USER MOD reduce.3.24.130724 H: found=0, std=0, add=792, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 790 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 Single : A 1 GLY N :NH3+ 138:sc= 0.0383 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot -178:sc= -6.22! USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 ASN : amide:sc= 0.301 X(o=0.3,f=0) USER MOD Single : A 17 ASN : amide:sc= -1.17 K(o=-1.2,f=0.49) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 CYS SG : rot -167:sc= -0.316 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN : amide:sc=-0.00397 K(o=-0.004,f=-0.8) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 45 TYR OH : rot -140:sc= -2.12! USER MOD Single : A 59 SER OG : rot 57:sc= 0.0218 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 ASN : amide:sc= -0.223 K(o=-0.22,f=-2.5!) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 MET CE :methyl -113:sc= -4.12! (180deg=-5.15!) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 SER OG : rot 180:sc= -0.187 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 6.166 -20.171 13.676 1.00 0.00 N ATOM 2 CA GLY A 1 4.885 -19.489 13.739 1.00 0.00 C ATOM 3 C GLY A 1 4.415 -19.075 12.343 1.00 0.00 C ATOM 4 O GLY A 1 5.230 -18.759 11.478 1.00 0.00 O ATOM 0 H1 GLY A 1 6.774 -19.839 14.451 1.00 0.00 H new ATOM 0 H2 GLY A 1 6.018 -21.196 13.766 1.00 0.00 H new ATOM 0 H3 GLY A 1 6.624 -19.966 12.765 1.00 0.00 H new ATOM 0 HA2 GLY A 1 4.143 -20.143 14.197 1.00 0.00 H new ATOM 0 HA3 GLY A 1 4.969 -18.607 14.375 1.00 0.00 H new ATOM 8 N SER A 2 3.102 -19.090 12.167 1.00 0.00 N ATOM 9 CA SER A 2 2.513 -18.720 10.891 1.00 0.00 C ATOM 10 C SER A 2 1.571 -17.529 11.075 1.00 0.00 C ATOM 11 O SER A 2 0.833 -17.462 12.056 1.00 0.00 O ATOM 12 CB SER A 2 1.763 -19.899 10.268 1.00 0.00 C ATOM 13 OG SER A 2 0.612 -20.260 11.027 1.00 0.00 O ATOM 0 H SER A 2 2.429 -19.353 12.887 1.00 0.00 H new ATOM 0 HA SER A 2 3.318 -18.437 10.212 1.00 0.00 H new ATOM 0 HB2 SER A 2 1.462 -19.641 9.253 1.00 0.00 H new ATOM 0 HB3 SER A 2 2.432 -20.756 10.194 1.00 0.00 H new ATOM 0 HG SER A 2 0.160 -21.015 10.596 1.00 0.00 H new ATOM 19 N SER A 3 1.628 -16.617 10.115 1.00 0.00 N ATOM 20 CA SER A 3 0.789 -15.431 10.159 1.00 0.00 C ATOM 21 C SER A 3 -0.500 -15.673 9.370 1.00 0.00 C ATOM 22 O SER A 3 -1.587 -15.696 9.944 1.00 0.00 O ATOM 23 CB SER A 3 1.529 -14.212 9.605 1.00 0.00 C ATOM 24 OG SER A 3 0.765 -13.017 9.739 1.00 0.00 O ATOM 0 H SER A 3 2.242 -16.675 9.303 1.00 0.00 H new ATOM 0 HA SER A 3 0.538 -15.228 11.200 1.00 0.00 H new ATOM 0 HB2 SER A 3 2.478 -14.096 10.128 1.00 0.00 H new ATOM 0 HB3 SER A 3 1.763 -14.377 8.553 1.00 0.00 H new ATOM 0 HG SER A 3 1.273 -12.262 9.375 1.00 0.00 H new ATOM 30 N GLY A 4 -0.335 -15.847 8.067 1.00 0.00 N ATOM 31 CA GLY A 4 -1.471 -16.086 7.194 1.00 0.00 C ATOM 32 C GLY A 4 -1.744 -14.871 6.304 1.00 0.00 C ATOM 33 O GLY A 4 -1.395 -14.870 5.125 1.00 0.00 O ATOM 0 H GLY A 4 0.569 -15.827 7.595 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -1.279 -16.961 6.573 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -2.354 -16.308 7.793 1.00 0.00 H new ATOM 37 N SER A 5 -2.366 -13.866 6.904 1.00 0.00 N ATOM 38 CA SER A 5 -2.690 -12.649 6.181 1.00 0.00 C ATOM 39 C SER A 5 -1.420 -11.831 5.937 1.00 0.00 C ATOM 40 O SER A 5 -1.106 -10.922 6.704 1.00 0.00 O ATOM 41 CB SER A 5 -3.721 -11.813 6.942 1.00 0.00 C ATOM 42 OG SER A 5 -4.717 -12.626 7.558 1.00 0.00 O ATOM 0 H SER A 5 -2.654 -13.870 7.883 1.00 0.00 H new ATOM 0 HA SER A 5 -3.125 -12.928 5.221 1.00 0.00 H new ATOM 0 HB2 SER A 5 -3.216 -11.219 7.704 1.00 0.00 H new ATOM 0 HB3 SER A 5 -4.198 -11.113 6.256 1.00 0.00 H new ATOM 0 HG SER A 5 -5.373 -12.054 8.008 1.00 0.00 H new ATOM 48 N SER A 6 -0.724 -12.184 4.866 1.00 0.00 N ATOM 49 CA SER A 6 0.505 -11.494 4.512 1.00 0.00 C ATOM 50 C SER A 6 0.495 -11.139 3.024 1.00 0.00 C ATOM 51 O SER A 6 -0.488 -11.388 2.329 1.00 0.00 O ATOM 52 CB SER A 6 1.731 -12.346 4.846 1.00 0.00 C ATOM 53 OG SER A 6 2.208 -12.100 6.166 1.00 0.00 O ATOM 0 H SER A 6 -0.988 -12.938 4.232 1.00 0.00 H new ATOM 0 HA SER A 6 0.563 -10.577 5.098 1.00 0.00 H new ATOM 0 HB2 SER A 6 1.478 -13.401 4.743 1.00 0.00 H new ATOM 0 HB3 SER A 6 2.525 -12.136 4.129 1.00 0.00 H new ATOM 0 HG SER A 6 2.990 -12.664 6.342 1.00 0.00 H new ATOM 59 N GLY A 7 1.602 -10.562 2.579 1.00 0.00 N ATOM 60 CA GLY A 7 1.733 -10.170 1.186 1.00 0.00 C ATOM 61 C GLY A 7 0.786 -9.017 0.849 1.00 0.00 C ATOM 62 O GLY A 7 1.226 -7.887 0.641 1.00 0.00 O ATOM 0 H GLY A 7 2.416 -10.357 3.158 1.00 0.00 H new ATOM 0 HA2 GLY A 7 2.762 -9.871 0.984 1.00 0.00 H new ATOM 0 HA3 GLY A 7 1.517 -11.023 0.543 1.00 0.00 H new ATOM 66 N LEU A 8 -0.498 -9.341 0.806 1.00 0.00 N ATOM 67 CA LEU A 8 -1.511 -8.346 0.498 1.00 0.00 C ATOM 68 C LEU A 8 -1.160 -7.033 1.199 1.00 0.00 C ATOM 69 O LEU A 8 -1.068 -5.988 0.557 1.00 0.00 O ATOM 70 CB LEU A 8 -2.904 -8.875 0.845 1.00 0.00 C ATOM 71 CG LEU A 8 -3.333 -10.157 0.128 1.00 0.00 C ATOM 72 CD1 LEU A 8 -4.759 -10.552 0.518 1.00 0.00 C ATOM 73 CD2 LEU A 8 -3.171 -10.018 -1.387 1.00 0.00 C ATOM 0 H LEU A 8 -0.860 -10.279 0.979 1.00 0.00 H new ATOM 0 HA LEU A 8 -1.530 -8.141 -0.572 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -2.946 -9.052 1.920 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -3.633 -8.096 0.621 1.00 0.00 H new ATOM 0 HG LEU A 8 -2.676 -10.965 0.449 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -5.039 -11.466 -0.005 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -4.809 -10.720 1.594 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -5.446 -9.752 0.244 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -3.483 -10.943 -1.873 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -3.789 -9.194 -1.745 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -2.126 -9.818 -1.624 1.00 0.00 H new ATOM 85 N LYS A 9 -0.974 -7.128 2.507 1.00 0.00 N ATOM 86 CA LYS A 9 -0.634 -5.961 3.302 1.00 0.00 C ATOM 87 C LYS A 9 0.412 -5.129 2.558 1.00 0.00 C ATOM 88 O LYS A 9 0.195 -3.948 2.289 1.00 0.00 O ATOM 89 CB LYS A 9 -0.201 -6.378 4.709 1.00 0.00 C ATOM 90 CG LYS A 9 -0.988 -5.612 5.775 1.00 0.00 C ATOM 91 CD LYS A 9 -0.290 -5.691 7.134 1.00 0.00 C ATOM 92 CE LYS A 9 -1.162 -6.424 8.156 1.00 0.00 C ATOM 93 NZ LYS A 9 -0.320 -7.191 9.101 1.00 0.00 N ATOM 0 H LYS A 9 -1.052 -7.996 3.037 1.00 0.00 H new ATOM 0 HA LYS A 9 -1.509 -5.326 3.438 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -0.355 -7.449 4.838 1.00 0.00 H new ATOM 0 HB3 LYS A 9 0.866 -6.192 4.835 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -1.092 -4.569 5.476 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -1.994 -6.023 5.855 1.00 0.00 H new ATOM 0 HD2 LYS A 9 0.664 -6.207 7.027 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -0.070 -4.686 7.493 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -1.772 -5.706 8.704 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -1.847 -7.097 7.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -0.928 -7.682 9.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 0.244 -7.889 8.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 0.317 -6.541 9.605 1.00 0.00 H new ATOM 107 N GLN A 10 1.524 -5.777 2.246 1.00 0.00 N ATOM 108 CA GLN A 10 2.604 -5.112 1.538 1.00 0.00 C ATOM 109 C GLN A 10 2.141 -4.683 0.144 1.00 0.00 C ATOM 110 O GLN A 10 2.362 -3.544 -0.265 1.00 0.00 O ATOM 111 CB GLN A 10 3.840 -6.010 1.452 1.00 0.00 C ATOM 112 CG GLN A 10 5.071 -5.306 2.025 1.00 0.00 C ATOM 113 CD GLN A 10 6.355 -6.041 1.635 1.00 0.00 C ATOM 114 OE1 GLN A 10 6.592 -7.175 2.018 1.00 0.00 O ATOM 115 NE2 GLN A 10 7.166 -5.335 0.853 1.00 0.00 N ATOM 0 H GLN A 10 1.701 -6.756 2.471 1.00 0.00 H new ATOM 0 HA GLN A 10 2.882 -4.219 2.098 1.00 0.00 H new ATOM 0 HB2 GLN A 10 3.660 -6.936 1.998 1.00 0.00 H new ATOM 0 HB3 GLN A 10 4.024 -6.283 0.413 1.00 0.00 H new ATOM 0 HG2 GLN A 10 5.110 -4.280 1.660 1.00 0.00 H new ATOM 0 HG3 GLN A 10 4.993 -5.255 3.111 1.00 0.00 H new ATOM 0 HE21 GLN A 10 6.906 -4.390 0.569 1.00 0.00 H new ATOM 0 HE22 GLN A 10 8.048 -5.738 0.537 1.00 0.00 H new ATOM 124 N LYS A 11 1.507 -5.619 -0.548 1.00 0.00 N ATOM 125 CA LYS A 11 1.011 -5.353 -1.887 1.00 0.00 C ATOM 126 C LYS A 11 0.160 -4.081 -1.867 1.00 0.00 C ATOM 127 O LYS A 11 0.502 -3.091 -2.512 1.00 0.00 O ATOM 128 CB LYS A 11 0.276 -6.576 -2.439 1.00 0.00 C ATOM 129 CG LYS A 11 1.228 -7.764 -2.594 1.00 0.00 C ATOM 130 CD LYS A 11 0.488 -9.088 -2.397 1.00 0.00 C ATOM 131 CE LYS A 11 0.644 -9.991 -3.623 1.00 0.00 C ATOM 132 NZ LYS A 11 0.001 -11.302 -3.386 1.00 0.00 N ATOM 0 H LYS A 11 1.326 -6.563 -0.206 1.00 0.00 H new ATOM 0 HA LYS A 11 1.840 -5.172 -2.572 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -0.542 -6.846 -1.771 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -0.168 -6.333 -3.404 1.00 0.00 H new ATOM 0 HG2 LYS A 11 1.685 -7.742 -3.584 1.00 0.00 H new ATOM 0 HG3 LYS A 11 2.037 -7.684 -1.868 1.00 0.00 H new ATOM 0 HD2 LYS A 11 0.875 -9.597 -1.514 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -0.569 -8.894 -2.216 1.00 0.00 H new ATOM 0 HE2 LYS A 11 0.197 -9.512 -4.494 1.00 0.00 H new ATOM 0 HE3 LYS A 11 1.702 -10.133 -3.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 0.116 -11.902 -4.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 0.446 -11.764 -2.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -1.012 -11.163 -3.196 1.00 0.00 H new ATOM 146 N VAL A 12 -0.933 -4.150 -1.121 1.00 0.00 N ATOM 147 CA VAL A 12 -1.835 -3.017 -1.009 1.00 0.00 C ATOM 148 C VAL A 12 -1.046 -1.783 -0.567 1.00 0.00 C ATOM 149 O VAL A 12 -1.263 -0.686 -1.079 1.00 0.00 O ATOM 150 CB VAL A 12 -2.989 -3.358 -0.064 1.00 0.00 C ATOM 151 CG1 VAL A 12 -3.822 -2.115 0.255 1.00 0.00 C ATOM 152 CG2 VAL A 12 -3.864 -4.470 -0.647 1.00 0.00 C ATOM 0 H VAL A 12 -1.214 -4.973 -0.588 1.00 0.00 H new ATOM 0 HA VAL A 12 -2.281 -2.788 -1.977 1.00 0.00 H new ATOM 0 HB VAL A 12 -2.561 -3.723 0.870 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -4.635 -2.385 0.928 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -3.190 -1.366 0.732 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -4.235 -1.707 -0.668 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -4.677 -4.693 0.044 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -4.278 -4.145 -1.601 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -3.261 -5.365 -0.800 1.00 0.00 H new ATOM 162 N GLU A 13 -0.145 -2.004 0.380 1.00 0.00 N ATOM 163 CA GLU A 13 0.678 -0.924 0.897 1.00 0.00 C ATOM 164 C GLU A 13 1.364 -0.183 -0.253 1.00 0.00 C ATOM 165 O GLU A 13 1.258 1.038 -0.359 1.00 0.00 O ATOM 166 CB GLU A 13 1.706 -1.451 1.900 1.00 0.00 C ATOM 167 CG GLU A 13 1.125 -1.480 3.315 1.00 0.00 C ATOM 168 CD GLU A 13 1.918 -2.431 4.214 1.00 0.00 C ATOM 169 OE1 GLU A 13 3.153 -2.249 4.284 1.00 0.00 O ATOM 170 OE2 GLU A 13 1.272 -3.319 4.811 1.00 0.00 O ATOM 0 H GLU A 13 0.033 -2.915 0.802 1.00 0.00 H new ATOM 0 HA GLU A 13 0.033 -0.221 1.423 1.00 0.00 H new ATOM 0 HB2 GLU A 13 2.020 -2.454 1.611 1.00 0.00 H new ATOM 0 HB3 GLU A 13 2.595 -0.820 1.881 1.00 0.00 H new ATOM 0 HG2 GLU A 13 1.140 -0.476 3.739 1.00 0.00 H new ATOM 0 HG3 GLU A 13 0.082 -1.794 3.277 1.00 0.00 H new ATOM 177 N ASN A 14 2.051 -0.952 -1.084 1.00 0.00 N ATOM 178 CA ASN A 14 2.754 -0.383 -2.222 1.00 0.00 C ATOM 179 C ASN A 14 1.739 0.241 -3.182 1.00 0.00 C ATOM 180 O ASN A 14 1.951 1.344 -3.683 1.00 0.00 O ATOM 181 CB ASN A 14 3.528 -1.459 -2.985 1.00 0.00 C ATOM 182 CG ASN A 14 4.904 -1.693 -2.359 1.00 0.00 C ATOM 183 OD1 ASN A 14 5.856 -0.970 -2.602 1.00 0.00 O ATOM 184 ND2 ASN A 14 4.956 -2.742 -1.543 1.00 0.00 N ATOM 0 H ASN A 14 2.136 -1.964 -0.993 1.00 0.00 H new ATOM 0 HA ASN A 14 3.452 0.366 -1.848 1.00 0.00 H new ATOM 0 HB2 ASN A 14 2.961 -2.390 -2.983 1.00 0.00 H new ATOM 0 HB3 ASN A 14 3.645 -1.159 -4.026 1.00 0.00 H new ATOM 0 HD21 ASN A 14 5.831 -2.983 -1.077 1.00 0.00 H new ATOM 0 HD22 ASN A 14 4.121 -3.306 -1.383 1.00 0.00 H new ATOM 191 N LEU A 15 0.660 -0.492 -3.411 1.00 0.00 N ATOM 192 CA LEU A 15 -0.388 -0.025 -4.303 1.00 0.00 C ATOM 193 C LEU A 15 -0.633 1.466 -4.057 1.00 0.00 C ATOM 194 O LEU A 15 -0.372 2.293 -4.929 1.00 0.00 O ATOM 195 CB LEU A 15 -1.643 -0.887 -4.154 1.00 0.00 C ATOM 196 CG LEU A 15 -2.978 -0.166 -4.348 1.00 0.00 C ATOM 197 CD1 LEU A 15 -3.123 0.344 -5.783 1.00 0.00 C ATOM 198 CD2 LEU A 15 -4.149 -1.062 -3.937 1.00 0.00 C ATOM 0 H LEU A 15 0.488 -1.407 -2.994 1.00 0.00 H new ATOM 0 HA LEU A 15 -0.079 -0.131 -5.343 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -1.586 -1.704 -4.873 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -1.636 -1.336 -3.161 1.00 0.00 H new ATOM 0 HG LEU A 15 -2.994 0.706 -3.694 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -4.081 0.852 -5.893 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -2.315 1.041 -6.005 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -3.077 -0.497 -6.475 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -5.087 -0.526 -4.085 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -4.148 -1.965 -4.547 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -4.048 -1.334 -2.886 1.00 0.00 H new ATOM 210 N PHE A 16 -1.131 1.762 -2.865 1.00 0.00 N ATOM 211 CA PHE A 16 -1.414 3.138 -2.494 1.00 0.00 C ATOM 212 C PHE A 16 -0.198 4.033 -2.739 1.00 0.00 C ATOM 213 O PHE A 16 -0.242 4.932 -3.578 1.00 0.00 O ATOM 214 CB PHE A 16 -1.741 3.140 -1.000 1.00 0.00 C ATOM 215 CG PHE A 16 -2.997 2.345 -0.636 1.00 0.00 C ATOM 216 CD1 PHE A 16 -4.051 2.309 -1.495 1.00 0.00 C ATOM 217 CD2 PHE A 16 -3.058 1.673 0.545 1.00 0.00 C ATOM 218 CE1 PHE A 16 -5.216 1.571 -1.158 1.00 0.00 C ATOM 219 CE2 PHE A 16 -4.223 0.935 0.882 1.00 0.00 C ATOM 220 CZ PHE A 16 -5.278 0.899 0.023 1.00 0.00 C ATOM 0 H PHE A 16 -1.346 1.073 -2.144 1.00 0.00 H new ATOM 0 HA PHE A 16 -2.240 3.522 -3.092 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -0.893 2.730 -0.452 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -1.867 4.170 -0.668 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -4.002 2.842 -2.433 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -2.220 1.701 1.226 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -6.053 1.543 -1.840 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -4.272 0.402 1.820 1.00 0.00 H new ATOM 0 HZ PHE A 16 -6.164 0.337 0.279 1.00 0.00 H new ATOM 230 N ASN A 17 0.861 3.757 -1.991 1.00 0.00 N ATOM 231 CA ASN A 17 2.087 4.526 -2.116 1.00 0.00 C ATOM 232 C ASN A 17 2.359 4.807 -3.596 1.00 0.00 C ATOM 233 O ASN A 17 2.523 5.960 -3.993 1.00 0.00 O ATOM 234 CB ASN A 17 3.282 3.753 -1.554 1.00 0.00 C ATOM 235 CG ASN A 17 3.232 3.702 -0.026 1.00 0.00 C ATOM 236 OD1 ASN A 17 2.476 2.953 0.571 1.00 0.00 O ATOM 237 ND2 ASN A 17 4.076 4.538 0.571 1.00 0.00 N ATOM 0 H ASN A 17 0.895 3.011 -1.296 1.00 0.00 H new ATOM 0 HA ASN A 17 1.962 5.453 -1.557 1.00 0.00 H new ATOM 0 HB2 ASN A 17 3.285 2.740 -1.955 1.00 0.00 H new ATOM 0 HB3 ASN A 17 4.210 4.226 -1.876 1.00 0.00 H new ATOM 0 HD21 ASN A 17 4.118 4.579 1.589 1.00 0.00 H new ATOM 0 HD22 ASN A 17 4.682 5.138 0.011 1.00 0.00 H new ATOM 244 N GLU A 18 2.399 3.733 -4.371 1.00 0.00 N ATOM 245 CA GLU A 18 2.648 3.850 -5.798 1.00 0.00 C ATOM 246 C GLU A 18 1.643 4.812 -6.436 1.00 0.00 C ATOM 247 O GLU A 18 2.031 5.822 -7.021 1.00 0.00 O ATOM 248 CB GLU A 18 2.602 2.479 -6.476 1.00 0.00 C ATOM 249 CG GLU A 18 4.012 1.964 -6.770 1.00 0.00 C ATOM 250 CD GLU A 18 4.265 1.885 -8.277 1.00 0.00 C ATOM 251 OE1 GLU A 18 3.329 1.460 -8.987 1.00 0.00 O ATOM 252 OE2 GLU A 18 5.388 2.252 -8.684 1.00 0.00 O ATOM 0 H GLU A 18 2.263 2.778 -4.038 1.00 0.00 H new ATOM 0 HA GLU A 18 3.649 4.256 -5.940 1.00 0.00 H new ATOM 0 HB2 GLU A 18 2.079 1.770 -5.835 1.00 0.00 H new ATOM 0 HB3 GLU A 18 2.035 2.548 -7.405 1.00 0.00 H new ATOM 0 HG2 GLU A 18 4.747 2.623 -6.309 1.00 0.00 H new ATOM 0 HG3 GLU A 18 4.143 0.978 -6.324 1.00 0.00 H new ATOM 259 N LYS A 19 0.372 4.464 -6.301 1.00 0.00 N ATOM 260 CA LYS A 19 -0.691 5.283 -6.857 1.00 0.00 C ATOM 261 C LYS A 19 -0.458 6.745 -6.469 1.00 0.00 C ATOM 262 O LYS A 19 -0.684 7.648 -7.273 1.00 0.00 O ATOM 263 CB LYS A 19 -2.059 4.746 -6.433 1.00 0.00 C ATOM 264 CG LYS A 19 -2.339 3.387 -7.080 1.00 0.00 C ATOM 265 CD LYS A 19 -2.353 3.499 -8.606 1.00 0.00 C ATOM 266 CE LYS A 19 -3.627 2.885 -9.188 1.00 0.00 C ATOM 267 NZ LYS A 19 -3.561 2.860 -10.667 1.00 0.00 N ATOM 0 H LYS A 19 0.054 3.626 -5.814 1.00 0.00 H new ATOM 0 HA LYS A 19 -0.679 5.235 -7.946 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -2.096 4.651 -5.348 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -2.836 5.455 -6.717 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -1.579 2.670 -6.771 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -3.298 3.005 -6.731 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -2.284 4.547 -8.898 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -1.480 2.994 -9.019 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -3.757 1.872 -8.807 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -4.495 3.460 -8.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -4.434 2.440 -11.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -3.459 3.831 -11.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -2.744 2.292 -10.968 1.00 0.00 H new ATOM 281 N CYS A 20 -0.008 6.933 -5.237 1.00 0.00 N ATOM 282 CA CYS A 20 0.259 8.269 -4.733 1.00 0.00 C ATOM 283 C CYS A 20 0.986 9.058 -5.824 1.00 0.00 C ATOM 284 O CYS A 20 0.418 9.975 -6.415 1.00 0.00 O ATOM 285 CB CYS A 20 1.055 8.233 -3.427 1.00 0.00 C ATOM 286 SG CYS A 20 0.388 9.467 -2.252 1.00 0.00 S ATOM 0 H CYS A 20 0.178 6.182 -4.573 1.00 0.00 H new ATOM 0 HA CYS A 20 -0.682 8.765 -4.494 1.00 0.00 H new ATOM 0 HB2 CYS A 20 1.004 7.237 -2.988 1.00 0.00 H new ATOM 0 HB3 CYS A 20 2.106 8.440 -3.627 1.00 0.00 H new ATOM 0 HG CYS A 20 1.218 9.617 -1.262 1.00 0.00 H new ATOM 292 N GLY A 21 2.232 8.672 -6.057 1.00 0.00 N ATOM 293 CA GLY A 21 3.043 9.332 -7.067 1.00 0.00 C ATOM 294 C GLY A 21 2.287 9.439 -8.393 1.00 0.00 C ATOM 295 O GLY A 21 2.232 10.510 -8.995 1.00 0.00 O ATOM 0 H GLY A 21 2.700 7.911 -5.564 1.00 0.00 H new ATOM 0 HA2 GLY A 21 3.321 10.328 -6.722 1.00 0.00 H new ATOM 0 HA3 GLY A 21 3.969 8.776 -7.216 1.00 0.00 H new ATOM 299 N GLU A 22 1.723 8.315 -8.809 1.00 0.00 N ATOM 300 CA GLU A 22 0.973 8.269 -10.052 1.00 0.00 C ATOM 301 C GLU A 22 0.070 9.498 -10.173 1.00 0.00 C ATOM 302 O GLU A 22 -0.077 10.061 -11.256 1.00 0.00 O ATOM 303 CB GLU A 22 0.159 6.978 -10.154 1.00 0.00 C ATOM 304 CG GLU A 22 0.353 6.314 -11.519 1.00 0.00 C ATOM 305 CD GLU A 22 -0.959 6.285 -12.306 1.00 0.00 C ATOM 306 OE1 GLU A 22 -2.011 6.130 -11.650 1.00 0.00 O ATOM 307 OE2 GLU A 22 -0.880 6.419 -13.547 1.00 0.00 O ATOM 0 H GLU A 22 1.771 7.428 -8.307 1.00 0.00 H new ATOM 0 HA GLU A 22 1.681 8.280 -10.881 1.00 0.00 H new ATOM 0 HB2 GLU A 22 0.461 6.290 -9.365 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -0.897 7.197 -9.999 1.00 0.00 H new ATOM 0 HG2 GLU A 22 1.110 6.856 -12.087 1.00 0.00 H new ATOM 0 HG3 GLU A 22 0.723 5.298 -11.384 1.00 0.00 H new ATOM 314 N ALA A 23 -0.512 9.878 -9.045 1.00 0.00 N ATOM 315 CA ALA A 23 -1.398 11.029 -9.010 1.00 0.00 C ATOM 316 C ALA A 23 -0.677 12.239 -9.608 1.00 0.00 C ATOM 317 O ALA A 23 -1.153 12.836 -10.573 1.00 0.00 O ATOM 318 CB ALA A 23 -1.858 11.277 -7.573 1.00 0.00 C ATOM 0 H ALA A 23 -0.387 9.409 -8.148 1.00 0.00 H new ATOM 0 HA ALA A 23 -2.289 10.845 -9.610 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -2.523 12.141 -7.548 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -2.389 10.399 -7.204 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -0.991 11.468 -6.941 1.00 0.00 H new ATOM 324 N LEU A 24 0.460 12.566 -9.010 1.00 0.00 N ATOM 325 CA LEU A 24 1.251 13.694 -9.472 1.00 0.00 C ATOM 326 C LEU A 24 1.922 13.332 -10.798 1.00 0.00 C ATOM 327 O LEU A 24 2.430 14.205 -11.500 1.00 0.00 O ATOM 328 CB LEU A 24 2.234 14.138 -8.387 1.00 0.00 C ATOM 329 CG LEU A 24 1.613 14.583 -7.061 1.00 0.00 C ATOM 330 CD1 LEU A 24 1.935 13.588 -5.944 1.00 0.00 C ATOM 331 CD2 LEU A 24 2.045 16.006 -6.703 1.00 0.00 C ATOM 0 H LEU A 24 0.852 12.069 -8.210 1.00 0.00 H new ATOM 0 HA LEU A 24 0.611 14.555 -9.663 1.00 0.00 H new ATOM 0 HB2 LEU A 24 2.919 13.314 -8.186 1.00 0.00 H new ATOM 0 HB3 LEU A 24 2.831 14.961 -8.780 1.00 0.00 H new ATOM 0 HG LEU A 24 0.529 14.596 -7.179 1.00 0.00 H new ATOM 0 HD11 LEU A 24 1.482 13.928 -5.013 1.00 0.00 H new ATOM 0 HD12 LEU A 24 1.537 12.607 -6.205 1.00 0.00 H new ATOM 0 HD13 LEU A 24 3.016 13.519 -5.818 1.00 0.00 H new ATOM 0 HD21 LEU A 24 1.590 16.297 -5.757 1.00 0.00 H new ATOM 0 HD22 LEU A 24 3.130 16.044 -6.610 1.00 0.00 H new ATOM 0 HD23 LEU A 24 1.723 16.692 -7.487 1.00 0.00 H new ATOM 343 N GLY A 25 1.903 12.042 -11.102 1.00 0.00 N ATOM 344 CA GLY A 25 2.503 11.554 -12.332 1.00 0.00 C ATOM 345 C GLY A 25 4.008 11.339 -12.160 1.00 0.00 C ATOM 346 O GLY A 25 4.813 12.021 -12.792 1.00 0.00 O ATOM 0 H GLY A 25 1.481 11.320 -10.517 1.00 0.00 H new ATOM 0 HA2 GLY A 25 2.029 10.617 -12.625 1.00 0.00 H new ATOM 0 HA3 GLY A 25 2.323 12.267 -13.136 1.00 0.00 H new ATOM 350 N LEU A 26 4.342 10.386 -11.302 1.00 0.00 N ATOM 351 CA LEU A 26 5.736 10.072 -11.038 1.00 0.00 C ATOM 352 C LEU A 26 6.001 8.609 -11.398 1.00 0.00 C ATOM 353 O LEU A 26 5.067 7.820 -11.532 1.00 0.00 O ATOM 354 CB LEU A 26 6.102 10.427 -9.596 1.00 0.00 C ATOM 355 CG LEU A 26 5.845 11.875 -9.175 1.00 0.00 C ATOM 356 CD1 LEU A 26 6.154 12.078 -7.691 1.00 0.00 C ATOM 357 CD2 LEU A 26 6.622 12.850 -10.062 1.00 0.00 C ATOM 0 H LEU A 26 3.671 9.821 -10.781 1.00 0.00 H new ATOM 0 HA LEU A 26 6.389 10.679 -11.666 1.00 0.00 H new ATOM 0 HB2 LEU A 26 5.543 9.771 -8.928 1.00 0.00 H new ATOM 0 HB3 LEU A 26 7.159 10.208 -9.446 1.00 0.00 H new ATOM 0 HG LEU A 26 4.785 12.088 -9.314 1.00 0.00 H new ATOM 0 HD11 LEU A 26 5.963 13.116 -7.418 1.00 0.00 H new ATOM 0 HD12 LEU A 26 5.519 11.423 -7.094 1.00 0.00 H new ATOM 0 HD13 LEU A 26 7.201 11.840 -7.501 1.00 0.00 H new ATOM 0 HD21 LEU A 26 6.422 13.872 -9.741 1.00 0.00 H new ATOM 0 HD22 LEU A 26 7.690 12.646 -9.979 1.00 0.00 H new ATOM 0 HD23 LEU A 26 6.309 12.727 -11.099 1.00 0.00 H new ATOM 369 N LYS A 27 7.279 8.291 -11.544 1.00 0.00 N ATOM 370 CA LYS A 27 7.679 6.936 -11.886 1.00 0.00 C ATOM 371 C LYS A 27 8.039 6.177 -10.607 1.00 0.00 C ATOM 372 O LYS A 27 8.525 5.049 -10.666 1.00 0.00 O ATOM 373 CB LYS A 27 8.801 6.955 -12.926 1.00 0.00 C ATOM 374 CG LYS A 27 8.247 7.230 -14.325 1.00 0.00 C ATOM 375 CD LYS A 27 9.194 6.699 -15.404 1.00 0.00 C ATOM 376 CE LYS A 27 9.928 7.845 -16.102 1.00 0.00 C ATOM 377 NZ LYS A 27 11.393 7.662 -15.998 1.00 0.00 N ATOM 0 H LYS A 27 8.051 8.948 -11.432 1.00 0.00 H new ATOM 0 HA LYS A 27 6.852 6.401 -12.353 1.00 0.00 H new ATOM 0 HB2 LYS A 27 9.532 7.720 -12.664 1.00 0.00 H new ATOM 0 HB3 LYS A 27 9.324 5.999 -12.920 1.00 0.00 H new ATOM 0 HG2 LYS A 27 7.269 6.761 -14.431 1.00 0.00 H new ATOM 0 HG3 LYS A 27 8.102 8.302 -14.459 1.00 0.00 H new ATOM 0 HD2 LYS A 27 9.918 6.019 -14.955 1.00 0.00 H new ATOM 0 HD3 LYS A 27 8.629 6.124 -16.138 1.00 0.00 H new ATOM 0 HE2 LYS A 27 9.634 7.887 -17.151 1.00 0.00 H new ATOM 0 HE3 LYS A 27 9.641 8.796 -15.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 11.876 8.449 -16.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 11.670 7.644 -14.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 11.664 6.764 -16.448 1.00 0.00 H new ATOM 391 N GLN A 28 7.786 6.827 -9.480 1.00 0.00 N ATOM 392 CA GLN A 28 8.076 6.228 -8.189 1.00 0.00 C ATOM 393 C GLN A 28 6.859 6.334 -7.269 1.00 0.00 C ATOM 394 O GLN A 28 5.797 6.790 -7.688 1.00 0.00 O ATOM 395 CB GLN A 28 9.306 6.875 -7.549 1.00 0.00 C ATOM 396 CG GLN A 28 9.078 8.369 -7.312 1.00 0.00 C ATOM 397 CD GLN A 28 9.963 9.212 -8.233 1.00 0.00 C ATOM 398 OE1 GLN A 28 10.067 8.973 -9.425 1.00 0.00 O ATOM 399 NE2 GLN A 28 10.593 10.207 -7.616 1.00 0.00 N ATOM 0 H GLN A 28 7.383 7.763 -9.435 1.00 0.00 H new ATOM 0 HA GLN A 28 8.300 5.172 -8.342 1.00 0.00 H new ATOM 0 HB2 GLN A 28 9.529 6.383 -6.602 1.00 0.00 H new ATOM 0 HB3 GLN A 28 10.173 6.734 -8.194 1.00 0.00 H new ATOM 0 HG2 GLN A 28 8.030 8.613 -7.486 1.00 0.00 H new ATOM 0 HG3 GLN A 28 9.293 8.613 -6.272 1.00 0.00 H new ATOM 0 HE21 GLN A 28 10.461 10.351 -6.615 1.00 0.00 H new ATOM 0 HE22 GLN A 28 11.208 10.826 -8.144 1.00 0.00 H new ATOM 408 N ALA A 29 7.054 5.904 -6.030 1.00 0.00 N ATOM 409 CA ALA A 29 5.985 5.945 -5.047 1.00 0.00 C ATOM 410 C ALA A 29 6.124 7.212 -4.201 1.00 0.00 C ATOM 411 O ALA A 29 7.146 7.894 -4.261 1.00 0.00 O ATOM 412 CB ALA A 29 6.022 4.671 -4.200 1.00 0.00 C ATOM 0 H ALA A 29 7.936 5.526 -5.685 1.00 0.00 H new ATOM 0 HA ALA A 29 5.013 5.982 -5.538 1.00 0.00 H new ATOM 0 HB1 ALA A 29 5.220 4.701 -3.462 1.00 0.00 H new ATOM 0 HB2 ALA A 29 5.890 3.802 -4.844 1.00 0.00 H new ATOM 0 HB3 ALA A 29 6.982 4.601 -3.689 1.00 0.00 H new ATOM 418 N VAL A 30 5.081 7.490 -3.433 1.00 0.00 N ATOM 419 CA VAL A 30 5.074 8.663 -2.576 1.00 0.00 C ATOM 420 C VAL A 30 4.179 8.399 -1.364 1.00 0.00 C ATOM 421 O VAL A 30 3.008 8.052 -1.516 1.00 0.00 O ATOM 422 CB VAL A 30 4.647 9.894 -3.378 1.00 0.00 C ATOM 423 CG1 VAL A 30 4.762 11.165 -2.533 1.00 0.00 C ATOM 424 CG2 VAL A 30 5.461 10.017 -4.667 1.00 0.00 C ATOM 0 H VAL A 30 4.235 6.923 -3.386 1.00 0.00 H new ATOM 0 HA VAL A 30 6.077 8.868 -2.201 1.00 0.00 H new ATOM 0 HB VAL A 30 3.600 9.769 -3.654 1.00 0.00 H new ATOM 0 HG11 VAL A 30 4.453 12.026 -3.126 1.00 0.00 H new ATOM 0 HG12 VAL A 30 4.120 11.079 -1.657 1.00 0.00 H new ATOM 0 HG13 VAL A 30 5.796 11.297 -2.214 1.00 0.00 H new ATOM 0 HG21 VAL A 30 5.138 10.900 -5.219 1.00 0.00 H new ATOM 0 HG22 VAL A 30 6.519 10.109 -4.422 1.00 0.00 H new ATOM 0 HG23 VAL A 30 5.307 9.129 -5.281 1.00 0.00 H new ATOM 434 N LYS A 31 4.763 8.573 -0.187 1.00 0.00 N ATOM 435 CA LYS A 31 4.032 8.357 1.050 1.00 0.00 C ATOM 436 C LYS A 31 2.606 8.889 0.894 1.00 0.00 C ATOM 437 O LYS A 31 2.387 9.906 0.238 1.00 0.00 O ATOM 438 CB LYS A 31 4.789 8.965 2.232 1.00 0.00 C ATOM 439 CG LYS A 31 4.755 8.032 3.444 1.00 0.00 C ATOM 440 CD LYS A 31 3.503 8.276 4.289 1.00 0.00 C ATOM 441 CE LYS A 31 3.434 7.298 5.463 1.00 0.00 C ATOM 442 NZ LYS A 31 3.696 8.002 6.739 1.00 0.00 N ATOM 0 H LYS A 31 5.734 8.861 -0.064 1.00 0.00 H new ATOM 0 HA LYS A 31 3.953 7.291 1.265 1.00 0.00 H new ATOM 0 HB2 LYS A 31 5.823 9.158 1.946 1.00 0.00 H new ATOM 0 HB3 LYS A 31 4.347 9.926 2.496 1.00 0.00 H new ATOM 0 HG2 LYS A 31 4.776 6.995 3.110 1.00 0.00 H new ATOM 0 HG3 LYS A 31 5.645 8.189 4.053 1.00 0.00 H new ATOM 0 HD2 LYS A 31 3.507 9.300 4.664 1.00 0.00 H new ATOM 0 HD3 LYS A 31 2.614 8.167 3.668 1.00 0.00 H new ATOM 0 HE2 LYS A 31 2.451 6.828 5.495 1.00 0.00 H new ATOM 0 HE3 LYS A 31 4.164 6.501 5.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 3.646 7.324 7.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 4.643 8.430 6.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 2.983 8.747 6.877 1.00 0.00 H new ATOM 456 N VAL A 32 1.673 8.178 1.509 1.00 0.00 N ATOM 457 CA VAL A 32 0.274 8.565 1.447 1.00 0.00 C ATOM 458 C VAL A 32 -0.074 9.402 2.680 1.00 0.00 C ATOM 459 O VAL A 32 -0.102 8.886 3.797 1.00 0.00 O ATOM 460 CB VAL A 32 -0.607 7.323 1.299 1.00 0.00 C ATOM 461 CG1 VAL A 32 -2.082 7.668 1.516 1.00 0.00 C ATOM 462 CG2 VAL A 32 -0.394 6.659 -0.063 1.00 0.00 C ATOM 0 H VAL A 32 1.858 7.335 2.053 1.00 0.00 H new ATOM 0 HA VAL A 32 0.088 9.185 0.570 1.00 0.00 H new ATOM 0 HB VAL A 32 -0.313 6.610 2.069 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -2.686 6.768 1.405 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -2.217 8.075 2.518 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -2.395 8.408 0.779 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -1.032 5.779 -0.142 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -0.648 7.364 -0.855 1.00 0.00 H new ATOM 0 HG23 VAL A 32 0.650 6.361 -0.163 1.00 0.00 H new ATOM 472 N PRO A 33 -0.338 10.712 2.430 1.00 0.00 N ATOM 473 CA PRO A 33 -0.683 11.625 3.507 1.00 0.00 C ATOM 474 C PRO A 33 -2.118 11.391 3.984 1.00 0.00 C ATOM 475 O PRO A 33 -2.962 12.281 3.884 1.00 0.00 O ATOM 476 CB PRO A 33 -0.468 13.014 2.929 1.00 0.00 C ATOM 477 CG PRO A 33 -0.460 12.841 1.418 1.00 0.00 C ATOM 478 CD PRO A 33 -0.315 11.357 1.120 1.00 0.00 C ATOM 0 HA PRO A 33 -0.069 11.479 4.396 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -1.262 13.693 3.240 1.00 0.00 H new ATOM 0 HB3 PRO A 33 0.472 13.441 3.278 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -1.382 13.229 0.984 1.00 0.00 H new ATOM 0 HG3 PRO A 33 0.362 13.402 0.974 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -1.128 10.999 0.488 1.00 0.00 H new ATOM 0 HD3 PRO A 33 0.615 11.148 0.592 1.00 0.00 H new ATOM 486 N PHE A 34 -2.350 10.191 4.494 1.00 0.00 N ATOM 487 CA PHE A 34 -3.668 9.829 4.987 1.00 0.00 C ATOM 488 C PHE A 34 -4.322 11.005 5.716 1.00 0.00 C ATOM 489 O PHE A 34 -5.504 11.283 5.516 1.00 0.00 O ATOM 490 CB PHE A 34 -3.476 8.676 5.974 1.00 0.00 C ATOM 491 CG PHE A 34 -3.263 7.315 5.308 1.00 0.00 C ATOM 492 CD1 PHE A 34 -4.335 6.577 4.912 1.00 0.00 C ATOM 493 CD2 PHE A 34 -2.003 6.844 5.111 1.00 0.00 C ATOM 494 CE1 PHE A 34 -4.138 5.314 4.294 1.00 0.00 C ATOM 495 CE2 PHE A 34 -1.806 5.581 4.493 1.00 0.00 C ATOM 496 CZ PHE A 34 -2.877 4.843 4.097 1.00 0.00 C ATOM 0 H PHE A 34 -1.647 9.456 4.577 1.00 0.00 H new ATOM 0 HA PHE A 34 -4.312 9.548 4.154 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -2.619 8.895 6.611 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -4.349 8.618 6.624 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -5.336 6.952 5.068 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -1.152 7.430 5.425 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -4.989 4.727 3.980 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -0.805 5.206 4.337 1.00 0.00 H new ATOM 0 HZ PHE A 34 -2.727 3.883 3.626 1.00 0.00 H new ATOM 506 N ALA A 35 -3.526 11.663 6.545 1.00 0.00 N ATOM 507 CA ALA A 35 -4.012 12.802 7.304 1.00 0.00 C ATOM 508 C ALA A 35 -4.759 13.753 6.367 1.00 0.00 C ATOM 509 O ALA A 35 -5.916 14.091 6.613 1.00 0.00 O ATOM 510 CB ALA A 35 -2.839 13.483 8.012 1.00 0.00 C ATOM 0 H ALA A 35 -2.547 11.429 6.708 1.00 0.00 H new ATOM 0 HA ALA A 35 -4.713 12.479 8.073 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -3.204 14.338 8.581 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -2.361 12.774 8.688 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -2.115 13.823 7.272 1.00 0.00 H new ATOM 516 N LEU A 36 -4.067 14.157 5.312 1.00 0.00 N ATOM 517 CA LEU A 36 -4.650 15.062 4.336 1.00 0.00 C ATOM 518 C LEU A 36 -6.034 14.548 3.933 1.00 0.00 C ATOM 519 O LEU A 36 -7.005 15.303 3.932 1.00 0.00 O ATOM 520 CB LEU A 36 -3.700 15.261 3.154 1.00 0.00 C ATOM 521 CG LEU A 36 -2.718 16.429 3.271 1.00 0.00 C ATOM 522 CD1 LEU A 36 -1.589 16.100 4.250 1.00 0.00 C ATOM 523 CD2 LEU A 36 -2.185 16.836 1.897 1.00 0.00 C ATOM 0 H LEU A 36 -3.108 13.874 5.112 1.00 0.00 H new ATOM 0 HA LEU A 36 -4.791 16.051 4.771 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -3.128 14.344 3.015 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -4.297 15.403 2.253 1.00 0.00 H new ATOM 0 HG LEU A 36 -3.254 17.287 3.675 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.905 16.946 4.315 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -2.009 15.897 5.235 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -1.047 15.222 3.899 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -1.489 17.668 2.008 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -1.670 15.990 1.442 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -3.016 17.140 1.260 1.00 0.00 H new ATOM 535 N PHE A 37 -6.080 13.266 3.601 1.00 0.00 N ATOM 536 CA PHE A 37 -7.329 12.642 3.197 1.00 0.00 C ATOM 537 C PHE A 37 -8.320 12.595 4.361 1.00 0.00 C ATOM 538 O PHE A 37 -9.509 12.351 4.160 1.00 0.00 O ATOM 539 CB PHE A 37 -6.996 11.212 2.768 1.00 0.00 C ATOM 540 CG PHE A 37 -6.222 11.121 1.452 1.00 0.00 C ATOM 541 CD1 PHE A 37 -4.873 11.293 1.443 1.00 0.00 C ATOM 542 CD2 PHE A 37 -6.883 10.868 0.290 1.00 0.00 C ATOM 543 CE1 PHE A 37 -4.154 11.209 0.220 1.00 0.00 C ATOM 544 CE2 PHE A 37 -6.165 10.784 -0.932 1.00 0.00 C ATOM 545 CZ PHE A 37 -4.815 10.956 -0.941 1.00 0.00 C ATOM 0 H PHE A 37 -5.273 12.642 3.603 1.00 0.00 H new ATOM 0 HA PHE A 37 -7.786 13.213 2.389 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -6.412 10.734 3.555 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -7.923 10.647 2.672 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -4.348 11.493 2.365 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -7.954 10.731 0.297 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -3.083 11.346 0.213 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -6.690 10.584 -1.854 1.00 0.00 H new ATOM 0 HZ PHE A 37 -4.269 10.892 -1.870 1.00 0.00 H new ATOM 555 N GLU A 38 -7.795 12.834 5.554 1.00 0.00 N ATOM 556 CA GLU A 38 -8.619 12.822 6.751 1.00 0.00 C ATOM 557 C GLU A 38 -9.060 14.243 7.106 1.00 0.00 C ATOM 558 O GLU A 38 -10.253 14.515 7.225 1.00 0.00 O ATOM 559 CB GLU A 38 -7.879 12.169 7.920 1.00 0.00 C ATOM 560 CG GLU A 38 -7.500 10.724 7.590 1.00 0.00 C ATOM 561 CD GLU A 38 -8.157 9.748 8.569 1.00 0.00 C ATOM 562 OE1 GLU A 38 -9.293 9.322 8.269 1.00 0.00 O ATOM 563 OE2 GLU A 38 -7.508 9.450 9.595 1.00 0.00 O ATOM 0 H GLU A 38 -6.809 13.037 5.717 1.00 0.00 H new ATOM 0 HA GLU A 38 -9.509 12.226 6.550 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -6.980 12.741 8.151 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -8.508 12.190 8.810 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -7.809 10.487 6.572 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -6.417 10.610 7.629 1.00 0.00 H new ATOM 570 N SER A 39 -8.072 15.112 7.264 1.00 0.00 N ATOM 571 CA SER A 39 -8.343 16.499 7.603 1.00 0.00 C ATOM 572 C SER A 39 -8.933 17.228 6.394 1.00 0.00 C ATOM 573 O SER A 39 -9.728 18.153 6.550 1.00 0.00 O ATOM 574 CB SER A 39 -7.075 17.207 8.083 1.00 0.00 C ATOM 575 OG SER A 39 -6.814 16.959 9.462 1.00 0.00 O ATOM 0 H SER A 39 -7.083 14.883 7.164 1.00 0.00 H new ATOM 0 HA SER A 39 -9.067 16.516 8.418 1.00 0.00 H new ATOM 0 HB2 SER A 39 -6.226 16.872 7.487 1.00 0.00 H new ATOM 0 HB3 SER A 39 -7.175 18.280 7.920 1.00 0.00 H new ATOM 0 HG SER A 39 -5.995 17.427 9.729 1.00 0.00 H new ATOM 581 N PHE A 40 -8.520 16.783 5.216 1.00 0.00 N ATOM 582 CA PHE A 40 -8.998 17.381 3.981 1.00 0.00 C ATOM 583 C PHE A 40 -9.518 16.311 3.019 1.00 0.00 C ATOM 584 O PHE A 40 -8.922 16.073 1.970 1.00 0.00 O ATOM 585 CB PHE A 40 -7.805 18.092 3.339 1.00 0.00 C ATOM 586 CG PHE A 40 -6.981 18.932 4.316 1.00 0.00 C ATOM 587 CD1 PHE A 40 -7.558 19.976 4.970 1.00 0.00 C ATOM 588 CD2 PHE A 40 -5.671 18.635 4.532 1.00 0.00 C ATOM 589 CE1 PHE A 40 -6.792 20.756 5.877 1.00 0.00 C ATOM 590 CE2 PHE A 40 -4.906 19.414 5.439 1.00 0.00 C ATOM 591 CZ PHE A 40 -5.483 20.458 6.093 1.00 0.00 C ATOM 0 H PHE A 40 -7.860 16.016 5.091 1.00 0.00 H new ATOM 0 HA PHE A 40 -9.817 18.069 4.192 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -7.156 17.347 2.879 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -8.167 18.736 2.538 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -8.598 20.212 4.800 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -5.213 17.806 4.013 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -7.249 21.586 6.395 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -3.866 19.178 5.610 1.00 0.00 H new ATOM 0 HZ PHE A 40 -4.901 21.050 6.784 1.00 0.00 H new ATOM 601 N PRO A 41 -10.652 15.679 3.421 1.00 0.00 N ATOM 602 CA PRO A 41 -11.259 14.640 2.606 1.00 0.00 C ATOM 603 C PRO A 41 -11.981 15.242 1.399 1.00 0.00 C ATOM 604 O PRO A 41 -12.233 14.550 0.413 1.00 0.00 O ATOM 605 CB PRO A 41 -12.194 13.898 3.547 1.00 0.00 C ATOM 606 CG PRO A 41 -12.427 14.830 4.725 1.00 0.00 C ATOM 607 CD PRO A 41 -11.385 15.935 4.657 1.00 0.00 C ATOM 0 HA PRO A 41 -10.524 13.959 2.177 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -13.133 13.653 3.051 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -11.752 12.957 3.875 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -13.432 15.250 4.687 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -12.345 14.285 5.665 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -11.853 16.920 4.643 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -10.723 15.909 5.523 1.00 0.00 H new ATOM 615 N GLU A 42 -12.294 16.524 1.515 1.00 0.00 N ATOM 616 CA GLU A 42 -12.981 17.227 0.445 1.00 0.00 C ATOM 617 C GLU A 42 -11.969 17.829 -0.531 1.00 0.00 C ATOM 618 O GLU A 42 -12.153 18.946 -1.012 1.00 0.00 O ATOM 619 CB GLU A 42 -13.910 18.306 1.006 1.00 0.00 C ATOM 620 CG GLU A 42 -15.362 17.824 1.023 1.00 0.00 C ATOM 621 CD GLU A 42 -16.308 18.918 0.522 1.00 0.00 C ATOM 622 OE1 GLU A 42 -16.087 19.380 -0.618 1.00 0.00 O ATOM 623 OE2 GLU A 42 -17.230 19.266 1.290 1.00 0.00 O ATOM 0 H GLU A 42 -12.084 17.095 2.334 1.00 0.00 H new ATOM 0 HA GLU A 42 -13.597 16.509 -0.098 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -13.599 18.569 2.017 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -13.830 19.210 0.402 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -15.462 16.937 0.397 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -15.641 17.533 2.036 1.00 0.00 H new ATOM 630 N ASP A 43 -10.921 17.062 -0.795 1.00 0.00 N ATOM 631 CA ASP A 43 -9.879 17.505 -1.706 1.00 0.00 C ATOM 632 C ASP A 43 -9.009 16.310 -2.099 1.00 0.00 C ATOM 633 O ASP A 43 -8.692 16.128 -3.273 1.00 0.00 O ATOM 634 CB ASP A 43 -8.978 18.550 -1.044 1.00 0.00 C ATOM 635 CG ASP A 43 -9.674 19.859 -0.666 1.00 0.00 C ATOM 636 OD1 ASP A 43 -10.268 20.470 -1.580 1.00 0.00 O ATOM 637 OD2 ASP A 43 -9.596 20.218 0.529 1.00 0.00 O ATOM 0 H ASP A 43 -10.771 16.136 -0.394 1.00 0.00 H new ATOM 0 HA ASP A 43 -10.359 17.944 -2.580 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -8.543 18.115 -0.144 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -8.153 18.777 -1.720 1.00 0.00 H new ATOM 642 N PHE A 44 -8.647 15.527 -1.094 1.00 0.00 N ATOM 643 CA PHE A 44 -7.819 14.354 -1.320 1.00 0.00 C ATOM 644 C PHE A 44 -8.609 13.068 -1.068 1.00 0.00 C ATOM 645 O PHE A 44 -8.913 12.736 0.077 1.00 0.00 O ATOM 646 CB PHE A 44 -6.658 14.428 -0.326 1.00 0.00 C ATOM 647 CG PHE A 44 -5.887 15.749 -0.366 1.00 0.00 C ATOM 648 CD1 PHE A 44 -5.379 16.204 -1.543 1.00 0.00 C ATOM 649 CD2 PHE A 44 -5.711 16.468 0.774 1.00 0.00 C ATOM 650 CE1 PHE A 44 -4.664 17.430 -1.580 1.00 0.00 C ATOM 651 CE2 PHE A 44 -4.996 17.695 0.737 1.00 0.00 C ATOM 652 CZ PHE A 44 -4.487 18.150 -0.440 1.00 0.00 C ATOM 0 H PHE A 44 -8.912 15.681 -0.121 1.00 0.00 H new ATOM 0 HA PHE A 44 -7.471 14.338 -2.353 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -7.046 14.276 0.681 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -5.967 13.610 -0.529 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -5.520 15.633 -2.449 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -6.115 16.106 1.708 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -4.260 17.791 -2.514 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -4.856 18.266 1.643 1.00 0.00 H new ATOM 0 HZ PHE A 44 -3.943 19.082 -0.469 1.00 0.00 H new ATOM 662 N TYR A 45 -8.919 12.380 -2.156 1.00 0.00 N ATOM 663 CA TYR A 45 -9.668 11.138 -2.068 1.00 0.00 C ATOM 664 C TYR A 45 -9.217 10.147 -3.143 1.00 0.00 C ATOM 665 O TYR A 45 -8.575 10.534 -4.119 1.00 0.00 O ATOM 666 CB TYR A 45 -11.132 11.509 -2.316 1.00 0.00 C ATOM 667 CG TYR A 45 -11.339 12.474 -3.485 1.00 0.00 C ATOM 668 CD1 TYR A 45 -11.121 13.825 -3.312 1.00 0.00 C ATOM 669 CD2 TYR A 45 -11.744 11.992 -4.714 1.00 0.00 C ATOM 670 CE1 TYR A 45 -11.316 14.733 -4.412 1.00 0.00 C ATOM 671 CE2 TYR A 45 -11.939 12.900 -5.814 1.00 0.00 C ATOM 672 CZ TYR A 45 -11.716 14.226 -5.609 1.00 0.00 C ATOM 673 OH TYR A 45 -11.900 15.083 -6.649 1.00 0.00 O ATOM 0 H TYR A 45 -8.665 12.659 -3.104 1.00 0.00 H new ATOM 0 HA TYR A 45 -9.514 10.666 -1.097 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -11.700 10.598 -2.505 1.00 0.00 H new ATOM 0 HB3 TYR A 45 -11.541 11.958 -1.411 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -10.804 14.202 -2.351 1.00 0.00 H new ATOM 0 HD2 TYR A 45 -11.914 10.934 -4.850 1.00 0.00 H new ATOM 0 HE1 TYR A 45 -11.148 15.793 -4.289 1.00 0.00 H new ATOM 0 HE2 TYR A 45 -12.255 12.536 -6.781 1.00 0.00 H new ATOM 0 HH TYR A 45 -12.696 14.817 -7.155 1.00 0.00 H new ATOM 683 N VAL A 46 -9.569 8.888 -2.928 1.00 0.00 N ATOM 684 CA VAL A 46 -9.208 7.839 -3.866 1.00 0.00 C ATOM 685 C VAL A 46 -10.479 7.256 -4.487 1.00 0.00 C ATOM 686 O VAL A 46 -11.392 6.848 -3.772 1.00 0.00 O ATOM 687 CB VAL A 46 -8.347 6.785 -3.167 1.00 0.00 C ATOM 688 CG1 VAL A 46 -8.067 5.602 -4.096 1.00 0.00 C ATOM 689 CG2 VAL A 46 -7.043 7.397 -2.650 1.00 0.00 C ATOM 0 H VAL A 46 -10.101 8.571 -2.117 1.00 0.00 H new ATOM 0 HA VAL A 46 -8.606 8.245 -4.679 1.00 0.00 H new ATOM 0 HB VAL A 46 -8.905 6.412 -2.308 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -7.453 4.867 -3.575 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -9.009 5.142 -4.393 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -7.539 5.953 -4.983 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -6.450 6.627 -2.157 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -6.479 7.811 -3.486 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -7.271 8.190 -1.938 1.00 0.00 H new ATOM 699 N GLU A 47 -10.497 7.236 -5.812 1.00 0.00 N ATOM 700 CA GLU A 47 -11.641 6.710 -6.537 1.00 0.00 C ATOM 701 C GLU A 47 -11.297 5.356 -7.161 1.00 0.00 C ATOM 702 O GLU A 47 -10.141 4.937 -7.144 1.00 0.00 O ATOM 703 CB GLU A 47 -12.117 7.700 -7.602 1.00 0.00 C ATOM 704 CG GLU A 47 -12.468 9.052 -6.977 1.00 0.00 C ATOM 705 CD GLU A 47 -13.964 9.344 -7.107 1.00 0.00 C ATOM 706 OE1 GLU A 47 -14.750 8.506 -6.615 1.00 0.00 O ATOM 707 OE2 GLU A 47 -14.287 10.398 -7.695 1.00 0.00 O ATOM 0 H GLU A 47 -9.738 7.576 -6.402 1.00 0.00 H new ATOM 0 HA GLU A 47 -12.459 6.565 -5.831 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -11.338 7.834 -8.353 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -12.989 7.295 -8.116 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -12.183 9.055 -5.925 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -11.896 9.842 -7.464 1.00 0.00 H new ATOM 714 N GLY A 48 -12.322 4.710 -7.696 1.00 0.00 N ATOM 715 CA GLY A 48 -12.143 3.412 -8.324 1.00 0.00 C ATOM 716 C GLY A 48 -12.327 2.282 -7.310 1.00 0.00 C ATOM 717 O GLY A 48 -12.716 1.173 -7.674 1.00 0.00 O ATOM 0 H GLY A 48 -13.280 5.061 -7.708 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -12.859 3.296 -9.137 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -11.148 3.351 -8.765 1.00 0.00 H new ATOM 721 N LEU A 49 -12.039 2.602 -6.057 1.00 0.00 N ATOM 722 CA LEU A 49 -12.168 1.627 -4.987 1.00 0.00 C ATOM 723 C LEU A 49 -13.431 0.794 -5.212 1.00 0.00 C ATOM 724 O LEU A 49 -14.377 1.254 -5.849 1.00 0.00 O ATOM 725 CB LEU A 49 -12.122 2.319 -3.623 1.00 0.00 C ATOM 726 CG LEU A 49 -10.743 2.786 -3.154 1.00 0.00 C ATOM 727 CD1 LEU A 49 -10.866 3.924 -2.138 1.00 0.00 C ATOM 728 CD2 LEU A 49 -9.924 1.615 -2.607 1.00 0.00 C ATOM 0 H LEU A 49 -11.717 3.523 -5.759 1.00 0.00 H new ATOM 0 HA LEU A 49 -11.325 0.937 -4.997 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -12.785 3.183 -3.654 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -12.525 1.634 -2.877 1.00 0.00 H new ATOM 0 HG LEU A 49 -10.204 3.180 -4.016 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -9.871 4.237 -1.821 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -11.383 4.767 -2.597 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -11.431 3.579 -1.272 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -8.948 1.975 -2.281 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -10.448 1.168 -1.762 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -9.792 0.867 -3.389 1.00 0.00 H new ATOM 740 N PRO A 50 -13.405 -0.450 -4.662 1.00 0.00 N ATOM 741 CA PRO A 50 -14.536 -1.352 -4.796 1.00 0.00 C ATOM 742 C PRO A 50 -15.684 -0.931 -3.876 1.00 0.00 C ATOM 743 O PRO A 50 -15.482 -0.720 -2.681 1.00 0.00 O ATOM 744 CB PRO A 50 -13.983 -2.728 -4.465 1.00 0.00 C ATOM 745 CG PRO A 50 -12.686 -2.486 -3.710 1.00 0.00 C ATOM 746 CD PRO A 50 -12.301 -1.028 -3.900 1.00 0.00 C ATOM 0 HA PRO A 50 -14.967 -1.341 -5.797 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -14.688 -3.296 -3.858 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -13.805 -3.306 -5.372 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -12.813 -2.712 -2.651 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -11.899 -3.141 -4.084 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -12.174 -0.524 -2.942 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -11.357 -0.934 -4.437 1.00 0.00 H new ATOM 754 N GLU A 51 -16.865 -0.822 -4.467 1.00 0.00 N ATOM 755 CA GLU A 51 -18.045 -0.431 -3.716 1.00 0.00 C ATOM 756 C GLU A 51 -18.147 -1.246 -2.426 1.00 0.00 C ATOM 757 O GLU A 51 -18.175 -2.476 -2.465 1.00 0.00 O ATOM 758 CB GLU A 51 -19.310 -0.584 -4.563 1.00 0.00 C ATOM 759 CG GLU A 51 -20.443 0.289 -4.020 1.00 0.00 C ATOM 760 CD GLU A 51 -21.775 -0.067 -4.683 1.00 0.00 C ATOM 761 OE1 GLU A 51 -22.139 -1.261 -4.621 1.00 0.00 O ATOM 762 OE2 GLU A 51 -22.400 0.864 -5.235 1.00 0.00 O ATOM 0 H GLU A 51 -17.030 -0.998 -5.458 1.00 0.00 H new ATOM 0 HA GLU A 51 -17.950 0.622 -3.451 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -19.096 -0.308 -5.595 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -19.623 -1.628 -4.571 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -20.523 0.157 -2.941 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -20.214 1.340 -4.197 1.00 0.00 H new ATOM 769 N GLY A 52 -18.202 -0.529 -1.313 1.00 0.00 N ATOM 770 CA GLY A 52 -18.300 -1.171 -0.013 1.00 0.00 C ATOM 771 C GLY A 52 -16.939 -1.210 0.684 1.00 0.00 C ATOM 772 O GLY A 52 -16.800 -1.809 1.750 1.00 0.00 O ATOM 0 H GLY A 52 -18.181 0.490 -1.285 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -19.016 -0.633 0.609 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -18.681 -2.185 -0.132 1.00 0.00 H new ATOM 776 N VAL A 53 -15.969 -0.563 0.055 1.00 0.00 N ATOM 777 CA VAL A 53 -14.623 -0.516 0.601 1.00 0.00 C ATOM 778 C VAL A 53 -14.168 0.941 0.699 1.00 0.00 C ATOM 779 O VAL A 53 -13.679 1.509 -0.276 1.00 0.00 O ATOM 780 CB VAL A 53 -13.685 -1.381 -0.243 1.00 0.00 C ATOM 781 CG1 VAL A 53 -12.249 -1.304 0.280 1.00 0.00 C ATOM 782 CG2 VAL A 53 -14.173 -2.830 -0.295 1.00 0.00 C ATOM 0 H VAL A 53 -16.088 -0.067 -0.828 1.00 0.00 H new ATOM 0 HA VAL A 53 -14.605 -0.930 1.609 1.00 0.00 H new ATOM 0 HB VAL A 53 -13.692 -0.989 -1.260 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -11.603 -1.928 -0.338 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -11.902 -0.271 0.240 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -12.218 -1.658 1.310 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -13.488 -3.423 -0.901 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -14.210 -3.238 0.715 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -15.169 -2.863 -0.736 1.00 0.00 H new ATOM 792 N PRO A 54 -14.349 1.520 1.916 1.00 0.00 N ATOM 793 CA PRO A 54 -13.963 2.900 2.154 1.00 0.00 C ATOM 794 C PRO A 54 -12.443 3.030 2.280 1.00 0.00 C ATOM 795 O PRO A 54 -11.834 2.409 3.149 1.00 0.00 O ATOM 796 CB PRO A 54 -14.700 3.303 3.421 1.00 0.00 C ATOM 797 CG PRO A 54 -15.102 2.003 4.100 1.00 0.00 C ATOM 798 CD PRO A 54 -14.925 0.877 3.094 1.00 0.00 C ATOM 0 HA PRO A 54 -14.229 3.559 1.328 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -14.062 3.902 4.071 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -15.576 3.909 3.188 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -14.486 1.827 4.982 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -16.137 2.053 4.438 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -14.267 0.099 3.482 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -15.878 0.402 2.860 1.00 0.00 H new ATOM 806 N PHE A 55 -11.876 3.841 1.400 1.00 0.00 N ATOM 807 CA PHE A 55 -10.439 4.060 1.402 1.00 0.00 C ATOM 808 C PHE A 55 -9.896 4.123 2.831 1.00 0.00 C ATOM 809 O PHE A 55 -10.142 5.090 3.550 1.00 0.00 O ATOM 810 CB PHE A 55 -10.191 5.405 0.715 1.00 0.00 C ATOM 811 CG PHE A 55 -8.711 5.740 0.520 1.00 0.00 C ATOM 812 CD1 PHE A 55 -7.851 4.787 0.073 1.00 0.00 C ATOM 813 CD2 PHE A 55 -8.256 6.992 0.794 1.00 0.00 C ATOM 814 CE1 PHE A 55 -6.477 5.098 -0.108 1.00 0.00 C ATOM 815 CE2 PHE A 55 -6.882 7.303 0.613 1.00 0.00 C ATOM 816 CZ PHE A 55 -6.022 6.350 0.166 1.00 0.00 C ATOM 0 H PHE A 55 -12.385 4.355 0.681 1.00 0.00 H new ATOM 0 HA PHE A 55 -9.937 3.241 0.887 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -10.683 5.401 -0.257 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -10.657 6.194 1.305 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -8.213 3.793 -0.145 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -8.939 7.749 1.149 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -5.794 4.341 -0.463 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -6.520 8.297 0.831 1.00 0.00 H new ATOM 0 HZ PHE A 55 -4.977 6.587 0.028 1.00 0.00 H new ATOM 826 N ARG A 56 -9.168 3.079 3.199 1.00 0.00 N ATOM 827 CA ARG A 56 -8.588 3.003 4.529 1.00 0.00 C ATOM 828 C ARG A 56 -7.180 2.408 4.461 1.00 0.00 C ATOM 829 O ARG A 56 -6.702 2.058 3.383 1.00 0.00 O ATOM 830 CB ARG A 56 -9.452 2.149 5.459 1.00 0.00 C ATOM 831 CG ARG A 56 -10.558 2.987 6.103 1.00 0.00 C ATOM 832 CD ARG A 56 -10.141 3.469 7.494 1.00 0.00 C ATOM 833 NE ARG A 56 -11.173 4.374 8.047 1.00 0.00 N ATOM 834 CZ ARG A 56 -11.221 4.765 9.327 1.00 0.00 C ATOM 835 NH1 ARG A 56 -10.296 4.334 10.195 1.00 0.00 N ATOM 836 NH2 ARG A 56 -12.195 5.588 9.740 1.00 0.00 N ATOM 0 H ARG A 56 -8.967 2.279 2.599 1.00 0.00 H new ATOM 0 HA ARG A 56 -8.539 4.016 4.928 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -9.895 1.327 4.897 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -8.828 1.705 6.235 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -10.785 3.845 5.470 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -11.471 2.396 6.178 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -10.001 2.615 8.157 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -9.184 3.988 7.436 1.00 0.00 H new ATOM 0 HE ARG A 56 -11.893 4.722 7.414 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -9.555 3.708 9.881 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -10.333 4.632 11.170 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -12.899 5.916 9.079 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -12.232 5.886 10.715 1.00 0.00 H new ATOM 850 N ARG A 57 -6.556 2.310 5.626 1.00 0.00 N ATOM 851 CA ARG A 57 -5.213 1.763 5.712 1.00 0.00 C ATOM 852 C ARG A 57 -5.216 0.285 5.316 1.00 0.00 C ATOM 853 O ARG A 57 -6.225 -0.401 5.471 1.00 0.00 O ATOM 854 CB ARG A 57 -4.651 1.903 7.128 1.00 0.00 C ATOM 855 CG ARG A 57 -4.444 3.374 7.493 1.00 0.00 C ATOM 856 CD ARG A 57 -4.825 3.637 8.951 1.00 0.00 C ATOM 857 NE ARG A 57 -4.447 5.016 9.332 1.00 0.00 N ATOM 858 CZ ARG A 57 -4.232 5.415 10.593 1.00 0.00 C ATOM 859 NH1 ARG A 57 -4.356 4.542 11.602 1.00 0.00 N ATOM 860 NH2 ARG A 57 -3.892 6.686 10.845 1.00 0.00 N ATOM 0 H ARG A 57 -6.956 2.600 6.518 1.00 0.00 H new ATOM 0 HA ARG A 57 -4.581 2.326 5.025 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -5.333 1.440 7.841 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -3.703 1.370 7.201 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -3.402 3.649 7.331 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -5.046 4.003 6.837 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -5.897 3.494 9.087 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -4.323 2.921 9.602 1.00 0.00 H new ATOM 0 HE ARG A 57 -4.344 5.706 8.588 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -4.614 3.574 11.410 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -4.192 4.845 12.562 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -3.797 7.350 10.077 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -3.728 6.989 11.805 1.00 0.00 H new ATOM 874 N PRO A 58 -4.045 -0.173 4.798 1.00 0.00 N ATOM 875 CA PRO A 58 -3.903 -1.557 4.378 1.00 0.00 C ATOM 876 C PRO A 58 -3.772 -2.486 5.587 1.00 0.00 C ATOM 877 O PRO A 58 -4.446 -3.513 5.661 1.00 0.00 O ATOM 878 CB PRO A 58 -2.676 -1.573 3.482 1.00 0.00 C ATOM 879 CG PRO A 58 -1.909 -0.300 3.804 1.00 0.00 C ATOM 880 CD PRO A 58 -2.829 0.611 4.599 1.00 0.00 C ATOM 0 HA PRO A 58 -4.777 -1.925 3.840 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -2.065 -2.456 3.672 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -2.961 -1.602 2.430 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -1.011 -0.530 4.378 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -1.584 0.192 2.887 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -2.380 0.894 5.551 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -3.037 1.534 4.058 1.00 0.00 H new ATOM 888 N SER A 59 -2.901 -2.092 6.504 1.00 0.00 N ATOM 889 CA SER A 59 -2.673 -2.877 7.706 1.00 0.00 C ATOM 890 C SER A 59 -3.906 -2.818 8.611 1.00 0.00 C ATOM 891 O SER A 59 -3.830 -2.332 9.738 1.00 0.00 O ATOM 892 CB SER A 59 -1.437 -2.383 8.460 1.00 0.00 C ATOM 893 OG SER A 59 -1.460 -0.971 8.656 1.00 0.00 O ATOM 0 H SER A 59 -2.345 -1.240 6.439 1.00 0.00 H new ATOM 0 HA SER A 59 -2.496 -3.911 7.411 1.00 0.00 H new ATOM 0 HB2 SER A 59 -1.379 -2.882 9.427 1.00 0.00 H new ATOM 0 HB3 SER A 59 -0.540 -2.657 7.905 1.00 0.00 H new ATOM 0 HG SER A 59 -2.276 -0.721 9.138 1.00 0.00 H new ATOM 899 N THR A 60 -5.012 -3.320 8.083 1.00 0.00 N ATOM 900 CA THR A 60 -6.259 -3.331 8.828 1.00 0.00 C ATOM 901 C THR A 60 -7.333 -4.104 8.060 1.00 0.00 C ATOM 902 O THR A 60 -8.093 -4.871 8.651 1.00 0.00 O ATOM 903 CB THR A 60 -6.648 -1.880 9.121 1.00 0.00 C ATOM 904 OG1 THR A 60 -6.857 -1.855 10.531 1.00 0.00 O ATOM 905 CG2 THR A 60 -8.012 -1.509 8.536 1.00 0.00 C ATOM 0 H THR A 60 -5.071 -3.722 7.148 1.00 0.00 H new ATOM 0 HA THR A 60 -6.146 -3.851 9.779 1.00 0.00 H new ATOM 0 HB THR A 60 -5.887 -1.212 8.718 1.00 0.00 H new ATOM 0 HG1 THR A 60 -7.111 -0.950 10.808 1.00 0.00 H new ATOM 0 HG21 THR A 60 -8.239 -0.470 8.773 1.00 0.00 H new ATOM 0 HG22 THR A 60 -7.991 -1.638 7.454 1.00 0.00 H new ATOM 0 HG23 THR A 60 -8.779 -2.154 8.964 1.00 0.00 H new ATOM 913 N PHE A 61 -7.363 -3.876 6.756 1.00 0.00 N ATOM 914 CA PHE A 61 -8.331 -4.541 5.901 1.00 0.00 C ATOM 915 C PHE A 61 -8.203 -6.062 6.008 1.00 0.00 C ATOM 916 O PHE A 61 -7.100 -6.587 6.152 1.00 0.00 O ATOM 917 CB PHE A 61 -8.025 -4.116 4.463 1.00 0.00 C ATOM 918 CG PHE A 61 -8.681 -2.796 4.052 1.00 0.00 C ATOM 919 CD1 PHE A 61 -10.028 -2.641 4.167 1.00 0.00 C ATOM 920 CD2 PHE A 61 -7.918 -1.778 3.571 1.00 0.00 C ATOM 921 CE1 PHE A 61 -10.637 -1.416 3.785 1.00 0.00 C ATOM 922 CE2 PHE A 61 -8.527 -0.554 3.189 1.00 0.00 C ATOM 923 CZ PHE A 61 -9.873 -0.399 3.304 1.00 0.00 C ATOM 0 H PHE A 61 -6.732 -3.239 6.270 1.00 0.00 H new ATOM 0 HA PHE A 61 -9.342 -4.266 6.200 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -6.945 -4.026 4.343 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -8.357 -4.902 3.784 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -10.634 -3.449 4.549 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -6.849 -1.901 3.480 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -11.706 -1.292 3.876 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -7.921 0.254 2.807 1.00 0.00 H new ATOM 0 HZ PHE A 61 -10.336 0.533 3.013 1.00 0.00 H new ATOM 933 N GLY A 62 -9.347 -6.726 5.935 1.00 0.00 N ATOM 934 CA GLY A 62 -9.377 -8.176 6.022 1.00 0.00 C ATOM 935 C GLY A 62 -8.574 -8.811 4.885 1.00 0.00 C ATOM 936 O GLY A 62 -8.180 -8.127 3.941 1.00 0.00 O ATOM 0 H GLY A 62 -10.260 -6.287 5.817 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -8.970 -8.495 6.982 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -10.409 -8.525 5.982 1.00 0.00 H new ATOM 940 N ILE A 63 -8.353 -10.111 5.013 1.00 0.00 N ATOM 941 CA ILE A 63 -7.604 -10.846 4.008 1.00 0.00 C ATOM 942 C ILE A 63 -8.290 -10.689 2.650 1.00 0.00 C ATOM 943 O ILE A 63 -7.629 -10.463 1.638 1.00 0.00 O ATOM 944 CB ILE A 63 -7.416 -12.302 4.438 1.00 0.00 C ATOM 945 CG1 ILE A 63 -6.553 -12.395 5.698 1.00 0.00 C ATOM 946 CG2 ILE A 63 -6.849 -13.143 3.292 1.00 0.00 C ATOM 947 CD1 ILE A 63 -6.874 -13.664 6.490 1.00 0.00 C ATOM 0 H ILE A 63 -8.680 -10.675 5.798 1.00 0.00 H new ATOM 0 HA ILE A 63 -6.599 -10.436 3.907 1.00 0.00 H new ATOM 0 HB ILE A 63 -8.394 -12.714 4.687 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -5.499 -12.391 5.422 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -6.722 -11.519 6.324 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -6.725 -14.174 3.624 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -7.535 -13.114 2.446 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -5.882 -12.741 2.989 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -6.247 -13.706 7.380 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -7.923 -13.653 6.785 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -6.681 -14.539 5.869 1.00 0.00 H new ATOM 959 N PRO A 64 -9.644 -10.818 2.672 1.00 0.00 N ATOM 960 CA PRO A 64 -10.428 -10.693 1.455 1.00 0.00 C ATOM 961 C PRO A 64 -10.540 -9.230 1.022 1.00 0.00 C ATOM 962 O PRO A 64 -10.288 -8.900 -0.135 1.00 0.00 O ATOM 963 CB PRO A 64 -11.772 -11.319 1.787 1.00 0.00 C ATOM 964 CG PRO A 64 -11.854 -11.351 3.304 1.00 0.00 C ATOM 965 CD PRO A 64 -10.461 -11.086 3.852 1.00 0.00 C ATOM 0 HA PRO A 64 -9.968 -11.197 0.605 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -12.590 -10.735 1.364 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -11.848 -12.323 1.371 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -12.555 -10.598 3.664 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -12.221 -12.319 3.646 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -10.459 -10.237 4.536 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -10.084 -11.944 4.408 1.00 0.00 H new ATOM 973 N ARG A 65 -10.918 -8.392 1.976 1.00 0.00 N ATOM 974 CA ARG A 65 -11.067 -6.972 1.709 1.00 0.00 C ATOM 975 C ARG A 65 -9.834 -6.437 0.978 1.00 0.00 C ATOM 976 O ARG A 65 -9.956 -5.650 0.041 1.00 0.00 O ATOM 977 CB ARG A 65 -11.264 -6.184 3.006 1.00 0.00 C ATOM 978 CG ARG A 65 -12.071 -4.909 2.756 1.00 0.00 C ATOM 979 CD ARG A 65 -13.139 -4.716 3.834 1.00 0.00 C ATOM 980 NE ARG A 65 -12.566 -4.993 5.170 1.00 0.00 N ATOM 981 CZ ARG A 65 -13.296 -5.160 6.281 1.00 0.00 C ATOM 982 NH1 ARG A 65 -14.632 -5.079 6.223 1.00 0.00 N ATOM 983 NH2 ARG A 65 -12.690 -5.408 7.450 1.00 0.00 N ATOM 0 H ARG A 65 -11.126 -8.670 2.935 1.00 0.00 H new ATOM 0 HA ARG A 65 -11.950 -6.844 1.082 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -11.778 -6.806 3.739 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -10.293 -5.927 3.430 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -11.403 -4.048 2.743 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -12.544 -4.960 1.775 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -13.523 -3.697 3.798 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -13.982 -5.381 3.646 1.00 0.00 H new ATOM 0 HE ARG A 65 -11.551 -5.061 5.250 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -15.093 -4.890 5.333 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -15.188 -5.206 7.069 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -11.673 -5.470 7.494 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -13.246 -5.535 8.296 1.00 0.00 H new ATOM 997 N LEU A 66 -8.674 -6.886 1.435 1.00 0.00 N ATOM 998 CA LEU A 66 -7.419 -6.463 0.836 1.00 0.00 C ATOM 999 C LEU A 66 -7.447 -6.766 -0.663 1.00 0.00 C ATOM 1000 O LEU A 66 -7.197 -5.883 -1.483 1.00 0.00 O ATOM 1001 CB LEU A 66 -6.235 -7.096 1.570 1.00 0.00 C ATOM 1002 CG LEU A 66 -5.738 -6.350 2.810 1.00 0.00 C ATOM 1003 CD1 LEU A 66 -4.959 -7.286 3.736 1.00 0.00 C ATOM 1004 CD2 LEU A 66 -4.919 -5.119 2.417 1.00 0.00 C ATOM 0 H LEU A 66 -8.577 -7.538 2.213 1.00 0.00 H new ATOM 0 HA LEU A 66 -7.290 -5.386 0.941 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -6.515 -8.107 1.867 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -5.405 -7.188 0.869 1.00 0.00 H new ATOM 0 HG LEU A 66 -6.605 -5.995 3.367 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -4.617 -6.731 4.610 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -5.606 -8.103 4.055 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -4.099 -7.691 3.204 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -4.578 -4.607 3.317 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -4.057 -5.429 1.827 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -5.538 -4.443 1.827 1.00 0.00 H new ATOM 1016 N GLU A 67 -7.753 -8.016 -0.977 1.00 0.00 N ATOM 1017 CA GLU A 67 -7.816 -8.446 -2.363 1.00 0.00 C ATOM 1018 C GLU A 67 -8.835 -7.604 -3.134 1.00 0.00 C ATOM 1019 O GLU A 67 -8.564 -7.163 -4.250 1.00 0.00 O ATOM 1020 CB GLU A 67 -8.151 -9.936 -2.460 1.00 0.00 C ATOM 1021 CG GLU A 67 -6.897 -10.793 -2.276 1.00 0.00 C ATOM 1022 CD GLU A 67 -6.527 -11.509 -3.576 1.00 0.00 C ATOM 1023 OE1 GLU A 67 -7.470 -11.903 -4.296 1.00 0.00 O ATOM 1024 OE2 GLU A 67 -5.309 -11.646 -3.821 1.00 0.00 O ATOM 0 H GLU A 67 -7.960 -8.745 -0.295 1.00 0.00 H new ATOM 0 HA GLU A 67 -6.835 -8.297 -2.814 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -8.889 -10.197 -1.701 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -8.602 -10.149 -3.429 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -6.067 -10.165 -1.954 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -7.066 -11.527 -1.488 1.00 0.00 H new ATOM 1031 N LYS A 68 -9.986 -7.405 -2.508 1.00 0.00 N ATOM 1032 CA LYS A 68 -11.046 -6.624 -3.121 1.00 0.00 C ATOM 1033 C LYS A 68 -10.444 -5.376 -3.771 1.00 0.00 C ATOM 1034 O LYS A 68 -10.777 -5.041 -4.907 1.00 0.00 O ATOM 1035 CB LYS A 68 -12.144 -6.317 -2.101 1.00 0.00 C ATOM 1036 CG LYS A 68 -12.724 -7.605 -1.515 1.00 0.00 C ATOM 1037 CD LYS A 68 -14.205 -7.434 -1.172 1.00 0.00 C ATOM 1038 CE LYS A 68 -14.421 -6.223 -0.262 1.00 0.00 C ATOM 1039 NZ LYS A 68 -14.910 -6.654 1.067 1.00 0.00 N ATOM 0 H LYS A 68 -10.207 -7.772 -1.582 1.00 0.00 H new ATOM 0 HA LYS A 68 -11.530 -7.195 -3.914 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -11.738 -5.699 -1.300 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -12.937 -5.741 -2.578 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -12.604 -8.420 -2.229 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -12.169 -7.883 -0.619 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -14.782 -7.312 -2.088 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -14.574 -8.334 -0.680 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -13.487 -5.673 -0.151 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -15.140 -5.542 -0.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -15.051 -5.820 1.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -15.812 -7.159 0.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -14.210 -7.286 1.506 1.00 0.00 H new ATOM 1053 N ILE A 69 -9.568 -4.723 -3.022 1.00 0.00 N ATOM 1054 CA ILE A 69 -8.916 -3.520 -3.511 1.00 0.00 C ATOM 1055 C ILE A 69 -7.988 -3.883 -4.672 1.00 0.00 C ATOM 1056 O ILE A 69 -8.067 -3.286 -5.744 1.00 0.00 O ATOM 1057 CB ILE A 69 -8.211 -2.789 -2.366 1.00 0.00 C ATOM 1058 CG1 ILE A 69 -9.224 -2.249 -1.354 1.00 0.00 C ATOM 1059 CG2 ILE A 69 -7.293 -1.688 -2.900 1.00 0.00 C ATOM 1060 CD1 ILE A 69 -8.892 -2.727 0.062 1.00 0.00 C ATOM 0 H ILE A 69 -9.294 -5.004 -2.080 1.00 0.00 H new ATOM 0 HA ILE A 69 -9.654 -2.819 -3.900 1.00 0.00 H new ATOM 0 HB ILE A 69 -7.581 -3.506 -1.840 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -9.227 -1.159 -1.383 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -10.227 -2.578 -1.627 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -6.805 -1.185 -2.065 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -6.537 -2.128 -3.551 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -7.882 -0.965 -3.465 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -9.627 -2.329 0.762 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -8.914 -3.816 0.093 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -7.898 -2.376 0.341 1.00 0.00 H new ATOM 1072 N LEU A 70 -7.130 -4.860 -4.418 1.00 0.00 N ATOM 1073 CA LEU A 70 -6.188 -5.310 -5.429 1.00 0.00 C ATOM 1074 C LEU A 70 -6.946 -5.635 -6.717 1.00 0.00 C ATOM 1075 O LEU A 70 -6.483 -5.316 -7.811 1.00 0.00 O ATOM 1076 CB LEU A 70 -5.349 -6.475 -4.899 1.00 0.00 C ATOM 1077 CG LEU A 70 -4.137 -6.095 -4.046 1.00 0.00 C ATOM 1078 CD1 LEU A 70 -4.109 -6.898 -2.744 1.00 0.00 C ATOM 1079 CD2 LEU A 70 -2.838 -6.246 -4.840 1.00 0.00 C ATOM 0 H LEU A 70 -7.067 -5.353 -3.527 1.00 0.00 H new ATOM 0 HA LEU A 70 -5.478 -4.518 -5.667 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -5.996 -7.123 -4.308 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -5.001 -7.062 -5.749 1.00 0.00 H new ATOM 0 HG LEU A 70 -4.228 -5.043 -3.774 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -3.238 -6.608 -2.157 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -5.015 -6.696 -2.173 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -4.054 -7.962 -2.974 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -1.992 -5.970 -4.210 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -2.727 -7.281 -5.163 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -2.868 -5.595 -5.714 1.00 0.00 H new ATOM 1091 N ARG A 71 -8.099 -6.265 -6.545 1.00 0.00 N ATOM 1092 CA ARG A 71 -8.926 -6.636 -7.681 1.00 0.00 C ATOM 1093 C ARG A 71 -9.215 -5.411 -8.551 1.00 0.00 C ATOM 1094 O ARG A 71 -9.552 -5.545 -9.726 1.00 0.00 O ATOM 1095 CB ARG A 71 -10.249 -7.251 -7.222 1.00 0.00 C ATOM 1096 CG ARG A 71 -10.077 -8.731 -6.878 1.00 0.00 C ATOM 1097 CD ARG A 71 -11.053 -9.597 -7.677 1.00 0.00 C ATOM 1098 NE ARG A 71 -10.400 -10.091 -8.910 1.00 0.00 N ATOM 1099 CZ ARG A 71 -11.052 -10.681 -9.921 1.00 0.00 C ATOM 1100 NH1 ARG A 71 -12.379 -10.855 -9.851 1.00 0.00 N ATOM 1101 NH2 ARG A 71 -10.378 -11.097 -11.001 1.00 0.00 N ATOM 0 H ARG A 71 -8.480 -6.528 -5.636 1.00 0.00 H new ATOM 0 HA ARG A 71 -8.377 -7.377 -8.262 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -10.621 -6.713 -6.350 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -10.997 -7.141 -8.008 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -9.054 -9.041 -7.090 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -10.241 -8.881 -5.811 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -11.386 -10.439 -7.070 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -11.940 -9.018 -7.933 1.00 0.00 H new ATOM 0 HE ARG A 71 -9.390 -9.975 -8.995 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -12.892 -10.538 -9.028 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -12.876 -11.304 -10.620 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -9.368 -10.965 -11.054 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -10.875 -11.546 -11.770 1.00 0.00 H new ATOM 1115 N ASN A 72 -9.072 -4.244 -7.939 1.00 0.00 N ATOM 1116 CA ASN A 72 -9.313 -2.996 -8.643 1.00 0.00 C ATOM 1117 C ASN A 72 -8.135 -2.048 -8.410 1.00 0.00 C ATOM 1118 O ASN A 72 -8.328 -0.890 -8.045 1.00 0.00 O ATOM 1119 CB ASN A 72 -10.581 -2.310 -8.128 1.00 0.00 C ATOM 1120 CG ASN A 72 -11.818 -2.814 -8.873 1.00 0.00 C ATOM 1121 OD1 ASN A 72 -11.733 -3.461 -9.904 1.00 0.00 O ATOM 1122 ND2 ASN A 72 -12.969 -2.483 -8.296 1.00 0.00 N ATOM 0 H ASN A 72 -8.792 -4.137 -6.964 1.00 0.00 H new ATOM 0 HA ASN A 72 -9.430 -3.223 -9.703 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -10.693 -2.499 -7.060 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -10.491 -1.231 -8.253 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -13.852 -2.773 -8.716 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -12.969 -1.939 -7.433 1.00 0.00 H new ATOM 1129 N LYS A 73 -6.940 -2.576 -8.631 1.00 0.00 N ATOM 1130 CA LYS A 73 -5.730 -1.791 -8.450 1.00 0.00 C ATOM 1131 C LYS A 73 -5.646 -0.732 -9.550 1.00 0.00 C ATOM 1132 O LYS A 73 -5.343 0.429 -9.277 1.00 0.00 O ATOM 1133 CB LYS A 73 -4.505 -2.705 -8.379 1.00 0.00 C ATOM 1134 CG LYS A 73 -4.086 -3.168 -9.776 1.00 0.00 C ATOM 1135 CD LYS A 73 -2.917 -4.153 -9.699 1.00 0.00 C ATOM 1136 CE LYS A 73 -3.301 -5.508 -10.297 1.00 0.00 C ATOM 1137 NZ LYS A 73 -2.744 -5.649 -11.661 1.00 0.00 N ATOM 0 H LYS A 73 -6.784 -3.537 -8.934 1.00 0.00 H new ATOM 0 HA LYS A 73 -5.758 -1.260 -7.498 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -3.679 -2.176 -7.904 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -4.729 -3.571 -7.756 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -4.932 -3.640 -10.276 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -3.801 -2.306 -10.379 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -2.058 -3.746 -10.233 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -2.614 -4.283 -8.660 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -2.929 -6.311 -9.661 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -4.386 -5.604 -10.329 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -3.014 -6.574 -12.052 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -3.119 -4.893 -12.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -1.707 -5.579 -11.621 1.00 0.00 H new ATOM 1151 N ALA A 74 -5.918 -1.169 -10.771 1.00 0.00 N ATOM 1152 CA ALA A 74 -5.877 -0.273 -11.914 1.00 0.00 C ATOM 1153 C ALA A 74 -7.043 0.713 -11.826 1.00 0.00 C ATOM 1154 O ALA A 74 -6.865 1.912 -12.037 1.00 0.00 O ATOM 1155 CB ALA A 74 -5.901 -1.091 -13.206 1.00 0.00 C ATOM 0 H ALA A 74 -6.168 -2.133 -10.994 1.00 0.00 H new ATOM 0 HA ALA A 74 -4.954 0.307 -11.913 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -5.870 -0.418 -14.063 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -5.036 -1.753 -13.233 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -6.814 -1.685 -13.244 1.00 0.00 H new ATOM 1161 N LYS A 75 -8.212 0.172 -11.514 1.00 0.00 N ATOM 1162 CA LYS A 75 -9.407 0.989 -11.396 1.00 0.00 C ATOM 1163 C LYS A 75 -9.147 2.125 -10.404 1.00 0.00 C ATOM 1164 O LYS A 75 -9.443 3.284 -10.691 1.00 0.00 O ATOM 1165 CB LYS A 75 -10.615 0.122 -11.035 1.00 0.00 C ATOM 1166 CG LYS A 75 -10.852 -0.956 -12.094 1.00 0.00 C ATOM 1167 CD LYS A 75 -11.378 -0.343 -13.393 1.00 0.00 C ATOM 1168 CE LYS A 75 -12.867 -0.644 -13.577 1.00 0.00 C ATOM 1169 NZ LYS A 75 -13.378 0.003 -14.806 1.00 0.00 N ATOM 0 H LYS A 75 -8.356 -0.823 -11.339 1.00 0.00 H new ATOM 0 HA LYS A 75 -9.649 1.450 -12.353 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -10.454 -0.346 -10.064 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -11.502 0.748 -10.944 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -9.922 -1.489 -12.290 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -11.566 -1.689 -11.718 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -11.220 0.735 -13.381 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -10.816 -0.738 -14.239 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -13.022 -1.721 -13.635 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -13.426 -0.287 -12.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -14.390 -0.211 -14.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -13.248 1.032 -14.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -12.856 -0.357 -15.630 1.00 0.00 H new ATOM 1183 N ILE A 76 -8.596 1.753 -9.258 1.00 0.00 N ATOM 1184 CA ILE A 76 -8.293 2.726 -8.222 1.00 0.00 C ATOM 1185 C ILE A 76 -7.596 3.934 -8.852 1.00 0.00 C ATOM 1186 O ILE A 76 -6.778 3.780 -9.757 1.00 0.00 O ATOM 1187 CB ILE A 76 -7.493 2.074 -7.092 1.00 0.00 C ATOM 1188 CG1 ILE A 76 -8.404 1.248 -6.182 1.00 0.00 C ATOM 1189 CG2 ILE A 76 -6.697 3.121 -6.310 1.00 0.00 C ATOM 1190 CD1 ILE A 76 -7.594 0.242 -5.363 1.00 0.00 C ATOM 0 H ILE A 76 -8.351 0.791 -9.024 1.00 0.00 H new ATOM 0 HA ILE A 76 -9.211 3.091 -7.761 1.00 0.00 H new ATOM 0 HB ILE A 76 -6.772 1.387 -7.535 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -8.952 1.910 -5.512 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -9.144 0.720 -6.784 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -6.137 2.632 -5.513 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -6.004 3.628 -6.982 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -7.382 3.850 -5.878 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -8.266 -0.332 -4.725 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -7.066 -0.434 -6.036 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -6.872 0.774 -4.744 1.00 0.00 H new ATOM 1202 N LYS A 77 -7.946 5.108 -8.347 1.00 0.00 N ATOM 1203 CA LYS A 77 -7.364 6.341 -8.849 1.00 0.00 C ATOM 1204 C LYS A 77 -7.334 7.380 -7.726 1.00 0.00 C ATOM 1205 O LYS A 77 -8.332 7.583 -7.037 1.00 0.00 O ATOM 1206 CB LYS A 77 -8.104 6.812 -10.102 1.00 0.00 C ATOM 1207 CG LYS A 77 -7.162 7.561 -11.047 1.00 0.00 C ATOM 1208 CD LYS A 77 -7.665 7.494 -12.490 1.00 0.00 C ATOM 1209 CE LYS A 77 -6.953 8.525 -13.368 1.00 0.00 C ATOM 1210 NZ LYS A 77 -7.717 8.761 -14.614 1.00 0.00 N ATOM 0 H LYS A 77 -8.625 5.231 -7.596 1.00 0.00 H new ATOM 0 HA LYS A 77 -6.332 6.176 -9.159 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -8.536 5.954 -10.618 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -8.931 7.462 -9.817 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -7.080 8.602 -10.735 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -6.162 7.131 -10.986 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -7.499 6.494 -12.890 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -8.740 7.672 -12.513 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -6.840 9.461 -12.821 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -5.950 8.174 -13.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -7.220 9.463 -15.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -7.803 7.869 -15.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -8.665 9.116 -14.378 1.00 0.00 H new ATOM 1224 N PHE A 78 -6.178 8.010 -7.576 1.00 0.00 N ATOM 1225 CA PHE A 78 -6.005 9.022 -6.549 1.00 0.00 C ATOM 1226 C PHE A 78 -6.346 10.413 -7.086 1.00 0.00 C ATOM 1227 O PHE A 78 -5.940 10.773 -8.191 1.00 0.00 O ATOM 1228 CB PHE A 78 -4.531 8.994 -6.137 1.00 0.00 C ATOM 1229 CG PHE A 78 -4.229 8.055 -4.968 1.00 0.00 C ATOM 1230 CD1 PHE A 78 -4.663 6.766 -5.002 1.00 0.00 C ATOM 1231 CD2 PHE A 78 -3.526 8.508 -3.896 1.00 0.00 C ATOM 1232 CE1 PHE A 78 -4.383 5.894 -3.917 1.00 0.00 C ATOM 1233 CE2 PHE A 78 -3.246 7.635 -2.811 1.00 0.00 C ATOM 1234 CZ PHE A 78 -3.680 6.347 -2.844 1.00 0.00 C ATOM 0 H PHE A 78 -5.352 7.839 -8.149 1.00 0.00 H new ATOM 0 HA PHE A 78 -6.667 8.815 -5.708 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -3.930 8.694 -6.995 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -4.220 10.004 -5.868 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -5.220 6.406 -5.854 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -3.181 9.531 -3.869 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -4.728 4.871 -3.944 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -2.688 7.995 -1.959 1.00 0.00 H new ATOM 0 HZ PHE A 78 -3.467 5.684 -2.019 1.00 0.00 H new ATOM 1244 N ILE A 79 -7.088 11.159 -6.281 1.00 0.00 N ATOM 1245 CA ILE A 79 -7.488 12.502 -6.662 1.00 0.00 C ATOM 1246 C ILE A 79 -6.834 13.512 -5.716 1.00 0.00 C ATOM 1247 O ILE A 79 -6.863 13.337 -4.499 1.00 0.00 O ATOM 1248 CB ILE A 79 -9.013 12.611 -6.719 1.00 0.00 C ATOM 1249 CG1 ILE A 79 -9.616 11.458 -7.523 1.00 0.00 C ATOM 1250 CG2 ILE A 79 -9.446 13.975 -7.261 1.00 0.00 C ATOM 1251 CD1 ILE A 79 -9.084 11.453 -8.958 1.00 0.00 C ATOM 0 H ILE A 79 -7.423 10.858 -5.366 1.00 0.00 H new ATOM 0 HA ILE A 79 -7.137 12.733 -7.668 1.00 0.00 H new ATOM 0 HB ILE A 79 -9.398 12.531 -5.703 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -9.379 10.510 -7.040 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -10.702 11.547 -7.534 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -10.534 14.026 -7.291 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -9.064 14.763 -6.612 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -9.049 14.110 -8.267 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -9.528 10.623 -9.508 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -9.344 12.392 -9.446 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -8.000 11.340 -8.944 1.00 0.00 H new ATOM 1263 N ILE A 80 -6.261 14.547 -6.312 1.00 0.00 N ATOM 1264 CA ILE A 80 -5.601 15.585 -5.539 1.00 0.00 C ATOM 1265 C ILE A 80 -6.044 16.957 -6.051 1.00 0.00 C ATOM 1266 O ILE A 80 -5.694 17.350 -7.163 1.00 0.00 O ATOM 1267 CB ILE A 80 -4.084 15.383 -5.554 1.00 0.00 C ATOM 1268 CG1 ILE A 80 -3.726 13.908 -5.355 1.00 0.00 C ATOM 1269 CG2 ILE A 80 -3.400 16.283 -4.524 1.00 0.00 C ATOM 1270 CD1 ILE A 80 -2.327 13.761 -4.753 1.00 0.00 C ATOM 0 H ILE A 80 -6.240 14.689 -7.322 1.00 0.00 H new ATOM 0 HA ILE A 80 -5.897 15.525 -4.492 1.00 0.00 H new ATOM 0 HB ILE A 80 -3.710 15.676 -6.535 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -4.459 13.437 -4.700 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -3.771 13.387 -6.311 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -2.323 16.119 -4.556 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -3.615 17.327 -4.753 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -3.774 16.045 -3.528 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -2.097 12.704 -4.622 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -1.594 14.212 -5.422 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -2.292 14.263 -3.786 1.00 0.00 H new ATOM 1282 N LYS A 81 -6.806 17.647 -5.216 1.00 0.00 N ATOM 1283 CA LYS A 81 -7.301 18.966 -5.571 1.00 0.00 C ATOM 1284 C LYS A 81 -6.429 20.030 -4.901 1.00 0.00 C ATOM 1285 O LYS A 81 -6.661 21.226 -5.071 1.00 0.00 O ATOM 1286 CB LYS A 81 -8.788 19.090 -5.236 1.00 0.00 C ATOM 1287 CG LYS A 81 -9.573 17.892 -5.775 1.00 0.00 C ATOM 1288 CD LYS A 81 -11.031 18.270 -6.048 1.00 0.00 C ATOM 1289 CE LYS A 81 -11.402 18.004 -7.508 1.00 0.00 C ATOM 1290 NZ LYS A 81 -11.449 19.272 -8.270 1.00 0.00 N ATOM 0 H LYS A 81 -7.093 17.318 -4.294 1.00 0.00 H new ATOM 0 HA LYS A 81 -7.227 19.123 -6.647 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -8.917 19.157 -4.156 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -9.185 20.011 -5.662 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -9.109 17.532 -6.693 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -9.534 17.074 -5.056 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -11.688 17.698 -5.392 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -11.187 19.323 -5.815 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -10.673 17.330 -7.958 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -12.370 17.506 -7.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -11.702 19.074 -9.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -12.161 19.903 -7.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -10.517 19.732 -8.237 1.00 0.00 H new ATOM 1304 N LYS A 82 -5.443 19.556 -4.152 1.00 0.00 N ATOM 1305 CA LYS A 82 -4.536 20.452 -3.456 1.00 0.00 C ATOM 1306 C LYS A 82 -3.158 19.796 -3.353 1.00 0.00 C ATOM 1307 O LYS A 82 -2.744 19.377 -2.273 1.00 0.00 O ATOM 1308 CB LYS A 82 -5.123 20.864 -2.104 1.00 0.00 C ATOM 1309 CG LYS A 82 -6.314 21.806 -2.288 1.00 0.00 C ATOM 1310 CD LYS A 82 -6.500 22.701 -1.062 1.00 0.00 C ATOM 1311 CE LYS A 82 -7.448 23.863 -1.369 1.00 0.00 C ATOM 1312 NZ LYS A 82 -8.171 24.279 -0.147 1.00 0.00 N ATOM 0 H LYS A 82 -5.253 18.564 -4.013 1.00 0.00 H new ATOM 0 HA LYS A 82 -4.408 21.377 -4.018 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -5.438 19.977 -1.555 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -4.356 21.354 -1.505 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -6.161 22.423 -3.173 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -7.220 21.224 -2.458 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -6.897 22.112 -0.235 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -5.534 23.090 -0.742 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -6.883 24.705 -1.769 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -8.162 23.565 -2.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -8.810 25.068 -0.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -8.726 23.478 0.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -7.487 24.583 0.575 1.00 0.00 H new ATOM 1326 N PRO A 83 -2.466 19.725 -4.522 1.00 0.00 N ATOM 1327 CA PRO A 83 -1.143 19.126 -4.574 1.00 0.00 C ATOM 1328 C PRO A 83 -0.094 20.063 -3.970 1.00 0.00 C ATOM 1329 O PRO A 83 1.070 19.690 -3.833 1.00 0.00 O ATOM 1330 CB PRO A 83 -0.901 18.833 -6.046 1.00 0.00 C ATOM 1331 CG PRO A 83 -1.892 19.696 -6.811 1.00 0.00 C ATOM 1332 CD PRO A 83 -2.924 20.210 -5.821 1.00 0.00 C ATOM 0 HA PRO A 83 -1.071 18.213 -3.983 1.00 0.00 H new ATOM 0 HB2 PRO A 83 0.124 19.072 -6.328 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -1.054 17.776 -6.264 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -1.380 20.528 -7.295 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -2.374 19.117 -7.599 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -2.982 21.298 -5.839 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -3.920 19.833 -6.056 1.00 0.00 H new ATOM 1340 N GLU A 84 -0.544 21.260 -3.626 1.00 0.00 N ATOM 1341 CA GLU A 84 0.341 22.252 -3.041 1.00 0.00 C ATOM 1342 C GLU A 84 0.724 21.847 -1.616 1.00 0.00 C ATOM 1343 O GLU A 84 1.742 22.296 -1.092 1.00 0.00 O ATOM 1344 CB GLU A 84 -0.301 23.641 -3.062 1.00 0.00 C ATOM 1345 CG GLU A 84 -1.460 23.724 -2.066 1.00 0.00 C ATOM 1346 CD GLU A 84 -2.100 25.114 -2.085 1.00 0.00 C ATOM 1347 OE1 GLU A 84 -2.735 25.432 -3.113 1.00 0.00 O ATOM 1348 OE2 GLU A 84 -1.940 25.827 -1.070 1.00 0.00 O ATOM 0 H GLU A 84 -1.510 21.565 -3.741 1.00 0.00 H new ATOM 0 HA GLU A 84 1.249 22.299 -3.642 1.00 0.00 H new ATOM 0 HB2 GLU A 84 0.447 24.395 -2.818 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -0.663 23.863 -4.066 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -2.209 22.971 -2.311 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -1.099 23.500 -1.062 1.00 0.00 H new ATOM 1355 N MET A 85 -0.112 21.003 -1.030 1.00 0.00 N ATOM 1356 CA MET A 85 0.126 20.532 0.324 1.00 0.00 C ATOM 1357 C MET A 85 0.829 19.173 0.316 1.00 0.00 C ATOM 1358 O MET A 85 1.293 18.704 1.354 1.00 0.00 O ATOM 1359 CB MET A 85 -1.207 20.414 1.065 1.00 0.00 C ATOM 1360 CG MET A 85 -1.787 21.795 1.375 1.00 0.00 C ATOM 1361 SD MET A 85 -1.842 22.053 3.140 1.00 0.00 S ATOM 1362 CE MET A 85 -2.940 20.727 3.613 1.00 0.00 C ATOM 0 H MET A 85 -0.955 20.633 -1.468 1.00 0.00 H new ATOM 0 HA MET A 85 0.771 21.250 0.831 1.00 0.00 H new ATOM 0 HB2 MET A 85 -1.914 19.846 0.460 1.00 0.00 H new ATOM 0 HB3 MET A 85 -1.064 19.859 1.992 1.00 0.00 H new ATOM 0 HG2 MET A 85 -1.178 22.568 0.905 1.00 0.00 H new ATOM 0 HG3 MET A 85 -2.789 21.880 0.956 1.00 0.00 H new ATOM 0 HE1 MET A 85 -3.875 21.145 3.986 1.00 0.00 H new ATOM 0 HE2 MET A 85 -3.144 20.097 2.747 1.00 0.00 H new ATOM 0 HE3 MET A 85 -2.472 20.129 4.395 1.00 0.00 H new ATOM 1372 N PHE A 86 0.885 18.579 -0.867 1.00 0.00 N ATOM 1373 CA PHE A 86 1.524 17.283 -1.023 1.00 0.00 C ATOM 1374 C PHE A 86 3.036 17.435 -1.202 1.00 0.00 C ATOM 1375 O PHE A 86 3.801 16.551 -0.819 1.00 0.00 O ATOM 1376 CB PHE A 86 0.935 16.644 -2.283 1.00 0.00 C ATOM 1377 CG PHE A 86 0.031 15.441 -2.006 1.00 0.00 C ATOM 1378 CD1 PHE A 86 -1.173 15.620 -1.399 1.00 0.00 C ATOM 1379 CD2 PHE A 86 0.432 14.192 -2.367 1.00 0.00 C ATOM 1380 CE1 PHE A 86 -2.012 14.504 -1.142 1.00 0.00 C ATOM 1381 CE2 PHE A 86 -0.407 13.076 -2.110 1.00 0.00 C ATOM 1382 CZ PHE A 86 -1.611 13.255 -1.503 1.00 0.00 C ATOM 0 H PHE A 86 0.499 18.971 -1.726 1.00 0.00 H new ATOM 0 HA PHE A 86 1.350 16.673 -0.137 1.00 0.00 H new ATOM 0 HB2 PHE A 86 0.364 17.397 -2.827 1.00 0.00 H new ATOM 0 HB3 PHE A 86 1.751 16.330 -2.934 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -1.491 16.612 -1.112 1.00 0.00 H new ATOM 0 HD2 PHE A 86 1.388 14.050 -2.849 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -2.968 14.646 -0.660 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -0.089 12.084 -2.397 1.00 0.00 H new ATOM 0 HZ PHE A 86 -2.249 12.406 -1.308 1.00 0.00 H new ATOM 1392 N GLU A 87 3.421 18.562 -1.782 1.00 0.00 N ATOM 1393 CA GLU A 87 4.828 18.840 -2.016 1.00 0.00 C ATOM 1394 C GLU A 87 5.653 18.477 -0.779 1.00 0.00 C ATOM 1395 O GLU A 87 6.654 17.770 -0.883 1.00 0.00 O ATOM 1396 CB GLU A 87 5.039 20.305 -2.405 1.00 0.00 C ATOM 1397 CG GLU A 87 5.760 20.415 -3.750 1.00 0.00 C ATOM 1398 CD GLU A 87 6.921 21.408 -3.670 1.00 0.00 C ATOM 1399 OE1 GLU A 87 6.656 22.611 -3.884 1.00 0.00 O ATOM 1400 OE2 GLU A 87 8.048 20.942 -3.396 1.00 0.00 O ATOM 0 H GLU A 87 2.783 19.293 -2.097 1.00 0.00 H new ATOM 0 HA GLU A 87 5.167 18.224 -2.849 1.00 0.00 H new ATOM 0 HB2 GLU A 87 4.076 20.813 -2.462 1.00 0.00 H new ATOM 0 HB3 GLU A 87 5.621 20.810 -1.634 1.00 0.00 H new ATOM 0 HG2 GLU A 87 6.134 19.435 -4.047 1.00 0.00 H new ATOM 0 HG3 GLU A 87 5.056 20.734 -4.519 1.00 0.00 H new ATOM 1407 N THR A 88 5.202 18.978 0.362 1.00 0.00 N ATOM 1408 CA THR A 88 5.886 18.715 1.616 1.00 0.00 C ATOM 1409 C THR A 88 6.138 17.215 1.782 1.00 0.00 C ATOM 1410 O THR A 88 7.231 16.805 2.170 1.00 0.00 O ATOM 1411 CB THR A 88 5.051 19.319 2.746 1.00 0.00 C ATOM 1412 OG1 THR A 88 5.338 20.714 2.683 1.00 0.00 O ATOM 1413 CG2 THR A 88 5.547 18.899 4.131 1.00 0.00 C ATOM 0 H THR A 88 4.371 19.564 0.444 1.00 0.00 H new ATOM 0 HA THR A 88 6.871 19.182 1.635 1.00 0.00 H new ATOM 0 HB THR A 88 4.010 19.019 2.627 1.00 0.00 H new ATOM 0 HG1 THR A 88 4.836 21.183 3.382 1.00 0.00 H new ATOM 0 HG21 THR A 88 4.919 19.356 4.896 1.00 0.00 H new ATOM 0 HG22 THR A 88 5.498 17.814 4.221 1.00 0.00 H new ATOM 0 HG23 THR A 88 6.578 19.228 4.264 1.00 0.00 H new ATOM 1421 N ALA A 89 5.109 16.438 1.480 1.00 0.00 N ATOM 1422 CA ALA A 89 5.205 14.992 1.591 1.00 0.00 C ATOM 1423 C ALA A 89 6.160 14.465 0.519 1.00 0.00 C ATOM 1424 O ALA A 89 6.975 13.584 0.788 1.00 0.00 O ATOM 1425 CB ALA A 89 3.808 14.377 1.480 1.00 0.00 C ATOM 0 H ALA A 89 4.204 16.782 1.158 1.00 0.00 H new ATOM 0 HA ALA A 89 5.610 14.708 2.562 1.00 0.00 H new ATOM 0 HB1 ALA A 89 3.880 13.293 1.563 1.00 0.00 H new ATOM 0 HB2 ALA A 89 3.177 14.761 2.281 1.00 0.00 H new ATOM 0 HB3 ALA A 89 3.371 14.639 0.516 1.00 0.00 H new ATOM 1431 N ILE A 90 6.029 15.027 -0.674 1.00 0.00 N ATOM 1432 CA ILE A 90 6.870 14.624 -1.788 1.00 0.00 C ATOM 1433 C ILE A 90 8.332 14.926 -1.452 1.00 0.00 C ATOM 1434 O ILE A 90 9.236 14.242 -1.928 1.00 0.00 O ATOM 1435 CB ILE A 90 6.390 15.278 -3.085 1.00 0.00 C ATOM 1436 CG1 ILE A 90 4.914 14.968 -3.341 1.00 0.00 C ATOM 1437 CG2 ILE A 90 7.275 14.869 -4.265 1.00 0.00 C ATOM 1438 CD1 ILE A 90 4.361 15.833 -4.475 1.00 0.00 C ATOM 0 H ILE A 90 5.353 15.758 -0.893 1.00 0.00 H new ATOM 0 HA ILE A 90 6.795 13.549 -1.953 1.00 0.00 H new ATOM 0 HB ILE A 90 6.478 16.359 -2.976 1.00 0.00 H new ATOM 0 HG12 ILE A 90 4.799 13.914 -3.593 1.00 0.00 H new ATOM 0 HG13 ILE A 90 4.339 15.143 -2.432 1.00 0.00 H new ATOM 0 HG21 ILE A 90 6.912 15.347 -5.175 1.00 0.00 H new ATOM 0 HG22 ILE A 90 8.302 15.182 -4.075 1.00 0.00 H new ATOM 0 HG23 ILE A 90 7.242 13.786 -4.387 1.00 0.00 H new ATOM 0 HD11 ILE A 90 3.310 15.593 -4.637 1.00 0.00 H new ATOM 0 HD12 ILE A 90 4.456 16.886 -4.209 1.00 0.00 H new ATOM 0 HD13 ILE A 90 4.922 15.638 -5.389 1.00 0.00 H new ATOM 1450 N LYS A 91 8.519 15.952 -0.633 1.00 0.00 N ATOM 1451 CA LYS A 91 9.855 16.352 -0.228 1.00 0.00 C ATOM 1452 C LYS A 91 10.419 15.318 0.748 1.00 0.00 C ATOM 1453 O LYS A 91 11.537 14.835 0.569 1.00 0.00 O ATOM 1454 CB LYS A 91 9.842 17.778 0.327 1.00 0.00 C ATOM 1455 CG LYS A 91 10.317 18.781 -0.726 1.00 0.00 C ATOM 1456 CD LYS A 91 9.767 20.179 -0.439 1.00 0.00 C ATOM 1457 CE LYS A 91 10.798 21.032 0.303 1.00 0.00 C ATOM 1458 NZ LYS A 91 11.245 22.160 -0.544 1.00 0.00 N ATOM 0 H LYS A 91 7.767 16.518 -0.240 1.00 0.00 H new ATOM 0 HA LYS A 91 10.523 16.375 -1.089 1.00 0.00 H new ATOM 0 HB2 LYS A 91 8.834 18.036 0.652 1.00 0.00 H new ATOM 0 HB3 LYS A 91 10.485 17.836 1.205 1.00 0.00 H new ATOM 0 HG2 LYS A 91 11.407 18.811 -0.740 1.00 0.00 H new ATOM 0 HG3 LYS A 91 9.995 18.455 -1.715 1.00 0.00 H new ATOM 0 HD2 LYS A 91 9.493 20.665 -1.375 1.00 0.00 H new ATOM 0 HD3 LYS A 91 8.858 20.101 0.157 1.00 0.00 H new ATOM 0 HE2 LYS A 91 10.365 21.413 1.228 1.00 0.00 H new ATOM 0 HE3 LYS A 91 11.654 20.417 0.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 11.944 22.728 -0.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 11.677 21.790 -1.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 10.428 22.755 -0.789 1.00 0.00 H new ATOM 1472 N GLU A 92 9.620 15.007 1.758 1.00 0.00 N ATOM 1473 CA GLU A 92 10.026 14.038 2.762 1.00 0.00 C ATOM 1474 C GLU A 92 9.970 12.622 2.186 1.00 0.00 C ATOM 1475 O GLU A 92 11.006 12.013 1.923 1.00 0.00 O ATOM 1476 CB GLU A 92 9.160 14.155 4.018 1.00 0.00 C ATOM 1477 CG GLU A 92 9.854 15.001 5.086 1.00 0.00 C ATOM 1478 CD GLU A 92 9.510 14.501 6.491 1.00 0.00 C ATOM 1479 OE1 GLU A 92 10.103 13.475 6.888 1.00 0.00 O ATOM 1480 OE2 GLU A 92 8.663 15.156 7.135 1.00 0.00 O ATOM 0 H GLU A 92 8.694 15.409 1.903 1.00 0.00 H new ATOM 0 HA GLU A 92 11.056 14.251 3.050 1.00 0.00 H new ATOM 0 HB2 GLU A 92 8.200 14.603 3.762 1.00 0.00 H new ATOM 0 HB3 GLU A 92 8.952 13.161 4.415 1.00 0.00 H new ATOM 0 HG2 GLU A 92 10.933 14.966 4.938 1.00 0.00 H new ATOM 0 HG3 GLU A 92 9.552 16.043 4.983 1.00 0.00 H new ATOM 1487 N SER A 93 8.749 12.138 2.008 1.00 0.00 N ATOM 1488 CA SER A 93 8.544 10.804 1.468 1.00 0.00 C ATOM 1489 C SER A 93 9.421 9.797 2.215 1.00 0.00 C ATOM 1490 O SER A 93 10.590 9.618 1.880 1.00 0.00 O ATOM 1491 CB SER A 93 8.849 10.764 -0.031 1.00 0.00 C ATOM 1492 OG SER A 93 7.666 10.625 -0.812 1.00 0.00 O ATOM 0 H SER A 93 7.892 12.645 2.228 1.00 0.00 H new ATOM 0 HA SER A 93 7.496 10.536 1.606 1.00 0.00 H new ATOM 0 HB2 SER A 93 9.369 11.677 -0.320 1.00 0.00 H new ATOM 0 HB3 SER A 93 9.523 9.933 -0.242 1.00 0.00 H new ATOM 0 HG SER A 93 7.902 10.605 -1.763 1.00 0.00 H new ATOM 1498 N SER A 94 8.822 9.166 3.215 1.00 0.00 N ATOM 1499 CA SER A 94 9.533 8.182 4.012 1.00 0.00 C ATOM 1500 C SER A 94 10.773 8.817 4.644 1.00 0.00 C ATOM 1501 O SER A 94 11.199 9.896 4.234 1.00 0.00 O ATOM 1502 CB SER A 94 9.930 6.971 3.166 1.00 0.00 C ATOM 1503 OG SER A 94 10.222 5.831 3.970 1.00 0.00 O ATOM 0 H SER A 94 7.852 9.318 3.491 1.00 0.00 H new ATOM 0 HA SER A 94 8.867 7.837 4.802 1.00 0.00 H new ATOM 0 HB2 SER A 94 9.122 6.730 2.476 1.00 0.00 H new ATOM 0 HB3 SER A 94 10.802 7.221 2.561 1.00 0.00 H new ATOM 0 HG SER A 94 10.469 5.079 3.393 1.00 0.00 H new ATOM 1509 N GLY A 95 11.318 8.121 5.631 1.00 0.00 N ATOM 1510 CA GLY A 95 12.501 8.604 6.323 1.00 0.00 C ATOM 1511 C GLY A 95 13.336 7.440 6.858 1.00 0.00 C ATOM 1512 O GLY A 95 12.960 6.279 6.704 1.00 0.00 O ATOM 0 H GLY A 95 10.962 7.226 5.968 1.00 0.00 H new ATOM 0 HA2 GLY A 95 13.104 9.206 5.643 1.00 0.00 H new ATOM 0 HA3 GLY A 95 12.205 9.253 7.147 1.00 0.00 H new ATOM 1516 N PRO A 96 14.484 7.800 7.493 1.00 0.00 N ATOM 1517 CA PRO A 96 15.376 6.799 8.052 1.00 0.00 C ATOM 1518 C PRO A 96 14.804 6.215 9.345 1.00 0.00 C ATOM 1519 O PRO A 96 15.389 6.375 10.415 1.00 0.00 O ATOM 1520 CB PRO A 96 16.697 7.521 8.260 1.00 0.00 C ATOM 1521 CG PRO A 96 16.368 9.004 8.248 1.00 0.00 C ATOM 1522 CD PRO A 96 14.961 9.165 7.694 1.00 0.00 C ATOM 0 HA PRO A 96 15.507 5.939 7.395 1.00 0.00 H new ATOM 0 HB2 PRO A 96 17.156 7.231 9.205 1.00 0.00 H new ATOM 0 HB3 PRO A 96 17.407 7.272 7.471 1.00 0.00 H new ATOM 0 HG2 PRO A 96 16.431 9.417 9.255 1.00 0.00 H new ATOM 0 HG3 PRO A 96 17.085 9.549 7.634 1.00 0.00 H new ATOM 0 HD2 PRO A 96 14.322 9.710 8.389 1.00 0.00 H new ATOM 0 HD3 PRO A 96 14.965 9.725 6.759 1.00 0.00 H new ATOM 1530 N SER A 97 13.666 5.550 9.204 1.00 0.00 N ATOM 1531 CA SER A 97 13.008 4.942 10.348 1.00 0.00 C ATOM 1532 C SER A 97 12.497 6.028 11.296 1.00 0.00 C ATOM 1533 O SER A 97 13.234 6.497 12.163 1.00 0.00 O ATOM 1534 CB SER A 97 13.954 3.993 11.087 1.00 0.00 C ATOM 1535 OG SER A 97 13.245 3.011 11.838 1.00 0.00 O ATOM 0 H SER A 97 13.183 5.419 8.315 1.00 0.00 H new ATOM 0 HA SER A 97 12.162 4.358 9.986 1.00 0.00 H new ATOM 0 HB2 SER A 97 14.606 3.498 10.367 1.00 0.00 H new ATOM 0 HB3 SER A 97 14.595 4.568 11.756 1.00 0.00 H new ATOM 0 HG SER A 97 13.884 2.424 12.294 1.00 0.00 H new ATOM 1541 N SER A 98 11.240 6.397 11.100 1.00 0.00 N ATOM 1542 CA SER A 98 10.623 7.419 11.928 1.00 0.00 C ATOM 1543 C SER A 98 10.538 6.939 13.378 1.00 0.00 C ATOM 1544 O SER A 98 11.093 7.569 14.277 1.00 0.00 O ATOM 1545 CB SER A 98 9.230 7.782 11.407 1.00 0.00 C ATOM 1546 OG SER A 98 8.687 8.914 12.081 1.00 0.00 O ATOM 0 H SER A 98 10.632 6.007 10.380 1.00 0.00 H new ATOM 0 HA SER A 98 11.244 8.314 11.885 1.00 0.00 H new ATOM 0 HB2 SER A 98 9.285 7.988 10.338 1.00 0.00 H new ATOM 0 HB3 SER A 98 8.562 6.930 11.533 1.00 0.00 H new ATOM 0 HG SER A 98 7.799 9.115 11.719 1.00 0.00 H new ATOM 1552 N GLY A 99 9.841 5.828 13.560 1.00 0.00 N ATOM 1553 CA GLY A 99 9.677 5.255 14.885 1.00 0.00 C ATOM 1554 C GLY A 99 8.764 4.028 14.844 1.00 0.00 C ATOM 1555 O GLY A 99 7.830 3.972 14.046 1.00 0.00 O ATOM 0 H GLY A 99 9.383 5.309 12.811 1.00 0.00 H new ATOM 0 HA2 GLY A 99 10.651 4.975 15.287 1.00 0.00 H new ATOM 0 HA3 GLY A 99 9.258 6.002 15.559 1.00 0.00 H new TER 1559 GLY A 99