USER MOD reduce.3.24.130724 H: found=0, std=0, add=1243, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1241 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 83 LYS NZ :NH3+ -143:sc= 0.374 (180deg=0.00624) USER MOD Set 1.2: A 85 SER OG : rot -53:sc= -0.246 USER MOD Set 2.1: A 17 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 136 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0.00148 USER MOD Single : A 3 SER OG : rot 57:sc= 1.19 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.00802) USER MOD Single : A 13 SER OG : rot 21:sc= 0.26 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 MET CE :methyl -135:sc= -0.0167 (180deg=-0.223) USER MOD Single : A 19 ASN : amide:sc= -2.61! K(o=-2.6!,f=0.49) USER MOD Single : A 20 ASN : amide:sc= -0.315 K(o=-0.32,f=-2) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 24 CYS SG : rot 151:sc= 0.19 USER MOD Single : A 28 MET CE :methyl -159:sc= -0.302 (180deg=-0.822) USER MOD Single : A 33 LYS NZ :NH3+ 151:sc= 0 (180deg=-0.611) USER MOD Single : A 34 SER OG : rot 160:sc= 0.619 USER MOD Single : A 35 SER OG : rot 180:sc= 0.00879 USER MOD Single : A 36 THR OG1 : rot 27:sc= 0.366 USER MOD Single : A 38 SER OG : rot 106:sc= 0.154 USER MOD Single : A 39 SER OG : rot 180:sc= -0.204 USER MOD Single : A 42 ASN : amide:sc=-0.00337 X(o=-0.0034,f=-0.36) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 CYS SG : rot -70:sc= -1.75 USER MOD Single : A 52 ASN : amide:sc= -6.63! C(o=-6.6!,f=-8.6!) USER MOD Single : A 54 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0384) USER MOD Single : A 60 SER OG : rot 63:sc= 0.857 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 TYR OH : rot 180:sc= -0.0146 USER MOD Single : A 65 SER OG : rot 180:sc= -0.0547 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 18:sc= 0.0379 USER MOD Single : A 73 CYS SG : rot 99:sc= 0.772 USER MOD Single : A 75 LYS NZ :NH3+ -161:sc= -0.0313 (180deg=-0.242) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 81 LYS NZ :NH3+ -146:sc=-0.00853 (180deg=-1.44!) USER MOD Single : A 88 ASN : amide:sc= -7.14! C(o=-7.1!,f=-12!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 MET CE :methyl 164:sc= -8.54! (180deg=-9.7!) USER MOD Single : A 99 SER OG : rot -114:sc= 0.328 USER MOD Single : A 100 GLN : amide:sc= -1.41 X(o=-1.4,f=-1) USER MOD Single : A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 GLN : amide:sc= -0.107 K(o=-0.11,f=-2.2!) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ -150:sc= 0 (180deg=-0.0853) USER MOD Single : A 115 LYS NZ :NH3+ 159:sc= -0.689 (180deg=-1.24) USER MOD Single : A 127 ASN : amide:sc= -10.4! C(o=-10!,f=-8.6!) USER MOD Single : A 134 LYS NZ :NH3+ 145:sc= -1.59 (180deg=-4.18!) USER MOD Single : A 139 CYS SG : rot 93:sc= 0.768 USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 145 GLN : amide:sc= -2.23! K(o=-2.2!,f=-0.67) USER MOD Single : A 147 SER OG : rot 180:sc= 0.138 USER MOD Single : A 149 ASN : amide:sc= -0.0588 K(o=-0.059,f=-1.4) USER MOD Single : A 151 SER OG : rot 180:sc= 0 USER MOD Single : A 153 GLN : amide:sc= 0 X(o=0,f=-0.0071) USER MOD Single : A 154 SER OG : rot 180:sc= 0 USER MOD Single : A 157 SER OG : rot 180:sc= 0 USER MOD Single : A 158 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 18.917 13.428 6.523 1.00 0.00 N ATOM 2 CA GLY A 1 19.774 13.556 7.687 1.00 0.00 C ATOM 3 C GLY A 1 19.026 13.332 8.986 1.00 0.00 C ATOM 4 O GLY A 1 18.273 14.196 9.434 1.00 0.00 O ATOM 0 H1 GLY A 1 19.476 13.590 5.661 1.00 0.00 H new ATOM 0 H2 GLY A 1 18.508 12.472 6.496 1.00 0.00 H new ATOM 0 H3 GLY A 1 18.152 14.130 6.577 1.00 0.00 H new ATOM 0 HA2 GLY A 1 20.591 12.838 7.613 1.00 0.00 H new ATOM 0 HA3 GLY A 1 20.223 14.549 7.696 1.00 0.00 H new ATOM 8 N SER A 2 19.231 12.167 9.592 1.00 0.00 N ATOM 9 CA SER A 2 18.566 11.829 10.844 1.00 0.00 C ATOM 10 C SER A 2 18.410 13.063 11.727 1.00 0.00 C ATOM 11 O SER A 2 19.391 13.597 12.245 1.00 0.00 O ATOM 12 CB SER A 2 19.354 10.750 11.590 1.00 0.00 C ATOM 13 OG SER A 2 19.614 9.637 10.753 1.00 0.00 O ATOM 0 H SER A 2 19.853 11.441 9.236 1.00 0.00 H new ATOM 0 HA SER A 2 17.574 11.445 10.607 1.00 0.00 H new ATOM 0 HB2 SER A 2 20.295 11.166 11.950 1.00 0.00 H new ATOM 0 HB3 SER A 2 18.793 10.426 12.467 1.00 0.00 H new ATOM 0 HG SER A 2 20.120 8.963 11.253 1.00 0.00 H new ATOM 19 N SER A 3 17.170 13.511 11.894 1.00 0.00 N ATOM 20 CA SER A 3 16.885 14.685 12.711 1.00 0.00 C ATOM 21 C SER A 3 16.004 14.317 13.902 1.00 0.00 C ATOM 22 O SER A 3 15.433 13.229 13.953 1.00 0.00 O ATOM 23 CB SER A 3 16.200 15.763 11.870 1.00 0.00 C ATOM 24 OG SER A 3 17.055 16.225 10.839 1.00 0.00 O ATOM 0 H SER A 3 16.347 13.079 11.475 1.00 0.00 H new ATOM 0 HA SER A 3 17.831 15.074 13.087 1.00 0.00 H new ATOM 0 HB2 SER A 3 15.284 15.362 11.435 1.00 0.00 H new ATOM 0 HB3 SER A 3 15.911 16.598 12.508 1.00 0.00 H new ATOM 0 HG SER A 3 17.331 15.469 10.280 1.00 0.00 H new ATOM 30 N GLY A 4 15.901 15.234 14.859 1.00 0.00 N ATOM 31 CA GLY A 4 15.089 14.989 16.036 1.00 0.00 C ATOM 32 C GLY A 4 13.999 16.027 16.216 1.00 0.00 C ATOM 33 O GLY A 4 14.222 17.070 16.831 1.00 0.00 O ATOM 0 H GLY A 4 16.365 16.142 14.840 1.00 0.00 H new ATOM 0 HA2 GLY A 4 14.636 14.000 15.961 1.00 0.00 H new ATOM 0 HA3 GLY A 4 15.728 14.981 16.919 1.00 0.00 H new ATOM 37 N SER A 5 12.818 15.743 15.677 1.00 0.00 N ATOM 38 CA SER A 5 11.691 16.663 15.777 1.00 0.00 C ATOM 39 C SER A 5 10.425 15.927 16.204 1.00 0.00 C ATOM 40 O SER A 5 9.675 15.423 15.369 1.00 0.00 O ATOM 41 CB SER A 5 11.459 17.365 14.437 1.00 0.00 C ATOM 42 OG SER A 5 10.803 18.608 14.620 1.00 0.00 O ATOM 0 H SER A 5 12.617 14.883 15.167 1.00 0.00 H new ATOM 0 HA SER A 5 11.929 17.410 16.535 1.00 0.00 H new ATOM 0 HB2 SER A 5 12.414 17.524 13.936 1.00 0.00 H new ATOM 0 HB3 SER A 5 10.861 16.727 13.787 1.00 0.00 H new ATOM 0 HG SER A 5 10.668 19.038 13.750 1.00 0.00 H new ATOM 48 N SER A 6 10.194 15.870 17.512 1.00 0.00 N ATOM 49 CA SER A 6 9.022 15.193 18.053 1.00 0.00 C ATOM 50 C SER A 6 7.836 16.148 18.142 1.00 0.00 C ATOM 51 O SER A 6 7.824 17.066 18.961 1.00 0.00 O ATOM 52 CB SER A 6 9.332 14.616 19.435 1.00 0.00 C ATOM 53 OG SER A 6 10.127 13.448 19.334 1.00 0.00 O ATOM 0 H SER A 6 10.804 16.285 18.217 1.00 0.00 H new ATOM 0 HA SER A 6 8.760 14.378 17.378 1.00 0.00 H new ATOM 0 HB2 SER A 6 9.852 15.362 20.036 1.00 0.00 H new ATOM 0 HB3 SER A 6 8.401 14.382 19.952 1.00 0.00 H new ATOM 0 HG SER A 6 10.312 13.100 20.231 1.00 0.00 H new ATOM 59 N GLY A 7 6.838 15.925 17.291 1.00 0.00 N ATOM 60 CA GLY A 7 5.661 16.773 17.289 1.00 0.00 C ATOM 61 C GLY A 7 4.425 16.048 16.795 1.00 0.00 C ATOM 62 O GLY A 7 4.404 14.819 16.720 1.00 0.00 O ATOM 0 H GLY A 7 6.824 15.172 16.603 1.00 0.00 H new ATOM 0 HA2 GLY A 7 5.482 17.143 18.298 1.00 0.00 H new ATOM 0 HA3 GLY A 7 5.845 17.643 16.658 1.00 0.00 H new ATOM 66 N LYS A 8 3.389 16.810 16.459 1.00 0.00 N ATOM 67 CA LYS A 8 2.142 16.233 15.970 1.00 0.00 C ATOM 68 C LYS A 8 2.337 15.602 14.596 1.00 0.00 C ATOM 69 O LYS A 8 3.163 16.056 13.804 1.00 0.00 O ATOM 70 CB LYS A 8 1.053 17.307 15.900 1.00 0.00 C ATOM 71 CG LYS A 8 -0.355 16.755 16.043 1.00 0.00 C ATOM 72 CD LYS A 8 -0.944 16.376 14.694 1.00 0.00 C ATOM 73 CE LYS A 8 -2.459 16.261 14.761 1.00 0.00 C ATOM 74 NZ LYS A 8 -2.892 14.947 15.312 1.00 0.00 N ATOM 0 H LYS A 8 3.388 17.828 16.516 1.00 0.00 H new ATOM 0 HA LYS A 8 1.832 15.454 16.667 1.00 0.00 H new ATOM 0 HB2 LYS A 8 1.228 18.042 16.686 1.00 0.00 H new ATOM 0 HB3 LYS A 8 1.133 17.833 14.949 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -0.340 15.880 16.693 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -0.991 17.498 16.523 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -0.667 17.124 13.952 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -0.520 15.428 14.364 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -2.857 17.064 15.382 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -2.878 16.392 13.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -3.931 14.908 15.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -2.534 14.181 14.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -2.514 14.832 16.274 1.00 0.00 H new ATOM 88 N VAL A 9 1.569 14.552 14.318 1.00 0.00 N ATOM 89 CA VAL A 9 1.656 13.860 13.037 1.00 0.00 C ATOM 90 C VAL A 9 0.269 13.520 12.501 1.00 0.00 C ATOM 91 O VAL A 9 -0.588 13.027 13.235 1.00 0.00 O ATOM 92 CB VAL A 9 2.480 12.564 13.155 1.00 0.00 C ATOM 93 CG1 VAL A 9 1.874 11.638 14.197 1.00 0.00 C ATOM 94 CG2 VAL A 9 2.576 11.870 11.804 1.00 0.00 C ATOM 0 H VAL A 9 0.881 14.163 14.962 1.00 0.00 H new ATOM 0 HA VAL A 9 2.155 14.538 12.344 1.00 0.00 H new ATOM 0 HB VAL A 9 3.488 12.823 13.478 1.00 0.00 H new ATOM 0 HG11 VAL A 9 2.470 10.728 14.266 1.00 0.00 H new ATOM 0 HG12 VAL A 9 1.862 12.138 15.165 1.00 0.00 H new ATOM 0 HG13 VAL A 9 0.854 11.383 13.908 1.00 0.00 H new ATOM 0 HG21 VAL A 9 3.161 10.956 11.905 1.00 0.00 H new ATOM 0 HG22 VAL A 9 1.575 11.622 11.450 1.00 0.00 H new ATOM 0 HG23 VAL A 9 3.060 12.534 11.088 1.00 0.00 H new ATOM 104 N VAL A 10 0.056 13.787 11.217 1.00 0.00 N ATOM 105 CA VAL A 10 -1.226 13.508 10.581 1.00 0.00 C ATOM 106 C VAL A 10 -1.194 12.177 9.838 1.00 0.00 C ATOM 107 O VAL A 10 -0.571 12.058 8.783 1.00 0.00 O ATOM 108 CB VAL A 10 -1.618 14.625 9.595 1.00 0.00 C ATOM 109 CG1 VAL A 10 -2.892 14.256 8.849 1.00 0.00 C ATOM 110 CG2 VAL A 10 -1.785 15.948 10.327 1.00 0.00 C ATOM 0 H VAL A 10 0.755 14.196 10.596 1.00 0.00 H new ATOM 0 HA VAL A 10 -1.969 13.458 11.377 1.00 0.00 H new ATOM 0 HB VAL A 10 -0.817 14.738 8.865 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -3.153 15.057 8.157 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -2.733 13.333 8.292 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -3.703 14.114 9.563 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -2.062 16.725 9.615 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -2.567 15.851 11.080 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -0.846 16.217 10.811 1.00 0.00 H new ATOM 120 N LYS A 11 -1.869 11.178 10.396 1.00 0.00 N ATOM 121 CA LYS A 11 -1.920 9.855 9.786 1.00 0.00 C ATOM 122 C LYS A 11 -3.349 9.487 9.401 1.00 0.00 C ATOM 123 O LYS A 11 -4.309 10.009 9.969 1.00 0.00 O ATOM 124 CB LYS A 11 -1.353 8.806 10.746 1.00 0.00 C ATOM 125 CG LYS A 11 -2.255 8.520 11.935 1.00 0.00 C ATOM 126 CD LYS A 11 -1.941 9.436 13.106 1.00 0.00 C ATOM 127 CE LYS A 11 -0.888 8.830 14.021 1.00 0.00 C ATOM 128 NZ LYS A 11 -1.459 7.773 14.900 1.00 0.00 N ATOM 0 H LYS A 11 -2.388 11.260 11.270 1.00 0.00 H new ATOM 0 HA LYS A 11 -1.313 9.877 8.881 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -1.182 7.879 10.199 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -0.383 9.145 11.110 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -3.297 8.647 11.641 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -2.135 7.481 12.242 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -1.590 10.398 12.733 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -2.851 9.627 13.674 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -0.084 8.406 13.419 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -0.446 9.614 14.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -0.736 7.457 15.577 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -2.275 8.156 15.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -1.766 6.967 14.319 1.00 0.00 H new ATOM 142 N PHE A 12 -3.484 8.586 8.434 1.00 0.00 N ATOM 143 CA PHE A 12 -4.797 8.148 7.974 1.00 0.00 C ATOM 144 C PHE A 12 -4.798 6.652 7.675 1.00 0.00 C ATOM 145 O PHE A 12 -3.794 6.097 7.227 1.00 0.00 O ATOM 146 CB PHE A 12 -5.209 8.930 6.726 1.00 0.00 C ATOM 147 CG PHE A 12 -4.111 9.060 5.710 1.00 0.00 C ATOM 148 CD1 PHE A 12 -3.194 10.096 5.790 1.00 0.00 C ATOM 149 CD2 PHE A 12 -3.995 8.147 4.674 1.00 0.00 C ATOM 150 CE1 PHE A 12 -2.182 10.219 4.857 1.00 0.00 C ATOM 151 CE2 PHE A 12 -2.985 8.264 3.738 1.00 0.00 C ATOM 152 CZ PHE A 12 -2.078 9.302 3.829 1.00 0.00 C ATOM 0 H PHE A 12 -2.700 8.145 7.953 1.00 0.00 H new ATOM 0 HA PHE A 12 -5.517 8.341 8.770 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -6.064 8.437 6.264 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -5.538 9.926 7.023 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -3.271 10.816 6.591 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -4.702 7.334 4.597 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -1.474 11.031 4.931 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -2.905 7.545 2.936 1.00 0.00 H new ATOM 0 HZ PHE A 12 -1.289 9.396 3.098 1.00 0.00 H new ATOM 162 N SER A 13 -5.931 6.005 7.927 1.00 0.00 N ATOM 163 CA SER A 13 -6.062 4.572 7.689 1.00 0.00 C ATOM 164 C SER A 13 -7.069 4.296 6.577 1.00 0.00 C ATOM 165 O SER A 13 -8.211 4.753 6.631 1.00 0.00 O ATOM 166 CB SER A 13 -6.493 3.858 8.971 1.00 0.00 C ATOM 167 OG SER A 13 -7.766 4.308 9.403 1.00 0.00 O ATOM 0 H SER A 13 -6.771 6.450 8.296 1.00 0.00 H new ATOM 0 HA SER A 13 -5.090 4.190 7.378 1.00 0.00 H new ATOM 0 HB2 SER A 13 -6.523 2.782 8.799 1.00 0.00 H new ATOM 0 HB3 SER A 13 -5.756 4.035 9.755 1.00 0.00 H new ATOM 0 HG SER A 13 -8.245 4.708 8.648 1.00 0.00 H new ATOM 173 N TYR A 14 -6.638 3.545 5.569 1.00 0.00 N ATOM 174 CA TYR A 14 -7.500 3.209 4.442 1.00 0.00 C ATOM 175 C TYR A 14 -7.709 1.701 4.347 1.00 0.00 C ATOM 176 O TYR A 14 -6.767 0.947 4.104 1.00 0.00 O ATOM 177 CB TYR A 14 -6.898 3.736 3.138 1.00 0.00 C ATOM 178 CG TYR A 14 -7.640 3.281 1.902 1.00 0.00 C ATOM 179 CD1 TYR A 14 -8.994 3.554 1.741 1.00 0.00 C ATOM 180 CD2 TYR A 14 -6.990 2.579 0.896 1.00 0.00 C ATOM 181 CE1 TYR A 14 -9.676 3.140 0.614 1.00 0.00 C ATOM 182 CE2 TYR A 14 -7.664 2.163 -0.236 1.00 0.00 C ATOM 183 CZ TYR A 14 -9.007 2.446 -0.372 1.00 0.00 C ATOM 184 OH TYR A 14 -9.683 2.031 -1.497 1.00 0.00 O ATOM 0 H TYR A 14 -5.696 3.157 5.510 1.00 0.00 H new ATOM 0 HA TYR A 14 -8.469 3.682 4.604 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -6.889 4.826 3.166 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -5.860 3.410 3.069 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -9.521 4.099 2.510 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -5.939 2.354 1.000 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -10.728 3.359 0.505 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -7.142 1.619 -1.010 1.00 0.00 H new ATOM 0 HH TYR A 14 -9.066 1.557 -2.093 1.00 0.00 H new ATOM 194 N MET A 15 -8.951 1.269 4.539 1.00 0.00 N ATOM 195 CA MET A 15 -9.286 -0.149 4.473 1.00 0.00 C ATOM 196 C MET A 15 -9.626 -0.561 3.045 1.00 0.00 C ATOM 197 O MET A 15 -10.623 -0.110 2.480 1.00 0.00 O ATOM 198 CB MET A 15 -10.462 -0.461 5.400 1.00 0.00 C ATOM 199 CG MET A 15 -10.568 -1.930 5.773 1.00 0.00 C ATOM 200 SD MET A 15 -12.102 -2.318 6.640 1.00 0.00 S ATOM 201 CE MET A 15 -11.885 -1.376 8.148 1.00 0.00 C ATOM 0 H MET A 15 -9.742 1.880 4.742 1.00 0.00 H new ATOM 0 HA MET A 15 -8.415 -0.718 4.799 1.00 0.00 H new ATOM 0 HB2 MET A 15 -10.363 0.130 6.310 1.00 0.00 H new ATOM 0 HB3 MET A 15 -11.388 -0.150 4.916 1.00 0.00 H new ATOM 0 HG2 MET A 15 -10.503 -2.536 4.869 1.00 0.00 H new ATOM 0 HG3 MET A 15 -9.721 -2.203 6.402 1.00 0.00 H new ATOM 0 HE1 MET A 15 -12.166 -1.990 9.004 1.00 0.00 H new ATOM 0 HE2 MET A 15 -10.841 -1.077 8.243 1.00 0.00 H new ATOM 0 HE3 MET A 15 -12.516 -0.488 8.116 1.00 0.00 H new ATOM 211 N TRP A 16 -8.792 -1.418 2.467 1.00 0.00 N ATOM 212 CA TRP A 16 -9.005 -1.890 1.103 1.00 0.00 C ATOM 213 C TRP A 16 -9.455 -3.347 1.096 1.00 0.00 C ATOM 214 O TRP A 16 -8.639 -4.260 1.221 1.00 0.00 O ATOM 215 CB TRP A 16 -7.725 -1.735 0.282 1.00 0.00 C ATOM 216 CG TRP A 16 -7.792 -2.406 -1.057 1.00 0.00 C ATOM 217 CD1 TRP A 16 -8.913 -2.864 -1.688 1.00 0.00 C ATOM 218 CD2 TRP A 16 -6.693 -2.696 -1.926 1.00 0.00 C ATOM 219 NE1 TRP A 16 -8.577 -3.421 -2.898 1.00 0.00 N ATOM 220 CE2 TRP A 16 -7.220 -3.330 -3.068 1.00 0.00 C ATOM 221 CE3 TRP A 16 -5.314 -2.480 -1.853 1.00 0.00 C ATOM 222 CZ2 TRP A 16 -6.417 -3.750 -4.124 1.00 0.00 C ATOM 223 CZ3 TRP A 16 -4.517 -2.898 -2.902 1.00 0.00 C ATOM 224 CH2 TRP A 16 -5.070 -3.526 -4.026 1.00 0.00 C ATOM 0 H TRP A 16 -7.962 -1.800 2.921 1.00 0.00 H new ATOM 0 HA TRP A 16 -9.792 -1.284 0.654 1.00 0.00 H new ATOM 0 HB2 TRP A 16 -7.520 -0.674 0.139 1.00 0.00 H new ATOM 0 HB3 TRP A 16 -6.888 -2.148 0.846 1.00 0.00 H new ATOM 0 HD1 TRP A 16 -9.916 -2.798 -1.294 1.00 0.00 H new ATOM 0 HE1 TRP A 16 -9.231 -3.835 -3.562 1.00 0.00 H new ATOM 0 HE3 TRP A 16 -4.879 -1.995 -0.992 1.00 0.00 H new ATOM 0 HZ2 TRP A 16 -6.841 -4.236 -4.990 1.00 0.00 H new ATOM 0 HZ3 TRP A 16 -3.450 -2.738 -2.855 1.00 0.00 H new ATOM 0 HH2 TRP A 16 -4.421 -3.839 -4.830 1.00 0.00 H new ATOM 235 N THR A 17 -10.759 -3.559 0.948 1.00 0.00 N ATOM 236 CA THR A 17 -11.317 -4.905 0.925 1.00 0.00 C ATOM 237 C THR A 17 -11.528 -5.388 -0.505 1.00 0.00 C ATOM 238 O THR A 17 -12.269 -4.776 -1.274 1.00 0.00 O ATOM 239 CB THR A 17 -12.658 -4.970 1.680 1.00 0.00 C ATOM 240 OG1 THR A 17 -12.497 -4.463 3.010 1.00 0.00 O ATOM 241 CG2 THR A 17 -13.179 -6.398 1.735 1.00 0.00 C ATOM 0 H THR A 17 -11.449 -2.815 0.842 1.00 0.00 H new ATOM 0 HA THR A 17 -10.597 -5.554 1.422 1.00 0.00 H new ATOM 0 HB THR A 17 -13.382 -4.357 1.144 1.00 0.00 H new ATOM 0 HG1 THR A 17 -13.354 -4.506 3.483 1.00 0.00 H new ATOM 0 HG21 THR A 17 -14.127 -6.419 2.273 1.00 0.00 H new ATOM 0 HG22 THR A 17 -13.329 -6.770 0.721 1.00 0.00 H new ATOM 0 HG23 THR A 17 -12.455 -7.030 2.250 1.00 0.00 H new ATOM 249 N ILE A 18 -10.873 -6.490 -0.855 1.00 0.00 N ATOM 250 CA ILE A 18 -10.991 -7.056 -2.193 1.00 0.00 C ATOM 251 C ILE A 18 -11.908 -8.274 -2.195 1.00 0.00 C ATOM 252 O ILE A 18 -11.496 -9.375 -1.830 1.00 0.00 O ATOM 253 CB ILE A 18 -9.616 -7.462 -2.756 1.00 0.00 C ATOM 254 CG1 ILE A 18 -8.680 -6.252 -2.798 1.00 0.00 C ATOM 255 CG2 ILE A 18 -9.769 -8.068 -4.142 1.00 0.00 C ATOM 256 CD1 ILE A 18 -7.213 -6.621 -2.786 1.00 0.00 C ATOM 0 H ILE A 18 -10.255 -7.008 -0.231 1.00 0.00 H new ATOM 0 HA ILE A 18 -11.419 -6.280 -2.827 1.00 0.00 H new ATOM 0 HB ILE A 18 -9.179 -8.213 -2.099 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -8.892 -5.670 -3.695 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -8.892 -5.610 -1.943 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -8.789 -8.350 -4.526 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -10.404 -8.952 -4.084 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -10.224 -7.337 -4.810 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -6.609 -5.714 -2.817 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -6.985 -7.177 -1.877 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -6.986 -7.238 -3.655 1.00 0.00 H new ATOM 268 N ASN A 19 -13.153 -8.069 -2.612 1.00 0.00 N ATOM 269 CA ASN A 19 -14.130 -9.152 -2.663 1.00 0.00 C ATOM 270 C ASN A 19 -13.662 -10.262 -3.599 1.00 0.00 C ATOM 271 O ASN A 19 -13.180 -9.998 -4.700 1.00 0.00 O ATOM 272 CB ASN A 19 -15.488 -8.619 -3.124 1.00 0.00 C ATOM 273 CG ASN A 19 -15.357 -7.421 -4.045 1.00 0.00 C ATOM 274 OD1 ASN A 19 -15.535 -7.535 -5.258 1.00 0.00 O ATOM 275 ND2 ASN A 19 -15.045 -6.265 -3.471 1.00 0.00 N ATOM 0 H ASN A 19 -13.510 -7.164 -2.919 1.00 0.00 H new ATOM 0 HA ASN A 19 -14.231 -9.566 -1.660 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -16.031 -9.412 -3.639 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -16.081 -8.341 -2.253 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -14.944 -5.424 -4.040 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -14.907 -6.218 -2.462 1.00 0.00 H new ATOM 282 N ASN A 20 -13.809 -11.505 -3.153 1.00 0.00 N ATOM 283 CA ASN A 20 -13.401 -12.657 -3.950 1.00 0.00 C ATOM 284 C ASN A 20 -11.924 -12.567 -4.320 1.00 0.00 C ATOM 285 O ASN A 20 -11.556 -12.690 -5.488 1.00 0.00 O ATOM 286 CB ASN A 20 -14.251 -12.751 -5.219 1.00 0.00 C ATOM 287 CG ASN A 20 -14.073 -14.075 -5.937 1.00 0.00 C ATOM 288 OD1 ASN A 20 -13.389 -14.973 -5.446 1.00 0.00 O ATOM 289 ND2 ASN A 20 -14.690 -14.201 -7.106 1.00 0.00 N ATOM 0 H ASN A 20 -14.208 -11.741 -2.244 1.00 0.00 H new ATOM 0 HA ASN A 20 -13.553 -13.555 -3.351 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -15.302 -12.620 -4.960 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -13.985 -11.937 -5.893 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -14.607 -15.069 -7.635 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -15.247 -13.430 -7.475 1.00 0.00 H new ATOM 296 N PHE A 21 -11.080 -12.352 -3.315 1.00 0.00 N ATOM 297 CA PHE A 21 -9.642 -12.246 -3.534 1.00 0.00 C ATOM 298 C PHE A 21 -9.101 -13.500 -4.215 1.00 0.00 C ATOM 299 O PHE A 21 -7.963 -13.523 -4.682 1.00 0.00 O ATOM 300 CB PHE A 21 -8.918 -12.021 -2.205 1.00 0.00 C ATOM 301 CG PHE A 21 -7.421 -12.040 -2.327 1.00 0.00 C ATOM 302 CD1 PHE A 21 -6.740 -10.946 -2.835 1.00 0.00 C ATOM 303 CD2 PHE A 21 -6.695 -13.153 -1.934 1.00 0.00 C ATOM 304 CE1 PHE A 21 -5.363 -10.962 -2.949 1.00 0.00 C ATOM 305 CE2 PHE A 21 -5.318 -13.174 -2.045 1.00 0.00 C ATOM 306 CZ PHE A 21 -4.651 -12.077 -2.553 1.00 0.00 C ATOM 0 H PHE A 21 -11.367 -12.248 -2.342 1.00 0.00 H new ATOM 0 HA PHE A 21 -9.461 -11.393 -4.188 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -9.228 -11.063 -1.789 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -9.227 -12.791 -1.497 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -7.291 -10.071 -3.145 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -7.212 -14.014 -1.536 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -4.844 -10.103 -3.348 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -4.764 -14.048 -1.735 1.00 0.00 H new ATOM 0 HZ PHE A 21 -3.575 -12.091 -2.640 1.00 0.00 H new ATOM 316 N SER A 22 -9.927 -14.540 -4.267 1.00 0.00 N ATOM 317 CA SER A 22 -9.531 -15.800 -4.886 1.00 0.00 C ATOM 318 C SER A 22 -9.442 -15.655 -6.403 1.00 0.00 C ATOM 319 O SER A 22 -8.677 -16.360 -7.061 1.00 0.00 O ATOM 320 CB SER A 22 -10.525 -16.905 -4.526 1.00 0.00 C ATOM 321 OG SER A 22 -10.349 -18.040 -5.355 1.00 0.00 O ATOM 0 H SER A 22 -10.874 -14.535 -3.888 1.00 0.00 H new ATOM 0 HA SER A 22 -8.546 -16.070 -4.505 1.00 0.00 H new ATOM 0 HB2 SER A 22 -10.394 -17.190 -3.482 1.00 0.00 H new ATOM 0 HB3 SER A 22 -11.543 -16.530 -4.629 1.00 0.00 H new ATOM 0 HG SER A 22 -10.995 -18.732 -5.103 1.00 0.00 H new ATOM 327 N PHE A 23 -10.230 -14.735 -6.950 1.00 0.00 N ATOM 328 CA PHE A 23 -10.242 -14.497 -8.389 1.00 0.00 C ATOM 329 C PHE A 23 -8.972 -13.777 -8.831 1.00 0.00 C ATOM 330 O PHE A 23 -8.478 -13.991 -9.939 1.00 0.00 O ATOM 331 CB PHE A 23 -11.471 -13.675 -8.781 1.00 0.00 C ATOM 332 CG PHE A 23 -11.209 -12.198 -8.848 1.00 0.00 C ATOM 333 CD1 PHE A 23 -10.344 -11.677 -9.797 1.00 0.00 C ATOM 334 CD2 PHE A 23 -11.825 -11.330 -7.961 1.00 0.00 C ATOM 335 CE1 PHE A 23 -10.100 -10.318 -9.862 1.00 0.00 C ATOM 336 CE2 PHE A 23 -11.586 -9.971 -8.021 1.00 0.00 C ATOM 337 CZ PHE A 23 -10.721 -9.464 -8.972 1.00 0.00 C ATOM 0 H PHE A 23 -10.868 -14.142 -6.419 1.00 0.00 H new ATOM 0 HA PHE A 23 -10.285 -15.463 -8.892 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -11.832 -14.016 -9.751 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -12.268 -13.862 -8.061 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -9.855 -12.341 -10.494 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -12.500 -11.721 -7.214 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -9.425 -9.925 -10.608 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -12.075 -9.305 -7.325 1.00 0.00 H new ATOM 0 HZ PHE A 23 -10.531 -8.402 -9.019 1.00 0.00 H new ATOM 347 N CYS A 24 -8.450 -12.921 -7.960 1.00 0.00 N ATOM 348 CA CYS A 24 -7.238 -12.167 -8.260 1.00 0.00 C ATOM 349 C CYS A 24 -6.214 -13.045 -8.972 1.00 0.00 C ATOM 350 O CYS A 24 -5.483 -13.803 -8.335 1.00 0.00 O ATOM 351 CB CYS A 24 -6.635 -11.598 -6.975 1.00 0.00 C ATOM 352 SG CYS A 24 -7.763 -10.543 -6.034 1.00 0.00 S ATOM 0 H CYS A 24 -8.847 -12.732 -7.040 1.00 0.00 H new ATOM 0 HA CYS A 24 -7.506 -11.344 -8.922 1.00 0.00 H new ATOM 0 HB2 CYS A 24 -6.313 -12.424 -6.341 1.00 0.00 H new ATOM 0 HB3 CYS A 24 -5.744 -11.024 -7.228 1.00 0.00 H new ATOM 0 HG CYS A 24 -7.470 -10.614 -4.769 1.00 0.00 H new ATOM 358 N ARG A 25 -6.168 -12.937 -10.296 1.00 0.00 N ATOM 359 CA ARG A 25 -5.236 -13.723 -11.094 1.00 0.00 C ATOM 360 C ARG A 25 -4.245 -12.818 -11.820 1.00 0.00 C ATOM 361 O ARG A 25 -3.870 -13.082 -12.962 1.00 0.00 O ATOM 362 CB ARG A 25 -5.996 -14.581 -12.108 1.00 0.00 C ATOM 363 CG ARG A 25 -5.174 -15.727 -12.673 1.00 0.00 C ATOM 364 CD ARG A 25 -5.032 -16.860 -11.669 1.00 0.00 C ATOM 365 NE ARG A 25 -4.422 -18.046 -12.263 1.00 0.00 N ATOM 366 CZ ARG A 25 -4.057 -19.114 -11.563 1.00 0.00 C ATOM 367 NH1 ARG A 25 -4.241 -19.144 -10.250 1.00 0.00 N ATOM 368 NH2 ARG A 25 -3.507 -20.154 -12.176 1.00 0.00 N ATOM 0 H ARG A 25 -6.765 -12.313 -10.838 1.00 0.00 H new ATOM 0 HA ARG A 25 -4.681 -14.375 -10.420 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -6.889 -14.986 -11.632 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -6.332 -13.947 -12.928 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -5.646 -16.102 -13.581 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -4.186 -15.363 -12.954 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -4.426 -16.524 -10.827 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -6.014 -17.118 -11.272 1.00 0.00 H new ATOM 0 HE ARG A 25 -4.268 -18.055 -13.271 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -4.664 -18.346 -9.776 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -3.960 -19.965 -9.714 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -3.364 -20.134 -13.186 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -3.227 -20.974 -11.638 1.00 0.00 H new ATOM 382 N GLU A 26 -3.825 -11.750 -11.149 1.00 0.00 N ATOM 383 CA GLU A 26 -2.879 -10.805 -11.731 1.00 0.00 C ATOM 384 C GLU A 26 -1.693 -11.537 -12.354 1.00 0.00 C ATOM 385 O GLU A 26 -0.972 -12.263 -11.671 1.00 0.00 O ATOM 386 CB GLU A 26 -2.385 -9.823 -10.668 1.00 0.00 C ATOM 387 CG GLU A 26 -2.009 -8.460 -11.225 1.00 0.00 C ATOM 388 CD GLU A 26 -3.046 -7.918 -12.190 1.00 0.00 C ATOM 389 OE1 GLU A 26 -4.238 -7.882 -11.821 1.00 0.00 O ATOM 390 OE2 GLU A 26 -2.664 -7.531 -13.314 1.00 0.00 O ATOM 0 H GLU A 26 -4.125 -11.518 -10.202 1.00 0.00 H new ATOM 0 HA GLU A 26 -3.395 -10.250 -12.515 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -3.162 -9.696 -9.914 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -1.519 -10.252 -10.164 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -1.882 -7.757 -10.401 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -1.048 -8.532 -11.733 1.00 0.00 H new ATOM 397 N GLU A 27 -1.500 -11.341 -13.654 1.00 0.00 N ATOM 398 CA GLU A 27 -0.403 -11.983 -14.369 1.00 0.00 C ATOM 399 C GLU A 27 0.917 -11.786 -13.629 1.00 0.00 C ATOM 400 O GLU A 27 0.995 -11.017 -12.672 1.00 0.00 O ATOM 401 CB GLU A 27 -0.294 -11.424 -15.789 1.00 0.00 C ATOM 402 CG GLU A 27 -1.430 -11.855 -16.702 1.00 0.00 C ATOM 403 CD GLU A 27 -1.503 -11.029 -17.971 1.00 0.00 C ATOM 404 OE1 GLU A 27 -0.436 -10.615 -18.471 1.00 0.00 O ATOM 405 OE2 GLU A 27 -2.626 -10.797 -18.465 1.00 0.00 O ATOM 0 H GLU A 27 -2.089 -10.743 -14.234 1.00 0.00 H new ATOM 0 HA GLU A 27 -0.613 -13.051 -14.423 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -0.271 -10.335 -15.741 1.00 0.00 H new ATOM 0 HB3 GLU A 27 0.652 -11.744 -16.225 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -1.303 -12.905 -16.963 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -2.375 -11.773 -16.164 1.00 0.00 H new ATOM 412 N MET A 28 1.952 -12.486 -14.082 1.00 0.00 N ATOM 413 CA MET A 28 3.269 -12.388 -13.464 1.00 0.00 C ATOM 414 C MET A 28 3.816 -10.968 -13.573 1.00 0.00 C ATOM 415 O MET A 28 3.741 -10.343 -14.631 1.00 0.00 O ATOM 416 CB MET A 28 4.239 -13.372 -14.120 1.00 0.00 C ATOM 417 CG MET A 28 5.412 -13.753 -13.232 1.00 0.00 C ATOM 418 SD MET A 28 5.014 -15.091 -12.091 1.00 0.00 S ATOM 419 CE MET A 28 5.333 -14.298 -10.517 1.00 0.00 C ATOM 0 H MET A 28 1.904 -13.127 -14.874 1.00 0.00 H new ATOM 0 HA MET A 28 3.167 -12.640 -12.408 1.00 0.00 H new ATOM 0 HB2 MET A 28 3.695 -14.275 -14.397 1.00 0.00 H new ATOM 0 HB3 MET A 28 4.620 -12.934 -15.042 1.00 0.00 H new ATOM 0 HG2 MET A 28 6.254 -14.052 -13.857 1.00 0.00 H new ATOM 0 HG3 MET A 28 5.731 -12.879 -12.664 1.00 0.00 H new ATOM 0 HE1 MET A 28 5.499 -15.058 -9.754 1.00 0.00 H new ATOM 0 HE2 MET A 28 6.218 -13.668 -10.600 1.00 0.00 H new ATOM 0 HE3 MET A 28 4.476 -13.685 -10.238 1.00 0.00 H new ATOM 429 N GLY A 29 4.367 -10.464 -12.473 1.00 0.00 N ATOM 430 CA GLY A 29 4.918 -9.121 -12.468 1.00 0.00 C ATOM 431 C GLY A 29 3.860 -8.061 -12.238 1.00 0.00 C ATOM 432 O GLY A 29 4.047 -7.153 -11.429 1.00 0.00 O ATOM 0 H GLY A 29 4.442 -10.961 -11.586 1.00 0.00 H new ATOM 0 HA2 GLY A 29 5.678 -9.046 -11.690 1.00 0.00 H new ATOM 0 HA3 GLY A 29 5.416 -8.932 -13.419 1.00 0.00 H new ATOM 436 N GLU A 30 2.745 -8.176 -12.953 1.00 0.00 N ATOM 437 CA GLU A 30 1.654 -7.217 -12.825 1.00 0.00 C ATOM 438 C GLU A 30 1.344 -6.938 -11.357 1.00 0.00 C ATOM 439 O GLU A 30 1.813 -7.648 -10.466 1.00 0.00 O ATOM 440 CB GLU A 30 0.401 -7.739 -13.531 1.00 0.00 C ATOM 441 CG GLU A 30 0.477 -7.655 -15.047 1.00 0.00 C ATOM 442 CD GLU A 30 0.706 -6.240 -15.542 1.00 0.00 C ATOM 443 OE1 GLU A 30 0.253 -5.294 -14.864 1.00 0.00 O ATOM 444 OE2 GLU A 30 1.337 -6.079 -16.607 1.00 0.00 O ATOM 0 H GLU A 30 2.574 -8.923 -13.626 1.00 0.00 H new ATOM 0 HA GLU A 30 1.967 -6.285 -13.296 1.00 0.00 H new ATOM 0 HB2 GLU A 30 0.236 -8.777 -13.241 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -0.463 -7.171 -13.187 1.00 0.00 H new ATOM 0 HG2 GLU A 30 1.284 -8.295 -15.403 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -0.448 -8.041 -15.475 1.00 0.00 H new ATOM 451 N VAL A 31 0.552 -5.899 -11.112 1.00 0.00 N ATOM 452 CA VAL A 31 0.179 -5.526 -9.752 1.00 0.00 C ATOM 453 C VAL A 31 -1.157 -4.793 -9.731 1.00 0.00 C ATOM 454 O VAL A 31 -1.523 -4.120 -10.695 1.00 0.00 O ATOM 455 CB VAL A 31 1.252 -4.635 -9.100 1.00 0.00 C ATOM 456 CG1 VAL A 31 1.348 -3.299 -9.822 1.00 0.00 C ATOM 457 CG2 VAL A 31 0.950 -4.431 -7.623 1.00 0.00 C ATOM 0 H VAL A 31 0.156 -5.301 -11.837 1.00 0.00 H new ATOM 0 HA VAL A 31 0.092 -6.451 -9.182 1.00 0.00 H new ATOM 0 HB VAL A 31 2.216 -5.137 -9.184 1.00 0.00 H new ATOM 0 HG11 VAL A 31 2.111 -2.683 -9.347 1.00 0.00 H new ATOM 0 HG12 VAL A 31 1.615 -3.468 -10.865 1.00 0.00 H new ATOM 0 HG13 VAL A 31 0.386 -2.788 -9.772 1.00 0.00 H new ATOM 0 HG21 VAL A 31 1.719 -3.799 -7.178 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -0.023 -3.951 -7.513 1.00 0.00 H new ATOM 0 HG23 VAL A 31 0.937 -5.397 -7.117 1.00 0.00 H new ATOM 467 N ILE A 32 -1.882 -4.927 -8.625 1.00 0.00 N ATOM 468 CA ILE A 32 -3.177 -4.275 -8.478 1.00 0.00 C ATOM 469 C ILE A 32 -3.034 -2.912 -7.809 1.00 0.00 C ATOM 470 O ILE A 32 -2.850 -2.821 -6.595 1.00 0.00 O ATOM 471 CB ILE A 32 -4.152 -5.139 -7.656 1.00 0.00 C ATOM 472 CG1 ILE A 32 -4.356 -6.498 -8.329 1.00 0.00 C ATOM 473 CG2 ILE A 32 -5.482 -4.420 -7.486 1.00 0.00 C ATOM 474 CD1 ILE A 32 -4.995 -7.529 -7.426 1.00 0.00 C ATOM 0 H ILE A 32 -1.594 -5.481 -7.818 1.00 0.00 H new ATOM 0 HA ILE A 32 -3.580 -4.143 -9.482 1.00 0.00 H new ATOM 0 HB ILE A 32 -3.723 -5.306 -6.668 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -4.978 -6.366 -9.214 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -3.391 -6.874 -8.671 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -6.160 -5.043 -6.903 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -5.321 -3.475 -6.967 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -5.919 -4.226 -8.466 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -5.109 -8.467 -7.969 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -4.363 -7.690 -6.553 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -5.974 -7.174 -7.105 1.00 0.00 H new ATOM 486 N LYS A 33 -3.121 -1.855 -8.608 1.00 0.00 N ATOM 487 CA LYS A 33 -3.005 -0.495 -8.094 1.00 0.00 C ATOM 488 C LYS A 33 -4.360 0.028 -7.628 1.00 0.00 C ATOM 489 O LYS A 33 -5.246 0.294 -8.441 1.00 0.00 O ATOM 490 CB LYS A 33 -2.430 0.431 -9.168 1.00 0.00 C ATOM 491 CG LYS A 33 -0.915 0.390 -9.259 1.00 0.00 C ATOM 492 CD LYS A 33 -0.375 1.544 -10.087 1.00 0.00 C ATOM 493 CE LYS A 33 -0.379 1.215 -11.572 1.00 0.00 C ATOM 494 NZ LYS A 33 -1.678 1.562 -12.213 1.00 0.00 N ATOM 0 H LYS A 33 -3.272 -1.913 -9.615 1.00 0.00 H new ATOM 0 HA LYS A 33 -2.329 -0.513 -7.239 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -2.851 0.157 -10.135 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -2.746 1.454 -8.961 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -0.488 0.429 -8.257 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -0.602 -0.555 -9.702 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -0.978 2.434 -9.909 1.00 0.00 H new ATOM 0 HD3 LYS A 33 0.641 1.778 -9.768 1.00 0.00 H new ATOM 0 HE2 LYS A 33 0.427 1.758 -12.067 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -0.179 0.152 -11.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -1.519 1.798 -13.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -2.325 0.751 -12.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -2.098 2.380 -11.726 1.00 0.00 H new ATOM 508 N SER A 34 -4.513 0.176 -6.316 1.00 0.00 N ATOM 509 CA SER A 34 -5.761 0.666 -5.743 1.00 0.00 C ATOM 510 C SER A 34 -5.940 2.154 -6.023 1.00 0.00 C ATOM 511 O SER A 34 -4.970 2.874 -6.261 1.00 0.00 O ATOM 512 CB SER A 34 -5.788 0.413 -4.234 1.00 0.00 C ATOM 513 OG SER A 34 -4.840 1.225 -3.564 1.00 0.00 O ATOM 0 H SER A 34 -3.789 -0.036 -5.630 1.00 0.00 H new ATOM 0 HA SER A 34 -6.584 0.125 -6.210 1.00 0.00 H new ATOM 0 HB2 SER A 34 -6.786 0.617 -3.846 1.00 0.00 H new ATOM 0 HB3 SER A 34 -5.577 -0.638 -4.034 1.00 0.00 H new ATOM 0 HG SER A 34 -5.080 1.294 -2.616 1.00 0.00 H new ATOM 519 N SER A 35 -7.189 2.610 -5.993 1.00 0.00 N ATOM 520 CA SER A 35 -7.498 4.012 -6.248 1.00 0.00 C ATOM 521 C SER A 35 -6.667 4.923 -5.350 1.00 0.00 C ATOM 522 O SER A 35 -5.797 4.461 -4.611 1.00 0.00 O ATOM 523 CB SER A 35 -8.988 4.277 -6.024 1.00 0.00 C ATOM 524 OG SER A 35 -9.447 5.334 -6.848 1.00 0.00 O ATOM 0 H SER A 35 -8.003 2.028 -5.795 1.00 0.00 H new ATOM 0 HA SER A 35 -7.250 4.230 -7.287 1.00 0.00 H new ATOM 0 HB2 SER A 35 -9.558 3.372 -6.237 1.00 0.00 H new ATOM 0 HB3 SER A 35 -9.163 4.525 -4.977 1.00 0.00 H new ATOM 0 HG SER A 35 -10.402 5.483 -6.687 1.00 0.00 H new ATOM 530 N THR A 36 -6.941 6.222 -5.419 1.00 0.00 N ATOM 531 CA THR A 36 -6.220 7.199 -4.614 1.00 0.00 C ATOM 532 C THR A 36 -7.013 7.580 -3.369 1.00 0.00 C ATOM 533 O THR A 36 -8.179 7.965 -3.458 1.00 0.00 O ATOM 534 CB THR A 36 -5.911 8.474 -5.421 1.00 0.00 C ATOM 535 OG1 THR A 36 -7.126 9.166 -5.729 1.00 0.00 O ATOM 536 CG2 THR A 36 -5.175 8.134 -6.709 1.00 0.00 C ATOM 0 H THR A 36 -7.658 6.622 -6.025 1.00 0.00 H new ATOM 0 HA THR A 36 -5.282 6.730 -4.315 1.00 0.00 H new ATOM 0 HB THR A 36 -5.272 9.115 -4.814 1.00 0.00 H new ATOM 0 HG1 THR A 36 -7.800 8.963 -5.047 1.00 0.00 H new ATOM 0 HG21 THR A 36 -4.968 9.050 -7.262 1.00 0.00 H new ATOM 0 HG22 THR A 36 -4.236 7.634 -6.471 1.00 0.00 H new ATOM 0 HG23 THR A 36 -5.793 7.474 -7.318 1.00 0.00 H new ATOM 544 N PHE A 37 -6.374 7.471 -2.209 1.00 0.00 N ATOM 545 CA PHE A 37 -7.021 7.804 -0.945 1.00 0.00 C ATOM 546 C PHE A 37 -6.207 8.838 -0.173 1.00 0.00 C ATOM 547 O PHE A 37 -4.985 8.904 -0.302 1.00 0.00 O ATOM 548 CB PHE A 37 -7.205 6.545 -0.095 1.00 0.00 C ATOM 549 CG PHE A 37 -5.930 5.785 0.134 1.00 0.00 C ATOM 550 CD1 PHE A 37 -5.496 4.842 -0.783 1.00 0.00 C ATOM 551 CD2 PHE A 37 -5.166 6.013 1.267 1.00 0.00 C ATOM 552 CE1 PHE A 37 -4.323 4.141 -0.576 1.00 0.00 C ATOM 553 CE2 PHE A 37 -3.993 5.315 1.480 1.00 0.00 C ATOM 554 CZ PHE A 37 -3.571 4.377 0.558 1.00 0.00 C ATOM 0 H PHE A 37 -5.409 7.155 -2.118 1.00 0.00 H new ATOM 0 HA PHE A 37 -7.999 8.230 -1.167 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -7.629 6.826 0.869 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -7.927 5.890 -0.582 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -6.081 4.652 -1.671 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -5.491 6.745 1.992 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -3.995 3.410 -1.300 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -3.406 5.503 2.367 1.00 0.00 H new ATOM 0 HZ PHE A 37 -2.655 3.829 0.724 1.00 0.00 H new ATOM 564 N SER A 38 -6.895 9.645 0.629 1.00 0.00 N ATOM 565 CA SER A 38 -6.237 10.680 1.418 1.00 0.00 C ATOM 566 C SER A 38 -6.728 10.654 2.863 1.00 0.00 C ATOM 567 O SER A 38 -7.550 9.817 3.236 1.00 0.00 O ATOM 568 CB SER A 38 -6.492 12.058 0.806 1.00 0.00 C ATOM 569 OG SER A 38 -7.869 12.391 0.855 1.00 0.00 O ATOM 0 H SER A 38 -7.907 9.602 0.749 1.00 0.00 H new ATOM 0 HA SER A 38 -5.165 10.481 1.412 1.00 0.00 H new ATOM 0 HB2 SER A 38 -5.913 12.810 1.342 1.00 0.00 H new ATOM 0 HB3 SER A 38 -6.148 12.069 -0.228 1.00 0.00 H new ATOM 0 HG SER A 38 -8.019 13.060 1.555 1.00 0.00 H new ATOM 575 N SER A 39 -6.217 11.578 3.671 1.00 0.00 N ATOM 576 CA SER A 39 -6.599 11.660 5.076 1.00 0.00 C ATOM 577 C SER A 39 -8.017 12.204 5.222 1.00 0.00 C ATOM 578 O SER A 39 -8.851 11.618 5.911 1.00 0.00 O ATOM 579 CB SER A 39 -5.618 12.549 5.842 1.00 0.00 C ATOM 580 OG SER A 39 -5.715 12.331 7.239 1.00 0.00 O ATOM 0 H SER A 39 -5.538 12.280 3.377 1.00 0.00 H new ATOM 0 HA SER A 39 -6.569 10.654 5.495 1.00 0.00 H new ATOM 0 HB2 SER A 39 -4.601 12.344 5.509 1.00 0.00 H new ATOM 0 HB3 SER A 39 -5.822 13.596 5.619 1.00 0.00 H new ATOM 0 HG SER A 39 -5.077 12.910 7.706 1.00 0.00 H new ATOM 586 N GLY A 40 -8.282 13.331 4.568 1.00 0.00 N ATOM 587 CA GLY A 40 -9.599 13.937 4.637 1.00 0.00 C ATOM 588 C GLY A 40 -9.995 14.615 3.341 1.00 0.00 C ATOM 589 O GLY A 40 -9.836 14.046 2.261 1.00 0.00 O ATOM 0 H GLY A 40 -7.608 13.835 3.992 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -10.335 13.171 4.882 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -9.617 14.668 5.446 1.00 0.00 H new ATOM 593 N ALA A 41 -10.513 15.834 3.447 1.00 0.00 N ATOM 594 CA ALA A 41 -10.932 16.591 2.273 1.00 0.00 C ATOM 595 C ALA A 41 -9.943 16.416 1.126 1.00 0.00 C ATOM 596 O ALA A 41 -8.766 16.136 1.346 1.00 0.00 O ATOM 597 CB ALA A 41 -11.084 18.064 2.622 1.00 0.00 C ATOM 0 H ALA A 41 -10.653 16.319 4.333 1.00 0.00 H new ATOM 0 HA ALA A 41 -11.898 16.205 1.947 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -11.397 18.617 1.737 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -11.834 18.177 3.405 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -10.130 18.455 2.975 1.00 0.00 H new ATOM 603 N ASN A 42 -10.430 16.583 -0.100 1.00 0.00 N ATOM 604 CA ASN A 42 -9.589 16.442 -1.282 1.00 0.00 C ATOM 605 C ASN A 42 -8.222 17.081 -1.057 1.00 0.00 C ATOM 606 O ASN A 42 -8.050 18.286 -1.240 1.00 0.00 O ATOM 607 CB ASN A 42 -10.268 17.080 -2.496 1.00 0.00 C ATOM 608 CG ASN A 42 -11.512 16.326 -2.925 1.00 0.00 C ATOM 609 OD1 ASN A 42 -11.517 15.096 -2.981 1.00 0.00 O ATOM 610 ND2 ASN A 42 -12.574 17.062 -3.231 1.00 0.00 N ATOM 0 H ASN A 42 -11.403 16.816 -0.300 1.00 0.00 H new ATOM 0 HA ASN A 42 -9.447 15.378 -1.470 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -10.534 18.110 -2.260 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -9.563 17.115 -3.327 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -13.439 16.610 -3.527 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -12.524 18.079 -3.170 1.00 0.00 H new ATOM 617 N ASP A 43 -7.252 16.265 -0.658 1.00 0.00 N ATOM 618 CA ASP A 43 -5.900 16.750 -0.408 1.00 0.00 C ATOM 619 C ASP A 43 -5.008 16.522 -1.625 1.00 0.00 C ATOM 620 O ASP A 43 -4.957 15.421 -2.174 1.00 0.00 O ATOM 621 CB ASP A 43 -5.303 16.052 0.815 1.00 0.00 C ATOM 622 CG ASP A 43 -6.092 16.325 2.080 1.00 0.00 C ATOM 623 OD1 ASP A 43 -6.167 17.503 2.489 1.00 0.00 O ATOM 624 OD2 ASP A 43 -6.634 15.362 2.661 1.00 0.00 O ATOM 0 H ASP A 43 -7.377 15.265 -0.501 1.00 0.00 H new ATOM 0 HA ASP A 43 -5.954 17.821 -0.215 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -5.270 14.977 0.636 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -4.274 16.384 0.953 1.00 0.00 H new ATOM 629 N LYS A 44 -4.307 17.570 -2.043 1.00 0.00 N ATOM 630 CA LYS A 44 -3.416 17.486 -3.194 1.00 0.00 C ATOM 631 C LYS A 44 -2.591 16.204 -3.152 1.00 0.00 C ATOM 632 O LYS A 44 -2.449 15.511 -4.160 1.00 0.00 O ATOM 633 CB LYS A 44 -2.487 18.702 -3.237 1.00 0.00 C ATOM 634 CG LYS A 44 -3.213 20.013 -3.483 1.00 0.00 C ATOM 635 CD LYS A 44 -3.710 20.116 -4.915 1.00 0.00 C ATOM 636 CE LYS A 44 -4.617 21.321 -5.105 1.00 0.00 C ATOM 637 NZ LYS A 44 -5.318 21.286 -6.419 1.00 0.00 N ATOM 0 H LYS A 44 -4.339 18.489 -1.601 1.00 0.00 H new ATOM 0 HA LYS A 44 -4.029 17.473 -4.095 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -1.945 18.768 -2.294 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -1.745 18.554 -4.022 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -4.056 20.097 -2.798 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -2.544 20.846 -3.269 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -2.859 20.190 -5.592 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -4.250 19.207 -5.180 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -5.353 21.352 -4.302 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -4.027 22.235 -5.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -5.927 22.124 -6.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -4.616 21.282 -7.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -5.901 20.427 -6.479 1.00 0.00 H new ATOM 651 N LEU A 45 -2.051 15.892 -1.979 1.00 0.00 N ATOM 652 CA LEU A 45 -1.241 14.692 -1.804 1.00 0.00 C ATOM 653 C LEU A 45 -2.116 13.442 -1.785 1.00 0.00 C ATOM 654 O LEU A 45 -3.060 13.344 -1.001 1.00 0.00 O ATOM 655 CB LEU A 45 -0.433 14.782 -0.509 1.00 0.00 C ATOM 656 CG LEU A 45 0.398 13.549 -0.149 1.00 0.00 C ATOM 657 CD1 LEU A 45 1.341 13.191 -1.286 1.00 0.00 C ATOM 658 CD2 LEU A 45 1.176 13.787 1.137 1.00 0.00 C ATOM 0 H LEU A 45 -2.160 16.454 -1.135 1.00 0.00 H new ATOM 0 HA LEU A 45 -0.555 14.621 -2.648 1.00 0.00 H new ATOM 0 HB2 LEU A 45 0.237 15.639 -0.581 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -1.121 14.984 0.312 1.00 0.00 H new ATOM 0 HG LEU A 45 -0.281 12.711 0.010 1.00 0.00 H new ATOM 0 HD11 LEU A 45 1.924 12.312 -1.012 1.00 0.00 H new ATOM 0 HD12 LEU A 45 0.763 12.977 -2.185 1.00 0.00 H new ATOM 0 HD13 LEU A 45 2.014 14.027 -1.478 1.00 0.00 H new ATOM 0 HD21 LEU A 45 1.761 12.900 1.378 1.00 0.00 H new ATOM 0 HD22 LEU A 45 1.844 14.638 1.006 1.00 0.00 H new ATOM 0 HD23 LEU A 45 0.480 13.994 1.950 1.00 0.00 H new ATOM 670 N LYS A 46 -1.796 12.488 -2.652 1.00 0.00 N ATOM 671 CA LYS A 46 -2.550 11.243 -2.734 1.00 0.00 C ATOM 672 C LYS A 46 -1.645 10.042 -2.479 1.00 0.00 C ATOM 673 O LYS A 46 -0.421 10.171 -2.447 1.00 0.00 O ATOM 674 CB LYS A 46 -3.213 11.113 -4.107 1.00 0.00 C ATOM 675 CG LYS A 46 -4.248 12.189 -4.386 1.00 0.00 C ATOM 676 CD LYS A 46 -5.486 12.008 -3.524 1.00 0.00 C ATOM 677 CE LYS A 46 -6.578 12.998 -3.902 1.00 0.00 C ATOM 678 NZ LYS A 46 -7.812 12.798 -3.093 1.00 0.00 N ATOM 0 H LYS A 46 -1.018 12.553 -3.309 1.00 0.00 H new ATOM 0 HA LYS A 46 -3.323 11.264 -1.965 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -2.444 11.152 -4.878 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -3.689 10.135 -4.181 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -3.813 13.171 -4.198 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -4.529 12.161 -5.439 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -5.862 10.991 -3.634 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -5.222 12.139 -2.474 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -6.211 14.015 -3.760 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -6.816 12.890 -4.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -8.532 13.491 -3.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -8.176 11.836 -3.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -7.591 12.926 -2.085 1.00 0.00 H new ATOM 692 N TRP A 47 -2.254 8.875 -2.301 1.00 0.00 N ATOM 693 CA TRP A 47 -1.503 7.651 -2.051 1.00 0.00 C ATOM 694 C TRP A 47 -2.239 6.437 -2.607 1.00 0.00 C ATOM 695 O TRP A 47 -3.470 6.402 -2.627 1.00 0.00 O ATOM 696 CB TRP A 47 -1.262 7.473 -0.551 1.00 0.00 C ATOM 697 CG TRP A 47 -0.645 8.675 0.098 1.00 0.00 C ATOM 698 CD1 TRP A 47 -1.296 9.788 0.549 1.00 0.00 C ATOM 699 CD2 TRP A 47 0.746 8.886 0.366 1.00 0.00 C ATOM 700 NE1 TRP A 47 -0.394 10.677 1.082 1.00 0.00 N ATOM 701 CE2 TRP A 47 0.865 10.147 0.982 1.00 0.00 C ATOM 702 CE3 TRP A 47 1.901 8.131 0.148 1.00 0.00 C ATOM 703 CZ2 TRP A 47 2.093 10.668 1.380 1.00 0.00 C ATOM 704 CZ3 TRP A 47 3.120 8.650 0.543 1.00 0.00 C ATOM 705 CH2 TRP A 47 3.208 9.908 1.154 1.00 0.00 C ATOM 0 H TRP A 47 -3.266 8.751 -2.325 1.00 0.00 H new ATOM 0 HA TRP A 47 -0.542 7.734 -2.559 1.00 0.00 H new ATOM 0 HB2 TRP A 47 -2.210 7.251 -0.062 1.00 0.00 H new ATOM 0 HB3 TRP A 47 -0.613 6.611 -0.394 1.00 0.00 H new ATOM 0 HD1 TRP A 47 -2.363 9.946 0.495 1.00 0.00 H new ATOM 0 HE1 TRP A 47 -0.625 11.585 1.487 1.00 0.00 H new ATOM 0 HE3 TRP A 47 1.843 7.160 -0.321 1.00 0.00 H new ATOM 0 HZ2 TRP A 47 2.163 11.638 1.850 1.00 0.00 H new ATOM 0 HZ3 TRP A 47 4.020 8.076 0.378 1.00 0.00 H new ATOM 0 HH2 TRP A 47 4.175 10.285 1.452 1.00 0.00 H new ATOM 716 N CYS A 48 -1.479 5.445 -3.056 1.00 0.00 N ATOM 717 CA CYS A 48 -2.060 4.228 -3.614 1.00 0.00 C ATOM 718 C CYS A 48 -1.316 2.993 -3.118 1.00 0.00 C ATOM 719 O CYS A 48 -0.135 3.063 -2.775 1.00 0.00 O ATOM 720 CB CYS A 48 -2.030 4.278 -5.142 1.00 0.00 C ATOM 721 SG CYS A 48 -0.492 3.666 -5.870 1.00 0.00 S ATOM 0 H CYS A 48 -0.459 5.459 -3.045 1.00 0.00 H new ATOM 0 HA CYS A 48 -3.096 4.163 -3.280 1.00 0.00 H new ATOM 0 HB2 CYS A 48 -2.862 3.691 -5.531 1.00 0.00 H new ATOM 0 HB3 CYS A 48 -2.188 5.307 -5.464 1.00 0.00 H new ATOM 0 HG CYS A 48 0.470 4.504 -5.620 1.00 0.00 H new ATOM 727 N LEU A 49 -2.013 1.863 -3.081 1.00 0.00 N ATOM 728 CA LEU A 49 -1.419 0.611 -2.626 1.00 0.00 C ATOM 729 C LEU A 49 -1.258 -0.368 -3.784 1.00 0.00 C ATOM 730 O LEU A 49 -2.164 -0.533 -4.601 1.00 0.00 O ATOM 731 CB LEU A 49 -2.281 -0.015 -1.528 1.00 0.00 C ATOM 732 CG LEU A 49 -2.145 0.600 -0.135 1.00 0.00 C ATOM 733 CD1 LEU A 49 -3.067 -0.101 0.850 1.00 0.00 C ATOM 734 CD2 LEU A 49 -0.701 0.529 0.341 1.00 0.00 C ATOM 0 H LEU A 49 -2.991 1.788 -3.361 1.00 0.00 H new ATOM 0 HA LEU A 49 -0.431 0.831 -2.222 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -3.326 0.051 -1.832 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -2.035 -1.075 -1.461 1.00 0.00 H new ATOM 0 HG LEU A 49 -2.437 1.649 -0.192 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -2.957 0.350 1.836 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -4.100 0.002 0.518 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -2.806 -1.158 0.903 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -0.623 0.971 1.334 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -0.382 -0.513 0.382 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -0.062 1.077 -0.351 1.00 0.00 H new ATOM 746 N ARG A 50 -0.101 -1.018 -3.846 1.00 0.00 N ATOM 747 CA ARG A 50 0.178 -1.983 -4.903 1.00 0.00 C ATOM 748 C ARG A 50 0.244 -3.400 -4.342 1.00 0.00 C ATOM 749 O ARG A 50 1.209 -3.770 -3.674 1.00 0.00 O ATOM 750 CB ARG A 50 1.494 -1.638 -5.603 1.00 0.00 C ATOM 751 CG ARG A 50 1.341 -0.620 -6.721 1.00 0.00 C ATOM 752 CD ARG A 50 2.692 -0.158 -7.244 1.00 0.00 C ATOM 753 NE ARG A 50 3.537 -1.280 -7.643 1.00 0.00 N ATOM 754 CZ ARG A 50 4.640 -1.147 -8.371 1.00 0.00 C ATOM 755 NH1 ARG A 50 5.030 0.053 -8.776 1.00 0.00 N ATOM 756 NH2 ARG A 50 5.356 -2.216 -8.694 1.00 0.00 N ATOM 0 H ARG A 50 0.659 -0.894 -3.177 1.00 0.00 H new ATOM 0 HA ARG A 50 -0.635 -1.935 -5.628 1.00 0.00 H new ATOM 0 HB2 ARG A 50 2.198 -1.252 -4.865 1.00 0.00 H new ATOM 0 HB3 ARG A 50 1.929 -2.550 -6.011 1.00 0.00 H new ATOM 0 HG2 ARG A 50 0.765 -1.057 -7.536 1.00 0.00 H new ATOM 0 HG3 ARG A 50 0.777 0.239 -6.357 1.00 0.00 H new ATOM 0 HD2 ARG A 50 2.543 0.505 -8.096 1.00 0.00 H new ATOM 0 HD3 ARG A 50 3.200 0.422 -6.474 1.00 0.00 H new ATOM 0 HE ARG A 50 3.265 -2.217 -7.346 1.00 0.00 H new ATOM 0 HH11 ARG A 50 4.483 0.877 -8.529 1.00 0.00 H new ATOM 0 HH12 ARG A 50 5.877 0.152 -9.335 1.00 0.00 H new ATOM 0 HH21 ARG A 50 5.060 -3.141 -8.383 1.00 0.00 H new ATOM 0 HH22 ARG A 50 6.203 -2.113 -9.253 1.00 0.00 H new ATOM 770 N VAL A 51 -0.790 -4.189 -4.618 1.00 0.00 N ATOM 771 CA VAL A 51 -0.849 -5.566 -4.142 1.00 0.00 C ATOM 772 C VAL A 51 -0.643 -6.552 -5.286 1.00 0.00 C ATOM 773 O VAL A 51 -1.274 -6.441 -6.336 1.00 0.00 O ATOM 774 CB VAL A 51 -2.196 -5.865 -3.457 1.00 0.00 C ATOM 775 CG1 VAL A 51 -2.318 -7.348 -3.143 1.00 0.00 C ATOM 776 CG2 VAL A 51 -2.349 -5.029 -2.195 1.00 0.00 C ATOM 0 H VAL A 51 -1.598 -3.898 -5.169 1.00 0.00 H new ATOM 0 HA VAL A 51 -0.046 -5.685 -3.415 1.00 0.00 H new ATOM 0 HB VAL A 51 -3.000 -5.597 -4.142 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -3.276 -7.540 -2.659 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -2.257 -7.922 -4.068 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -1.509 -7.647 -2.476 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -3.306 -5.253 -1.724 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -1.540 -5.264 -1.503 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -2.310 -3.971 -2.453 1.00 0.00 H new ATOM 786 N ASN A 52 0.245 -7.518 -5.074 1.00 0.00 N ATOM 787 CA ASN A 52 0.535 -8.526 -6.088 1.00 0.00 C ATOM 788 C ASN A 52 0.222 -9.926 -5.569 1.00 0.00 C ATOM 789 O ASN A 52 0.987 -10.517 -4.806 1.00 0.00 O ATOM 790 CB ASN A 52 2.002 -8.443 -6.514 1.00 0.00 C ATOM 791 CG ASN A 52 2.511 -7.015 -6.561 1.00 0.00 C ATOM 792 OD1 ASN A 52 2.274 -6.230 -5.643 1.00 0.00 O ATOM 793 ND2 ASN A 52 3.214 -6.673 -7.634 1.00 0.00 N ATOM 0 H ASN A 52 0.776 -7.624 -4.210 1.00 0.00 H new ATOM 0 HA ASN A 52 -0.099 -8.329 -6.953 1.00 0.00 H new ATOM 0 HB2 ASN A 52 2.612 -9.021 -5.820 1.00 0.00 H new ATOM 0 HB3 ASN A 52 2.118 -8.900 -7.497 1.00 0.00 H new ATOM 0 HD21 ASN A 52 3.582 -5.726 -7.722 1.00 0.00 H new ATOM 0 HD22 ASN A 52 3.386 -7.357 -8.371 1.00 0.00 H new ATOM 800 N PRO A 53 -0.928 -10.471 -5.991 1.00 0.00 N ATOM 801 CA PRO A 53 -1.368 -11.808 -5.582 1.00 0.00 C ATOM 802 C PRO A 53 -0.509 -12.911 -6.190 1.00 0.00 C ATOM 803 O PRO A 53 -0.355 -13.985 -5.607 1.00 0.00 O ATOM 804 CB PRO A 53 -2.800 -11.889 -6.118 1.00 0.00 C ATOM 805 CG PRO A 53 -2.831 -10.937 -7.263 1.00 0.00 C ATOM 806 CD PRO A 53 -1.888 -9.823 -6.901 1.00 0.00 C ATOM 0 HA PRO A 53 -1.293 -11.950 -4.504 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -3.046 -12.901 -6.438 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -3.525 -11.612 -5.353 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -2.521 -11.427 -8.186 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -3.839 -10.557 -7.427 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -1.393 -9.413 -7.782 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -2.409 -8.998 -6.415 1.00 0.00 H new ATOM 814 N LYS A 54 0.051 -12.641 -7.364 1.00 0.00 N ATOM 815 CA LYS A 54 0.897 -13.610 -8.051 1.00 0.00 C ATOM 816 C LYS A 54 2.372 -13.337 -7.774 1.00 0.00 C ATOM 817 O LYS A 54 3.234 -14.157 -8.087 1.00 0.00 O ATOM 818 CB LYS A 54 0.634 -13.569 -9.558 1.00 0.00 C ATOM 819 CG LYS A 54 0.913 -14.887 -10.259 1.00 0.00 C ATOM 820 CD LYS A 54 0.222 -14.957 -11.611 1.00 0.00 C ATOM 821 CE LYS A 54 -0.029 -16.396 -12.035 1.00 0.00 C ATOM 822 NZ LYS A 54 1.235 -17.181 -12.109 1.00 0.00 N ATOM 0 H LYS A 54 -0.066 -11.758 -7.860 1.00 0.00 H new ATOM 0 HA LYS A 54 0.652 -14.602 -7.672 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -0.405 -13.288 -9.730 1.00 0.00 H new ATOM 0 HB3 LYS A 54 1.252 -12.791 -10.005 1.00 0.00 H new ATOM 0 HG2 LYS A 54 1.988 -15.009 -10.392 1.00 0.00 H new ATOM 0 HG3 LYS A 54 0.574 -15.712 -9.633 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -0.725 -14.420 -11.565 1.00 0.00 H new ATOM 0 HD3 LYS A 54 0.836 -14.457 -12.361 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -0.710 -16.870 -11.328 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -0.521 -16.408 -13.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 1.038 -18.119 -12.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 1.920 -16.681 -12.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 1.631 -17.292 -11.154 1.00 0.00 H new ATOM 836 N GLY A 55 2.654 -12.179 -7.184 1.00 0.00 N ATOM 837 CA GLY A 55 4.026 -11.820 -6.874 1.00 0.00 C ATOM 838 C GLY A 55 4.773 -11.289 -8.081 1.00 0.00 C ATOM 839 O GLY A 55 4.370 -11.521 -9.222 1.00 0.00 O ATOM 0 H GLY A 55 1.958 -11.484 -6.915 1.00 0.00 H new ATOM 0 HA2 GLY A 55 4.032 -11.066 -6.086 1.00 0.00 H new ATOM 0 HA3 GLY A 55 4.548 -12.694 -6.483 1.00 0.00 H new ATOM 843 N LEU A 56 5.864 -10.573 -7.832 1.00 0.00 N ATOM 844 CA LEU A 56 6.669 -10.005 -8.907 1.00 0.00 C ATOM 845 C LEU A 56 7.461 -11.093 -9.627 1.00 0.00 C ATOM 846 O LEU A 56 7.371 -11.237 -10.846 1.00 0.00 O ATOM 847 CB LEU A 56 7.624 -8.946 -8.352 1.00 0.00 C ATOM 848 CG LEU A 56 6.969 -7.704 -7.747 1.00 0.00 C ATOM 849 CD1 LEU A 56 8.001 -6.859 -7.016 1.00 0.00 C ATOM 850 CD2 LEU A 56 6.276 -6.887 -8.828 1.00 0.00 C ATOM 0 H LEU A 56 6.211 -10.372 -6.894 1.00 0.00 H new ATOM 0 HA LEU A 56 5.995 -9.537 -9.624 1.00 0.00 H new ATOM 0 HB2 LEU A 56 8.248 -9.412 -7.589 1.00 0.00 H new ATOM 0 HB3 LEU A 56 8.288 -8.627 -9.155 1.00 0.00 H new ATOM 0 HG LEU A 56 6.218 -8.027 -7.026 1.00 0.00 H new ATOM 0 HD11 LEU A 56 7.517 -5.979 -6.592 1.00 0.00 H new ATOM 0 HD12 LEU A 56 8.451 -7.446 -6.216 1.00 0.00 H new ATOM 0 HD13 LEU A 56 8.776 -6.545 -7.716 1.00 0.00 H new ATOM 0 HD21 LEU A 56 5.815 -6.007 -8.380 1.00 0.00 H new ATOM 0 HD22 LEU A 56 7.008 -6.574 -9.573 1.00 0.00 H new ATOM 0 HD23 LEU A 56 5.508 -7.494 -9.307 1.00 0.00 H new ATOM 862 N ASP A 57 8.235 -11.857 -8.864 1.00 0.00 N ATOM 863 CA ASP A 57 9.040 -12.934 -9.427 1.00 0.00 C ATOM 864 C ASP A 57 8.767 -14.251 -8.707 1.00 0.00 C ATOM 865 O ASP A 57 8.158 -14.269 -7.638 1.00 0.00 O ATOM 866 CB ASP A 57 10.527 -12.588 -9.338 1.00 0.00 C ATOM 867 CG ASP A 57 10.789 -11.106 -9.523 1.00 0.00 C ATOM 868 OD1 ASP A 57 10.349 -10.549 -10.551 1.00 0.00 O ATOM 869 OD2 ASP A 57 11.433 -10.503 -8.640 1.00 0.00 O ATOM 0 H ASP A 57 8.322 -11.750 -7.853 1.00 0.00 H new ATOM 0 HA ASP A 57 8.764 -13.050 -10.475 1.00 0.00 H new ATOM 0 HB2 ASP A 57 10.913 -12.904 -8.369 1.00 0.00 H new ATOM 0 HB3 ASP A 57 11.073 -13.148 -10.097 1.00 0.00 H new ATOM 874 N GLU A 58 9.221 -15.350 -9.302 1.00 0.00 N ATOM 875 CA GLU A 58 9.024 -16.671 -8.717 1.00 0.00 C ATOM 876 C GLU A 58 9.535 -16.711 -7.280 1.00 0.00 C ATOM 877 O GLU A 58 9.220 -17.630 -6.524 1.00 0.00 O ATOM 878 CB GLU A 58 9.737 -17.735 -9.554 1.00 0.00 C ATOM 879 CG GLU A 58 9.043 -18.039 -10.871 1.00 0.00 C ATOM 880 CD GLU A 58 9.832 -19.000 -11.738 1.00 0.00 C ATOM 881 OE1 GLU A 58 10.891 -18.595 -12.262 1.00 0.00 O ATOM 882 OE2 GLU A 58 9.391 -20.159 -11.892 1.00 0.00 O ATOM 0 H GLU A 58 9.727 -15.352 -10.188 1.00 0.00 H new ATOM 0 HA GLU A 58 7.955 -16.882 -8.710 1.00 0.00 H new ATOM 0 HB2 GLU A 58 10.755 -17.403 -9.758 1.00 0.00 H new ATOM 0 HB3 GLU A 58 9.812 -18.653 -8.972 1.00 0.00 H new ATOM 0 HG2 GLU A 58 8.059 -18.462 -10.670 1.00 0.00 H new ATOM 0 HG3 GLU A 58 8.885 -17.109 -11.417 1.00 0.00 H new ATOM 889 N GLU A 59 10.326 -15.709 -6.910 1.00 0.00 N ATOM 890 CA GLU A 59 10.883 -15.631 -5.565 1.00 0.00 C ATOM 891 C GLU A 59 9.787 -15.358 -4.538 1.00 0.00 C ATOM 892 O GLU A 59 9.769 -15.953 -3.461 1.00 0.00 O ATOM 893 CB GLU A 59 11.949 -14.536 -5.492 1.00 0.00 C ATOM 894 CG GLU A 59 12.419 -14.237 -4.078 1.00 0.00 C ATOM 895 CD GLU A 59 13.521 -15.172 -3.620 1.00 0.00 C ATOM 896 OE1 GLU A 59 13.445 -16.378 -3.932 1.00 0.00 O ATOM 897 OE2 GLU A 59 14.460 -14.696 -2.948 1.00 0.00 O ATOM 0 H GLU A 59 10.596 -14.940 -7.523 1.00 0.00 H new ATOM 0 HA GLU A 59 11.344 -16.592 -5.334 1.00 0.00 H new ATOM 0 HB2 GLU A 59 12.806 -14.835 -6.095 1.00 0.00 H new ATOM 0 HB3 GLU A 59 11.551 -13.623 -5.934 1.00 0.00 H new ATOM 0 HG2 GLU A 59 12.776 -13.208 -4.028 1.00 0.00 H new ATOM 0 HG3 GLU A 59 11.574 -14.315 -3.394 1.00 0.00 H new ATOM 904 N SER A 60 8.876 -14.453 -4.881 1.00 0.00 N ATOM 905 CA SER A 60 7.779 -14.097 -3.988 1.00 0.00 C ATOM 906 C SER A 60 6.432 -14.286 -4.680 1.00 0.00 C ATOM 907 O SER A 60 5.593 -13.385 -4.689 1.00 0.00 O ATOM 908 CB SER A 60 7.925 -12.648 -3.519 1.00 0.00 C ATOM 909 OG SER A 60 7.563 -11.741 -4.545 1.00 0.00 O ATOM 0 H SER A 60 8.876 -13.953 -5.770 1.00 0.00 H new ATOM 0 HA SER A 60 7.819 -14.758 -3.122 1.00 0.00 H new ATOM 0 HB2 SER A 60 7.297 -12.481 -2.644 1.00 0.00 H new ATOM 0 HB3 SER A 60 8.955 -12.464 -3.213 1.00 0.00 H new ATOM 0 HG SER A 60 6.616 -11.859 -4.766 1.00 0.00 H new ATOM 915 N LYS A 61 6.232 -15.466 -5.258 1.00 0.00 N ATOM 916 CA LYS A 61 4.988 -15.776 -5.952 1.00 0.00 C ATOM 917 C LYS A 61 4.008 -16.483 -5.021 1.00 0.00 C ATOM 918 O LYS A 61 2.795 -16.293 -5.121 1.00 0.00 O ATOM 919 CB LYS A 61 5.267 -16.653 -7.175 1.00 0.00 C ATOM 920 CG LYS A 61 5.279 -18.140 -6.868 1.00 0.00 C ATOM 921 CD LYS A 61 5.864 -18.942 -8.018 1.00 0.00 C ATOM 922 CE LYS A 61 4.885 -19.052 -9.177 1.00 0.00 C ATOM 923 NZ LYS A 61 5.199 -20.208 -10.061 1.00 0.00 N ATOM 0 H LYS A 61 6.916 -16.223 -5.259 1.00 0.00 H new ATOM 0 HA LYS A 61 4.540 -14.838 -6.279 1.00 0.00 H new ATOM 0 HB2 LYS A 61 4.511 -16.454 -7.934 1.00 0.00 H new ATOM 0 HB3 LYS A 61 6.230 -16.371 -7.602 1.00 0.00 H new ATOM 0 HG2 LYS A 61 5.861 -18.321 -5.964 1.00 0.00 H new ATOM 0 HG3 LYS A 61 4.263 -18.479 -6.667 1.00 0.00 H new ATOM 0 HD2 LYS A 61 6.784 -18.469 -8.361 1.00 0.00 H new ATOM 0 HD3 LYS A 61 6.129 -19.940 -7.669 1.00 0.00 H new ATOM 0 HE2 LYS A 61 3.872 -19.157 -8.788 1.00 0.00 H new ATOM 0 HE3 LYS A 61 4.908 -18.132 -9.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 4.509 -20.248 -10.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 6.156 -20.096 -10.453 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 5.152 -21.089 -9.510 1.00 0.00 H new ATOM 937 N ASP A 62 4.540 -17.296 -4.116 1.00 0.00 N ATOM 938 CA ASP A 62 3.712 -18.029 -3.165 1.00 0.00 C ATOM 939 C ASP A 62 3.176 -17.098 -2.081 1.00 0.00 C ATOM 940 O ASP A 62 2.169 -17.394 -1.438 1.00 0.00 O ATOM 941 CB ASP A 62 4.513 -19.165 -2.527 1.00 0.00 C ATOM 942 CG ASP A 62 5.839 -18.693 -1.962 1.00 0.00 C ATOM 943 OD1 ASP A 62 6.293 -17.597 -2.353 1.00 0.00 O ATOM 944 OD2 ASP A 62 6.422 -19.419 -1.130 1.00 0.00 O ATOM 0 H ASP A 62 5.541 -17.465 -4.020 1.00 0.00 H new ATOM 0 HA ASP A 62 2.867 -18.451 -3.708 1.00 0.00 H new ATOM 0 HB2 ASP A 62 3.923 -19.619 -1.731 1.00 0.00 H new ATOM 0 HB3 ASP A 62 4.694 -19.941 -3.271 1.00 0.00 H new ATOM 949 N TYR A 63 3.855 -15.974 -1.885 1.00 0.00 N ATOM 950 CA TYR A 63 3.449 -15.002 -0.877 1.00 0.00 C ATOM 951 C TYR A 63 2.816 -13.775 -1.527 1.00 0.00 C ATOM 952 O TYR A 63 2.858 -13.613 -2.748 1.00 0.00 O ATOM 953 CB TYR A 63 4.652 -14.581 -0.031 1.00 0.00 C ATOM 954 CG TYR A 63 5.545 -15.733 0.368 1.00 0.00 C ATOM 955 CD1 TYR A 63 5.164 -16.622 1.365 1.00 0.00 C ATOM 956 CD2 TYR A 63 6.771 -15.935 -0.255 1.00 0.00 C ATOM 957 CE1 TYR A 63 5.977 -17.676 1.733 1.00 0.00 C ATOM 958 CE2 TYR A 63 7.591 -16.987 0.105 1.00 0.00 C ATOM 959 CZ TYR A 63 7.190 -17.854 1.100 1.00 0.00 C ATOM 960 OH TYR A 63 8.002 -18.904 1.462 1.00 0.00 O ATOM 0 H TYR A 63 4.689 -15.713 -2.411 1.00 0.00 H new ATOM 0 HA TYR A 63 2.707 -15.473 -0.233 1.00 0.00 H new ATOM 0 HB2 TYR A 63 5.241 -13.853 -0.589 1.00 0.00 H new ATOM 0 HB3 TYR A 63 4.295 -14.080 0.869 1.00 0.00 H new ATOM 0 HD1 TYR A 63 4.215 -16.486 1.862 1.00 0.00 H new ATOM 0 HD2 TYR A 63 7.088 -15.258 -1.034 1.00 0.00 H new ATOM 0 HE1 TYR A 63 5.665 -18.357 2.511 1.00 0.00 H new ATOM 0 HE2 TYR A 63 8.540 -17.130 -0.390 1.00 0.00 H new ATOM 0 HH TYR A 63 8.818 -18.888 0.920 1.00 0.00 H new ATOM 970 N LEU A 64 2.231 -12.913 -0.703 1.00 0.00 N ATOM 971 CA LEU A 64 1.589 -11.699 -1.196 1.00 0.00 C ATOM 972 C LEU A 64 2.530 -10.504 -1.090 1.00 0.00 C ATOM 973 O LEU A 64 3.061 -10.212 -0.019 1.00 0.00 O ATOM 974 CB LEU A 64 0.305 -11.423 -0.411 1.00 0.00 C ATOM 975 CG LEU A 64 -0.660 -10.414 -1.035 1.00 0.00 C ATOM 976 CD1 LEU A 64 -0.142 -8.996 -0.851 1.00 0.00 C ATOM 977 CD2 LEU A 64 -0.869 -10.720 -2.511 1.00 0.00 C ATOM 0 H LEU A 64 2.188 -13.032 0.309 1.00 0.00 H new ATOM 0 HA LEU A 64 1.340 -11.850 -2.246 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -0.224 -12.366 -0.276 1.00 0.00 H new ATOM 0 HB3 LEU A 64 0.580 -11.067 0.582 1.00 0.00 H new ATOM 0 HG LEU A 64 -1.621 -10.496 -0.527 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -0.842 -8.292 -1.301 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -0.044 -8.780 0.213 1.00 0.00 H new ATOM 0 HD13 LEU A 64 0.831 -8.899 -1.332 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -1.558 -9.992 -2.939 1.00 0.00 H new ATOM 0 HD22 LEU A 64 0.086 -10.665 -3.033 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -1.285 -11.722 -2.620 1.00 0.00 H new ATOM 989 N SER A 65 2.731 -9.815 -2.209 1.00 0.00 N ATOM 990 CA SER A 65 3.610 -8.652 -2.243 1.00 0.00 C ATOM 991 C SER A 65 2.800 -7.359 -2.244 1.00 0.00 C ATOM 992 O SER A 65 2.128 -7.034 -3.224 1.00 0.00 O ATOM 993 CB SER A 65 4.512 -8.703 -3.477 1.00 0.00 C ATOM 994 OG SER A 65 5.749 -8.058 -3.232 1.00 0.00 O ATOM 0 H SER A 65 2.297 -10.042 -3.104 1.00 0.00 H new ATOM 0 HA SER A 65 4.231 -8.671 -1.347 1.00 0.00 H new ATOM 0 HB2 SER A 65 4.689 -9.741 -3.759 1.00 0.00 H new ATOM 0 HB3 SER A 65 4.010 -8.225 -4.318 1.00 0.00 H new ATOM 0 HG SER A 65 6.308 -8.106 -4.036 1.00 0.00 H new ATOM 1000 N LEU A 66 2.868 -6.624 -1.139 1.00 0.00 N ATOM 1001 CA LEU A 66 2.141 -5.366 -1.011 1.00 0.00 C ATOM 1002 C LEU A 66 3.101 -4.204 -0.776 1.00 0.00 C ATOM 1003 O LEU A 66 3.786 -4.148 0.245 1.00 0.00 O ATOM 1004 CB LEU A 66 1.134 -5.450 0.137 1.00 0.00 C ATOM 1005 CG LEU A 66 0.020 -4.403 0.131 1.00 0.00 C ATOM 1006 CD1 LEU A 66 -1.099 -4.809 1.079 1.00 0.00 C ATOM 1007 CD2 LEU A 66 0.571 -3.036 0.507 1.00 0.00 C ATOM 0 H LEU A 66 3.419 -6.878 -0.319 1.00 0.00 H new ATOM 0 HA LEU A 66 1.605 -5.188 -1.943 1.00 0.00 H new ATOM 0 HB2 LEU A 66 0.676 -6.439 0.120 1.00 0.00 H new ATOM 0 HB3 LEU A 66 1.678 -5.367 1.078 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.390 -4.342 -0.877 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -1.883 -4.052 1.062 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -1.513 -5.767 0.764 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -0.704 -4.899 2.091 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -0.236 -2.303 0.498 1.00 0.00 H new ATOM 0 HD22 LEU A 66 1.008 -3.082 1.505 1.00 0.00 H new ATOM 0 HD23 LEU A 66 1.336 -2.742 -0.211 1.00 0.00 H new ATOM 1019 N TYR A 67 3.145 -3.278 -1.727 1.00 0.00 N ATOM 1020 CA TYR A 67 4.021 -2.117 -1.624 1.00 0.00 C ATOM 1021 C TYR A 67 3.218 -0.821 -1.684 1.00 0.00 C ATOM 1022 O TYR A 67 2.186 -0.746 -2.353 1.00 0.00 O ATOM 1023 CB TYR A 67 5.062 -2.137 -2.745 1.00 0.00 C ATOM 1024 CG TYR A 67 6.237 -3.046 -2.463 1.00 0.00 C ATOM 1025 CD1 TYR A 67 6.166 -4.408 -2.731 1.00 0.00 C ATOM 1026 CD2 TYR A 67 7.417 -2.544 -1.930 1.00 0.00 C ATOM 1027 CE1 TYR A 67 7.236 -5.243 -2.475 1.00 0.00 C ATOM 1028 CE2 TYR A 67 8.493 -3.371 -1.672 1.00 0.00 C ATOM 1029 CZ TYR A 67 8.398 -4.719 -1.946 1.00 0.00 C ATOM 1030 OH TYR A 67 9.467 -5.547 -1.689 1.00 0.00 O ATOM 0 H TYR A 67 2.584 -3.309 -2.578 1.00 0.00 H new ATOM 0 HA TYR A 67 4.531 -2.163 -0.662 1.00 0.00 H new ATOM 0 HB2 TYR A 67 4.581 -2.455 -3.670 1.00 0.00 H new ATOM 0 HB3 TYR A 67 5.428 -1.123 -2.908 1.00 0.00 H new ATOM 0 HD1 TYR A 67 5.259 -4.820 -3.147 1.00 0.00 H new ATOM 0 HD2 TYR A 67 7.495 -1.489 -1.713 1.00 0.00 H new ATOM 0 HE1 TYR A 67 7.164 -6.299 -2.687 1.00 0.00 H new ATOM 0 HE2 TYR A 67 9.404 -2.964 -1.258 1.00 0.00 H new ATOM 0 HH TYR A 67 10.207 -5.021 -1.320 1.00 0.00 H new ATOM 1040 N LEU A 68 3.698 0.197 -0.980 1.00 0.00 N ATOM 1041 CA LEU A 68 3.027 1.492 -0.952 1.00 0.00 C ATOM 1042 C LEU A 68 3.662 2.457 -1.948 1.00 0.00 C ATOM 1043 O LEU A 68 4.821 2.846 -1.800 1.00 0.00 O ATOM 1044 CB LEU A 68 3.082 2.087 0.456 1.00 0.00 C ATOM 1045 CG LEU A 68 2.683 3.558 0.580 1.00 0.00 C ATOM 1046 CD1 LEU A 68 1.173 3.712 0.489 1.00 0.00 C ATOM 1047 CD2 LEU A 68 3.203 4.144 1.885 1.00 0.00 C ATOM 0 H LEU A 68 4.550 0.151 -0.421 1.00 0.00 H new ATOM 0 HA LEU A 68 1.986 1.339 -1.235 1.00 0.00 H new ATOM 0 HB2 LEU A 68 2.431 1.499 1.103 1.00 0.00 H new ATOM 0 HB3 LEU A 68 4.097 1.973 0.837 1.00 0.00 H new ATOM 0 HG LEU A 68 3.134 4.107 -0.247 1.00 0.00 H new ATOM 0 HD11 LEU A 68 0.909 4.766 0.579 1.00 0.00 H new ATOM 0 HD12 LEU A 68 0.826 3.332 -0.472 1.00 0.00 H new ATOM 0 HD13 LEU A 68 0.701 3.149 1.294 1.00 0.00 H new ATOM 0 HD21 LEU A 68 2.910 5.191 1.956 1.00 0.00 H new ATOM 0 HD22 LEU A 68 2.782 3.592 2.725 1.00 0.00 H new ATOM 0 HD23 LEU A 68 4.290 4.069 1.910 1.00 0.00 H new ATOM 1059 N LEU A 69 2.895 2.840 -2.963 1.00 0.00 N ATOM 1060 CA LEU A 69 3.381 3.762 -3.984 1.00 0.00 C ATOM 1061 C LEU A 69 2.739 5.136 -3.828 1.00 0.00 C ATOM 1062 O LEU A 69 1.590 5.251 -3.398 1.00 0.00 O ATOM 1063 CB LEU A 69 3.092 3.206 -5.380 1.00 0.00 C ATOM 1064 CG LEU A 69 3.592 4.049 -6.554 1.00 0.00 C ATOM 1065 CD1 LEU A 69 5.020 3.670 -6.913 1.00 0.00 C ATOM 1066 CD2 LEU A 69 2.675 3.883 -7.758 1.00 0.00 C ATOM 0 H LEU A 69 1.934 2.526 -3.101 1.00 0.00 H new ATOM 0 HA LEU A 69 4.458 3.869 -3.858 1.00 0.00 H new ATOM 0 HB2 LEU A 69 3.539 2.214 -5.454 1.00 0.00 H new ATOM 0 HB3 LEU A 69 2.014 3.079 -5.483 1.00 0.00 H new ATOM 0 HG LEU A 69 3.580 5.097 -6.255 1.00 0.00 H new ATOM 0 HD11 LEU A 69 5.359 4.280 -7.750 1.00 0.00 H new ATOM 0 HD12 LEU A 69 5.669 3.841 -6.054 1.00 0.00 H new ATOM 0 HD13 LEU A 69 5.058 2.617 -7.193 1.00 0.00 H new ATOM 0 HD21 LEU A 69 3.046 4.490 -8.584 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.654 2.835 -8.058 1.00 0.00 H new ATOM 0 HD23 LEU A 69 1.667 4.205 -7.495 1.00 0.00 H new ATOM 1078 N LEU A 70 3.486 6.176 -4.181 1.00 0.00 N ATOM 1079 CA LEU A 70 2.988 7.544 -4.083 1.00 0.00 C ATOM 1080 C LEU A 70 2.438 8.021 -5.423 1.00 0.00 C ATOM 1081 O LEU A 70 3.160 8.607 -6.229 1.00 0.00 O ATOM 1082 CB LEU A 70 4.103 8.480 -3.614 1.00 0.00 C ATOM 1083 CG LEU A 70 3.771 9.973 -3.615 1.00 0.00 C ATOM 1084 CD1 LEU A 70 2.521 10.242 -2.791 1.00 0.00 C ATOM 1085 CD2 LEU A 70 4.946 10.781 -3.084 1.00 0.00 C ATOM 0 H LEU A 70 4.438 6.099 -4.538 1.00 0.00 H new ATOM 0 HA LEU A 70 2.178 7.559 -3.354 1.00 0.00 H new ATOM 0 HB2 LEU A 70 4.390 8.193 -2.602 1.00 0.00 H new ATOM 0 HB3 LEU A 70 4.974 8.322 -4.249 1.00 0.00 H new ATOM 0 HG LEU A 70 3.578 10.282 -4.642 1.00 0.00 H new ATOM 0 HD11 LEU A 70 2.300 11.309 -2.803 1.00 0.00 H new ATOM 0 HD12 LEU A 70 1.680 9.693 -3.215 1.00 0.00 H new ATOM 0 HD13 LEU A 70 2.686 9.917 -1.764 1.00 0.00 H new ATOM 0 HD21 LEU A 70 4.692 11.841 -3.092 1.00 0.00 H new ATOM 0 HD22 LEU A 70 5.171 10.469 -2.064 1.00 0.00 H new ATOM 0 HD23 LEU A 70 5.818 10.612 -3.715 1.00 0.00 H new ATOM 1097 N VAL A 71 1.154 7.768 -5.654 1.00 0.00 N ATOM 1098 CA VAL A 71 0.505 8.174 -6.894 1.00 0.00 C ATOM 1099 C VAL A 71 0.945 9.573 -7.312 1.00 0.00 C ATOM 1100 O VAL A 71 1.598 9.749 -8.341 1.00 0.00 O ATOM 1101 CB VAL A 71 -1.029 8.149 -6.760 1.00 0.00 C ATOM 1102 CG1 VAL A 71 -1.446 8.479 -5.335 1.00 0.00 C ATOM 1103 CG2 VAL A 71 -1.666 9.116 -7.747 1.00 0.00 C ATOM 0 H VAL A 71 0.542 7.283 -4.998 1.00 0.00 H new ATOM 0 HA VAL A 71 0.807 7.457 -7.658 1.00 0.00 H new ATOM 0 HB VAL A 71 -1.380 7.144 -6.993 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -2.533 8.457 -5.260 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -1.020 7.744 -4.652 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -1.084 9.473 -5.071 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -2.750 9.085 -7.638 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -1.310 10.127 -7.548 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -1.395 8.830 -8.763 1.00 0.00 H new ATOM 1113 N SER A 72 0.583 10.567 -6.506 1.00 0.00 N ATOM 1114 CA SER A 72 0.938 11.951 -6.793 1.00 0.00 C ATOM 1115 C SER A 72 1.259 12.708 -5.508 1.00 0.00 C ATOM 1116 O SER A 72 0.651 12.467 -4.464 1.00 0.00 O ATOM 1117 CB SER A 72 -0.204 12.649 -7.536 1.00 0.00 C ATOM 1118 OG SER A 72 -0.170 12.348 -8.921 1.00 0.00 O ATOM 0 H SER A 72 0.044 10.439 -5.649 1.00 0.00 H new ATOM 0 HA SER A 72 1.826 11.948 -7.425 1.00 0.00 H new ATOM 0 HB2 SER A 72 -1.160 12.337 -7.116 1.00 0.00 H new ATOM 0 HB3 SER A 72 -0.130 13.727 -7.393 1.00 0.00 H new ATOM 0 HG SER A 72 0.377 11.548 -9.069 1.00 0.00 H new ATOM 1124 N CYS A 73 2.219 13.622 -5.592 1.00 0.00 N ATOM 1125 CA CYS A 73 2.623 14.414 -4.435 1.00 0.00 C ATOM 1126 C CYS A 73 2.770 15.886 -4.809 1.00 0.00 C ATOM 1127 O CYS A 73 3.212 16.233 -5.904 1.00 0.00 O ATOM 1128 CB CYS A 73 3.941 13.887 -3.865 1.00 0.00 C ATOM 1129 SG CYS A 73 5.320 13.927 -5.034 1.00 0.00 S ATOM 0 H CYS A 73 2.732 13.833 -6.448 1.00 0.00 H new ATOM 0 HA CYS A 73 1.846 14.326 -3.676 1.00 0.00 H new ATOM 0 HB2 CYS A 73 4.206 14.476 -2.987 1.00 0.00 H new ATOM 0 HB3 CYS A 73 3.794 12.861 -3.528 1.00 0.00 H new ATOM 0 HG CYS A 73 6.053 14.976 -4.805 1.00 0.00 H new ATOM 1135 N PRO A 74 2.389 16.773 -3.878 1.00 0.00 N ATOM 1136 CA PRO A 74 2.468 18.222 -4.087 1.00 0.00 C ATOM 1137 C PRO A 74 3.907 18.726 -4.119 1.00 0.00 C ATOM 1138 O PRO A 74 4.299 19.458 -5.028 1.00 0.00 O ATOM 1139 CB PRO A 74 1.728 18.796 -2.876 1.00 0.00 C ATOM 1140 CG PRO A 74 1.853 17.748 -1.824 1.00 0.00 C ATOM 1141 CD PRO A 74 1.853 16.431 -2.550 1.00 0.00 C ATOM 0 HA PRO A 74 2.041 18.519 -5.045 1.00 0.00 H new ATOM 0 HB2 PRO A 74 2.171 19.738 -2.551 1.00 0.00 H new ATOM 0 HB3 PRO A 74 0.683 18.999 -3.110 1.00 0.00 H new ATOM 0 HG2 PRO A 74 2.771 17.878 -1.251 1.00 0.00 H new ATOM 0 HG3 PRO A 74 1.025 17.804 -1.117 1.00 0.00 H new ATOM 0 HD2 PRO A 74 2.475 15.693 -2.044 1.00 0.00 H new ATOM 0 HD3 PRO A 74 0.850 16.010 -2.618 1.00 0.00 H new ATOM 1149 N LYS A 75 4.691 18.329 -3.122 1.00 0.00 N ATOM 1150 CA LYS A 75 6.087 18.739 -3.037 1.00 0.00 C ATOM 1151 C LYS A 75 6.998 17.705 -3.692 1.00 0.00 C ATOM 1152 O LYS A 75 6.588 16.572 -3.942 1.00 0.00 O ATOM 1153 CB LYS A 75 6.493 18.938 -1.575 1.00 0.00 C ATOM 1154 CG LYS A 75 5.966 17.859 -0.645 1.00 0.00 C ATOM 1155 CD LYS A 75 6.497 18.033 0.768 1.00 0.00 C ATOM 1156 CE LYS A 75 5.512 17.510 1.802 1.00 0.00 C ATOM 1157 NZ LYS A 75 4.301 18.371 1.900 1.00 0.00 N ATOM 0 H LYS A 75 4.383 17.723 -2.361 1.00 0.00 H new ATOM 0 HA LYS A 75 6.196 19.684 -3.570 1.00 0.00 H new ATOM 0 HB2 LYS A 75 7.581 18.963 -1.509 1.00 0.00 H new ATOM 0 HB3 LYS A 75 6.130 19.908 -1.235 1.00 0.00 H new ATOM 0 HG2 LYS A 75 4.877 17.889 -0.632 1.00 0.00 H new ATOM 0 HG3 LYS A 75 6.253 16.878 -1.024 1.00 0.00 H new ATOM 0 HD2 LYS A 75 7.446 17.506 0.869 1.00 0.00 H new ATOM 0 HD3 LYS A 75 6.697 19.088 0.955 1.00 0.00 H new ATOM 0 HE2 LYS A 75 5.215 16.494 1.540 1.00 0.00 H new ATOM 0 HE3 LYS A 75 6.000 17.458 2.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 3.817 18.189 2.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 4.582 19.371 1.854 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 3.657 18.155 1.112 1.00 0.00 H new ATOM 1171 N SER A 76 8.237 18.103 -3.965 1.00 0.00 N ATOM 1172 CA SER A 76 9.205 17.212 -4.593 1.00 0.00 C ATOM 1173 C SER A 76 9.191 15.839 -3.927 1.00 0.00 C ATOM 1174 O SER A 76 8.892 14.831 -4.566 1.00 0.00 O ATOM 1175 CB SER A 76 10.609 17.814 -4.516 1.00 0.00 C ATOM 1176 OG SER A 76 11.484 17.186 -5.437 1.00 0.00 O ATOM 0 H SER A 76 8.594 19.037 -3.761 1.00 0.00 H new ATOM 0 HA SER A 76 8.926 17.092 -5.640 1.00 0.00 H new ATOM 0 HB2 SER A 76 10.562 18.883 -4.725 1.00 0.00 H new ATOM 0 HB3 SER A 76 11.000 17.704 -3.505 1.00 0.00 H new ATOM 0 HG SER A 76 12.374 17.590 -5.370 1.00 0.00 H new ATOM 1182 N GLU A 77 9.517 15.810 -2.639 1.00 0.00 N ATOM 1183 CA GLU A 77 9.543 14.561 -1.886 1.00 0.00 C ATOM 1184 C GLU A 77 8.723 14.681 -0.605 1.00 0.00 C ATOM 1185 O GLU A 77 8.479 15.782 -0.111 1.00 0.00 O ATOM 1186 CB GLU A 77 10.984 14.173 -1.549 1.00 0.00 C ATOM 1187 CG GLU A 77 11.576 14.971 -0.399 1.00 0.00 C ATOM 1188 CD GLU A 77 13.056 14.705 -0.204 1.00 0.00 C ATOM 1189 OE1 GLU A 77 13.697 14.204 -1.152 1.00 0.00 O ATOM 1190 OE2 GLU A 77 13.573 14.996 0.894 1.00 0.00 O ATOM 0 H GLU A 77 9.767 16.636 -2.095 1.00 0.00 H new ATOM 0 HA GLU A 77 9.101 13.782 -2.507 1.00 0.00 H new ATOM 0 HB2 GLU A 77 11.017 13.113 -1.299 1.00 0.00 H new ATOM 0 HB3 GLU A 77 11.605 14.311 -2.434 1.00 0.00 H new ATOM 0 HG2 GLU A 77 11.423 16.034 -0.583 1.00 0.00 H new ATOM 0 HG3 GLU A 77 11.043 14.727 0.520 1.00 0.00 H new ATOM 1197 N VAL A 78 8.300 13.540 -0.070 1.00 0.00 N ATOM 1198 CA VAL A 78 7.509 13.516 1.154 1.00 0.00 C ATOM 1199 C VAL A 78 7.880 12.321 2.025 1.00 0.00 C ATOM 1200 O VAL A 78 8.113 11.221 1.522 1.00 0.00 O ATOM 1201 CB VAL A 78 6.001 13.464 0.846 1.00 0.00 C ATOM 1202 CG1 VAL A 78 5.718 12.474 -0.274 1.00 0.00 C ATOM 1203 CG2 VAL A 78 5.214 13.105 2.097 1.00 0.00 C ATOM 0 H VAL A 78 8.492 12.620 -0.466 1.00 0.00 H new ATOM 0 HA VAL A 78 7.731 14.437 1.693 1.00 0.00 H new ATOM 0 HB VAL A 78 5.682 14.452 0.514 1.00 0.00 H new ATOM 0 HG11 VAL A 78 4.647 12.451 -0.477 1.00 0.00 H new ATOM 0 HG12 VAL A 78 6.252 12.780 -1.174 1.00 0.00 H new ATOM 0 HG13 VAL A 78 6.052 11.481 0.026 1.00 0.00 H new ATOM 0 HG21 VAL A 78 4.150 13.073 1.861 1.00 0.00 H new ATOM 0 HG22 VAL A 78 5.535 12.129 2.461 1.00 0.00 H new ATOM 0 HG23 VAL A 78 5.392 13.856 2.867 1.00 0.00 H new ATOM 1213 N ARG A 79 7.933 12.543 3.334 1.00 0.00 N ATOM 1214 CA ARG A 79 8.276 11.485 4.276 1.00 0.00 C ATOM 1215 C ARG A 79 7.042 11.017 5.042 1.00 0.00 C ATOM 1216 O ARG A 79 6.292 11.828 5.584 1.00 0.00 O ATOM 1217 CB ARG A 79 9.344 11.972 5.256 1.00 0.00 C ATOM 1218 CG ARG A 79 10.761 11.870 4.715 1.00 0.00 C ATOM 1219 CD ARG A 79 11.667 12.930 5.321 1.00 0.00 C ATOM 1220 NE ARG A 79 11.989 12.641 6.716 1.00 0.00 N ATOM 1221 CZ ARG A 79 12.711 13.449 7.486 1.00 0.00 C ATOM 1222 NH1 ARG A 79 13.182 14.589 6.999 1.00 0.00 N ATOM 1223 NH2 ARG A 79 12.962 13.117 8.746 1.00 0.00 N ATOM 0 H ARG A 79 7.743 13.447 3.767 1.00 0.00 H new ATOM 0 HA ARG A 79 8.671 10.642 3.709 1.00 0.00 H new ATOM 0 HB2 ARG A 79 9.138 13.010 5.518 1.00 0.00 H new ATOM 0 HB3 ARG A 79 9.273 11.391 6.176 1.00 0.00 H new ATOM 0 HG2 ARG A 79 11.163 10.880 4.930 1.00 0.00 H new ATOM 0 HG3 ARG A 79 10.746 11.979 3.631 1.00 0.00 H new ATOM 0 HD2 ARG A 79 12.588 12.994 4.742 1.00 0.00 H new ATOM 0 HD3 ARG A 79 11.181 13.903 5.255 1.00 0.00 H new ATOM 0 HE ARG A 79 11.641 11.772 7.121 1.00 0.00 H new ATOM 0 HH11 ARG A 79 12.991 14.848 6.031 1.00 0.00 H new ATOM 0 HH12 ARG A 79 13.736 15.207 7.592 1.00 0.00 H new ATOM 0 HH21 ARG A 79 12.601 12.241 9.124 1.00 0.00 H new ATOM 0 HH22 ARG A 79 13.516 13.738 9.336 1.00 0.00 H new ATOM 1237 N ALA A 80 6.839 9.704 5.080 1.00 0.00 N ATOM 1238 CA ALA A 80 5.697 9.129 5.781 1.00 0.00 C ATOM 1239 C ALA A 80 5.921 7.648 6.071 1.00 0.00 C ATOM 1240 O ALA A 80 6.662 6.970 5.359 1.00 0.00 O ATOM 1241 CB ALA A 80 4.426 9.323 4.967 1.00 0.00 C ATOM 0 H ALA A 80 7.450 9.019 4.634 1.00 0.00 H new ATOM 0 HA ALA A 80 5.588 9.647 6.734 1.00 0.00 H new ATOM 0 HB1 ALA A 80 3.581 8.889 5.502 1.00 0.00 H new ATOM 0 HB2 ALA A 80 4.251 10.388 4.815 1.00 0.00 H new ATOM 0 HB3 ALA A 80 4.534 8.831 4.000 1.00 0.00 H new ATOM 1247 N LYS A 81 5.277 7.153 7.122 1.00 0.00 N ATOM 1248 CA LYS A 81 5.404 5.752 7.508 1.00 0.00 C ATOM 1249 C LYS A 81 4.129 4.980 7.183 1.00 0.00 C ATOM 1250 O LYS A 81 3.022 5.462 7.422 1.00 0.00 O ATOM 1251 CB LYS A 81 5.715 5.640 9.002 1.00 0.00 C ATOM 1252 CG LYS A 81 6.934 6.437 9.432 1.00 0.00 C ATOM 1253 CD LYS A 81 6.546 7.806 9.963 1.00 0.00 C ATOM 1254 CE LYS A 81 7.555 8.316 10.980 1.00 0.00 C ATOM 1255 NZ LYS A 81 6.925 9.222 11.980 1.00 0.00 N ATOM 0 H LYS A 81 4.661 7.701 7.723 1.00 0.00 H new ATOM 0 HA LYS A 81 6.225 5.317 6.939 1.00 0.00 H new ATOM 0 HB2 LYS A 81 4.850 5.980 9.571 1.00 0.00 H new ATOM 0 HB3 LYS A 81 5.870 4.591 9.254 1.00 0.00 H new ATOM 0 HG2 LYS A 81 7.476 5.888 10.202 1.00 0.00 H new ATOM 0 HG3 LYS A 81 7.611 6.553 8.586 1.00 0.00 H new ATOM 0 HD2 LYS A 81 6.474 8.511 9.135 1.00 0.00 H new ATOM 0 HD3 LYS A 81 5.559 7.753 10.423 1.00 0.00 H new ATOM 0 HE2 LYS A 81 8.012 7.470 11.494 1.00 0.00 H new ATOM 0 HE3 LYS A 81 8.355 8.846 10.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 7.604 9.959 12.257 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 6.083 9.667 11.563 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 6.647 8.674 12.819 1.00 0.00 H new ATOM 1269 N PHE A 82 4.293 3.779 6.638 1.00 0.00 N ATOM 1270 CA PHE A 82 3.155 2.940 6.281 1.00 0.00 C ATOM 1271 C PHE A 82 3.143 1.659 7.110 1.00 0.00 C ATOM 1272 O PHE A 82 4.166 1.251 7.659 1.00 0.00 O ATOM 1273 CB PHE A 82 3.195 2.597 4.791 1.00 0.00 C ATOM 1274 CG PHE A 82 4.498 1.995 4.349 1.00 0.00 C ATOM 1275 CD1 PHE A 82 5.575 2.805 4.023 1.00 0.00 C ATOM 1276 CD2 PHE A 82 4.647 0.621 4.261 1.00 0.00 C ATOM 1277 CE1 PHE A 82 6.775 2.254 3.615 1.00 0.00 C ATOM 1278 CE2 PHE A 82 5.845 0.064 3.854 1.00 0.00 C ATOM 1279 CZ PHE A 82 6.911 0.881 3.532 1.00 0.00 C ATOM 0 H PHE A 82 5.203 3.365 6.434 1.00 0.00 H new ATOM 0 HA PHE A 82 2.243 3.498 6.493 1.00 0.00 H new ATOM 0 HB2 PHE A 82 2.387 1.901 4.565 1.00 0.00 H new ATOM 0 HB3 PHE A 82 3.007 3.502 4.213 1.00 0.00 H new ATOM 0 HD1 PHE A 82 5.475 3.878 4.089 1.00 0.00 H new ATOM 0 HD2 PHE A 82 3.818 -0.023 4.513 1.00 0.00 H new ATOM 0 HE1 PHE A 82 7.606 2.896 3.361 1.00 0.00 H new ATOM 0 HE2 PHE A 82 5.947 -1.009 3.788 1.00 0.00 H new ATOM 0 HZ PHE A 82 7.849 0.448 3.216 1.00 0.00 H new ATOM 1289 N LYS A 83 1.976 1.028 7.196 1.00 0.00 N ATOM 1290 CA LYS A 83 1.828 -0.207 7.956 1.00 0.00 C ATOM 1291 C LYS A 83 0.779 -1.114 7.321 1.00 0.00 C ATOM 1292 O LYS A 83 -0.399 -0.763 7.251 1.00 0.00 O ATOM 1293 CB LYS A 83 1.440 0.104 9.403 1.00 0.00 C ATOM 1294 CG LYS A 83 1.403 -1.122 10.300 1.00 0.00 C ATOM 1295 CD LYS A 83 0.032 -1.777 10.291 1.00 0.00 C ATOM 1296 CE LYS A 83 -0.935 -1.060 11.220 1.00 0.00 C ATOM 1297 NZ LYS A 83 -2.351 -1.418 10.931 1.00 0.00 N ATOM 0 H LYS A 83 1.119 1.352 6.748 1.00 0.00 H new ATOM 0 HA LYS A 83 2.786 -0.727 7.947 1.00 0.00 H new ATOM 0 HB2 LYS A 83 2.149 0.823 9.814 1.00 0.00 H new ATOM 0 HB3 LYS A 83 0.460 0.581 9.413 1.00 0.00 H new ATOM 0 HG2 LYS A 83 2.153 -1.840 9.968 1.00 0.00 H new ATOM 0 HG3 LYS A 83 1.664 -0.837 11.319 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -0.367 -1.774 9.277 1.00 0.00 H new ATOM 0 HD3 LYS A 83 0.124 -2.820 10.595 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -0.700 -1.313 12.254 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -0.805 0.017 11.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -2.954 -0.580 11.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -2.430 -1.757 9.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -2.659 -2.168 11.582 1.00 0.00 H new ATOM 1311 N PHE A 84 1.214 -2.282 6.860 1.00 0.00 N ATOM 1312 CA PHE A 84 0.312 -3.240 6.231 1.00 0.00 C ATOM 1313 C PHE A 84 -0.125 -4.311 7.227 1.00 0.00 C ATOM 1314 O PHE A 84 0.705 -4.932 7.891 1.00 0.00 O ATOM 1315 CB PHE A 84 0.989 -3.895 5.026 1.00 0.00 C ATOM 1316 CG PHE A 84 1.581 -2.907 4.061 1.00 0.00 C ATOM 1317 CD1 PHE A 84 0.940 -1.707 3.797 1.00 0.00 C ATOM 1318 CD2 PHE A 84 2.777 -3.179 3.417 1.00 0.00 C ATOM 1319 CE1 PHE A 84 1.482 -0.796 2.910 1.00 0.00 C ATOM 1320 CE2 PHE A 84 3.324 -2.272 2.529 1.00 0.00 C ATOM 1321 CZ PHE A 84 2.675 -1.079 2.275 1.00 0.00 C ATOM 0 H PHE A 84 2.186 -2.588 6.910 1.00 0.00 H new ATOM 0 HA PHE A 84 -0.573 -2.700 5.893 1.00 0.00 H new ATOM 0 HB2 PHE A 84 1.776 -4.562 5.379 1.00 0.00 H new ATOM 0 HB3 PHE A 84 0.260 -4.512 4.501 1.00 0.00 H new ATOM 0 HD1 PHE A 84 0.006 -1.481 4.290 1.00 0.00 H new ATOM 0 HD2 PHE A 84 3.288 -4.111 3.611 1.00 0.00 H new ATOM 0 HE1 PHE A 84 0.973 0.136 2.714 1.00 0.00 H new ATOM 0 HE2 PHE A 84 4.258 -2.496 2.034 1.00 0.00 H new ATOM 0 HZ PHE A 84 3.100 -0.369 1.581 1.00 0.00 H new ATOM 1331 N SER A 85 -1.434 -4.520 7.326 1.00 0.00 N ATOM 1332 CA SER A 85 -1.982 -5.511 8.244 1.00 0.00 C ATOM 1333 C SER A 85 -3.171 -6.233 7.617 1.00 0.00 C ATOM 1334 O SER A 85 -3.695 -5.809 6.586 1.00 0.00 O ATOM 1335 CB SER A 85 -2.408 -4.845 9.553 1.00 0.00 C ATOM 1336 OG SER A 85 -3.526 -3.997 9.354 1.00 0.00 O ATOM 0 H SER A 85 -2.134 -4.016 6.782 1.00 0.00 H new ATOM 0 HA SER A 85 -1.203 -6.244 8.455 1.00 0.00 H new ATOM 0 HB2 SER A 85 -2.654 -5.609 10.290 1.00 0.00 H new ATOM 0 HB3 SER A 85 -1.577 -4.267 9.958 1.00 0.00 H new ATOM 0 HG SER A 85 -3.333 -3.365 8.630 1.00 0.00 H new ATOM 1342 N ILE A 86 -3.591 -7.325 8.246 1.00 0.00 N ATOM 1343 CA ILE A 86 -4.719 -8.105 7.751 1.00 0.00 C ATOM 1344 C ILE A 86 -5.776 -8.292 8.834 1.00 0.00 C ATOM 1345 O ILE A 86 -5.459 -8.635 9.974 1.00 0.00 O ATOM 1346 CB ILE A 86 -4.267 -9.488 7.245 1.00 0.00 C ATOM 1347 CG1 ILE A 86 -3.244 -9.335 6.118 1.00 0.00 C ATOM 1348 CG2 ILE A 86 -5.467 -10.297 6.773 1.00 0.00 C ATOM 1349 CD1 ILE A 86 -2.263 -10.483 6.032 1.00 0.00 C ATOM 0 H ILE A 86 -3.168 -7.690 9.099 1.00 0.00 H new ATOM 0 HA ILE A 86 -5.150 -7.546 6.920 1.00 0.00 H new ATOM 0 HB ILE A 86 -3.794 -10.023 8.068 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -3.772 -9.247 5.169 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -2.692 -8.406 6.263 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -5.132 -11.272 6.418 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -6.163 -10.432 7.601 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -5.966 -9.768 5.961 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -1.568 -10.307 5.211 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -1.708 -10.558 6.967 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -2.805 -11.412 5.856 1.00 0.00 H new ATOM 1361 N LEU A 87 -7.033 -8.067 8.470 1.00 0.00 N ATOM 1362 CA LEU A 87 -8.139 -8.213 9.410 1.00 0.00 C ATOM 1363 C LEU A 87 -8.813 -9.572 9.253 1.00 0.00 C ATOM 1364 O LEU A 87 -9.609 -9.779 8.338 1.00 0.00 O ATOM 1365 CB LEU A 87 -9.163 -7.096 9.200 1.00 0.00 C ATOM 1366 CG LEU A 87 -8.695 -5.682 9.547 1.00 0.00 C ATOM 1367 CD1 LEU A 87 -9.867 -4.831 10.012 1.00 0.00 C ATOM 1368 CD2 LEU A 87 -7.610 -5.726 10.613 1.00 0.00 C ATOM 0 H LEU A 87 -7.312 -7.783 7.531 1.00 0.00 H new ATOM 0 HA LEU A 87 -7.736 -8.143 10.420 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -9.475 -7.108 8.156 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -10.045 -7.322 9.799 1.00 0.00 H new ATOM 0 HG LEU A 87 -8.276 -5.228 8.649 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -9.515 -3.828 10.255 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -10.611 -4.772 9.218 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -10.316 -5.282 10.897 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -7.289 -4.711 10.847 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -8.003 -6.199 11.513 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -6.760 -6.299 10.243 1.00 0.00 H new ATOM 1380 N ASN A 88 -8.489 -10.495 10.153 1.00 0.00 N ATOM 1381 CA ASN A 88 -9.064 -11.835 10.114 1.00 0.00 C ATOM 1382 C ASN A 88 -10.585 -11.777 10.217 1.00 0.00 C ATOM 1383 O ASN A 88 -11.176 -10.697 10.228 1.00 0.00 O ATOM 1384 CB ASN A 88 -8.497 -12.688 11.250 1.00 0.00 C ATOM 1385 CG ASN A 88 -9.176 -12.410 12.577 1.00 0.00 C ATOM 1386 OD1 ASN A 88 -9.797 -13.295 13.167 1.00 0.00 O ATOM 1387 ND2 ASN A 88 -9.062 -11.176 13.053 1.00 0.00 N ATOM 0 H ASN A 88 -7.832 -10.340 10.918 1.00 0.00 H new ATOM 0 HA ASN A 88 -8.799 -12.290 9.160 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -8.612 -13.743 11.000 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -7.428 -12.497 11.345 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -9.499 -10.930 13.941 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -8.538 -10.474 12.530 1.00 0.00 H new ATOM 1394 N ALA A 89 -11.213 -12.946 10.294 1.00 0.00 N ATOM 1395 CA ALA A 89 -12.664 -13.028 10.399 1.00 0.00 C ATOM 1396 C ALA A 89 -13.175 -12.222 11.588 1.00 0.00 C ATOM 1397 O ALA A 89 -14.317 -11.762 11.594 1.00 0.00 O ATOM 1398 CB ALA A 89 -13.103 -14.481 10.516 1.00 0.00 C ATOM 0 H ALA A 89 -10.739 -13.849 10.286 1.00 0.00 H new ATOM 0 HA ALA A 89 -13.094 -12.601 9.493 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -14.189 -14.528 10.594 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -12.778 -15.031 9.633 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -12.656 -14.926 11.405 1.00 0.00 H new ATOM 1404 N LYS A 90 -12.323 -12.054 12.593 1.00 0.00 N ATOM 1405 CA LYS A 90 -12.688 -11.302 13.788 1.00 0.00 C ATOM 1406 C LYS A 90 -12.389 -9.817 13.609 1.00 0.00 C ATOM 1407 O LYS A 90 -12.415 -9.049 14.569 1.00 0.00 O ATOM 1408 CB LYS A 90 -11.933 -11.842 15.005 1.00 0.00 C ATOM 1409 CG LYS A 90 -12.449 -13.183 15.496 1.00 0.00 C ATOM 1410 CD LYS A 90 -11.817 -14.336 14.735 1.00 0.00 C ATOM 1411 CE LYS A 90 -12.611 -15.622 14.911 1.00 0.00 C ATOM 1412 NZ LYS A 90 -11.925 -16.787 14.286 1.00 0.00 N ATOM 0 H LYS A 90 -11.374 -12.429 12.604 1.00 0.00 H new ATOM 0 HA LYS A 90 -13.759 -11.422 13.950 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -10.877 -11.939 14.753 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -12.002 -11.117 15.816 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -12.237 -13.288 16.560 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -13.532 -13.221 15.382 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -11.758 -14.085 13.676 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -10.795 -14.487 15.084 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -12.759 -15.815 15.974 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -13.600 -15.502 14.468 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -12.497 -17.644 14.427 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -11.806 -16.614 13.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -10.992 -16.918 14.726 1.00 0.00 H new ATOM 1426 N GLY A 91 -12.108 -9.420 12.371 1.00 0.00 N ATOM 1427 CA GLY A 91 -11.810 -8.028 12.089 1.00 0.00 C ATOM 1428 C GLY A 91 -10.654 -7.503 12.917 1.00 0.00 C ATOM 1429 O GLY A 91 -10.553 -6.301 13.160 1.00 0.00 O ATOM 0 H GLY A 91 -12.082 -10.037 11.559 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -11.574 -7.917 11.031 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -12.696 -7.423 12.283 1.00 0.00 H new ATOM 1433 N GLU A 92 -9.782 -8.406 13.352 1.00 0.00 N ATOM 1434 CA GLU A 92 -8.628 -8.026 14.160 1.00 0.00 C ATOM 1435 C GLU A 92 -7.344 -8.092 13.339 1.00 0.00 C ATOM 1436 O GLU A 92 -7.158 -9.001 12.531 1.00 0.00 O ATOM 1437 CB GLU A 92 -8.512 -8.938 15.383 1.00 0.00 C ATOM 1438 CG GLU A 92 -9.852 -9.311 15.994 1.00 0.00 C ATOM 1439 CD GLU A 92 -9.712 -9.954 17.360 1.00 0.00 C ATOM 1440 OE1 GLU A 92 -8.928 -9.436 18.182 1.00 0.00 O ATOM 1441 OE2 GLU A 92 -10.387 -10.975 17.606 1.00 0.00 O ATOM 0 H GLU A 92 -9.852 -9.405 13.159 1.00 0.00 H new ATOM 0 HA GLU A 92 -8.773 -6.999 14.494 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -7.986 -9.849 15.098 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -7.903 -8.442 16.139 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -10.470 -8.417 16.079 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -10.374 -9.996 15.326 1.00 0.00 H new ATOM 1448 N GLU A 93 -6.462 -7.121 13.552 1.00 0.00 N ATOM 1449 CA GLU A 93 -5.195 -7.067 12.831 1.00 0.00 C ATOM 1450 C GLU A 93 -4.380 -8.335 13.069 1.00 0.00 C ATOM 1451 O GLU A 93 -4.204 -8.771 14.208 1.00 0.00 O ATOM 1452 CB GLU A 93 -4.388 -5.841 13.262 1.00 0.00 C ATOM 1453 CG GLU A 93 -4.778 -4.568 12.530 1.00 0.00 C ATOM 1454 CD GLU A 93 -4.372 -3.315 13.282 1.00 0.00 C ATOM 1455 OE1 GLU A 93 -3.155 -3.069 13.412 1.00 0.00 O ATOM 1456 OE2 GLU A 93 -5.273 -2.581 13.739 1.00 0.00 O ATOM 0 H GLU A 93 -6.601 -6.361 14.218 1.00 0.00 H new ATOM 0 HA GLU A 93 -5.416 -6.991 11.766 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -4.519 -5.689 14.333 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -3.329 -6.036 13.095 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -4.312 -4.563 11.545 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -5.857 -4.560 12.373 1.00 0.00 H new ATOM 1463 N THR A 94 -3.885 -8.925 11.985 1.00 0.00 N ATOM 1464 CA THR A 94 -3.090 -10.144 12.074 1.00 0.00 C ATOM 1465 C THR A 94 -1.998 -10.167 11.011 1.00 0.00 C ATOM 1466 O THR A 94 -2.182 -9.658 9.905 1.00 0.00 O ATOM 1467 CB THR A 94 -3.968 -11.400 11.919 1.00 0.00 C ATOM 1468 OG1 THR A 94 -3.277 -12.547 12.424 1.00 0.00 O ATOM 1469 CG2 THR A 94 -4.337 -11.626 10.460 1.00 0.00 C ATOM 0 H THR A 94 -4.021 -8.578 11.035 1.00 0.00 H new ATOM 0 HA THR A 94 -2.631 -10.150 13.063 1.00 0.00 H new ATOM 0 HB THR A 94 -4.884 -11.248 12.490 1.00 0.00 H new ATOM 0 HG1 THR A 94 -3.843 -13.341 12.323 1.00 0.00 H new ATOM 0 HG21 THR A 94 -4.957 -12.518 10.376 1.00 0.00 H new ATOM 0 HG22 THR A 94 -4.889 -10.764 10.087 1.00 0.00 H new ATOM 0 HG23 THR A 94 -3.429 -11.758 9.871 1.00 0.00 H new ATOM 1477 N LYS A 95 -0.859 -10.760 11.353 1.00 0.00 N ATOM 1478 CA LYS A 95 0.264 -10.852 10.427 1.00 0.00 C ATOM 1479 C LYS A 95 0.563 -9.495 9.799 1.00 0.00 C ATOM 1480 O LYS A 95 0.729 -9.385 8.584 1.00 0.00 O ATOM 1481 CB LYS A 95 -0.034 -11.878 9.332 1.00 0.00 C ATOM 1482 CG LYS A 95 -0.802 -13.091 9.827 1.00 0.00 C ATOM 1483 CD LYS A 95 0.083 -14.014 10.648 1.00 0.00 C ATOM 1484 CE LYS A 95 -0.411 -15.452 10.597 1.00 0.00 C ATOM 1485 NZ LYS A 95 0.453 -16.364 11.397 1.00 0.00 N ATOM 0 H LYS A 95 -0.689 -11.184 12.265 1.00 0.00 H new ATOM 0 HA LYS A 95 1.141 -11.174 10.989 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -0.606 -11.395 8.539 1.00 0.00 H new ATOM 0 HB3 LYS A 95 0.906 -12.209 8.891 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -1.649 -12.765 10.431 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -1.209 -13.637 8.976 1.00 0.00 H new ATOM 0 HD2 LYS A 95 1.106 -13.966 10.274 1.00 0.00 H new ATOM 0 HD3 LYS A 95 0.105 -13.673 11.683 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -1.433 -15.498 10.972 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -0.436 -15.791 9.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 0.083 -17.334 11.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 1.423 -16.340 11.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 0.457 -16.056 12.390 1.00 0.00 H new ATOM 1499 N ALA A 96 0.632 -8.463 10.634 1.00 0.00 N ATOM 1500 CA ALA A 96 0.915 -7.114 10.160 1.00 0.00 C ATOM 1501 C ALA A 96 2.405 -6.802 10.252 1.00 0.00 C ATOM 1502 O ALA A 96 3.123 -7.387 11.062 1.00 0.00 O ATOM 1503 CB ALA A 96 0.111 -6.096 10.955 1.00 0.00 C ATOM 0 H ALA A 96 0.496 -8.536 11.642 1.00 0.00 H new ATOM 0 HA ALA A 96 0.621 -7.054 9.112 1.00 0.00 H new ATOM 0 HB1 ALA A 96 0.332 -5.093 10.590 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -0.953 -6.299 10.835 1.00 0.00 H new ATOM 0 HB3 ALA A 96 0.377 -6.166 12.010 1.00 0.00 H new ATOM 1509 N MET A 97 2.863 -5.876 9.415 1.00 0.00 N ATOM 1510 CA MET A 97 4.268 -5.486 9.402 1.00 0.00 C ATOM 1511 C MET A 97 4.419 -3.989 9.654 1.00 0.00 C ATOM 1512 O MET A 97 3.896 -3.169 8.901 1.00 0.00 O ATOM 1513 CB MET A 97 4.911 -5.857 8.065 1.00 0.00 C ATOM 1514 CG MET A 97 4.025 -5.568 6.864 1.00 0.00 C ATOM 1515 SD MET A 97 4.887 -5.786 5.296 1.00 0.00 S ATOM 1516 CE MET A 97 5.728 -7.341 5.585 1.00 0.00 C ATOM 0 H MET A 97 2.282 -5.382 8.738 1.00 0.00 H new ATOM 0 HA MET A 97 4.776 -6.025 10.202 1.00 0.00 H new ATOM 0 HB2 MET A 97 5.847 -5.308 7.956 1.00 0.00 H new ATOM 0 HB3 MET A 97 5.163 -6.918 8.074 1.00 0.00 H new ATOM 0 HG2 MET A 97 3.157 -6.226 6.891 1.00 0.00 H new ATOM 0 HG3 MET A 97 3.652 -4.546 6.930 1.00 0.00 H new ATOM 0 HE1 MET A 97 6.067 -7.753 4.635 1.00 0.00 H new ATOM 0 HE2 MET A 97 6.587 -7.175 6.236 1.00 0.00 H new ATOM 0 HE3 MET A 97 5.043 -8.042 6.061 1.00 0.00 H new ATOM 1526 N GLU A 98 5.137 -3.642 10.718 1.00 0.00 N ATOM 1527 CA GLU A 98 5.355 -2.243 11.068 1.00 0.00 C ATOM 1528 C GLU A 98 6.715 -1.763 10.570 1.00 0.00 C ATOM 1529 O GLU A 98 7.567 -2.565 10.187 1.00 0.00 O ATOM 1530 CB GLU A 98 5.258 -2.052 12.583 1.00 0.00 C ATOM 1531 CG GLU A 98 3.893 -2.401 13.154 1.00 0.00 C ATOM 1532 CD GLU A 98 3.832 -2.239 14.660 1.00 0.00 C ATOM 1533 OE1 GLU A 98 3.632 -1.098 15.126 1.00 0.00 O ATOM 1534 OE2 GLU A 98 3.985 -3.253 15.373 1.00 0.00 O ATOM 0 H GLU A 98 5.577 -4.309 11.352 1.00 0.00 H new ATOM 0 HA GLU A 98 4.580 -1.649 10.584 1.00 0.00 H new ATOM 0 HB2 GLU A 98 6.014 -2.670 13.068 1.00 0.00 H new ATOM 0 HB3 GLU A 98 5.490 -1.015 12.826 1.00 0.00 H new ATOM 0 HG2 GLU A 98 3.137 -1.765 12.693 1.00 0.00 H new ATOM 0 HG3 GLU A 98 3.646 -3.430 12.893 1.00 0.00 H new ATOM 1541 N SER A 99 6.912 -0.448 10.579 1.00 0.00 N ATOM 1542 CA SER A 99 8.166 0.140 10.124 1.00 0.00 C ATOM 1543 C SER A 99 8.854 0.895 11.258 1.00 0.00 C ATOM 1544 O SER A 99 8.206 1.333 12.208 1.00 0.00 O ATOM 1545 CB SER A 99 7.915 1.083 8.947 1.00 0.00 C ATOM 1546 OG SER A 99 9.114 1.715 8.534 1.00 0.00 O ATOM 0 H SER A 99 6.219 0.230 10.896 1.00 0.00 H new ATOM 0 HA SER A 99 8.821 -0.668 9.798 1.00 0.00 H new ATOM 0 HB2 SER A 99 7.489 0.524 8.114 1.00 0.00 H new ATOM 0 HB3 SER A 99 7.182 1.838 9.232 1.00 0.00 H new ATOM 0 HG SER A 99 9.053 2.677 8.709 1.00 0.00 H new ATOM 1552 N GLN A 100 10.170 1.043 11.149 1.00 0.00 N ATOM 1553 CA GLN A 100 10.947 1.745 12.164 1.00 0.00 C ATOM 1554 C GLN A 100 10.805 3.255 12.011 1.00 0.00 C ATOM 1555 O GLN A 100 10.354 3.943 12.927 1.00 0.00 O ATOM 1556 CB GLN A 100 12.421 1.347 12.075 1.00 0.00 C ATOM 1557 CG GLN A 100 12.704 -0.058 12.583 1.00 0.00 C ATOM 1558 CD GLN A 100 11.924 -1.119 11.832 1.00 0.00 C ATOM 1559 OE1 GLN A 100 11.160 -1.881 12.426 1.00 0.00 O ATOM 1560 NE2 GLN A 100 12.112 -1.173 10.519 1.00 0.00 N ATOM 0 H GLN A 100 10.721 0.686 10.368 1.00 0.00 H new ATOM 0 HA GLN A 100 10.560 1.460 13.142 1.00 0.00 H new ATOM 0 HB2 GLN A 100 12.747 1.422 11.038 1.00 0.00 H new ATOM 0 HB3 GLN A 100 13.016 2.058 12.648 1.00 0.00 H new ATOM 0 HG2 GLN A 100 13.770 -0.265 12.493 1.00 0.00 H new ATOM 0 HG3 GLN A 100 12.457 -0.113 13.643 1.00 0.00 H new ATOM 0 HE21 GLN A 100 12.755 -0.522 10.069 1.00 0.00 H new ATOM 0 HE22 GLN A 100 11.614 -1.866 9.961 1.00 0.00 H new ATOM 1569 N ARG A 101 11.193 3.766 10.847 1.00 0.00 N ATOM 1570 CA ARG A 101 11.111 5.195 10.574 1.00 0.00 C ATOM 1571 C ARG A 101 10.453 5.454 9.222 1.00 0.00 C ATOM 1572 O ARG A 101 10.001 4.525 8.553 1.00 0.00 O ATOM 1573 CB ARG A 101 12.506 5.823 10.603 1.00 0.00 C ATOM 1574 CG ARG A 101 13.145 5.824 11.982 1.00 0.00 C ATOM 1575 CD ARG A 101 14.663 5.826 11.892 1.00 0.00 C ATOM 1576 NE ARG A 101 15.289 5.907 13.209 1.00 0.00 N ATOM 1577 CZ ARG A 101 16.603 5.954 13.397 1.00 0.00 C ATOM 1578 NH1 ARG A 101 17.426 5.929 12.358 1.00 0.00 N ATOM 1579 NH2 ARG A 101 17.097 6.027 14.627 1.00 0.00 N ATOM 0 H ARG A 101 11.567 3.211 10.078 1.00 0.00 H new ATOM 0 HA ARG A 101 10.498 5.652 11.351 1.00 0.00 H new ATOM 0 HB2 ARG A 101 13.153 5.282 9.912 1.00 0.00 H new ATOM 0 HB3 ARG A 101 12.441 6.849 10.241 1.00 0.00 H new ATOM 0 HG2 ARG A 101 12.811 6.700 12.538 1.00 0.00 H new ATOM 0 HG3 ARG A 101 12.813 4.947 12.539 1.00 0.00 H new ATOM 0 HD2 ARG A 101 14.997 4.920 11.387 1.00 0.00 H new ATOM 0 HD3 ARG A 101 14.989 6.669 11.283 1.00 0.00 H new ATOM 0 HE ARG A 101 14.684 5.929 14.030 1.00 0.00 H new ATOM 0 HH11 ARG A 101 17.051 5.874 11.411 1.00 0.00 H new ATOM 0 HH12 ARG A 101 18.435 5.965 12.505 1.00 0.00 H new ATOM 0 HH21 ARG A 101 16.467 6.047 15.429 1.00 0.00 H new ATOM 0 HH22 ARG A 101 18.106 6.063 14.770 1.00 0.00 H new ATOM 1593 N ALA A 102 10.403 6.722 8.826 1.00 0.00 N ATOM 1594 CA ALA A 102 9.802 7.102 7.554 1.00 0.00 C ATOM 1595 C ALA A 102 10.853 7.176 6.451 1.00 0.00 C ATOM 1596 O ALA A 102 11.996 7.563 6.694 1.00 0.00 O ATOM 1597 CB ALA A 102 9.082 8.435 7.689 1.00 0.00 C ATOM 0 H ALA A 102 10.772 7.503 9.368 1.00 0.00 H new ATOM 0 HA ALA A 102 9.077 6.336 7.279 1.00 0.00 H new ATOM 0 HB1 ALA A 102 8.638 8.707 6.732 1.00 0.00 H new ATOM 0 HB2 ALA A 102 8.298 8.351 8.442 1.00 0.00 H new ATOM 0 HB3 ALA A 102 9.793 9.204 7.990 1.00 0.00 H new ATOM 1603 N TYR A 103 10.458 6.800 5.239 1.00 0.00 N ATOM 1604 CA TYR A 103 11.367 6.820 4.100 1.00 0.00 C ATOM 1605 C TYR A 103 11.035 7.974 3.158 1.00 0.00 C ATOM 1606 O TYR A 103 10.038 8.673 3.343 1.00 0.00 O ATOM 1607 CB TYR A 103 11.298 5.493 3.342 1.00 0.00 C ATOM 1608 CG TYR A 103 11.942 4.341 4.080 1.00 0.00 C ATOM 1609 CD1 TYR A 103 11.633 4.083 5.409 1.00 0.00 C ATOM 1610 CD2 TYR A 103 12.860 3.512 3.448 1.00 0.00 C ATOM 1611 CE1 TYR A 103 12.220 3.032 6.088 1.00 0.00 C ATOM 1612 CE2 TYR A 103 13.450 2.458 4.117 1.00 0.00 C ATOM 1613 CZ TYR A 103 13.127 2.222 5.437 1.00 0.00 C ATOM 1614 OH TYR A 103 13.714 1.173 6.109 1.00 0.00 O ATOM 0 H TYR A 103 9.515 6.478 5.021 1.00 0.00 H new ATOM 0 HA TYR A 103 12.379 6.963 4.478 1.00 0.00 H new ATOM 0 HB2 TYR A 103 10.254 5.250 3.146 1.00 0.00 H new ATOM 0 HB3 TYR A 103 11.785 5.611 2.374 1.00 0.00 H new ATOM 0 HD1 TYR A 103 10.922 4.714 5.921 1.00 0.00 H new ATOM 0 HD2 TYR A 103 13.117 3.695 2.415 1.00 0.00 H new ATOM 0 HE1 TYR A 103 11.970 2.846 7.122 1.00 0.00 H new ATOM 0 HE2 TYR A 103 14.160 1.822 3.610 1.00 0.00 H new ATOM 0 HH TYR A 103 14.327 0.701 5.507 1.00 0.00 H new ATOM 1624 N ARG A 104 11.876 8.166 2.147 1.00 0.00 N ATOM 1625 CA ARG A 104 11.673 9.234 1.176 1.00 0.00 C ATOM 1626 C ARG A 104 10.720 8.790 0.071 1.00 0.00 C ATOM 1627 O ARG A 104 11.060 7.939 -0.752 1.00 0.00 O ATOM 1628 CB ARG A 104 13.011 9.662 0.570 1.00 0.00 C ATOM 1629 CG ARG A 104 12.871 10.637 -0.588 1.00 0.00 C ATOM 1630 CD ARG A 104 14.033 10.516 -1.561 1.00 0.00 C ATOM 1631 NE ARG A 104 15.167 11.347 -1.166 1.00 0.00 N ATOM 1632 CZ ARG A 104 16.365 11.274 -1.734 1.00 0.00 C ATOM 1633 NH1 ARG A 104 16.584 10.413 -2.718 1.00 0.00 N ATOM 1634 NH2 ARG A 104 17.347 12.064 -1.319 1.00 0.00 N ATOM 0 H ARG A 104 12.705 7.595 1.979 1.00 0.00 H new ATOM 0 HA ARG A 104 11.229 10.084 1.695 1.00 0.00 H new ATOM 0 HB2 ARG A 104 13.623 10.120 1.348 1.00 0.00 H new ATOM 0 HB3 ARG A 104 13.544 8.776 0.225 1.00 0.00 H new ATOM 0 HG2 ARG A 104 11.934 10.448 -1.113 1.00 0.00 H new ATOM 0 HG3 ARG A 104 12.821 11.656 -0.203 1.00 0.00 H new ATOM 0 HD2 ARG A 104 14.350 9.475 -1.619 1.00 0.00 H new ATOM 0 HD3 ARG A 104 13.702 10.805 -2.559 1.00 0.00 H new ATOM 0 HE ARG A 104 15.031 12.021 -0.412 1.00 0.00 H new ATOM 0 HH11 ARG A 104 15.831 9.805 -3.040 1.00 0.00 H new ATOM 0 HH12 ARG A 104 17.505 10.359 -3.153 1.00 0.00 H new ATOM 0 HH21 ARG A 104 17.182 12.728 -0.563 1.00 0.00 H new ATOM 0 HH22 ARG A 104 18.267 12.007 -1.756 1.00 0.00 H new ATOM 1648 N PHE A 105 9.525 9.371 0.058 1.00 0.00 N ATOM 1649 CA PHE A 105 8.522 9.034 -0.946 1.00 0.00 C ATOM 1650 C PHE A 105 8.448 10.111 -2.024 1.00 0.00 C ATOM 1651 O PHE A 105 8.112 11.262 -1.745 1.00 0.00 O ATOM 1652 CB PHE A 105 7.151 8.859 -0.289 1.00 0.00 C ATOM 1653 CG PHE A 105 6.932 7.489 0.287 1.00 0.00 C ATOM 1654 CD1 PHE A 105 6.762 6.394 -0.543 1.00 0.00 C ATOM 1655 CD2 PHE A 105 6.896 7.298 1.659 1.00 0.00 C ATOM 1656 CE1 PHE A 105 6.561 5.131 -0.017 1.00 0.00 C ATOM 1657 CE2 PHE A 105 6.696 6.038 2.191 1.00 0.00 C ATOM 1658 CZ PHE A 105 6.527 4.954 1.352 1.00 0.00 C ATOM 0 H PHE A 105 9.227 10.077 0.731 1.00 0.00 H new ATOM 0 HA PHE A 105 8.815 8.095 -1.415 1.00 0.00 H new ATOM 0 HB2 PHE A 105 7.040 9.599 0.503 1.00 0.00 H new ATOM 0 HB3 PHE A 105 6.375 9.062 -1.027 1.00 0.00 H new ATOM 0 HD1 PHE A 105 6.787 6.528 -1.614 1.00 0.00 H new ATOM 0 HD2 PHE A 105 7.026 8.143 2.320 1.00 0.00 H new ATOM 0 HE1 PHE A 105 6.431 4.285 -0.675 1.00 0.00 H new ATOM 0 HE2 PHE A 105 6.672 5.901 3.262 1.00 0.00 H new ATOM 0 HZ PHE A 105 6.368 3.969 1.766 1.00 0.00 H new ATOM 1668 N VAL A 106 8.765 9.729 -3.257 1.00 0.00 N ATOM 1669 CA VAL A 106 8.735 10.660 -4.378 1.00 0.00 C ATOM 1670 C VAL A 106 7.842 10.141 -5.500 1.00 0.00 C ATOM 1671 O VAL A 106 7.736 8.934 -5.712 1.00 0.00 O ATOM 1672 CB VAL A 106 10.148 10.913 -4.936 1.00 0.00 C ATOM 1673 CG1 VAL A 106 11.082 11.383 -3.832 1.00 0.00 C ATOM 1674 CG2 VAL A 106 10.688 9.658 -5.605 1.00 0.00 C ATOM 0 H VAL A 106 9.046 8.780 -3.505 1.00 0.00 H new ATOM 0 HA VAL A 106 8.329 11.598 -3.999 1.00 0.00 H new ATOM 0 HB VAL A 106 10.088 11.701 -5.687 1.00 0.00 H new ATOM 0 HG11 VAL A 106 12.076 11.557 -4.245 1.00 0.00 H new ATOM 0 HG12 VAL A 106 10.701 12.309 -3.403 1.00 0.00 H new ATOM 0 HG13 VAL A 106 11.140 10.620 -3.055 1.00 0.00 H new ATOM 0 HG21 VAL A 106 11.687 9.854 -5.994 1.00 0.00 H new ATOM 0 HG22 VAL A 106 10.735 8.849 -4.876 1.00 0.00 H new ATOM 0 HG23 VAL A 106 10.030 9.371 -6.425 1.00 0.00 H new ATOM 1684 N GLN A 107 7.204 11.062 -6.215 1.00 0.00 N ATOM 1685 CA GLN A 107 6.320 10.697 -7.315 1.00 0.00 C ATOM 1686 C GLN A 107 6.930 9.580 -8.156 1.00 0.00 C ATOM 1687 O GLN A 107 7.783 9.826 -9.008 1.00 0.00 O ATOM 1688 CB GLN A 107 6.034 11.916 -8.194 1.00 0.00 C ATOM 1689 CG GLN A 107 4.678 11.868 -8.879 1.00 0.00 C ATOM 1690 CD GLN A 107 4.646 12.668 -10.166 1.00 0.00 C ATOM 1691 OE1 GLN A 107 5.672 13.170 -10.625 1.00 0.00 O ATOM 1692 NE2 GLN A 107 3.463 12.791 -10.757 1.00 0.00 N ATOM 0 H GLN A 107 7.283 12.066 -6.052 1.00 0.00 H new ATOM 0 HA GLN A 107 5.383 10.337 -6.890 1.00 0.00 H new ATOM 0 HB2 GLN A 107 6.091 12.816 -7.582 1.00 0.00 H new ATOM 0 HB3 GLN A 107 6.812 11.997 -8.953 1.00 0.00 H new ATOM 0 HG2 GLN A 107 4.420 10.831 -9.094 1.00 0.00 H new ATOM 0 HG3 GLN A 107 3.918 12.251 -8.198 1.00 0.00 H new ATOM 0 HE21 GLN A 107 2.638 12.358 -10.342 1.00 0.00 H new ATOM 0 HE22 GLN A 107 3.380 13.318 -11.626 1.00 0.00 H new ATOM 1701 N GLY A 108 6.487 8.351 -7.910 1.00 0.00 N ATOM 1702 CA GLY A 108 7.002 7.215 -8.652 1.00 0.00 C ATOM 1703 C GLY A 108 7.901 6.331 -7.811 1.00 0.00 C ATOM 1704 O GLY A 108 8.697 5.556 -8.342 1.00 0.00 O ATOM 0 H GLY A 108 5.781 8.122 -7.210 1.00 0.00 H new ATOM 0 HA2 GLY A 108 6.168 6.624 -9.030 1.00 0.00 H new ATOM 0 HA3 GLY A 108 7.558 7.573 -9.519 1.00 0.00 H new ATOM 1708 N LYS A 109 7.776 6.447 -6.493 1.00 0.00 N ATOM 1709 CA LYS A 109 8.583 5.653 -5.575 1.00 0.00 C ATOM 1710 C LYS A 109 7.758 4.530 -4.956 1.00 0.00 C ATOM 1711 O LYS A 109 6.575 4.705 -4.662 1.00 0.00 O ATOM 1712 CB LYS A 109 9.161 6.543 -4.471 1.00 0.00 C ATOM 1713 CG LYS A 109 10.432 5.991 -3.849 1.00 0.00 C ATOM 1714 CD LYS A 109 11.435 5.569 -4.909 1.00 0.00 C ATOM 1715 CE LYS A 109 12.843 5.481 -4.341 1.00 0.00 C ATOM 1716 NZ LYS A 109 13.879 5.576 -5.407 1.00 0.00 N ATOM 0 H LYS A 109 7.123 7.084 -6.037 1.00 0.00 H new ATOM 0 HA LYS A 109 9.401 5.209 -6.142 1.00 0.00 H new ATOM 0 HB2 LYS A 109 9.367 7.531 -4.883 1.00 0.00 H new ATOM 0 HB3 LYS A 109 8.411 6.673 -3.691 1.00 0.00 H new ATOM 0 HG2 LYS A 109 10.880 6.747 -3.204 1.00 0.00 H new ATOM 0 HG3 LYS A 109 10.188 5.137 -3.218 1.00 0.00 H new ATOM 0 HD2 LYS A 109 11.146 4.602 -5.320 1.00 0.00 H new ATOM 0 HD3 LYS A 109 11.418 6.283 -5.732 1.00 0.00 H new ATOM 0 HE2 LYS A 109 12.993 6.282 -3.617 1.00 0.00 H new ATOM 0 HE3 LYS A 109 12.960 4.540 -3.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 14.825 5.512 -4.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 13.752 4.797 -6.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 13.785 6.485 -5.903 1.00 0.00 H new ATOM 1730 N ASP A 110 8.388 3.377 -4.759 1.00 0.00 N ATOM 1731 CA ASP A 110 7.712 2.226 -4.173 1.00 0.00 C ATOM 1732 C ASP A 110 8.511 1.666 -3.000 1.00 0.00 C ATOM 1733 O ASP A 110 9.685 1.322 -3.144 1.00 0.00 O ATOM 1734 CB ASP A 110 7.501 1.139 -5.228 1.00 0.00 C ATOM 1735 CG ASP A 110 8.770 0.823 -5.995 1.00 0.00 C ATOM 1736 OD1 ASP A 110 9.360 1.758 -6.577 1.00 0.00 O ATOM 1737 OD2 ASP A 110 9.173 -0.358 -6.013 1.00 0.00 O ATOM 0 H ASP A 110 9.367 3.215 -4.997 1.00 0.00 H new ATOM 0 HA ASP A 110 6.741 2.556 -3.804 1.00 0.00 H new ATOM 0 HB2 ASP A 110 7.137 0.233 -4.744 1.00 0.00 H new ATOM 0 HB3 ASP A 110 6.728 1.460 -5.926 1.00 0.00 H new ATOM 1742 N TRP A 111 7.869 1.578 -1.841 1.00 0.00 N ATOM 1743 CA TRP A 111 8.520 1.060 -0.644 1.00 0.00 C ATOM 1744 C TRP A 111 7.593 0.119 0.117 1.00 0.00 C ATOM 1745 O TRP A 111 6.413 0.414 0.306 1.00 0.00 O ATOM 1746 CB TRP A 111 8.955 2.212 0.264 1.00 0.00 C ATOM 1747 CG TRP A 111 10.222 2.875 -0.184 1.00 0.00 C ATOM 1748 CD1 TRP A 111 10.359 4.151 -0.652 1.00 0.00 C ATOM 1749 CD2 TRP A 111 11.531 2.295 -0.208 1.00 0.00 C ATOM 1750 NE1 TRP A 111 11.673 4.399 -0.965 1.00 0.00 N ATOM 1751 CE2 TRP A 111 12.413 3.276 -0.701 1.00 0.00 C ATOM 1752 CE3 TRP A 111 12.044 1.043 0.141 1.00 0.00 C ATOM 1753 CZ2 TRP A 111 13.777 3.042 -0.854 1.00 0.00 C ATOM 1754 CZ3 TRP A 111 13.398 0.812 -0.011 1.00 0.00 C ATOM 1755 CH2 TRP A 111 14.252 1.807 -0.505 1.00 0.00 C ATOM 0 H TRP A 111 6.898 1.859 -1.705 1.00 0.00 H new ATOM 0 HA TRP A 111 9.401 0.498 -0.955 1.00 0.00 H new ATOM 0 HB2 TRP A 111 8.159 2.955 0.303 1.00 0.00 H new ATOM 0 HB3 TRP A 111 9.089 1.835 1.278 1.00 0.00 H new ATOM 0 HD1 TRP A 111 9.552 4.861 -0.760 1.00 0.00 H new ATOM 0 HE1 TRP A 111 12.039 5.277 -1.334 1.00 0.00 H new ATOM 0 HE3 TRP A 111 11.394 0.270 0.523 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 14.437 3.808 -1.235 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 13.805 -0.152 0.256 1.00 0.00 H new ATOM 0 HH2 TRP A 111 15.306 1.595 -0.612 1.00 0.00 H new ATOM 1766 N GLY A 112 8.134 -1.015 0.553 1.00 0.00 N ATOM 1767 CA GLY A 112 7.339 -1.981 1.289 1.00 0.00 C ATOM 1768 C GLY A 112 8.061 -3.300 1.478 1.00 0.00 C ATOM 1769 O GLY A 112 9.291 -3.348 1.490 1.00 0.00 O ATOM 0 H GLY A 112 9.108 -1.282 0.410 1.00 0.00 H new ATOM 0 HA2 GLY A 112 7.082 -1.568 2.264 1.00 0.00 H new ATOM 0 HA3 GLY A 112 6.402 -2.155 0.759 1.00 0.00 H new ATOM 1773 N PHE A 113 7.294 -4.376 1.629 1.00 0.00 N ATOM 1774 CA PHE A 113 7.868 -5.702 1.822 1.00 0.00 C ATOM 1775 C PHE A 113 7.552 -6.609 0.635 1.00 0.00 C ATOM 1776 O PHE A 113 6.549 -6.423 -0.054 1.00 0.00 O ATOM 1777 CB PHE A 113 7.336 -6.329 3.112 1.00 0.00 C ATOM 1778 CG PHE A 113 7.722 -5.571 4.350 1.00 0.00 C ATOM 1779 CD1 PHE A 113 7.353 -4.244 4.509 1.00 0.00 C ATOM 1780 CD2 PHE A 113 8.452 -6.184 5.355 1.00 0.00 C ATOM 1781 CE1 PHE A 113 7.708 -3.544 5.647 1.00 0.00 C ATOM 1782 CE2 PHE A 113 8.809 -5.489 6.495 1.00 0.00 C ATOM 1783 CZ PHE A 113 8.436 -4.168 6.641 1.00 0.00 C ATOM 0 H PHE A 113 6.274 -4.355 1.621 1.00 0.00 H new ATOM 0 HA PHE A 113 8.950 -5.594 1.898 1.00 0.00 H new ATOM 0 HB2 PHE A 113 6.249 -6.389 3.056 1.00 0.00 H new ATOM 0 HB3 PHE A 113 7.708 -7.351 3.190 1.00 0.00 H new ATOM 0 HD1 PHE A 113 6.782 -3.752 3.735 1.00 0.00 H new ATOM 0 HD2 PHE A 113 8.746 -7.218 5.246 1.00 0.00 H new ATOM 0 HE1 PHE A 113 7.416 -2.510 5.759 1.00 0.00 H new ATOM 0 HE2 PHE A 113 9.379 -5.979 7.271 1.00 0.00 H new ATOM 0 HZ PHE A 113 8.713 -3.623 7.531 1.00 0.00 H new ATOM 1793 N LYS A 114 8.417 -7.590 0.402 1.00 0.00 N ATOM 1794 CA LYS A 114 8.233 -8.527 -0.699 1.00 0.00 C ATOM 1795 C LYS A 114 7.292 -9.659 -0.299 1.00 0.00 C ATOM 1796 O LYS A 114 6.279 -9.900 -0.956 1.00 0.00 O ATOM 1797 CB LYS A 114 9.581 -9.102 -1.138 1.00 0.00 C ATOM 1798 CG LYS A 114 9.622 -9.511 -2.601 1.00 0.00 C ATOM 1799 CD LYS A 114 11.048 -9.704 -3.087 1.00 0.00 C ATOM 1800 CE LYS A 114 11.093 -10.007 -4.577 1.00 0.00 C ATOM 1801 NZ LYS A 114 10.913 -8.779 -5.399 1.00 0.00 N ATOM 0 H LYS A 114 9.253 -7.757 0.962 1.00 0.00 H new ATOM 0 HA LYS A 114 7.787 -7.985 -1.533 1.00 0.00 H new ATOM 0 HB2 LYS A 114 10.359 -8.361 -0.955 1.00 0.00 H new ATOM 0 HB3 LYS A 114 9.815 -9.969 -0.520 1.00 0.00 H new ATOM 0 HG2 LYS A 114 9.062 -10.436 -2.737 1.00 0.00 H new ATOM 0 HG3 LYS A 114 9.130 -8.749 -3.206 1.00 0.00 H new ATOM 0 HD2 LYS A 114 11.629 -8.805 -2.880 1.00 0.00 H new ATOM 0 HD3 LYS A 114 11.515 -10.520 -2.535 1.00 0.00 H new ATOM 0 HE2 LYS A 114 12.047 -10.473 -4.824 1.00 0.00 H new ATOM 0 HE3 LYS A 114 10.313 -10.727 -4.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 10.454 -9.028 -6.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 10.318 -8.100 -4.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 11.841 -8.350 -5.590 1.00 0.00 H new ATOM 1815 N LYS A 115 7.632 -10.351 0.783 1.00 0.00 N ATOM 1816 CA LYS A 115 6.817 -11.456 1.274 1.00 0.00 C ATOM 1817 C LYS A 115 5.971 -11.020 2.466 1.00 0.00 C ATOM 1818 O LYS A 115 6.433 -11.036 3.607 1.00 0.00 O ATOM 1819 CB LYS A 115 7.706 -12.636 1.670 1.00 0.00 C ATOM 1820 CG LYS A 115 8.167 -13.473 0.489 1.00 0.00 C ATOM 1821 CD LYS A 115 9.488 -12.971 -0.069 1.00 0.00 C ATOM 1822 CE LYS A 115 10.140 -14.005 -0.974 1.00 0.00 C ATOM 1823 NZ LYS A 115 11.623 -13.875 -0.986 1.00 0.00 N ATOM 0 H LYS A 115 8.468 -10.166 1.337 1.00 0.00 H new ATOM 0 HA LYS A 115 6.149 -11.767 0.471 1.00 0.00 H new ATOM 0 HB2 LYS A 115 8.580 -12.259 2.201 1.00 0.00 H new ATOM 0 HB3 LYS A 115 7.161 -13.274 2.366 1.00 0.00 H new ATOM 0 HG2 LYS A 115 8.273 -14.513 0.798 1.00 0.00 H new ATOM 0 HG3 LYS A 115 7.408 -13.449 -0.293 1.00 0.00 H new ATOM 0 HD2 LYS A 115 9.322 -12.050 -0.628 1.00 0.00 H new ATOM 0 HD3 LYS A 115 10.162 -12.728 0.752 1.00 0.00 H new ATOM 0 HE2 LYS A 115 9.866 -15.005 -0.639 1.00 0.00 H new ATOM 0 HE3 LYS A 115 9.757 -13.893 -1.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 12.047 -14.770 -1.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 11.899 -13.112 -1.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 11.960 -13.652 -0.028 1.00 0.00 H new ATOM 1837 N PHE A 116 4.729 -10.633 2.195 1.00 0.00 N ATOM 1838 CA PHE A 116 3.818 -10.194 3.246 1.00 0.00 C ATOM 1839 C PHE A 116 3.208 -11.390 3.971 1.00 0.00 C ATOM 1840 O PHE A 116 3.172 -11.430 5.202 1.00 0.00 O ATOM 1841 CB PHE A 116 2.708 -9.321 2.656 1.00 0.00 C ATOM 1842 CG PHE A 116 1.753 -8.790 3.686 1.00 0.00 C ATOM 1843 CD1 PHE A 116 2.209 -8.386 4.930 1.00 0.00 C ATOM 1844 CD2 PHE A 116 0.398 -8.695 3.410 1.00 0.00 C ATOM 1845 CE1 PHE A 116 1.331 -7.898 5.880 1.00 0.00 C ATOM 1846 CE2 PHE A 116 -0.484 -8.208 4.355 1.00 0.00 C ATOM 1847 CZ PHE A 116 -0.017 -7.807 5.592 1.00 0.00 C ATOM 0 H PHE A 116 4.330 -10.614 1.256 1.00 0.00 H new ATOM 0 HA PHE A 116 4.389 -9.607 3.966 1.00 0.00 H new ATOM 0 HB2 PHE A 116 3.159 -8.483 2.124 1.00 0.00 H new ATOM 0 HB3 PHE A 116 2.151 -9.902 1.921 1.00 0.00 H new ATOM 0 HD1 PHE A 116 3.262 -8.453 5.160 1.00 0.00 H new ATOM 0 HD2 PHE A 116 0.027 -9.006 2.444 1.00 0.00 H new ATOM 0 HE1 PHE A 116 1.699 -7.588 6.847 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -1.538 -8.141 4.127 1.00 0.00 H new ATOM 0 HZ PHE A 116 -0.704 -7.423 6.332 1.00 0.00 H new ATOM 1857 N ILE A 117 2.730 -12.361 3.201 1.00 0.00 N ATOM 1858 CA ILE A 117 2.123 -13.558 3.770 1.00 0.00 C ATOM 1859 C ILE A 117 1.778 -14.569 2.682 1.00 0.00 C ATOM 1860 O ILE A 117 1.399 -14.197 1.571 1.00 0.00 O ATOM 1861 CB ILE A 117 0.847 -13.219 4.563 1.00 0.00 C ATOM 1862 CG1 ILE A 117 0.139 -14.501 5.006 1.00 0.00 C ATOM 1863 CG2 ILE A 117 -0.085 -12.356 3.724 1.00 0.00 C ATOM 1864 CD1 ILE A 117 -0.617 -14.355 6.307 1.00 0.00 C ATOM 0 H ILE A 117 2.751 -12.343 2.181 1.00 0.00 H new ATOM 0 HA ILE A 117 2.858 -13.993 4.448 1.00 0.00 H new ATOM 0 HB ILE A 117 1.129 -12.656 5.453 1.00 0.00 H new ATOM 0 HG12 ILE A 117 -0.555 -14.812 4.225 1.00 0.00 H new ATOM 0 HG13 ILE A 117 0.877 -15.296 5.111 1.00 0.00 H new ATOM 0 HG21 ILE A 117 -0.982 -12.125 4.298 1.00 0.00 H new ATOM 0 HG22 ILE A 117 0.422 -11.429 3.454 1.00 0.00 H new ATOM 0 HG23 ILE A 117 -0.363 -12.895 2.818 1.00 0.00 H new ATOM 0 HD11 ILE A 117 -1.094 -15.302 6.559 1.00 0.00 H new ATOM 0 HD12 ILE A 117 0.075 -14.075 7.101 1.00 0.00 H new ATOM 0 HD13 ILE A 117 -1.379 -13.583 6.200 1.00 0.00 H new ATOM 1876 N ARG A 118 1.909 -15.850 3.010 1.00 0.00 N ATOM 1877 CA ARG A 118 1.611 -16.916 2.061 1.00 0.00 C ATOM 1878 C ARG A 118 0.176 -16.808 1.555 1.00 0.00 C ATOM 1879 O ARG A 118 -0.774 -16.866 2.336 1.00 0.00 O ATOM 1880 CB ARG A 118 1.832 -18.283 2.711 1.00 0.00 C ATOM 1881 CG ARG A 118 3.246 -18.816 2.543 1.00 0.00 C ATOM 1882 CD ARG A 118 3.272 -20.337 2.546 1.00 0.00 C ATOM 1883 NE ARG A 118 4.500 -20.864 1.956 1.00 0.00 N ATOM 1884 CZ ARG A 118 5.645 -20.973 2.620 1.00 0.00 C ATOM 1885 NH1 ARG A 118 5.719 -20.594 3.888 1.00 0.00 N ATOM 1886 NH2 ARG A 118 6.720 -21.463 2.015 1.00 0.00 N ATOM 0 H ARG A 118 2.220 -16.175 3.926 1.00 0.00 H new ATOM 0 HA ARG A 118 2.286 -16.811 1.212 1.00 0.00 H new ATOM 0 HB2 ARG A 118 1.604 -18.211 3.774 1.00 0.00 H new ATOM 0 HB3 ARG A 118 1.130 -18.998 2.282 1.00 0.00 H new ATOM 0 HG2 ARG A 118 3.667 -18.446 1.608 1.00 0.00 H new ATOM 0 HG3 ARG A 118 3.876 -18.439 3.348 1.00 0.00 H new ATOM 0 HD2 ARG A 118 3.177 -20.699 3.570 1.00 0.00 H new ATOM 0 HD3 ARG A 118 2.412 -20.715 1.993 1.00 0.00 H new ATOM 0 HE ARG A 118 4.477 -21.164 0.982 1.00 0.00 H new ATOM 0 HH11 ARG A 118 4.895 -20.217 4.357 1.00 0.00 H new ATOM 0 HH12 ARG A 118 6.600 -20.679 4.395 1.00 0.00 H new ATOM 0 HH21 ARG A 118 6.667 -21.756 1.039 1.00 0.00 H new ATOM 0 HH22 ARG A 118 7.599 -21.546 2.526 1.00 0.00 H new ATOM 1900 N ARG A 119 0.026 -16.650 0.244 1.00 0.00 N ATOM 1901 CA ARG A 119 -1.293 -16.531 -0.366 1.00 0.00 C ATOM 1902 C ARG A 119 -2.219 -17.642 0.121 1.00 0.00 C ATOM 1903 O ARG A 119 -3.400 -17.411 0.379 1.00 0.00 O ATOM 1904 CB ARG A 119 -1.179 -16.579 -1.891 1.00 0.00 C ATOM 1905 CG ARG A 119 -2.261 -15.787 -2.607 1.00 0.00 C ATOM 1906 CD ARG A 119 -2.362 -16.182 -4.073 1.00 0.00 C ATOM 1907 NE ARG A 119 -3.255 -17.320 -4.273 1.00 0.00 N ATOM 1908 CZ ARG A 119 -3.709 -17.697 -5.463 1.00 0.00 C ATOM 1909 NH1 ARG A 119 -3.356 -17.030 -6.553 1.00 0.00 N ATOM 1910 NH2 ARG A 119 -4.519 -18.743 -5.564 1.00 0.00 N ATOM 0 H ARG A 119 0.802 -16.601 -0.416 1.00 0.00 H new ATOM 0 HA ARG A 119 -1.718 -15.572 -0.070 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -0.203 -16.194 -2.186 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -1.224 -17.618 -2.218 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -3.220 -15.954 -2.117 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -2.045 -14.721 -2.530 1.00 0.00 H new ATOM 0 HD2 ARG A 119 -2.722 -15.332 -4.653 1.00 0.00 H new ATOM 0 HD3 ARG A 119 -1.370 -16.429 -4.451 1.00 0.00 H new ATOM 0 HE ARG A 119 -3.546 -17.854 -3.454 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -2.734 -16.225 -6.479 1.00 0.00 H new ATOM 0 HH12 ARG A 119 -3.706 -17.322 -7.465 1.00 0.00 H new ATOM 0 HH21 ARG A 119 -4.793 -19.258 -4.728 1.00 0.00 H new ATOM 0 HH22 ARG A 119 -4.867 -19.032 -6.478 1.00 0.00 H new ATOM 1924 N ASP A 120 -1.674 -18.847 0.244 1.00 0.00 N ATOM 1925 CA ASP A 120 -2.451 -19.994 0.700 1.00 0.00 C ATOM 1926 C ASP A 120 -2.971 -19.769 2.117 1.00 0.00 C ATOM 1927 O ASP A 120 -4.104 -20.129 2.437 1.00 0.00 O ATOM 1928 CB ASP A 120 -1.600 -21.265 0.652 1.00 0.00 C ATOM 1929 CG ASP A 120 -2.202 -22.395 1.464 1.00 0.00 C ATOM 1930 OD1 ASP A 120 -3.269 -22.909 1.067 1.00 0.00 O ATOM 1931 OD2 ASP A 120 -1.605 -22.766 2.496 1.00 0.00 O ATOM 0 H ASP A 120 -0.698 -19.055 0.035 1.00 0.00 H new ATOM 0 HA ASP A 120 -3.305 -20.112 0.033 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -1.488 -21.585 -0.384 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -0.601 -21.044 1.027 1.00 0.00 H new ATOM 1936 N PHE A 121 -2.136 -19.173 2.961 1.00 0.00 N ATOM 1937 CA PHE A 121 -2.511 -18.901 4.344 1.00 0.00 C ATOM 1938 C PHE A 121 -3.749 -18.012 4.407 1.00 0.00 C ATOM 1939 O PHE A 121 -4.479 -18.014 5.399 1.00 0.00 O ATOM 1940 CB PHE A 121 -1.351 -18.235 5.087 1.00 0.00 C ATOM 1941 CG PHE A 121 -1.520 -18.230 6.580 1.00 0.00 C ATOM 1942 CD1 PHE A 121 -1.099 -19.307 7.341 1.00 0.00 C ATOM 1943 CD2 PHE A 121 -2.102 -17.148 7.221 1.00 0.00 C ATOM 1944 CE1 PHE A 121 -1.252 -19.306 8.715 1.00 0.00 C ATOM 1945 CE2 PHE A 121 -2.257 -17.140 8.594 1.00 0.00 C ATOM 1946 CZ PHE A 121 -1.833 -18.221 9.342 1.00 0.00 C ATOM 0 H PHE A 121 -1.195 -18.869 2.712 1.00 0.00 H new ATOM 0 HA PHE A 121 -2.744 -19.851 4.825 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -0.425 -18.752 4.836 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -1.248 -17.208 4.737 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -0.645 -20.158 6.855 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -2.438 -16.301 6.641 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -0.918 -20.152 9.297 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -2.709 -16.289 9.082 1.00 0.00 H new ATOM 0 HZ PHE A 121 -1.956 -18.218 10.415 1.00 0.00 H new ATOM 1956 N LEU A 122 -3.979 -17.252 3.342 1.00 0.00 N ATOM 1957 CA LEU A 122 -5.128 -16.356 3.275 1.00 0.00 C ATOM 1958 C LEU A 122 -6.406 -17.131 2.971 1.00 0.00 C ATOM 1959 O LEU A 122 -7.342 -17.145 3.772 1.00 0.00 O ATOM 1960 CB LEU A 122 -4.902 -15.284 2.208 1.00 0.00 C ATOM 1961 CG LEU A 122 -3.499 -14.680 2.150 1.00 0.00 C ATOM 1962 CD1 LEU A 122 -3.313 -13.884 0.867 1.00 0.00 C ATOM 1963 CD2 LEU A 122 -3.245 -13.801 3.366 1.00 0.00 C ATOM 0 H LEU A 122 -3.385 -17.238 2.513 1.00 0.00 H new ATOM 0 HA LEU A 122 -5.239 -15.875 4.247 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -5.130 -15.716 1.234 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -5.616 -14.478 2.375 1.00 0.00 H new ATOM 0 HG LEU A 122 -2.774 -15.494 2.157 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -2.308 -13.462 0.843 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -3.451 -14.541 0.008 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -4.046 -13.078 0.829 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -2.241 -13.380 3.307 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -3.977 -12.993 3.390 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -3.335 -14.399 4.273 1.00 0.00 H new ATOM 1975 N LEU A 123 -6.438 -17.777 1.811 1.00 0.00 N ATOM 1976 CA LEU A 123 -7.600 -18.558 1.401 1.00 0.00 C ATOM 1977 C LEU A 123 -7.886 -19.674 2.400 1.00 0.00 C ATOM 1978 O LEU A 123 -9.027 -20.113 2.547 1.00 0.00 O ATOM 1979 CB LEU A 123 -7.377 -19.149 0.008 1.00 0.00 C ATOM 1980 CG LEU A 123 -7.331 -18.147 -1.147 1.00 0.00 C ATOM 1981 CD1 LEU A 123 -8.531 -17.215 -1.093 1.00 0.00 C ATOM 1982 CD2 LEU A 123 -6.034 -17.352 -1.112 1.00 0.00 C ATOM 0 H LEU A 123 -5.672 -17.776 1.137 1.00 0.00 H new ATOM 0 HA LEU A 123 -8.462 -17.892 1.372 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -6.440 -19.706 0.017 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -8.172 -19.867 -0.192 1.00 0.00 H new ATOM 0 HG LEU A 123 -7.369 -18.701 -2.085 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -8.481 -16.509 -1.922 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -9.449 -17.799 -1.168 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -8.525 -16.668 -0.150 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -6.019 -16.644 -1.941 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -5.966 -16.809 -0.170 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -5.187 -18.033 -1.201 1.00 0.00 H new ATOM 1994 N ASP A 124 -6.843 -20.128 3.086 1.00 0.00 N ATOM 1995 CA ASP A 124 -6.982 -21.192 4.074 1.00 0.00 C ATOM 1996 C ASP A 124 -8.052 -20.841 5.103 1.00 0.00 C ATOM 1997 O ASP A 124 -8.018 -19.769 5.706 1.00 0.00 O ATOM 1998 CB ASP A 124 -5.646 -21.444 4.775 1.00 0.00 C ATOM 1999 CG ASP A 124 -4.789 -22.457 4.041 1.00 0.00 C ATOM 2000 OD1 ASP A 124 -5.351 -23.259 3.265 1.00 0.00 O ATOM 2001 OD2 ASP A 124 -3.557 -22.448 4.242 1.00 0.00 O ATOM 0 H ASP A 124 -5.892 -19.776 2.976 1.00 0.00 H new ATOM 0 HA ASP A 124 -7.287 -22.100 3.554 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -5.100 -20.504 4.860 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -5.832 -21.797 5.789 1.00 0.00 H new ATOM 2006 N GLU A 125 -9.001 -21.751 5.296 1.00 0.00 N ATOM 2007 CA GLU A 125 -10.082 -21.536 6.251 1.00 0.00 C ATOM 2008 C GLU A 125 -9.557 -21.569 7.684 1.00 0.00 C ATOM 2009 O GLU A 125 -10.022 -20.822 8.544 1.00 0.00 O ATOM 2010 CB GLU A 125 -11.170 -22.596 6.071 1.00 0.00 C ATOM 2011 CG GLU A 125 -10.710 -24.004 6.410 1.00 0.00 C ATOM 2012 CD GLU A 125 -11.441 -25.065 5.610 1.00 0.00 C ATOM 2013 OE1 GLU A 125 -12.688 -25.096 5.668 1.00 0.00 O ATOM 2014 OE2 GLU A 125 -10.767 -25.864 4.927 1.00 0.00 O ATOM 0 H GLU A 125 -9.043 -22.644 4.804 1.00 0.00 H new ATOM 0 HA GLU A 125 -10.509 -20.551 6.061 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -12.022 -22.340 6.700 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -11.518 -22.575 5.038 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -9.639 -24.087 6.224 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -10.864 -24.186 7.474 1.00 0.00 H new ATOM 2021 N ALA A 126 -8.585 -22.441 7.932 1.00 0.00 N ATOM 2022 CA ALA A 126 -7.995 -22.570 9.259 1.00 0.00 C ATOM 2023 C ALA A 126 -7.723 -21.202 9.875 1.00 0.00 C ATOM 2024 O ALA A 126 -7.857 -21.018 11.084 1.00 0.00 O ATOM 2025 CB ALA A 126 -6.712 -23.384 9.188 1.00 0.00 C ATOM 0 H ALA A 126 -8.190 -23.068 7.232 1.00 0.00 H new ATOM 0 HA ALA A 126 -8.708 -23.091 9.898 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -6.282 -23.473 10.186 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -6.933 -24.378 8.798 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -6.001 -22.886 8.529 1.00 0.00 H new ATOM 2031 N ASN A 127 -7.340 -20.246 9.035 1.00 0.00 N ATOM 2032 CA ASN A 127 -7.048 -18.894 9.498 1.00 0.00 C ATOM 2033 C ASN A 127 -8.296 -18.018 9.442 1.00 0.00 C ATOM 2034 O ASN A 127 -8.460 -17.102 10.246 1.00 0.00 O ATOM 2035 CB ASN A 127 -5.936 -18.272 8.651 1.00 0.00 C ATOM 2036 CG ASN A 127 -4.894 -19.289 8.227 1.00 0.00 C ATOM 2037 OD1 ASN A 127 -3.957 -19.580 8.969 1.00 0.00 O ATOM 2038 ND2 ASN A 127 -5.055 -19.834 7.027 1.00 0.00 N ATOM 0 H ASN A 127 -7.225 -20.382 8.031 1.00 0.00 H new ATOM 0 HA ASN A 127 -6.715 -18.955 10.534 1.00 0.00 H new ATOM 0 HB2 ASN A 127 -6.373 -17.812 7.764 1.00 0.00 H new ATOM 0 HB3 ASN A 127 -5.453 -17.476 9.218 1.00 0.00 H new ATOM 0 HD21 ASN A 127 -4.386 -20.525 6.687 1.00 0.00 H new ATOM 0 HD22 ASN A 127 -5.848 -19.562 6.446 1.00 0.00 H new ATOM 2045 N GLY A 128 -9.174 -18.308 8.487 1.00 0.00 N ATOM 2046 CA GLY A 128 -10.396 -17.539 8.344 1.00 0.00 C ATOM 2047 C GLY A 128 -10.138 -16.128 7.854 1.00 0.00 C ATOM 2048 O GLY A 128 -11.065 -15.325 7.735 1.00 0.00 O ATOM 0 H GLY A 128 -9.061 -19.062 7.810 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -11.062 -18.047 7.646 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -10.911 -17.499 9.304 1.00 0.00 H new ATOM 2052 N LEU A 129 -8.877 -15.823 7.569 1.00 0.00 N ATOM 2053 CA LEU A 129 -8.500 -14.498 7.090 1.00 0.00 C ATOM 2054 C LEU A 129 -9.517 -13.973 6.082 1.00 0.00 C ATOM 2055 O LEU A 129 -9.704 -12.763 5.946 1.00 0.00 O ATOM 2056 CB LEU A 129 -7.109 -14.541 6.454 1.00 0.00 C ATOM 2057 CG LEU A 129 -5.935 -14.237 7.384 1.00 0.00 C ATOM 2058 CD1 LEU A 129 -6.231 -14.724 8.794 1.00 0.00 C ATOM 2059 CD2 LEU A 129 -4.657 -14.871 6.856 1.00 0.00 C ATOM 0 H LEU A 129 -8.098 -16.475 7.661 1.00 0.00 H new ATOM 0 HA LEU A 129 -8.481 -13.822 7.944 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -6.959 -15.531 6.024 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -7.087 -13.829 5.629 1.00 0.00 H new ATOM 0 HG LEU A 129 -5.793 -13.157 7.417 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -5.384 -14.499 9.442 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -7.121 -14.222 9.173 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -6.400 -15.801 8.779 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -3.832 -14.644 7.531 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -4.786 -15.951 6.792 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -4.435 -14.473 5.866 1.00 0.00 H new ATOM 2071 N LEU A 130 -10.173 -14.890 5.379 1.00 0.00 N ATOM 2072 CA LEU A 130 -11.174 -14.520 4.385 1.00 0.00 C ATOM 2073 C LEU A 130 -12.475 -15.282 4.612 1.00 0.00 C ATOM 2074 O LEU A 130 -12.729 -16.321 4.003 1.00 0.00 O ATOM 2075 CB LEU A 130 -10.648 -14.796 2.976 1.00 0.00 C ATOM 2076 CG LEU A 130 -9.156 -14.543 2.755 1.00 0.00 C ATOM 2077 CD1 LEU A 130 -8.770 -14.848 1.316 1.00 0.00 C ATOM 2078 CD2 LEU A 130 -8.799 -13.108 3.113 1.00 0.00 C ATOM 0 H LEU A 130 -10.030 -15.895 5.479 1.00 0.00 H new ATOM 0 HA LEU A 130 -11.376 -13.454 4.489 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -10.860 -15.836 2.728 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -11.209 -14.180 2.273 1.00 0.00 H new ATOM 0 HG LEU A 130 -8.594 -15.209 3.409 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -7.705 -14.662 1.178 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -8.988 -15.893 1.095 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -9.340 -14.208 0.643 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -7.734 -12.947 2.949 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -9.370 -12.424 2.486 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -9.037 -12.924 4.161 1.00 0.00 H new ATOM 2090 N PRO A 131 -13.322 -14.754 5.509 1.00 0.00 N ATOM 2091 CA PRO A 131 -14.613 -15.367 5.835 1.00 0.00 C ATOM 2092 C PRO A 131 -15.611 -15.264 4.686 1.00 0.00 C ATOM 2093 O PRO A 131 -16.463 -16.135 4.512 1.00 0.00 O ATOM 2094 CB PRO A 131 -15.098 -14.554 7.038 1.00 0.00 C ATOM 2095 CG PRO A 131 -14.421 -13.234 6.901 1.00 0.00 C ATOM 2096 CD PRO A 131 -13.085 -13.517 6.272 1.00 0.00 C ATOM 0 HA PRO A 131 -14.518 -16.434 6.034 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -16.183 -14.445 7.031 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -14.832 -15.040 7.977 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -15.008 -12.557 6.281 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -14.301 -12.754 7.872 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -12.765 -12.701 5.625 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -12.307 -13.651 7.024 1.00 0.00 H new ATOM 2104 N ASP A 132 -15.498 -14.196 3.905 1.00 0.00 N ATOM 2105 CA ASP A 132 -16.390 -13.980 2.771 1.00 0.00 C ATOM 2106 C ASP A 132 -15.600 -13.886 1.469 1.00 0.00 C ATOM 2107 O ASP A 132 -16.053 -13.278 0.500 1.00 0.00 O ATOM 2108 CB ASP A 132 -17.212 -12.707 2.976 1.00 0.00 C ATOM 2109 CG ASP A 132 -18.526 -12.974 3.685 1.00 0.00 C ATOM 2110 OD1 ASP A 132 -19.190 -13.975 3.344 1.00 0.00 O ATOM 2111 OD2 ASP A 132 -18.889 -12.183 4.580 1.00 0.00 O ATOM 0 H ASP A 132 -14.798 -13.466 4.036 1.00 0.00 H new ATOM 0 HA ASP A 132 -17.066 -14.832 2.705 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -16.629 -11.991 3.555 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -17.412 -12.247 2.008 1.00 0.00 H new ATOM 2116 N ASP A 133 -14.417 -14.491 1.456 1.00 0.00 N ATOM 2117 CA ASP A 133 -13.564 -14.476 0.273 1.00 0.00 C ATOM 2118 C ASP A 133 -13.095 -13.059 -0.040 1.00 0.00 C ATOM 2119 O ASP A 133 -12.891 -12.702 -1.201 1.00 0.00 O ATOM 2120 CB ASP A 133 -14.312 -15.056 -0.929 1.00 0.00 C ATOM 2121 CG ASP A 133 -14.907 -16.419 -0.638 1.00 0.00 C ATOM 2122 OD1 ASP A 133 -14.202 -17.430 -0.843 1.00 0.00 O ATOM 2123 OD2 ASP A 133 -16.078 -16.476 -0.206 1.00 0.00 O ATOM 0 H ASP A 133 -14.027 -14.998 2.251 1.00 0.00 H new ATOM 0 HA ASP A 133 -12.689 -15.092 0.478 1.00 0.00 H new ATOM 0 HB2 ASP A 133 -15.107 -14.371 -1.223 1.00 0.00 H new ATOM 0 HB3 ASP A 133 -13.629 -15.134 -1.775 1.00 0.00 H new ATOM 2128 N LYS A 134 -12.925 -12.253 1.003 1.00 0.00 N ATOM 2129 CA LYS A 134 -12.480 -10.874 0.842 1.00 0.00 C ATOM 2130 C LYS A 134 -11.255 -10.593 1.707 1.00 0.00 C ATOM 2131 O LYS A 134 -11.250 -10.881 2.905 1.00 0.00 O ATOM 2132 CB LYS A 134 -13.607 -9.906 1.205 1.00 0.00 C ATOM 2133 CG LYS A 134 -14.571 -10.456 2.243 1.00 0.00 C ATOM 2134 CD LYS A 134 -15.340 -9.344 2.935 1.00 0.00 C ATOM 2135 CE LYS A 134 -16.538 -8.898 2.111 1.00 0.00 C ATOM 2136 NZ LYS A 134 -17.723 -9.771 2.338 1.00 0.00 N ATOM 0 H LYS A 134 -13.089 -12.532 1.970 1.00 0.00 H new ATOM 0 HA LYS A 134 -12.207 -10.727 -0.203 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -13.172 -8.980 1.580 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -14.163 -9.654 0.302 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -15.271 -11.140 1.764 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -14.018 -11.033 2.984 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -15.677 -9.688 3.913 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -14.678 -8.495 3.106 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -16.791 -7.869 2.366 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -16.276 -8.909 1.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -18.590 -9.198 2.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -17.757 -10.507 1.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -17.651 -10.218 3.274 1.00 0.00 H new ATOM 2150 N LEU A 135 -10.220 -10.029 1.094 1.00 0.00 N ATOM 2151 CA LEU A 135 -8.990 -9.708 1.809 1.00 0.00 C ATOM 2152 C LEU A 135 -9.021 -8.274 2.329 1.00 0.00 C ATOM 2153 O LEU A 135 -8.705 -7.331 1.603 1.00 0.00 O ATOM 2154 CB LEU A 135 -7.779 -9.905 0.895 1.00 0.00 C ATOM 2155 CG LEU A 135 -6.423 -9.518 1.486 1.00 0.00 C ATOM 2156 CD1 LEU A 135 -6.036 -10.472 2.605 1.00 0.00 C ATOM 2157 CD2 LEU A 135 -5.355 -9.502 0.402 1.00 0.00 C ATOM 0 H LEU A 135 -10.208 -9.785 0.104 1.00 0.00 H new ATOM 0 HA LEU A 135 -8.908 -10.383 2.661 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -7.738 -10.953 0.600 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -7.936 -9.324 -0.014 1.00 0.00 H new ATOM 0 HG LEU A 135 -6.503 -8.515 1.905 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -5.068 -10.181 3.013 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -6.789 -10.433 3.393 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -5.973 -11.487 2.212 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -4.396 -9.225 0.840 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -5.276 -10.493 -0.046 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -5.626 -8.777 -0.366 1.00 0.00 H new ATOM 2169 N THR A 136 -9.403 -8.116 3.593 1.00 0.00 N ATOM 2170 CA THR A 136 -9.475 -6.798 4.211 1.00 0.00 C ATOM 2171 C THR A 136 -8.085 -6.277 4.557 1.00 0.00 C ATOM 2172 O THR A 136 -7.538 -6.592 5.616 1.00 0.00 O ATOM 2173 CB THR A 136 -10.335 -6.822 5.488 1.00 0.00 C ATOM 2174 OG1 THR A 136 -11.659 -7.272 5.179 1.00 0.00 O ATOM 2175 CG2 THR A 136 -10.398 -5.442 6.124 1.00 0.00 C ATOM 0 H THR A 136 -9.667 -8.885 4.209 1.00 0.00 H new ATOM 0 HA THR A 136 -9.939 -6.132 3.483 1.00 0.00 H new ATOM 0 HB THR A 136 -9.874 -7.510 6.197 1.00 0.00 H new ATOM 0 HG1 THR A 136 -12.199 -7.286 5.997 1.00 0.00 H new ATOM 0 HG21 THR A 136 -11.011 -5.484 7.024 1.00 0.00 H new ATOM 0 HG22 THR A 136 -9.391 -5.115 6.385 1.00 0.00 H new ATOM 0 HG23 THR A 136 -10.837 -4.736 5.419 1.00 0.00 H new ATOM 2183 N LEU A 137 -7.517 -5.478 3.661 1.00 0.00 N ATOM 2184 CA LEU A 137 -6.189 -4.912 3.872 1.00 0.00 C ATOM 2185 C LEU A 137 -6.278 -3.567 4.586 1.00 0.00 C ATOM 2186 O LEU A 137 -6.768 -2.586 4.025 1.00 0.00 O ATOM 2187 CB LEU A 137 -5.464 -4.747 2.535 1.00 0.00 C ATOM 2188 CG LEU A 137 -4.690 -5.967 2.036 1.00 0.00 C ATOM 2189 CD1 LEU A 137 -4.215 -5.751 0.608 1.00 0.00 C ATOM 2190 CD2 LEU A 137 -3.511 -6.262 2.953 1.00 0.00 C ATOM 0 H LEU A 137 -7.955 -5.207 2.781 1.00 0.00 H new ATOM 0 HA LEU A 137 -5.624 -5.600 4.501 1.00 0.00 H new ATOM 0 HB2 LEU A 137 -6.199 -4.473 1.778 1.00 0.00 H new ATOM 0 HB3 LEU A 137 -4.769 -3.912 2.622 1.00 0.00 H new ATOM 0 HG LEU A 137 -5.359 -6.827 2.048 1.00 0.00 H new ATOM 0 HD11 LEU A 137 -3.666 -6.630 0.270 1.00 0.00 H new ATOM 0 HD12 LEU A 137 -5.076 -5.589 -0.041 1.00 0.00 H new ATOM 0 HD13 LEU A 137 -3.562 -4.879 0.570 1.00 0.00 H new ATOM 0 HD21 LEU A 137 -2.971 -7.134 2.583 1.00 0.00 H new ATOM 0 HD22 LEU A 137 -2.842 -5.402 2.973 1.00 0.00 H new ATOM 0 HD23 LEU A 137 -3.875 -6.462 3.961 1.00 0.00 H new ATOM 2202 N PHE A 138 -5.799 -3.527 5.825 1.00 0.00 N ATOM 2203 CA PHE A 138 -5.823 -2.301 6.614 1.00 0.00 C ATOM 2204 C PHE A 138 -4.454 -1.627 6.615 1.00 0.00 C ATOM 2205 O PHE A 138 -3.528 -2.079 7.289 1.00 0.00 O ATOM 2206 CB PHE A 138 -6.256 -2.603 8.051 1.00 0.00 C ATOM 2207 CG PHE A 138 -6.674 -1.383 8.820 1.00 0.00 C ATOM 2208 CD1 PHE A 138 -5.729 -0.578 9.435 1.00 0.00 C ATOM 2209 CD2 PHE A 138 -8.013 -1.042 8.929 1.00 0.00 C ATOM 2210 CE1 PHE A 138 -6.111 0.546 10.144 1.00 0.00 C ATOM 2211 CE2 PHE A 138 -8.400 0.081 9.635 1.00 0.00 C ATOM 2212 CZ PHE A 138 -7.448 0.875 10.244 1.00 0.00 C ATOM 0 H PHE A 138 -5.390 -4.329 6.304 1.00 0.00 H new ATOM 0 HA PHE A 138 -6.543 -1.620 6.160 1.00 0.00 H new ATOM 0 HB2 PHE A 138 -7.084 -3.312 8.031 1.00 0.00 H new ATOM 0 HB3 PHE A 138 -5.433 -3.089 8.575 1.00 0.00 H new ATOM 0 HD1 PHE A 138 -4.682 -0.831 9.360 1.00 0.00 H new ATOM 0 HD2 PHE A 138 -8.762 -1.661 8.457 1.00 0.00 H new ATOM 0 HE1 PHE A 138 -5.365 1.166 10.619 1.00 0.00 H new ATOM 0 HE2 PHE A 138 -9.446 0.338 9.711 1.00 0.00 H new ATOM 0 HZ PHE A 138 -7.749 1.752 10.798 1.00 0.00 H new ATOM 2222 N CYS A 139 -4.334 -0.545 5.854 1.00 0.00 N ATOM 2223 CA CYS A 139 -3.079 0.191 5.764 1.00 0.00 C ATOM 2224 C CYS A 139 -3.173 1.519 6.508 1.00 0.00 C ATOM 2225 O CYS A 139 -4.225 2.157 6.528 1.00 0.00 O ATOM 2226 CB CYS A 139 -2.711 0.438 4.300 1.00 0.00 C ATOM 2227 SG CYS A 139 -1.042 1.089 4.058 1.00 0.00 S ATOM 0 H CYS A 139 -5.091 -0.158 5.290 1.00 0.00 H new ATOM 0 HA CYS A 139 -2.299 -0.412 6.230 1.00 0.00 H new ATOM 0 HB2 CYS A 139 -2.808 -0.498 3.749 1.00 0.00 H new ATOM 0 HB3 CYS A 139 -3.428 1.137 3.869 1.00 0.00 H new ATOM 0 HG CYS A 139 -0.216 0.104 3.864 1.00 0.00 H new ATOM 2233 N GLU A 140 -2.066 1.929 7.120 1.00 0.00 N ATOM 2234 CA GLU A 140 -2.026 3.180 7.868 1.00 0.00 C ATOM 2235 C GLU A 140 -0.812 4.014 7.468 1.00 0.00 C ATOM 2236 O GLU A 140 0.325 3.547 7.535 1.00 0.00 O ATOM 2237 CB GLU A 140 -1.993 2.901 9.372 1.00 0.00 C ATOM 2238 CG GLU A 140 -3.195 2.117 9.872 1.00 0.00 C ATOM 2239 CD GLU A 140 -3.450 2.322 11.352 1.00 0.00 C ATOM 2240 OE1 GLU A 140 -3.506 3.491 11.789 1.00 0.00 O ATOM 2241 OE2 GLU A 140 -3.596 1.313 12.074 1.00 0.00 O ATOM 0 H GLU A 140 -1.186 1.413 7.112 1.00 0.00 H new ATOM 0 HA GLU A 140 -2.928 3.744 7.630 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -1.084 2.348 9.611 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -1.939 3.849 9.908 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -4.079 2.417 9.310 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -3.039 1.056 9.678 1.00 0.00 H new ATOM 2248 N VAL A 141 -1.063 5.251 7.051 1.00 0.00 N ATOM 2249 CA VAL A 141 0.008 6.151 6.640 1.00 0.00 C ATOM 2250 C VAL A 141 0.148 7.318 7.612 1.00 0.00 C ATOM 2251 O VAL A 141 -0.844 7.910 8.034 1.00 0.00 O ATOM 2252 CB VAL A 141 -0.235 6.704 5.223 1.00 0.00 C ATOM 2253 CG1 VAL A 141 0.946 7.548 4.768 1.00 0.00 C ATOM 2254 CG2 VAL A 141 -0.497 5.567 4.246 1.00 0.00 C ATOM 0 H VAL A 141 -1.999 5.653 6.989 1.00 0.00 H new ATOM 0 HA VAL A 141 0.929 5.568 6.641 1.00 0.00 H new ATOM 0 HB VAL A 141 -1.118 7.343 5.248 1.00 0.00 H new ATOM 0 HG11 VAL A 141 0.755 7.930 3.765 1.00 0.00 H new ATOM 0 HG12 VAL A 141 1.082 8.384 5.454 1.00 0.00 H new ATOM 0 HG13 VAL A 141 1.848 6.936 4.758 1.00 0.00 H new ATOM 0 HG21 VAL A 141 -0.667 5.975 3.250 1.00 0.00 H new ATOM 0 HG22 VAL A 141 0.365 4.901 4.223 1.00 0.00 H new ATOM 0 HG23 VAL A 141 -1.378 5.009 4.564 1.00 0.00 H new ATOM 2264 N SER A 142 1.389 7.644 7.961 1.00 0.00 N ATOM 2265 CA SER A 142 1.660 8.738 8.886 1.00 0.00 C ATOM 2266 C SER A 142 2.560 9.786 8.239 1.00 0.00 C ATOM 2267 O SER A 142 3.737 9.535 7.979 1.00 0.00 O ATOM 2268 CB SER A 142 2.314 8.206 10.162 1.00 0.00 C ATOM 2269 OG SER A 142 1.834 6.910 10.479 1.00 0.00 O ATOM 0 H SER A 142 2.222 7.166 7.617 1.00 0.00 H new ATOM 0 HA SER A 142 0.710 9.208 9.142 1.00 0.00 H new ATOM 0 HB2 SER A 142 3.396 8.175 10.034 1.00 0.00 H new ATOM 0 HB3 SER A 142 2.110 8.885 10.990 1.00 0.00 H new ATOM 0 HG SER A 142 2.268 6.591 11.298 1.00 0.00 H new ATOM 2275 N VAL A 143 1.997 10.962 7.980 1.00 0.00 N ATOM 2276 CA VAL A 143 2.748 12.050 7.365 1.00 0.00 C ATOM 2277 C VAL A 143 3.495 12.866 8.414 1.00 0.00 C ATOM 2278 O VAL A 143 2.888 13.438 9.319 1.00 0.00 O ATOM 2279 CB VAL A 143 1.824 12.987 6.564 1.00 0.00 C ATOM 2280 CG1 VAL A 143 2.623 14.121 5.940 1.00 0.00 C ATOM 2281 CG2 VAL A 143 1.068 12.207 5.499 1.00 0.00 C ATOM 0 H VAL A 143 1.023 11.186 8.187 1.00 0.00 H new ATOM 0 HA VAL A 143 3.467 11.593 6.686 1.00 0.00 H new ATOM 0 HB VAL A 143 1.096 13.422 7.248 1.00 0.00 H new ATOM 0 HG11 VAL A 143 1.953 14.772 5.378 1.00 0.00 H new ATOM 0 HG12 VAL A 143 3.113 14.696 6.726 1.00 0.00 H new ATOM 0 HG13 VAL A 143 3.376 13.709 5.268 1.00 0.00 H new ATOM 0 HG21 VAL A 143 0.420 12.885 4.943 1.00 0.00 H new ATOM 0 HG22 VAL A 143 1.778 11.742 4.816 1.00 0.00 H new ATOM 0 HG23 VAL A 143 0.463 11.435 5.974 1.00 0.00 H new ATOM 2291 N VAL A 144 4.817 12.915 8.286 1.00 0.00 N ATOM 2292 CA VAL A 144 5.648 13.662 9.222 1.00 0.00 C ATOM 2293 C VAL A 144 5.678 15.145 8.869 1.00 0.00 C ATOM 2294 O VAL A 144 6.450 15.572 8.010 1.00 0.00 O ATOM 2295 CB VAL A 144 7.091 13.122 9.247 1.00 0.00 C ATOM 2296 CG1 VAL A 144 7.104 11.652 9.638 1.00 0.00 C ATOM 2297 CG2 VAL A 144 7.760 13.329 7.897 1.00 0.00 C ATOM 0 H VAL A 144 5.335 12.446 7.543 1.00 0.00 H new ATOM 0 HA VAL A 144 5.204 13.536 10.209 1.00 0.00 H new ATOM 0 HB VAL A 144 7.656 13.677 9.996 1.00 0.00 H new ATOM 0 HG11 VAL A 144 8.131 11.288 9.650 1.00 0.00 H new ATOM 0 HG12 VAL A 144 6.666 11.535 10.629 1.00 0.00 H new ATOM 0 HG13 VAL A 144 6.524 11.078 8.915 1.00 0.00 H new ATOM 0 HG21 VAL A 144 8.778 12.942 7.932 1.00 0.00 H new ATOM 0 HG22 VAL A 144 7.198 12.801 7.127 1.00 0.00 H new ATOM 0 HG23 VAL A 144 7.784 14.393 7.662 1.00 0.00 H new ATOM 2307 N GLN A 145 4.834 15.924 9.536 1.00 0.00 N ATOM 2308 CA GLN A 145 4.764 17.360 9.292 1.00 0.00 C ATOM 2309 C GLN A 145 5.001 18.143 10.579 1.00 0.00 C ATOM 2310 O GLN A 145 4.875 17.603 11.678 1.00 0.00 O ATOM 2311 CB GLN A 145 3.404 17.732 8.697 1.00 0.00 C ATOM 2312 CG GLN A 145 2.227 17.132 9.449 1.00 0.00 C ATOM 2313 CD GLN A 145 0.959 17.099 8.618 1.00 0.00 C ATOM 2314 OE1 GLN A 145 0.147 18.023 8.667 1.00 0.00 O ATOM 2315 NE2 GLN A 145 0.783 16.031 7.848 1.00 0.00 N ATOM 0 H GLN A 145 4.189 15.585 10.250 1.00 0.00 H new ATOM 0 HA GLN A 145 5.547 17.621 8.580 1.00 0.00 H new ATOM 0 HB2 GLN A 145 3.305 18.817 8.689 1.00 0.00 H new ATOM 0 HB3 GLN A 145 3.368 17.401 7.659 1.00 0.00 H new ATOM 0 HG2 GLN A 145 2.479 16.118 9.761 1.00 0.00 H new ATOM 0 HG3 GLN A 145 2.048 17.710 10.356 1.00 0.00 H new ATOM 0 HE21 GLN A 145 1.482 15.288 7.838 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -0.051 15.954 7.266 1.00 0.00 H new ATOM 2324 N ASP A 146 5.344 19.418 10.434 1.00 0.00 N ATOM 2325 CA ASP A 146 5.598 20.277 11.585 1.00 0.00 C ATOM 2326 C ASP A 146 4.358 20.385 12.467 1.00 0.00 C ATOM 2327 O ASP A 146 3.238 20.149 12.012 1.00 0.00 O ATOM 2328 CB ASP A 146 6.033 21.669 11.124 1.00 0.00 C ATOM 2329 CG ASP A 146 7.492 21.712 10.713 1.00 0.00 C ATOM 2330 OD1 ASP A 146 8.358 21.428 11.566 1.00 0.00 O ATOM 2331 OD2 ASP A 146 7.768 22.032 9.537 1.00 0.00 O ATOM 0 H ASP A 146 5.453 19.880 9.531 1.00 0.00 H new ATOM 0 HA ASP A 146 6.401 19.829 12.171 1.00 0.00 H new ATOM 0 HB2 ASP A 146 5.412 21.981 10.284 1.00 0.00 H new ATOM 0 HB3 ASP A 146 5.864 22.385 11.929 1.00 0.00 H new ATOM 2336 N SER A 147 4.566 20.741 13.731 1.00 0.00 N ATOM 2337 CA SER A 147 3.465 20.874 14.678 1.00 0.00 C ATOM 2338 C SER A 147 2.556 22.038 14.293 1.00 0.00 C ATOM 2339 O SER A 147 2.784 23.179 14.695 1.00 0.00 O ATOM 2340 CB SER A 147 4.005 21.082 16.094 1.00 0.00 C ATOM 2341 OG SER A 147 4.229 19.841 16.741 1.00 0.00 O ATOM 0 H SER A 147 5.486 20.942 14.123 1.00 0.00 H new ATOM 0 HA SER A 147 2.881 19.954 14.651 1.00 0.00 H new ATOM 0 HB2 SER A 147 4.936 21.647 16.052 1.00 0.00 H new ATOM 0 HB3 SER A 147 3.297 21.675 16.673 1.00 0.00 H new ATOM 0 HG SER A 147 4.576 20.001 17.644 1.00 0.00 H new ATOM 2347 N VAL A 148 1.523 21.739 13.512 1.00 0.00 N ATOM 2348 CA VAL A 148 0.577 22.758 13.072 1.00 0.00 C ATOM 2349 C VAL A 148 -0.455 23.054 14.155 1.00 0.00 C ATOM 2350 O VAL A 148 -0.900 24.191 14.308 1.00 0.00 O ATOM 2351 CB VAL A 148 -0.154 22.329 11.786 1.00 0.00 C ATOM 2352 CG1 VAL A 148 0.648 22.729 10.557 1.00 0.00 C ATOM 2353 CG2 VAL A 148 -0.415 20.831 11.797 1.00 0.00 C ATOM 0 H VAL A 148 1.320 20.799 13.171 1.00 0.00 H new ATOM 0 HA VAL A 148 1.155 23.659 12.868 1.00 0.00 H new ATOM 0 HB VAL A 148 -1.115 22.842 11.746 1.00 0.00 H new ATOM 0 HG11 VAL A 148 0.116 22.418 9.658 1.00 0.00 H new ATOM 0 HG12 VAL A 148 0.779 23.811 10.545 1.00 0.00 H new ATOM 0 HG13 VAL A 148 1.624 22.245 10.586 1.00 0.00 H new ATOM 0 HG21 VAL A 148 -0.932 20.545 10.881 1.00 0.00 H new ATOM 0 HG22 VAL A 148 0.533 20.297 11.860 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -1.033 20.576 12.658 1.00 0.00 H new ATOM 2363 N ASN A 149 -0.830 22.023 14.905 1.00 0.00 N ATOM 2364 CA ASN A 149 -1.810 22.172 15.975 1.00 0.00 C ATOM 2365 C ASN A 149 -2.919 23.136 15.566 1.00 0.00 C ATOM 2366 O ASN A 149 -3.362 23.963 16.363 1.00 0.00 O ATOM 2367 CB ASN A 149 -1.130 22.671 17.251 1.00 0.00 C ATOM 2368 CG ASN A 149 -1.947 22.376 18.494 1.00 0.00 C ATOM 2369 OD1 ASN A 149 -3.068 21.876 18.410 1.00 0.00 O ATOM 2370 ND2 ASN A 149 -1.386 22.687 19.658 1.00 0.00 N ATOM 0 H ASN A 149 -0.470 21.075 14.792 1.00 0.00 H new ATOM 0 HA ASN A 149 -2.254 21.195 16.166 1.00 0.00 H new ATOM 0 HB2 ASN A 149 -0.150 22.203 17.344 1.00 0.00 H new ATOM 0 HB3 ASN A 149 -0.964 23.746 17.175 1.00 0.00 H new ATOM 0 HD21 ASN A 149 -1.888 22.512 20.529 1.00 0.00 H new ATOM 0 HD22 ASN A 149 -0.454 23.100 19.681 1.00 0.00 H new ATOM 2377 N ILE A 150 -3.364 23.022 14.319 1.00 0.00 N ATOM 2378 CA ILE A 150 -4.423 23.882 13.804 1.00 0.00 C ATOM 2379 C ILE A 150 -5.798 23.279 14.069 1.00 0.00 C ATOM 2380 O ILE A 150 -6.318 22.514 13.256 1.00 0.00 O ATOM 2381 CB ILE A 150 -4.264 24.127 12.292 1.00 0.00 C ATOM 2382 CG1 ILE A 150 -2.990 24.928 12.014 1.00 0.00 C ATOM 2383 CG2 ILE A 150 -5.483 24.853 11.743 1.00 0.00 C ATOM 2384 CD1 ILE A 150 -3.046 26.350 12.529 1.00 0.00 C ATOM 0 H ILE A 150 -3.008 22.343 13.647 1.00 0.00 H new ATOM 0 HA ILE A 150 -4.340 24.834 14.328 1.00 0.00 H new ATOM 0 HB ILE A 150 -4.182 23.164 11.789 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -2.142 24.418 12.471 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -2.809 24.946 10.939 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -5.356 25.019 10.673 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -6.374 24.248 11.913 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -5.594 25.812 12.249 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -2.110 26.858 12.297 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -3.873 26.877 12.053 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -3.196 26.340 13.609 1.00 0.00 H new ATOM 2396 N SER A 151 -6.383 23.629 15.210 1.00 0.00 N ATOM 2397 CA SER A 151 -7.698 23.121 15.582 1.00 0.00 C ATOM 2398 C SER A 151 -8.368 24.041 16.598 1.00 0.00 C ATOM 2399 O SER A 151 -7.733 24.513 17.540 1.00 0.00 O ATOM 2400 CB SER A 151 -7.577 21.709 16.159 1.00 0.00 C ATOM 2401 OG SER A 151 -6.958 21.729 17.433 1.00 0.00 O ATOM 0 H SER A 151 -5.967 24.262 15.893 1.00 0.00 H new ATOM 0 HA SER A 151 -8.315 23.088 14.684 1.00 0.00 H new ATOM 0 HB2 SER A 151 -8.567 21.260 16.239 1.00 0.00 H new ATOM 0 HB3 SER A 151 -6.998 21.084 15.480 1.00 0.00 H new ATOM 0 HG SER A 151 -6.894 20.815 17.780 1.00 0.00 H new ATOM 2407 N GLY A 152 -9.658 24.293 16.398 1.00 0.00 N ATOM 2408 CA GLY A 152 -10.395 25.156 17.303 1.00 0.00 C ATOM 2409 C GLY A 152 -11.809 25.424 16.827 1.00 0.00 C ATOM 2410 O GLY A 152 -12.774 24.997 17.458 1.00 0.00 O ATOM 0 H GLY A 152 -10.206 23.915 15.625 1.00 0.00 H new ATOM 0 HA2 GLY A 152 -10.429 24.697 18.291 1.00 0.00 H new ATOM 0 HA3 GLY A 152 -9.865 26.103 17.409 1.00 0.00 H new ATOM 2414 N GLN A 153 -11.930 26.135 15.710 1.00 0.00 N ATOM 2415 CA GLN A 153 -13.236 26.461 15.151 1.00 0.00 C ATOM 2416 C GLN A 153 -13.109 26.925 13.704 1.00 0.00 C ATOM 2417 O GLN A 153 -12.309 27.808 13.393 1.00 0.00 O ATOM 2418 CB GLN A 153 -13.916 27.546 15.989 1.00 0.00 C ATOM 2419 CG GLN A 153 -15.412 27.657 15.742 1.00 0.00 C ATOM 2420 CD GLN A 153 -16.204 26.587 16.467 1.00 0.00 C ATOM 2421 OE1 GLN A 153 -16.194 26.516 17.696 1.00 0.00 O ATOM 2422 NE2 GLN A 153 -16.895 25.745 15.707 1.00 0.00 N ATOM 0 H GLN A 153 -11.140 26.496 15.175 1.00 0.00 H new ATOM 0 HA GLN A 153 -13.847 25.559 15.171 1.00 0.00 H new ATOM 0 HB2 GLN A 153 -13.745 27.338 17.045 1.00 0.00 H new ATOM 0 HB3 GLN A 153 -13.448 28.507 15.773 1.00 0.00 H new ATOM 0 HG2 GLN A 153 -15.757 28.640 16.063 1.00 0.00 H new ATOM 0 HG3 GLN A 153 -15.606 27.585 14.672 1.00 0.00 H new ATOM 0 HE21 GLN A 153 -16.875 25.840 14.692 1.00 0.00 H new ATOM 0 HE22 GLN A 153 -17.446 25.003 16.139 1.00 0.00 H new ATOM 2431 N SER A 154 -13.903 26.324 12.823 1.00 0.00 N ATOM 2432 CA SER A 154 -13.875 26.673 11.407 1.00 0.00 C ATOM 2433 C SER A 154 -13.985 28.183 11.217 1.00 0.00 C ATOM 2434 O SER A 154 -14.799 28.843 11.861 1.00 0.00 O ATOM 2435 CB SER A 154 -15.014 25.970 10.665 1.00 0.00 C ATOM 2436 OG SER A 154 -14.894 26.144 9.264 1.00 0.00 O ATOM 0 H SER A 154 -14.573 25.594 13.065 1.00 0.00 H new ATOM 0 HA SER A 154 -12.922 26.341 10.995 1.00 0.00 H new ATOM 0 HB2 SER A 154 -15.006 24.907 10.904 1.00 0.00 H new ATOM 0 HB3 SER A 154 -15.972 26.366 11.003 1.00 0.00 H new ATOM 0 HG SER A 154 -15.632 25.684 8.813 1.00 0.00 H new ATOM 2442 N GLY A 155 -13.158 28.723 10.327 1.00 0.00 N ATOM 2443 CA GLY A 155 -13.177 30.150 10.068 1.00 0.00 C ATOM 2444 C GLY A 155 -14.190 30.533 9.007 1.00 0.00 C ATOM 2445 O GLY A 155 -15.238 29.904 8.863 1.00 0.00 O ATOM 0 H GLY A 155 -12.475 28.197 9.781 1.00 0.00 H new ATOM 0 HA2 GLY A 155 -13.405 30.681 10.992 1.00 0.00 H new ATOM 0 HA3 GLY A 155 -12.185 30.472 9.752 1.00 0.00 H new ATOM 2449 N PRO A 156 -13.880 31.590 8.241 1.00 0.00 N ATOM 2450 CA PRO A 156 -14.758 32.080 7.175 1.00 0.00 C ATOM 2451 C PRO A 156 -14.827 31.120 5.992 1.00 0.00 C ATOM 2452 O PRO A 156 -15.736 31.202 5.166 1.00 0.00 O ATOM 2453 CB PRO A 156 -14.105 33.399 6.755 1.00 0.00 C ATOM 2454 CG PRO A 156 -12.669 33.244 7.121 1.00 0.00 C ATOM 2455 CD PRO A 156 -12.647 32.387 8.356 1.00 0.00 C ATOM 0 HA PRO A 156 -15.788 32.187 7.514 1.00 0.00 H new ATOM 0 HB2 PRO A 156 -14.224 33.577 5.686 1.00 0.00 H new ATOM 0 HB3 PRO A 156 -14.556 34.246 7.272 1.00 0.00 H new ATOM 0 HG2 PRO A 156 -12.108 32.777 6.312 1.00 0.00 H new ATOM 0 HG3 PRO A 156 -12.208 34.213 7.310 1.00 0.00 H new ATOM 0 HD2 PRO A 156 -11.761 31.753 8.390 1.00 0.00 H new ATOM 0 HD3 PRO A 156 -12.642 32.990 9.264 1.00 0.00 H new ATOM 2463 N SER A 157 -13.861 30.210 5.918 1.00 0.00 N ATOM 2464 CA SER A 157 -13.811 29.235 4.835 1.00 0.00 C ATOM 2465 C SER A 157 -14.836 28.127 5.053 1.00 0.00 C ATOM 2466 O SER A 157 -15.266 27.876 6.179 1.00 0.00 O ATOM 2467 CB SER A 157 -12.408 28.634 4.726 1.00 0.00 C ATOM 2468 OG SER A 157 -11.503 29.553 4.140 1.00 0.00 O ATOM 0 H SER A 157 -13.103 30.128 6.595 1.00 0.00 H new ATOM 0 HA SER A 157 -14.051 29.750 3.905 1.00 0.00 H new ATOM 0 HB2 SER A 157 -12.053 28.351 5.717 1.00 0.00 H new ATOM 0 HB3 SER A 157 -12.445 27.723 4.128 1.00 0.00 H new ATOM 0 HG SER A 157 -10.614 29.145 4.083 1.00 0.00 H new ATOM 2474 N SER A 158 -15.224 27.466 3.966 1.00 0.00 N ATOM 2475 CA SER A 158 -16.202 26.387 4.037 1.00 0.00 C ATOM 2476 C SER A 158 -16.037 25.428 2.862 1.00 0.00 C ATOM 2477 O SER A 158 -15.563 25.812 1.794 1.00 0.00 O ATOM 2478 CB SER A 158 -17.622 26.957 4.049 1.00 0.00 C ATOM 2479 OG SER A 158 -18.573 25.949 4.345 1.00 0.00 O ATOM 0 H SER A 158 -14.876 27.659 3.027 1.00 0.00 H new ATOM 0 HA SER A 158 -16.032 25.835 4.962 1.00 0.00 H new ATOM 0 HB2 SER A 158 -17.691 27.755 4.788 1.00 0.00 H new ATOM 0 HB3 SER A 158 -17.847 27.401 3.079 1.00 0.00 H new ATOM 0 HG SER A 158 -19.472 26.339 4.348 1.00 0.00 H new ATOM 2485 N GLY A 159 -16.434 24.175 3.068 1.00 0.00 N ATOM 2486 CA GLY A 159 -16.323 23.179 2.018 1.00 0.00 C ATOM 2487 C GLY A 159 -17.260 22.007 2.230 1.00 0.00 C ATOM 2488 O GLY A 159 -16.817 20.888 2.489 1.00 0.00 O ATOM 0 H GLY A 159 -16.830 23.832 3.943 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -16.539 23.644 1.056 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -15.296 22.816 1.973 1.00 0.00 H new TER 2492 GLY A 159