM 2003 CB ALA A 135 0.434 0.275 -4.449 1.00 0.00 C ATOM 0 H ALA A 135 -0.450 2.116 -2.945 1.00 0.00 H new ATOM 0 HA ALA A 135 -1.315 0.926 -5.476 1.00 0.00 H new ATOM 0 HB1 ALA A 135 0.498 -0.665 -4.998 1.00 0.00 H new ATOM 0 HB2 ALA A 135 1.068 1.020 -4.929 1.00 0.00 H new ATOM 0 HB3 ALA A 135 0.769 0.120 -3.423 1.00 0.00 H new ATOM 2009 N ASP A 136 -2.975 -0.650 -4.552 1.00 0.00 N ATOM 2010 CA ASP A 136 -3.940 -1.626 -4.060 1.00 0.00 C ATOM 2011 C ASP A 136 -3.333 -3.023 -3.958 1.00 0.00 C ATOM 2012 O ASP A 136 -2.479 -3.403 -4.758 1.00 0.00 O ATOM 2013 CB ASP A 136 -5.167 -1.660 -4.975 1.00 0.00 C ATOM 2014 CG ASP A 136 -6.467 -1.720 -4.195 1.00 0.00 C ATOM 2015 OD1 ASP A 136 -6.504 -2.412 -3.156 1.00 0.00 O ATOM 2016 OD2 ASP A 136 -7.447 -1.076 -4.623 1.00 0.00 O ATOM 0 H ASP A 136 -3.178 -0.287 -5.483 1.00 0.00 H new ATOM 0 HA ASP A 136 -4.238 -1.317 -3.058 1.00 0.00 H new ATOM 0 HB2 ASP A 136 -5.168 -0.774 -5.610 1.00 0.00 H new ATOM 0 HB3 ASP A 136 -5.102 -2.525 -5.634 1.00 0.00 H new ATOM 2021 N VAL A 137 -3.800 -3.784 -2.972 1.00 0.00 N ATOM 2022 CA VAL A 137 -3.330 -5.150 -2.759 1.00 0.00 C ATOM 2023 C VAL A 137 -4.210 -6.144 -3.524 1.00 0.00 C ATOM 2024 O VAL A 137 -4.118 -7.356 -3.330 1.00 0.00 O ATOM 2025 CB VAL A 137 -3.323 -5.503 -1.251 1.00 0.00 C ATOM 2026 CG1 VAL A 137 -2.922 -6.955 -1.018 1.00 0.00 C ATOM 2027 CG2 VAL A 137 -2.393 -4.569 -0.492 1.00 0.00 C ATOM 0 H VAL A 137 -4.507 -3.476 -2.305 1.00 0.00 H new ATOM 0 HA VAL A 137 -2.309 -5.217 -3.135 1.00 0.00 H new ATOM 0 HB VAL A 137 -4.338 -5.374 -0.876 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -2.928 -7.167 0.051 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -3.629 -7.613 -1.522 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -1.921 -7.124 -1.416 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -2.399 -4.830 0.566 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -1.380 -4.666 -0.884 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -2.732 -3.540 -0.614 1.00 0.00 H new ATOM 2037 N ARG A 138 -5.065 -5.617 -4.401 1.00 0.00 N ATOM 2038 CA ARG A 138 -5.964 -6.445 -5.199 1.00 0.00 C ATOM 2039 C ARG A 138 -5.205 -7.249 -6.257 1.00 0.00 C ATOM 2040 O ARG A 138 -5.791 -8.090 -6.938 1.00 0.00 O ATOM 2041 CB ARG A 138 -7.021 -5.566 -5.870 1.00 0.00 C ATOM 2042 CG ARG A 138 -7.783 -4.679 -4.897 1.00 0.00 C ATOM 2043 CD ARG A 138 -8.945 -5.423 -4.260 1.00 0.00 C ATOM 2044 NE ARG A 138 -9.950 -5.813 -5.246 1.00 0.00 N ATOM 2045 CZ ARG A 138 -11.192 -6.177 -4.933 1.00 0.00 C ATOM 2046 NH1 ARG A 138 -11.584 -6.204 -3.666 1.00 0.00 N ATOM 2047 NH2 ARG A 138 -12.044 -6.516 -5.891 1.00 0.00 N ATOM 0 H ARG A 138 -5.152 -4.616 -4.576 1.00 0.00 H new ATOM 0 HA ARG A 138 -6.448 -7.154 -4.528 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -6.537 -4.938 -6.618 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -7.730 -6.204 -6.398 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -7.106 -4.324 -4.120 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -8.156 -3.799 -5.421 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -8.572 -6.312 -3.752 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -9.407 -4.792 -3.501 1.00 0.00 H new ATOM 0 HE ARG A 138 -9.685 -5.806 -6.231 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -10.933 -5.945 -2.925 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -12.537 -6.484 -3.433 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -11.748 -6.498 -6.867 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -12.996 -6.795 -5.652 1.00 0.00 H new ATOM 2061 N ASP A 139 -3.907 -6.987 -6.400 1.00 0.00 N ATOM 2062 CA ASP A 139 -3.094 -7.694 -7.385 1.00 0.00 C ATOM 2063 C ASP A 139 -2.311 -8.845 -6.751 1.00 0.00 C ATOM 2064 O ASP A 139 -1.426 -9.419 -7.384 1.00 0.00 O ATOM 2065 CB ASP A 139 -2.128 -6.727 -8.070 1.00 0.00 C ATOM 2066 CG ASP A 139 -1.365 -5.871 -7.080 1.00 0.00 C ATOM 2067 OD1 ASP A 139 -1.880 -4.798 -6.703 1.00 0.00 O ATOM 2068 OD2 ASP A 139 -0.250 -6.270 -6.684 1.00 0.00 O ATOM 0 H ASP A 139 -3.399 -6.295 -5.850 1.00 0.00 H new ATOM 0 HA ASP A 139 -3.773 -8.115 -8.127 1.00 0.00 H new ATOM 0 HB2 ASP A 139 -1.421 -7.293 -8.676 1.00 0.00 H new ATOM 0 HB3 ASP A 139 -2.685 -6.082 -8.749 1.00 0.00 H new ATOM 2073 N LEU A 140 -2.636 -9.184 -5.505 1.00 0.00 N ATOM 2074 CA LEU A 140 -1.953 -10.269 -4.814 1.00 0.00 C ATOM 2075 C LEU A 140 -2.597 -10.526 -3.459 1.00 0.00 C ATOM 2076 O LEU A 140 -1.918 -10.791 -2.473 1.00 0.00 O ATOM 2077 CB LEU A 140 -0.452 -9.963 -4.660 1.00 0.00 C ATOM 2078 CG LEU A 140 -0.070 -8.756 -3.781 1.00 0.00 C ATOM 2079 CD1 LEU A 140 -1.094 -7.636 -3.881 1.00 0.00 C ATOM 2080 CD2 LEU A 140 0.106 -9.179 -2.332 1.00 0.00 C ATOM 0 H LEU A 140 -3.364 -8.724 -4.958 1.00 0.00 H new ATOM 0 HA LEU A 140 -2.050 -11.173 -5.416 1.00 0.00 H new ATOM 0 HB2 LEU A 140 0.034 -10.848 -4.249 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -0.035 -9.803 -5.654 1.00 0.00 H new ATOM 0 HG LEU A 140 0.879 -8.373 -4.155 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -0.787 -6.805 -3.246 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -1.163 -7.297 -4.915 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -2.067 -8.002 -3.554 1.00 0.00 H new ATOM 0 HD21 LEU A 140 0.375 -8.311 -1.730 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -0.827 -9.603 -1.961 1.00 0.00 H new ATOM 0 HD23 LEU A 140 0.896 -9.927 -2.265 1.00 0.00 H new ATOM 2092 N LEU A 141 -3.922 -10.440 -3.429 1.00 0.00 N ATOM 2093 CA LEU A 141 -4.682 -10.651 -2.205 1.00 0.00 C ATOM 2094 C LEU A 141 -4.407 -12.016 -1.580 1.00 0.00 C ATOM 2095 O LEU A 141 -4.649 -12.218 -0.391 1.00 0.00 O ATOM 2096 CB LEU A 141 -6.173 -10.494 -2.483 1.00 0.00 C ATOM 2097 CG LEU A 141 -6.877 -9.496 -1.571 1.00 0.00 C ATOM 2098 CD1 LEU A 141 -6.503 -9.750 -0.126 1.00 0.00 C ATOM 2099 CD2 LEU A 141 -6.530 -8.070 -1.969 1.00 0.00 C ATOM 0 H LEU A 141 -4.494 -10.224 -4.245 1.00 0.00 H new ATOM 0 HA LEU A 141 -4.360 -9.896 -1.488 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -6.307 -10.180 -3.518 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -6.655 -11.466 -2.380 1.00 0.00 H new ATOM 0 HG LEU A 141 -7.953 -9.628 -1.679 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -7.013 -9.030 0.514 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -6.801 -10.760 0.155 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -5.425 -9.643 -0.005 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -7.042 -7.372 -1.306 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -5.453 -7.922 -1.889 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -6.846 -7.892 -2.997 1.00 0.00 H new ATOM 2111 N TRP A 142 -3.908 -12.952 -2.380 1.00 0.00 N ATOM 2112 CA TRP A 142 -3.615 -14.296 -1.888 1.00 0.00 C ATOM 2113 C TRP A 142 -2.667 -14.258 -0.686 1.00 0.00 C ATOM 2114 O TRP A 142 -1.452 -14.387 -0.834 1.00 0.00 O ATOM 2115 CB TRP A 142 -3.020 -15.166 -3.004 1.00 0.00 C ATOM 2116 CG TRP A 142 -1.841 -14.550 -3.696 1.00 0.00 C ATOM 2117 CD1 TRP A 142 -1.849 -13.498 -4.568 1.00 0.00 C ATOM 2118 CD2 TRP A 142 -0.477 -14.964 -3.582 1.00 0.00 C ATOM 2119 NE1 TRP A 142 -0.571 -13.226 -4.990 1.00 0.00 N ATOM 2120 CE2 TRP A 142 0.289 -14.114 -4.399 1.00 0.00 C ATOM 2121 CE3 TRP A 142 0.171 -15.970 -2.863 1.00 0.00 C ATOM 2122 CZ2 TRP A 142 1.668 -14.239 -4.514 1.00 0.00 C ATOM 2123 CZ3 TRP A 142 1.543 -16.094 -2.978 1.00 0.00 C ATOM 2124 CH2 TRP A 142 2.279 -15.232 -3.798 1.00 0.00 C ATOM 0 H TRP A 142 -3.698 -12.807 -3.368 1.00 0.00 H new ATOM 0 HA TRP A 142 -4.557 -14.738 -1.562 1.00 0.00 H new ATOM 0 HB2 TRP A 142 -2.720 -16.125 -2.582 1.00 0.00 H new ATOM 0 HB3 TRP A 142 -3.795 -15.371 -3.742 1.00 0.00 H new ATOM 0 HD1 TRP A 142 -2.732 -12.959 -4.880 1.00 0.00 H new ATOM 0 HE1 TRP A 142 -0.305 -12.484 -5.638 1.00 0.00 H new ATOM 0 HE3 TRP A 142 -0.390 -16.640 -2.228 1.00 0.00 H new ATOM 0 HZ2 TRP A 142 2.238 -13.575 -5.147 1.00 0.00 H new ATOM 0 HZ3 TRP A 142 2.055 -16.869 -2.426 1.00 0.00 H new ATOM 0 HH2 TRP A 142 3.350 -15.353 -3.867 1.00 0.00 H new ATOM 2135 N LEU A 143 -3.242 -14.094 0.506 1.00 0.00 N ATOM 2136 CA LEU A 143 -2.468 -14.051 1.747 1.00 0.00 C ATOM 2137 C LEU A 143 -3.262 -14.678 2.888 1.00 0.00 C ATOM 2138 O LEU A 143 -2.748 -15.511 3.634 1.00 0.00 O ATOM 2139 CB LEU A 143 -2.095 -12.610 2.117 1.00 0.00 C ATOM 2140 CG LEU A 143 -1.051 -11.942 1.216 1.00 0.00 C ATOM 2141 CD1 LEU A 143 -1.732 -11.077 0.178 1.00 0.00 C ATOM 2142 CD2 LEU A 143 -0.083 -11.106 2.039 1.00 0.00 C ATOM 0 H LEU A 143 -4.248 -13.988 0.638 1.00 0.00 H new ATOM 0 HA LEU A 143 -1.551 -14.618 1.586 1.00 0.00 H new ATOM 0 HB2 LEU A 143 -3.001 -12.004 2.103 1.00 0.00 H new ATOM 0 HB3 LEU A 143 -1.722 -12.602 3.141 1.00 0.00 H new ATOM 0 HG LEU A 143 -0.486 -12.725 0.710 1.00 0.00 H new ATOM 0 HD11 LEU A 143 -0.979 -10.608 -0.456 1.00 0.00 H new ATOM 0 HD12 LEU A 143 -2.389 -11.694 -0.435 1.00 0.00 H new ATOM 0 HD13 LEU A 143 -2.319 -10.305 0.676 1.00 0.00 H new ATOM 0 HD21 LEU A 143 0.649 -10.641 1.378 1.00 0.00 H new ATOM 0 HD22 LEU A 143 -0.634 -10.331 2.572 1.00 0.00 H new ATOM 0 HD23 LEU A 143 0.431 -11.745 2.757 1.00 0.00 H new ATOM 2154 N GLU A 144 -4.521 -14.268 3.015 1.00 0.00 N ATOM 2155 CA GLU A 144 -5.394 -14.783 4.063 1.00 0.00 C ATOM 2156 C GLU A 144 -6.853 -14.752 3.613 1.00 0.00 C ATOM 2157 O GLU A 144 -7.150 -14.450 2.458 1.00 0.00 O ATOM 2158 CB GLU A 144 -5.223 -13.964 5.345 1.00 0.00 C ATOM 2159 CG GLU A 144 -4.224 -14.565 6.320 1.00 0.00 C ATOM 2160 CD GLU A 144 -4.120 -13.774 7.610 1.00 0.00 C ATOM 2161 OE1 GLU A 144 -4.911 -14.045 8.538 1.00 0.00 O ATOM 2162 OE2 GLU A 144 -3.248 -12.884 7.691 1.00 0.00 O ATOM 0 H GLU A 144 -4.959 -13.579 2.403 1.00 0.00 H new ATOM 0 HA GLU A 144 -5.115 -15.817 4.263 1.00 0.00 H new ATOM 0 HB2 GLU A 144 -4.901 -12.956 5.083 1.00 0.00 H new ATOM 0 HB3 GLU A 144 -6.190 -13.871 5.839 1.00 0.00 H new ATOM 0 HG2 GLU A 144 -4.517 -15.590 6.549 1.00 0.00 H new ATOM 0 HG3 GLU A 144 -3.243 -14.612 5.847 1.00 0.00 H new ATOM 2169 N ASP A 145 -7.761 -15.066 4.533 1.00 0.00 N ATOM 2170 CA ASP A 145 -9.188 -15.073 4.227 1.00 0.00 C ATOM 2171 C ASP A 145 -9.649 -13.700 3.747 1.00 0.00 C ATOM 2172 O ASP A 145 -9.282 -12.675 4.321 1.00 0.00 O ATOM 2173 CB ASP A 145 -9.993 -15.494 5.458 1.00 0.00 C ATOM 2174 CG ASP A 145 -11.179 -16.368 5.103 1.00 0.00 C ATOM 2175 OD1 ASP A 145 -11.673 -16.263 3.960 1.00 0.00 O ATOM 2176 OD2 ASP A 145 -11.614 -17.158 5.967 1.00 0.00 O ATOM 0 H ASP A 145 -7.534 -15.319 5.495 1.00 0.00 H new ATOM 0 HA ASP A 145 -9.359 -15.793 3.427 1.00 0.00 H new ATOM 0 HB2 ASP A 145 -9.342 -16.032 6.147 1.00 0.00 H new ATOM 0 HB3 ASP A 145 -10.345 -14.604 5.980 1.00 0.00 H new ATOM 2181 N ASP A 146 -10.457 -13.689 2.691 1.00 0.00 N ATOM 2182 CA ASP A 146 -10.971 -12.444 2.132 1.00 0.00 C ATOM 2183 C ASP A 146 -12.197 -11.967 2.902 1.00 0.00 C ATOM 2184 O ASP A 146 -12.911 -12.765 3.508 1.00 0.00 O ATOM 2185 CB ASP A 146 -11.322 -12.634 0.654 1.00 0.00 C ATOM 2186 CG ASP A 146 -10.109 -12.520 -0.249 1.00 0.00 C ATOM 2187 OD1 ASP A 146 -9.256 -11.646 0.011 1.00 0.00 O ATOM 2188 OD2 ASP A 146 -10.013 -13.305 -1.215 1.00 0.00 O ATOM 0 H ASP A 146 -10.770 -14.529 2.205 1.00 0.00 H new ATOM 0 HA ASP A 146 -10.194 -11.685 2.220 1.00 0.00 H new ATOM 0 HB2 ASP A 146 -11.783 -13.612 0.516 1.00 0.00 H new ATOM 0 HB3 ASP A 146 -12.061 -11.889 0.360 1.00 0.00 H new ATOM 2193 N ALA A 147 -12.439 -10.659 2.874 1.00 0.00 N ATOM 2194 CA ALA A 147 -13.580 -10.079 3.570 1.00 0.00 C ATOM 2195 C ALA A 147 -14.853 -10.213 2.742 1.00 0.00 C ATOM 2196 O ALA A 147 -14.818 -10.136 1.514 1.00 0.00 O ATOM 2197 CB ALA A 147 -13.314 -8.618 3.900 1.00 0.00 C ATOM 0 H ALA A 147 -11.860 -9.983 2.377 1.00 0.00 H new ATOM 0 HA ALA A 147 -13.722 -10.628 4.501 1.00 0.00 H new ATOM 0 HB1 ALA A 147 -14.176 -8.200 4.420 1.00 0.00 H new ATOM 0 HB2 ALA A 147 -12.434 -8.544 4.539 1.00 0.00 H new ATOM 0 HB3 ALA A 147 -13.141 -8.062 2.978 1.00 0.00 H new ATOM 2203 N MET A 148 -15.977 -10.415 3.423 1.00 0.00 N ATOM 2204 CA MET A 148 -17.262 -10.560 2.750 1.00 0.00 C ATOM 2205 C MET A 148 -17.254 -11.765 1.813 1.00 0.00 C ATOM 2206 O MET A 148 -17.313 -11.617 0.593 1.00 0.00 O ATOM 2207 CB MET A 148 -17.599 -9.289 1.965 1.00 0.00 C ATOM 2208 CG MET A 148 -18.979 -9.315 1.326 1.00 0.00 C ATOM 2209 SD MET A 148 -18.921 -9.129 -0.467 1.00 0.00 S ATOM 2210 CE MET A 148 -18.174 -7.508 -0.612 1.00 0.00 C ATOM 0 H MET A 148 -16.023 -10.482 4.440 1.00 0.00 H new ATOM 0 HA MET A 148 -18.025 -10.720 3.511 1.00 0.00 H new ATOM 0 HB2 MET A 148 -17.534 -8.431 2.634 1.00 0.00 H new ATOM 0 HB3 MET A 148 -16.850 -9.144 1.186 1.00 0.00 H new ATOM 0 HG2 MET A 148 -19.472 -10.255 1.574 1.00 0.00 H new ATOM 0 HG3 MET A 148 -19.586 -8.516 1.750 1.00 0.00 H new ATOM 0 HE1 MET A 148 -18.460 -7.059 -1.563 1.00 0.00 H new ATOM 0 HE2 MET A 148 -18.518 -6.875 0.206 1.00 0.00 H new ATOM 0 HE3 MET A 148 -17.089 -7.602 -0.567 1.00 0.00 H new ATOM 2220 N GLU A 149 -17.180 -12.958 2.395 1.00 0.00 N ATOM 2221 CA GLU A 149 -17.164 -14.189 1.612 1.00 0.00 C ATOM 2222 C GLU A 149 -18.546 -14.486 1.040 1.00 0.00 C ATOM 2223 O GLU A 149 -18.737 -14.497 -0.176 1.00 0.00 O ATOM 2224 CB GLU A 149 -16.694 -15.361 2.476 1.00 0.00 C ATOM 2225 CG GLU A 149 -16.400 -16.622 1.682 1.00 0.00 C ATOM 2226 CD GLU A 149 -14.915 -16.897 1.551 1.00 0.00 C ATOM 2227 OE1 GLU A 149 -14.322 -17.426 2.515 1.00 0.00 O ATOM 2228 OE2 GLU A 149 -14.344 -16.584 0.486 1.00 0.00 O ATOM 0 H GLU A 149 -17.130 -13.098 3.404 1.00 0.00 H new ATOM 0 HA GLU A 149 -16.468 -14.056 0.784 1.00 0.00 H new ATOM 0 HB2 GLU A 149 -15.796 -15.065 3.018 1.00 0.00 H new ATOM 0 HB3 GLU A 149 -17.458 -15.581 3.222 1.00 0.00 H new ATOM 0 HG2 GLU A 149 -16.882 -17.472 2.166 1.00 0.00 H new ATOM 0 HG3 GLU A 149 -16.838 -16.531 0.688 1.00 0.00 H new ATOM 2235 N GLN A 150 -19.508 -14.726 1.926 1.00 0.00 N ATOM 2236 CA GLN A 150 -20.874 -15.023 1.510 1.00 0.00 C ATOM 2237 C GLN A 150 -21.754 -13.781 1.609 1.00 0.00 C ATOM 2238 O GLN A 150 -22.994 -13.934 1.617 1.00 0.00 O ATOM 2239 CB GLN A 150 -21.457 -16.148 2.369 1.00 0.00 C ATOM 2240 CG GLN A 150 -21.375 -17.517 1.714 1.00 0.00 C ATOM 2241 CD GLN A 150 -22.500 -17.758 0.727 1.00 0.00 C ATOM 2242 OE1 GLN A 150 -23.677 -17.715 1.087 1.00 0.00 O ATOM 2243 NE2 GLN A 150 -22.144 -18.016 -0.525 1.00 0.00 N ATOM 2244 OXT GLN A 150 -21.197 -12.666 1.680 1.00 0.00 O ATOM 0 H GLN A 150 -19.367 -14.721 2.936 1.00 0.00 H new ATOM 0 HA GLN A 150 -20.850 -15.346 0.469 1.00 0.00 H new ATOM 0 HB2 GLN A 150 -20.928 -16.178 3.322 1.00 0.00 H new ATOM 0 HB3 GLN A 150 -22.500 -15.922 2.590 1.00 0.00 H new ATOM 0 HG2 GLN A 150 -20.419 -17.613 1.200 1.00 0.00 H new ATOM 0 HG3 GLN A 150 -21.402 -18.287 2.485 1.00 0.00 H new ATOM 0 HE21 GLN A 150 -21.157 -18.042 -0.779 1.00 0.00 H new ATOM 0 HE22 GLN A 150 -22.858 -18.188 -1.233 1.00 0.00 H new TER 2253 GLN A 150 HETATM 2254 ZN ZN A 151 -14.781 -1.693 2.471 1.00 0.00 ZN