USER MOD reduce.3.24.130724 H: found=0, std=0, add=1043, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1029 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 70 TYR OH : rot -46:sc= 1.08 USER MOD Set 1.2: A 117 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 100 ASN : amide:sc= 0.536 K(o=2.3,f=-2.4) USER MOD Set 2.2: A 119 TYR OH : rot -93:sc= 1.76 USER MOD Set 3.1: A 13 ASN : amide:sc= 1.24 K(o=1.7,f=-2.5) USER MOD Set 3.2: A 16 LYS NZ :NH3+ 175:sc= 0.434 (180deg=0) USER MOD Set 4.1: A 5 THR OG1 : rot 180:sc= 1.01 USER MOD Set 4.2: A 39 THR OG1 : rot -77:sc= 1.26 USER MOD Single : A 4 SER OG : rot 18:sc= 1.17 USER MOD Single : A 7 LYS NZ :NH3+ 159:sc= 0.0481 (180deg=0.00501) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 14 TYR OH : rot -173:sc= 1.15 USER MOD Single : A 18 MET CE :methyl -145:sc= -0.0533 (180deg=-0.916) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 24 ASN : amide:sc= 0.139 X(o=0.14,f=-0.0077) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 HIS : no HD1:sc= 0 X(o=0,f=-0.0096) USER MOD Single : A 35 ASN : amide:sc= 0.0368 X(o=0.037,f=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 GLN : amide:sc= 0.78 K(o=0.78,f=-0.13) USER MOD Single : A 45 ASN : amide:sc= 1.09 K(o=1.1,f=0) USER MOD Single : A 46 LYS NZ :NH3+ 150:sc= 0.862 (180deg=0.321) USER MOD Single : A 48 THR OG1 : rot 176:sc= 0.847 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot -46:sc= 1.57 USER MOD Single : A 54 THR OG1 : rot -85:sc= 1.13 USER MOD Single : A 57 ASN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 67 THR OG1 : rot 43:sc= 0.786 USER MOD Single : A 69 ASN : amide:sc= 1.21 K(o=1.2,f=-0.17) USER MOD Single : A 71 ASN : amide:sc= 0.191 X(o=0.19,f=0) USER MOD Single : A 76 THR OG1 : rot -154:sc= 0.337 USER MOD Single : A 81 THR OG1 : rot 28:sc= 0.917 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 LYS NZ :NH3+ 169:sc= 0.305 (180deg=0.166) USER MOD Single : A 92 LYS NZ :NH3+ -123:sc= 0.456 (180deg=-0.0012) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.289 USER MOD Single : A 98 ASN : amide:sc= -0.0577 X(o=-0.058,f=-0.11) USER MOD Single : A 103 ASN : amide:sc= 1.09 K(o=1.1,f=-1.8!) USER MOD Single : A 104 THR OG1 : rot -52:sc= 0.835 USER MOD Single : A 115 GLN : amide:sc= 0.474 K(o=0.47,f=-6.1!) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 LYS NZ :NH3+ -108:sc= 1.16 (180deg=-0.0154) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 11 N PHE A 2 4.748 2.077 0.285 1.00 0.00 N ATOM 12 CA PHE A 2 6.234 2.249 0.109 1.00 0.00 C ATOM 13 C PHE A 2 6.771 3.619 -0.460 1.00 0.00 C ATOM 14 O PHE A 2 7.990 3.784 -0.552 1.00 0.00 O ATOM 15 CB PHE A 2 6.890 1.036 -0.633 1.00 0.00 C ATOM 16 CG PHE A 2 6.765 -0.364 -0.007 1.00 0.00 C ATOM 17 CD1 PHE A 2 5.598 -1.117 -0.181 1.00 0.00 C ATOM 18 CD2 PHE A 2 7.834 -0.919 0.704 1.00 0.00 C ATOM 19 CE1 PHE A 2 5.488 -2.387 0.377 1.00 0.00 C ATOM 20 CE2 PHE A 2 7.725 -2.195 1.252 1.00 0.00 C ATOM 21 CZ PHE A 2 6.553 -2.926 1.087 1.00 0.00 C ATOM 0 HA PHE A 2 6.563 2.279 1.148 1.00 0.00 H new ATOM 0 HB2 PHE A 2 6.463 0.990 -1.635 1.00 0.00 H new ATOM 0 HB3 PHE A 2 7.952 1.253 -0.749 1.00 0.00 H new ATOM 0 HD1 PHE A 2 4.777 -0.709 -0.752 1.00 0.00 H new ATOM 0 HD2 PHE A 2 8.747 -0.356 0.829 1.00 0.00 H new ATOM 0 HE1 PHE A 2 4.576 -2.953 0.258 1.00 0.00 H new ATOM 0 HE2 PHE A 2 8.551 -2.617 1.805 1.00 0.00 H new ATOM 0 HZ PHE A 2 6.471 -3.915 1.512 1.00 0.00 H new ATOM 31 N ASP A 3 5.908 4.593 -0.811 1.00 0.00 N ATOM 32 CA ASP A 3 6.285 5.823 -1.560 1.00 0.00 C ATOM 33 C ASP A 3 7.131 6.825 -0.696 1.00 0.00 C ATOM 34 O ASP A 3 6.609 7.515 0.187 1.00 0.00 O ATOM 35 CB ASP A 3 4.944 6.412 -2.075 1.00 0.00 C ATOM 36 CG ASP A 3 5.112 7.478 -3.151 1.00 0.00 C ATOM 37 OD1 ASP A 3 5.346 8.657 -2.808 1.00 0.00 O ATOM 38 OD2 ASP A 3 5.004 7.134 -4.348 1.00 0.00 O ATOM 0 H ASP A 3 4.915 4.553 -0.582 1.00 0.00 H new ATOM 0 HA ASP A 3 6.953 5.602 -2.393 1.00 0.00 H new ATOM 0 HB2 ASP A 3 4.331 5.603 -2.472 1.00 0.00 H new ATOM 0 HB3 ASP A 3 4.400 6.841 -1.234 1.00 0.00 H new ATOM 43 N SER A 4 8.459 6.836 -0.916 1.00 0.00 N ATOM 44 CA SER A 4 9.450 7.671 -0.166 1.00 0.00 C ATOM 45 C SER A 4 10.904 7.408 -0.696 1.00 0.00 C ATOM 46 O SER A 4 11.194 6.433 -1.400 1.00 0.00 O ATOM 47 CB SER A 4 9.390 7.472 1.381 1.00 0.00 C ATOM 48 OG SER A 4 8.227 8.080 1.934 1.00 0.00 O ATOM 0 H SER A 4 8.895 6.256 -1.633 1.00 0.00 H new ATOM 0 HA SER A 4 9.175 8.709 -0.352 1.00 0.00 H new ATOM 0 HB2 SER A 4 9.392 6.407 1.614 1.00 0.00 H new ATOM 0 HB3 SER A 4 10.281 7.901 1.840 1.00 0.00 H new ATOM 0 HG SER A 4 7.572 8.240 1.223 1.00 0.00 H new ATOM 54 N THR A 5 11.837 8.302 -0.322 1.00 0.00 N ATOM 55 CA THR A 5 13.303 8.083 -0.506 1.00 0.00 C ATOM 56 C THR A 5 13.914 7.524 0.818 1.00 0.00 C ATOM 57 O THR A 5 13.957 8.223 1.832 1.00 0.00 O ATOM 58 CB THR A 5 13.930 9.404 -1.041 1.00 0.00 C ATOM 59 OG1 THR A 5 13.452 9.637 -2.365 1.00 0.00 O ATOM 60 CG2 THR A 5 15.458 9.413 -1.141 1.00 0.00 C ATOM 0 H THR A 5 11.609 9.195 0.115 1.00 0.00 H new ATOM 0 HA THR A 5 13.527 7.323 -1.255 1.00 0.00 H new ATOM 0 HB THR A 5 13.639 10.163 -0.315 1.00 0.00 H new ATOM 0 HG1 THR A 5 13.840 10.468 -2.711 1.00 0.00 H new ATOM 0 HG21 THR A 5 15.792 10.377 -1.524 1.00 0.00 H new ATOM 0 HG22 THR A 5 15.888 9.246 -0.154 1.00 0.00 H new ATOM 0 HG23 THR A 5 15.783 8.622 -1.817 1.00 0.00 H new ATOM 68 N TRP A 6 14.363 6.258 0.812 1.00 0.00 N ATOM 69 CA TRP A 6 14.774 5.539 2.053 1.00 0.00 C ATOM 70 C TRP A 6 16.328 5.353 2.090 1.00 0.00 C ATOM 71 O TRP A 6 16.875 4.620 1.266 1.00 0.00 O ATOM 72 CB TRP A 6 14.043 4.166 2.138 1.00 0.00 C ATOM 73 CG TRP A 6 12.510 4.123 2.082 1.00 0.00 C ATOM 74 CD1 TRP A 6 11.728 3.965 0.917 1.00 0.00 C ATOM 75 CD2 TRP A 6 11.611 4.147 3.132 1.00 0.00 C ATOM 76 NE1 TRP A 6 10.355 3.889 1.215 1.00 0.00 N ATOM 77 CE2 TRP A 6 10.307 4.013 2.593 1.00 0.00 C ATOM 78 CE3 TRP A 6 11.801 4.282 4.531 1.00 0.00 C ATOM 79 CZ2 TRP A 6 9.180 4.053 3.447 1.00 0.00 C ATOM 80 CZ3 TRP A 6 10.675 4.294 5.354 1.00 0.00 C ATOM 81 CH2 TRP A 6 9.385 4.182 4.823 1.00 0.00 C ATOM 0 H TRP A 6 14.455 5.700 -0.037 1.00 0.00 H new ATOM 0 HA TRP A 6 14.489 6.135 2.920 1.00 0.00 H new ATOM 0 HB2 TRP A 6 14.417 3.545 1.324 1.00 0.00 H new ATOM 0 HB3 TRP A 6 14.350 3.689 3.069 1.00 0.00 H new ATOM 0 HD1 TRP A 6 12.135 3.909 -0.082 1.00 0.00 H new ATOM 0 HE1 TRP A 6 9.576 3.770 0.567 1.00 0.00 H new ATOM 0 HE3 TRP A 6 12.793 4.373 4.949 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 8.181 3.985 3.043 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 10.801 4.392 6.422 1.00 0.00 H new ATOM 0 HH2 TRP A 6 8.534 4.196 5.488 1.00 0.00 H new ATOM 92 N LYS A 7 17.041 5.985 3.039 1.00 0.00 N ATOM 93 CA LYS A 7 18.529 5.872 3.185 1.00 0.00 C ATOM 94 C LYS A 7 18.951 4.738 4.181 1.00 0.00 C ATOM 95 O LYS A 7 18.381 4.646 5.274 1.00 0.00 O ATOM 96 CB LYS A 7 19.012 7.286 3.629 1.00 0.00 C ATOM 97 CG LYS A 7 20.496 7.453 4.047 1.00 0.00 C ATOM 98 CD LYS A 7 21.575 7.097 3.000 1.00 0.00 C ATOM 99 CE LYS A 7 21.688 8.095 1.839 1.00 0.00 C ATOM 100 NZ LYS A 7 22.853 7.756 0.996 1.00 0.00 N ATOM 0 H LYS A 7 16.613 6.594 3.736 1.00 0.00 H new ATOM 0 HA LYS A 7 19.000 5.577 2.247 1.00 0.00 H new ATOM 0 HB2 LYS A 7 18.817 7.978 2.810 1.00 0.00 H new ATOM 0 HB3 LYS A 7 18.392 7.602 4.468 1.00 0.00 H new ATOM 0 HG2 LYS A 7 20.647 8.490 4.346 1.00 0.00 H new ATOM 0 HG3 LYS A 7 20.668 6.838 4.930 1.00 0.00 H new ATOM 0 HD2 LYS A 7 22.541 7.030 3.500 1.00 0.00 H new ATOM 0 HD3 LYS A 7 21.357 6.109 2.594 1.00 0.00 H new ATOM 0 HE2 LYS A 7 20.777 8.075 1.241 1.00 0.00 H new ATOM 0 HE3 LYS A 7 21.792 9.108 2.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 22.734 8.178 0.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 23.719 8.128 1.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 22.927 6.723 0.906 1.00 0.00 H new ATOM 113 N VAL A 8 19.961 3.891 3.847 1.00 0.00 N ATOM 114 CA VAL A 8 20.390 2.779 4.755 1.00 0.00 C ATOM 115 C VAL A 8 21.210 3.266 6.001 1.00 0.00 C ATOM 116 O VAL A 8 22.196 4.001 5.884 1.00 0.00 O ATOM 117 CB VAL A 8 21.055 1.594 3.976 1.00 0.00 C ATOM 118 CG1 VAL A 8 22.508 1.826 3.514 1.00 0.00 C ATOM 119 CG2 VAL A 8 20.967 0.267 4.767 1.00 0.00 C ATOM 0 H VAL A 8 20.487 3.949 2.975 1.00 0.00 H new ATOM 0 HA VAL A 8 19.475 2.369 5.183 1.00 0.00 H new ATOM 0 HB VAL A 8 20.462 1.530 3.064 1.00 0.00 H new ATOM 0 HG11 VAL A 8 22.867 0.943 2.986 1.00 0.00 H new ATOM 0 HG12 VAL A 8 22.545 2.687 2.847 1.00 0.00 H new ATOM 0 HG13 VAL A 8 23.140 2.012 4.382 1.00 0.00 H new ATOM 0 HG21 VAL A 8 21.439 -0.531 4.193 1.00 0.00 H new ATOM 0 HG22 VAL A 8 21.479 0.379 5.723 1.00 0.00 H new ATOM 0 HG23 VAL A 8 19.921 0.017 4.943 1.00 0.00 H new ATOM 129 N ASP A 9 20.776 2.810 7.183 1.00 0.00 N ATOM 130 CA ASP A 9 21.371 3.188 8.495 1.00 0.00 C ATOM 131 C ASP A 9 21.934 1.933 9.237 1.00 0.00 C ATOM 132 O ASP A 9 23.141 1.827 9.469 1.00 0.00 O ATOM 133 CB ASP A 9 20.249 3.961 9.243 1.00 0.00 C ATOM 134 CG ASP A 9 20.570 4.474 10.654 1.00 0.00 C ATOM 135 OD1 ASP A 9 20.667 3.652 11.592 1.00 0.00 O ATOM 136 OD2 ASP A 9 20.644 5.705 10.846 1.00 0.00 O ATOM 0 H ASP A 9 19.994 2.161 7.269 1.00 0.00 H new ATOM 0 HA ASP A 9 22.246 3.832 8.409 1.00 0.00 H new ATOM 0 HB2 ASP A 9 19.962 4.815 8.630 1.00 0.00 H new ATOM 0 HB3 ASP A 9 19.378 3.310 9.311 1.00 0.00 H new ATOM 141 N ARG A 10 21.048 1.001 9.625 1.00 0.00 N ATOM 142 CA ARG A 10 21.370 -0.080 10.597 1.00 0.00 C ATOM 143 C ARG A 10 21.250 -1.489 9.944 1.00 0.00 C ATOM 144 O ARG A 10 20.301 -2.234 10.200 1.00 0.00 O ATOM 145 CB ARG A 10 20.595 0.130 11.939 1.00 0.00 C ATOM 146 CG ARG A 10 19.040 0.105 12.003 1.00 0.00 C ATOM 147 CD ARG A 10 18.319 1.288 11.311 1.00 0.00 C ATOM 148 NE ARG A 10 17.224 1.887 12.118 1.00 0.00 N ATOM 149 CZ ARG A 10 17.379 2.862 13.017 1.00 0.00 C ATOM 150 NH1 ARG A 10 18.535 3.406 13.325 1.00 0.00 N ATOM 151 NH2 ARG A 10 16.319 3.323 13.609 1.00 0.00 N ATOM 0 H ARG A 10 20.089 0.968 9.280 1.00 0.00 H new ATOM 0 HA ARG A 10 22.420 -0.021 10.882 1.00 0.00 H new ATOM 0 HB2 ARG A 10 20.951 -0.633 12.631 1.00 0.00 H new ATOM 0 HB3 ARG A 10 20.911 1.094 12.338 1.00 0.00 H new ATOM 0 HG2 ARG A 10 18.691 -0.823 11.551 1.00 0.00 H new ATOM 0 HG3 ARG A 10 18.738 0.082 13.050 1.00 0.00 H new ATOM 0 HD2 ARG A 10 19.052 2.062 11.081 1.00 0.00 H new ATOM 0 HD3 ARG A 10 17.910 0.944 10.361 1.00 0.00 H new ATOM 0 HE ARG A 10 16.281 1.525 11.974 1.00 0.00 H new ATOM 0 HH11 ARG A 10 19.388 3.086 12.866 1.00 0.00 H new ATOM 0 HH12 ARG A 10 18.579 4.149 14.023 1.00 0.00 H new ATOM 0 HH21 ARG A 10 15.401 2.940 13.382 1.00 0.00 H new ATOM 0 HH22 ARG A 10 16.404 4.068 14.301 1.00 0.00 H new ATOM 165 N SER A 11 22.239 -1.871 9.110 1.00 0.00 N ATOM 166 CA SER A 11 22.295 -3.236 8.515 1.00 0.00 C ATOM 167 C SER A 11 22.991 -4.297 9.413 1.00 0.00 C ATOM 168 O SER A 11 24.018 -4.045 10.048 1.00 0.00 O ATOM 169 CB SER A 11 22.876 -3.245 7.086 1.00 0.00 C ATOM 170 OG SER A 11 24.092 -2.511 6.937 1.00 0.00 O ATOM 0 H SER A 11 23.009 -1.263 8.830 1.00 0.00 H new ATOM 0 HA SER A 11 21.250 -3.538 8.448 1.00 0.00 H new ATOM 0 HB2 SER A 11 23.051 -4.278 6.785 1.00 0.00 H new ATOM 0 HB3 SER A 11 22.133 -2.835 6.402 1.00 0.00 H new ATOM 0 HG SER A 11 24.396 -2.566 6.007 1.00 0.00 H new ATOM 176 N GLU A 12 22.399 -5.499 9.422 1.00 0.00 N ATOM 177 CA GLU A 12 22.702 -6.560 10.415 1.00 0.00 C ATOM 178 C GLU A 12 23.792 -7.553 9.882 1.00 0.00 C ATOM 179 O GLU A 12 24.984 -7.242 9.967 1.00 0.00 O ATOM 180 CB GLU A 12 21.278 -7.031 10.857 1.00 0.00 C ATOM 181 CG GLU A 12 21.116 -8.338 11.677 1.00 0.00 C ATOM 182 CD GLU A 12 20.771 -9.594 10.880 1.00 0.00 C ATOM 183 OE1 GLU A 12 20.694 -9.539 9.628 1.00 0.00 O ATOM 184 OE2 GLU A 12 20.617 -10.653 11.514 1.00 0.00 O ATOM 0 H GLU A 12 21.691 -5.772 8.740 1.00 0.00 H new ATOM 0 HA GLU A 12 23.229 -6.284 11.328 1.00 0.00 H new ATOM 0 HB2 GLU A 12 20.836 -6.224 11.441 1.00 0.00 H new ATOM 0 HB3 GLU A 12 20.676 -7.137 9.954 1.00 0.00 H new ATOM 0 HG2 GLU A 12 22.044 -8.520 12.219 1.00 0.00 H new ATOM 0 HG3 GLU A 12 20.337 -8.180 12.423 1.00 0.00 H new ATOM 191 N ASN A 13 23.439 -8.724 9.331 1.00 0.00 N ATOM 192 CA ASN A 13 24.417 -9.822 9.046 1.00 0.00 C ATOM 193 C ASN A 13 24.868 -9.880 7.539 1.00 0.00 C ATOM 194 O ASN A 13 24.895 -10.932 6.891 1.00 0.00 O ATOM 195 CB ASN A 13 23.710 -11.065 9.658 1.00 0.00 C ATOM 196 CG ASN A 13 24.453 -12.396 9.642 1.00 0.00 C ATOM 197 OD1 ASN A 13 25.340 -12.652 10.447 1.00 0.00 O ATOM 198 ND2 ASN A 13 24.074 -13.306 8.782 1.00 0.00 N ATOM 0 H ASN A 13 22.480 -8.950 9.067 1.00 0.00 H new ATOM 0 HA ASN A 13 25.403 -9.698 9.495 1.00 0.00 H new ATOM 0 HB2 ASN A 13 23.466 -10.832 10.694 1.00 0.00 H new ATOM 0 HB3 ASN A 13 22.766 -11.204 9.131 1.00 0.00 H new ATOM 0 HD21 ASN A 13 24.517 -14.225 8.783 1.00 0.00 H new ATOM 0 HD22 ASN A 13 23.336 -13.097 8.110 1.00 0.00 H new ATOM 205 N TYR A 14 25.288 -8.723 6.993 1.00 0.00 N ATOM 206 CA TYR A 14 25.564 -8.554 5.536 1.00 0.00 C ATOM 207 C TYR A 14 26.913 -9.160 5.021 1.00 0.00 C ATOM 208 O TYR A 14 26.925 -9.772 3.951 1.00 0.00 O ATOM 209 CB TYR A 14 25.353 -7.043 5.217 1.00 0.00 C ATOM 210 CG TYR A 14 25.225 -6.577 3.747 1.00 0.00 C ATOM 211 CD1 TYR A 14 24.681 -7.377 2.725 1.00 0.00 C ATOM 212 CD2 TYR A 14 25.602 -5.269 3.445 1.00 0.00 C ATOM 213 CE1 TYR A 14 24.572 -6.877 1.426 1.00 0.00 C ATOM 214 CE2 TYR A 14 25.498 -4.777 2.147 1.00 0.00 C ATOM 215 CZ TYR A 14 24.974 -5.579 1.136 1.00 0.00 C ATOM 216 OH TYR A 14 24.811 -5.062 -0.129 1.00 0.00 O ATOM 0 H TYR A 14 25.448 -7.876 7.539 1.00 0.00 H new ATOM 0 HA TYR A 14 24.863 -9.161 4.963 1.00 0.00 H new ATOM 0 HB2 TYR A 14 24.451 -6.724 5.739 1.00 0.00 H new ATOM 0 HB3 TYR A 14 26.187 -6.498 5.659 1.00 0.00 H new ATOM 0 HD1 TYR A 14 24.347 -8.380 2.946 1.00 0.00 H new ATOM 0 HD2 TYR A 14 25.980 -4.629 4.229 1.00 0.00 H new ATOM 0 HE1 TYR A 14 24.173 -7.503 0.642 1.00 0.00 H new ATOM 0 HE2 TYR A 14 25.824 -3.772 1.924 1.00 0.00 H new ATOM 0 HH TYR A 14 25.246 -4.185 -0.183 1.00 0.00 H new ATOM 226 N ASP A 15 28.023 -9.050 5.778 1.00 0.00 N ATOM 227 CA ASP A 15 29.316 -9.725 5.429 1.00 0.00 C ATOM 228 C ASP A 15 29.291 -11.294 5.405 1.00 0.00 C ATOM 229 O ASP A 15 29.887 -11.883 4.500 1.00 0.00 O ATOM 230 CB ASP A 15 30.458 -9.207 6.346 1.00 0.00 C ATOM 231 CG ASP A 15 30.910 -7.772 6.078 1.00 0.00 C ATOM 232 OD1 ASP A 15 31.794 -7.691 5.043 1.00 0.00 O ATOM 233 OD2 ASP A 15 30.522 -6.804 6.721 1.00 0.00 O ATOM 0 H ASP A 15 28.063 -8.503 6.638 1.00 0.00 H new ATOM 0 HA ASP A 15 29.500 -9.447 4.391 1.00 0.00 H new ATOM 0 HB2 ASP A 15 30.130 -9.280 7.383 1.00 0.00 H new ATOM 0 HB3 ASP A 15 31.318 -9.868 6.236 1.00 0.00 H new ATOM 238 N LYS A 16 28.611 -11.963 6.355 1.00 0.00 N ATOM 239 CA LYS A 16 28.346 -13.435 6.295 1.00 0.00 C ATOM 240 C LYS A 16 27.379 -13.889 5.149 1.00 0.00 C ATOM 241 O LYS A 16 27.708 -14.849 4.446 1.00 0.00 O ATOM 242 CB LYS A 16 27.871 -13.907 7.694 1.00 0.00 C ATOM 243 CG LYS A 16 28.994 -14.023 8.761 1.00 0.00 C ATOM 244 CD LYS A 16 28.557 -13.573 10.170 1.00 0.00 C ATOM 245 CE LYS A 16 28.604 -12.044 10.348 1.00 0.00 C ATOM 246 NZ LYS A 16 27.913 -11.654 11.590 1.00 0.00 N ATOM 0 H LYS A 16 28.227 -11.513 7.186 1.00 0.00 H new ATOM 0 HA LYS A 16 29.284 -13.924 6.030 1.00 0.00 H new ATOM 0 HB2 LYS A 16 27.114 -13.212 8.058 1.00 0.00 H new ATOM 0 HB3 LYS A 16 27.388 -14.878 7.589 1.00 0.00 H new ATOM 0 HG2 LYS A 16 29.333 -15.058 8.808 1.00 0.00 H new ATOM 0 HG3 LYS A 16 29.847 -13.422 8.445 1.00 0.00 H new ATOM 0 HD2 LYS A 16 27.544 -13.926 10.361 1.00 0.00 H new ATOM 0 HD3 LYS A 16 29.203 -14.041 10.913 1.00 0.00 H new ATOM 0 HE2 LYS A 16 29.640 -11.706 10.378 1.00 0.00 H new ATOM 0 HE3 LYS A 16 28.134 -11.557 9.494 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 28.024 -10.631 11.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 26.902 -11.885 11.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 28.325 -12.171 12.393 1.00 0.00 H new ATOM 259 N PHE A 17 26.246 -13.189 4.896 1.00 0.00 N ATOM 260 CA PHE A 17 25.486 -13.298 3.609 1.00 0.00 C ATOM 261 C PHE A 17 26.371 -13.215 2.313 1.00 0.00 C ATOM 262 O PHE A 17 26.355 -14.144 1.501 1.00 0.00 O ATOM 263 CB PHE A 17 24.349 -12.237 3.708 1.00 0.00 C ATOM 264 CG PHE A 17 23.453 -12.009 2.477 1.00 0.00 C ATOM 265 CD1 PHE A 17 23.817 -11.046 1.527 1.00 0.00 C ATOM 266 CD2 PHE A 17 22.251 -12.705 2.318 1.00 0.00 C ATOM 267 CE1 PHE A 17 23.001 -10.795 0.428 1.00 0.00 C ATOM 268 CE2 PHE A 17 21.434 -12.451 1.218 1.00 0.00 C ATOM 269 CZ PHE A 17 21.809 -11.496 0.275 1.00 0.00 C ATOM 0 H PHE A 17 25.831 -12.539 5.563 1.00 0.00 H new ATOM 0 HA PHE A 17 25.064 -14.296 3.488 1.00 0.00 H new ATOM 0 HB2 PHE A 17 23.704 -12.518 4.541 1.00 0.00 H new ATOM 0 HB3 PHE A 17 24.807 -11.282 3.967 1.00 0.00 H new ATOM 0 HD1 PHE A 17 24.738 -10.494 1.648 1.00 0.00 H new ATOM 0 HD2 PHE A 17 21.955 -13.442 3.050 1.00 0.00 H new ATOM 0 HE1 PHE A 17 23.293 -10.057 -0.305 1.00 0.00 H new ATOM 0 HE2 PHE A 17 20.509 -12.995 1.096 1.00 0.00 H new ATOM 0 HZ PHE A 17 21.173 -11.300 -0.576 1.00 0.00 H new ATOM 279 N MET A 18 27.173 -12.147 2.158 1.00 0.00 N ATOM 280 CA MET A 18 28.118 -11.997 1.017 1.00 0.00 C ATOM 281 C MET A 18 29.301 -13.025 0.936 1.00 0.00 C ATOM 282 O MET A 18 29.648 -13.444 -0.173 1.00 0.00 O ATOM 283 CB MET A 18 28.576 -10.520 0.933 1.00 0.00 C ATOM 284 CG MET A 18 27.446 -9.518 0.611 1.00 0.00 C ATOM 285 SD MET A 18 28.116 -8.018 -0.125 1.00 0.00 S ATOM 286 CE MET A 18 27.903 -8.499 -1.849 1.00 0.00 C ATOM 0 H MET A 18 27.191 -11.364 2.811 1.00 0.00 H new ATOM 0 HA MET A 18 27.556 -12.265 0.122 1.00 0.00 H new ATOM 0 HB2 MET A 18 29.034 -10.240 1.882 1.00 0.00 H new ATOM 0 HB3 MET A 18 29.349 -10.435 0.169 1.00 0.00 H new ATOM 0 HG2 MET A 18 26.731 -9.976 -0.072 1.00 0.00 H new ATOM 0 HG3 MET A 18 26.902 -9.270 1.523 1.00 0.00 H new ATOM 0 HE1 MET A 18 28.726 -8.101 -2.442 1.00 0.00 H new ATOM 0 HE2 MET A 18 27.893 -9.586 -1.925 1.00 0.00 H new ATOM 0 HE3 MET A 18 26.960 -8.101 -2.224 1.00 0.00 H new ATOM 296 N GLU A 19 29.870 -13.503 2.061 1.00 0.00 N ATOM 297 CA GLU A 19 30.727 -14.728 2.083 1.00 0.00 C ATOM 298 C GLU A 19 30.091 -16.024 1.465 1.00 0.00 C ATOM 299 O GLU A 19 30.736 -16.678 0.640 1.00 0.00 O ATOM 300 CB GLU A 19 31.241 -14.938 3.534 1.00 0.00 C ATOM 301 CG GLU A 19 32.352 -16.018 3.688 1.00 0.00 C ATOM 302 CD GLU A 19 33.367 -15.745 4.785 1.00 0.00 C ATOM 303 OE1 GLU A 19 33.106 -16.074 5.956 1.00 0.00 O ATOM 304 OE2 GLU A 19 34.427 -15.157 4.469 1.00 0.00 O ATOM 0 H GLU A 19 29.757 -13.064 2.975 1.00 0.00 H new ATOM 0 HA GLU A 19 31.561 -14.546 1.405 1.00 0.00 H new ATOM 0 HB2 GLU A 19 31.623 -13.989 3.909 1.00 0.00 H new ATOM 0 HB3 GLU A 19 30.397 -15.214 4.166 1.00 0.00 H new ATOM 0 HG2 GLU A 19 31.878 -16.980 3.884 1.00 0.00 H new ATOM 0 HG3 GLU A 19 32.881 -16.111 2.740 1.00 0.00 H new ATOM 311 N LYS A 20 28.830 -16.356 1.803 1.00 0.00 N ATOM 312 CA LYS A 20 28.035 -17.387 1.082 1.00 0.00 C ATOM 313 C LYS A 20 27.714 -17.058 -0.422 1.00 0.00 C ATOM 314 O LYS A 20 27.828 -17.959 -1.257 1.00 0.00 O ATOM 315 CB LYS A 20 26.763 -17.693 1.927 1.00 0.00 C ATOM 316 CG LYS A 20 26.905 -18.746 3.054 1.00 0.00 C ATOM 317 CD LYS A 20 27.658 -18.250 4.305 1.00 0.00 C ATOM 318 CE LYS A 20 27.814 -19.338 5.378 1.00 0.00 C ATOM 319 NZ LYS A 20 28.493 -18.769 6.560 1.00 0.00 N ATOM 0 H LYS A 20 28.329 -15.923 2.579 1.00 0.00 H new ATOM 0 HA LYS A 20 28.652 -18.281 0.992 1.00 0.00 H new ATOM 0 HB2 LYS A 20 26.422 -16.760 2.376 1.00 0.00 H new ATOM 0 HB3 LYS A 20 25.978 -18.026 1.249 1.00 0.00 H new ATOM 0 HG2 LYS A 20 25.910 -19.076 3.352 1.00 0.00 H new ATOM 0 HG3 LYS A 20 27.424 -19.618 2.655 1.00 0.00 H new ATOM 0 HD2 LYS A 20 28.645 -17.892 4.011 1.00 0.00 H new ATOM 0 HD3 LYS A 20 27.125 -17.400 4.731 1.00 0.00 H new ATOM 0 HE2 LYS A 20 26.836 -19.729 5.660 1.00 0.00 H new ATOM 0 HE3 LYS A 20 28.390 -20.175 4.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 28.599 -19.505 7.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 29.432 -18.416 6.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 27.927 -17.985 6.942 1.00 0.00 H new ATOM 332 N MET A 21 27.356 -15.808 -0.796 1.00 0.00 N ATOM 333 CA MET A 21 27.268 -15.376 -2.229 1.00 0.00 C ATOM 334 C MET A 21 28.554 -15.611 -3.102 1.00 0.00 C ATOM 335 O MET A 21 28.444 -16.176 -4.198 1.00 0.00 O ATOM 336 CB MET A 21 26.786 -13.901 -2.328 1.00 0.00 C ATOM 337 CG MET A 21 25.345 -13.618 -1.845 1.00 0.00 C ATOM 338 SD MET A 21 24.145 -14.665 -2.699 1.00 0.00 S ATOM 339 CE MET A 21 23.993 -13.842 -4.294 1.00 0.00 C ATOM 0 H MET A 21 27.121 -15.072 -0.130 1.00 0.00 H new ATOM 0 HA MET A 21 26.527 -16.044 -2.669 1.00 0.00 H new ATOM 0 HB2 MET A 21 27.469 -13.278 -1.750 1.00 0.00 H new ATOM 0 HB3 MET A 21 26.867 -13.584 -3.368 1.00 0.00 H new ATOM 0 HG2 MET A 21 25.280 -13.789 -0.771 1.00 0.00 H new ATOM 0 HG3 MET A 21 25.102 -12.569 -2.016 1.00 0.00 H new ATOM 0 HE1 MET A 21 23.283 -14.385 -4.918 1.00 0.00 H new ATOM 0 HE2 MET A 21 23.639 -12.822 -4.145 1.00 0.00 H new ATOM 0 HE3 MET A 21 24.965 -13.820 -4.786 1.00 0.00 H new ATOM 349 N GLY A 22 29.740 -15.203 -2.615 1.00 0.00 N ATOM 350 CA GLY A 22 31.046 -15.524 -3.254 1.00 0.00 C ATOM 351 C GLY A 22 31.912 -14.292 -3.574 1.00 0.00 C ATOM 352 O GLY A 22 32.166 -14.011 -4.746 1.00 0.00 O ATOM 0 H GLY A 22 29.829 -14.641 -1.768 1.00 0.00 H new ATOM 0 HA2 GLY A 22 31.607 -16.187 -2.595 1.00 0.00 H new ATOM 0 HA3 GLY A 22 30.861 -16.074 -4.177 1.00 0.00 H new ATOM 356 N VAL A 23 32.378 -13.571 -2.539 1.00 0.00 N ATOM 357 CA VAL A 23 33.124 -12.287 -2.715 1.00 0.00 C ATOM 358 C VAL A 23 34.229 -12.131 -1.610 1.00 0.00 C ATOM 359 O VAL A 23 33.977 -12.296 -0.408 1.00 0.00 O ATOM 360 CB VAL A 23 32.134 -11.073 -2.844 1.00 0.00 C ATOM 361 CG1 VAL A 23 31.233 -10.808 -1.628 1.00 0.00 C ATOM 362 CG2 VAL A 23 32.823 -9.750 -3.233 1.00 0.00 C ATOM 0 H VAL A 23 32.257 -13.847 -1.565 1.00 0.00 H new ATOM 0 HA VAL A 23 33.667 -12.304 -3.660 1.00 0.00 H new ATOM 0 HB VAL A 23 31.492 -11.411 -3.657 1.00 0.00 H new ATOM 0 HG11 VAL A 23 30.593 -9.949 -1.830 1.00 0.00 H new ATOM 0 HG12 VAL A 23 30.614 -11.684 -1.436 1.00 0.00 H new ATOM 0 HG13 VAL A 23 31.852 -10.602 -0.755 1.00 0.00 H new ATOM 0 HG21 VAL A 23 32.077 -8.958 -3.303 1.00 0.00 H new ATOM 0 HG22 VAL A 23 33.561 -9.487 -2.475 1.00 0.00 H new ATOM 0 HG23 VAL A 23 33.319 -9.868 -4.197 1.00 0.00 H new ATOM 372 N ASN A 24 35.460 -11.787 -2.030 1.00 0.00 N ATOM 373 CA ASN A 24 36.614 -11.537 -1.116 1.00 0.00 C ATOM 374 C ASN A 24 36.636 -10.117 -0.456 1.00 0.00 C ATOM 375 O ASN A 24 36.029 -9.168 -0.958 1.00 0.00 O ATOM 376 CB ASN A 24 37.930 -11.849 -1.894 1.00 0.00 C ATOM 377 CG ASN A 24 38.277 -10.991 -3.125 1.00 0.00 C ATOM 378 OD1 ASN A 24 37.972 -11.345 -4.258 1.00 0.00 O ATOM 379 ND2 ASN A 24 38.916 -9.857 -2.962 1.00 0.00 N ATOM 0 H ASN A 24 35.694 -11.671 -3.016 1.00 0.00 H new ATOM 0 HA ASN A 24 36.509 -12.206 -0.262 1.00 0.00 H new ATOM 0 HB2 ASN A 24 38.758 -11.769 -1.190 1.00 0.00 H new ATOM 0 HB3 ASN A 24 37.886 -12.889 -2.217 1.00 0.00 H new ATOM 0 HD21 ASN A 24 39.152 -9.284 -3.772 1.00 0.00 H new ATOM 0 HD22 ASN A 24 39.177 -9.549 -2.025 1.00 0.00 H new ATOM 386 N ILE A 25 37.408 -9.954 0.638 1.00 0.00 N ATOM 387 CA ILE A 25 37.643 -8.634 1.301 1.00 0.00 C ATOM 388 C ILE A 25 38.277 -7.538 0.361 1.00 0.00 C ATOM 389 O ILE A 25 38.834 -7.840 -0.699 1.00 0.00 O ATOM 390 CB ILE A 25 38.383 -8.902 2.667 1.00 0.00 C ATOM 391 CG1 ILE A 25 38.114 -7.795 3.726 1.00 0.00 C ATOM 392 CG2 ILE A 25 39.905 -9.164 2.512 1.00 0.00 C ATOM 393 CD1 ILE A 25 38.382 -8.204 5.186 1.00 0.00 C ATOM 0 H ILE A 25 37.891 -10.728 1.095 1.00 0.00 H new ATOM 0 HA ILE A 25 36.690 -8.157 1.532 1.00 0.00 H new ATOM 0 HB ILE A 25 37.944 -9.828 3.038 1.00 0.00 H new ATOM 0 HG12 ILE A 25 38.733 -6.930 3.489 1.00 0.00 H new ATOM 0 HG13 ILE A 25 37.075 -7.477 3.640 1.00 0.00 H new ATOM 0 HG21 ILE A 25 40.346 -9.340 3.493 1.00 0.00 H new ATOM 0 HG22 ILE A 25 40.061 -10.040 1.882 1.00 0.00 H new ATOM 0 HG23 ILE A 25 40.378 -8.297 2.052 1.00 0.00 H new ATOM 0 HD11 ILE A 25 38.165 -7.363 5.845 1.00 0.00 H new ATOM 0 HD12 ILE A 25 37.744 -9.047 5.451 1.00 0.00 H new ATOM 0 HD13 ILE A 25 39.428 -8.491 5.297 1.00 0.00 H new ATOM 405 N VAL A 26 38.091 -6.260 0.733 1.00 0.00 N ATOM 406 CA VAL A 26 38.241 -5.073 -0.182 1.00 0.00 C ATOM 407 C VAL A 26 36.925 -4.890 -1.011 1.00 0.00 C ATOM 408 O VAL A 26 36.117 -4.015 -0.685 1.00 0.00 O ATOM 409 CB VAL A 26 39.594 -4.919 -0.976 1.00 0.00 C ATOM 410 CG1 VAL A 26 39.677 -3.612 -1.800 1.00 0.00 C ATOM 411 CG2 VAL A 26 40.839 -4.965 -0.061 1.00 0.00 C ATOM 0 H VAL A 26 37.829 -6.000 1.684 1.00 0.00 H new ATOM 0 HA VAL A 26 38.365 -4.203 0.463 1.00 0.00 H new ATOM 0 HB VAL A 26 39.593 -5.776 -1.649 1.00 0.00 H new ATOM 0 HG11 VAL A 26 40.634 -3.570 -2.321 1.00 0.00 H new ATOM 0 HG12 VAL A 26 38.866 -3.589 -2.528 1.00 0.00 H new ATOM 0 HG13 VAL A 26 39.590 -2.755 -1.132 1.00 0.00 H new ATOM 0 HG21 VAL A 26 41.739 -4.854 -0.666 1.00 0.00 H new ATOM 0 HG22 VAL A 26 40.787 -4.154 0.665 1.00 0.00 H new ATOM 0 HG23 VAL A 26 40.870 -5.920 0.464 1.00 0.00 H new ATOM 421 N LYS A 27 36.672 -5.755 -2.012 1.00 0.00 N ATOM 422 CA LYS A 27 35.340 -5.871 -2.685 1.00 0.00 C ATOM 423 C LYS A 27 34.113 -6.105 -1.742 1.00 0.00 C ATOM 424 O LYS A 27 33.156 -5.331 -1.790 1.00 0.00 O ATOM 425 CB LYS A 27 35.453 -6.945 -3.811 1.00 0.00 C ATOM 426 CG LYS A 27 35.840 -6.378 -5.199 1.00 0.00 C ATOM 427 CD LYS A 27 34.618 -5.749 -5.899 1.00 0.00 C ATOM 428 CE LYS A 27 34.905 -5.151 -7.280 1.00 0.00 C ATOM 429 NZ LYS A 27 33.637 -4.628 -7.829 1.00 0.00 N ATOM 0 H LYS A 27 37.374 -6.395 -2.384 1.00 0.00 H new ATOM 0 HA LYS A 27 35.111 -4.894 -3.110 1.00 0.00 H new ATOM 0 HB2 LYS A 27 36.195 -7.687 -3.515 1.00 0.00 H new ATOM 0 HB3 LYS A 27 34.499 -7.465 -3.898 1.00 0.00 H new ATOM 0 HG2 LYS A 27 36.623 -5.629 -5.084 1.00 0.00 H new ATOM 0 HG3 LYS A 27 36.249 -7.175 -5.820 1.00 0.00 H new ATOM 0 HD2 LYS A 27 33.845 -6.510 -6.002 1.00 0.00 H new ATOM 0 HD3 LYS A 27 34.212 -4.967 -5.257 1.00 0.00 H new ATOM 0 HE2 LYS A 27 35.644 -4.353 -7.203 1.00 0.00 H new ATOM 0 HE3 LYS A 27 35.323 -5.909 -7.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 33.809 -4.216 -8.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 32.948 -5.403 -7.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 33.260 -3.896 -7.194 1.00 0.00 H new ATOM 442 N ARG A 28 34.169 -7.092 -0.830 1.00 0.00 N ATOM 443 CA ARG A 28 33.182 -7.238 0.276 1.00 0.00 C ATOM 444 C ARG A 28 33.145 -6.081 1.336 1.00 0.00 C ATOM 445 O ARG A 28 32.099 -5.905 1.953 1.00 0.00 O ATOM 446 CB ARG A 28 33.446 -8.608 0.951 1.00 0.00 C ATOM 447 CG ARG A 28 32.309 -9.168 1.849 1.00 0.00 C ATOM 448 CD ARG A 28 32.788 -10.187 2.898 1.00 0.00 C ATOM 449 NE ARG A 28 33.406 -11.388 2.274 1.00 0.00 N ATOM 450 CZ ARG A 28 33.893 -12.427 2.942 1.00 0.00 C ATOM 451 NH1 ARG A 28 33.946 -12.508 4.245 1.00 0.00 N ATOM 452 NH2 ARG A 28 34.330 -13.444 2.270 1.00 0.00 N ATOM 0 H ARG A 28 34.892 -7.811 -0.831 1.00 0.00 H new ATOM 0 HA ARG A 28 32.191 -7.178 -0.175 1.00 0.00 H new ATOM 0 HB2 ARG A 28 33.655 -9.339 0.170 1.00 0.00 H new ATOM 0 HB3 ARG A 28 34.348 -8.522 1.557 1.00 0.00 H new ATOM 0 HG2 ARG A 28 31.820 -8.338 2.360 1.00 0.00 H new ATOM 0 HG3 ARG A 28 31.558 -9.639 1.215 1.00 0.00 H new ATOM 0 HD2 ARG A 28 33.511 -9.711 3.560 1.00 0.00 H new ATOM 0 HD3 ARG A 28 31.944 -10.494 3.515 1.00 0.00 H new ATOM 0 HE ARG A 28 33.460 -11.415 1.256 1.00 0.00 H new ATOM 0 HH11 ARG A 28 33.598 -11.739 4.818 1.00 0.00 H new ATOM 0 HH12 ARG A 28 34.335 -13.340 4.689 1.00 0.00 H new ATOM 0 HH21 ARG A 28 34.295 -13.435 1.251 1.00 0.00 H new ATOM 0 HH22 ARG A 28 34.709 -14.254 2.760 1.00 0.00 H new ATOM 466 N LYS A 29 34.217 -5.295 1.564 1.00 0.00 N ATOM 467 CA LYS A 29 34.123 -4.024 2.354 1.00 0.00 C ATOM 468 C LYS A 29 33.367 -2.877 1.605 1.00 0.00 C ATOM 469 O LYS A 29 32.432 -2.312 2.177 1.00 0.00 O ATOM 470 CB LYS A 29 35.526 -3.601 2.876 1.00 0.00 C ATOM 471 CG LYS A 29 36.103 -4.484 4.011 1.00 0.00 C ATOM 472 CD LYS A 29 35.504 -4.188 5.403 1.00 0.00 C ATOM 473 CE LYS A 29 35.937 -5.222 6.454 1.00 0.00 C ATOM 474 NZ LYS A 29 35.324 -4.913 7.761 1.00 0.00 N ATOM 0 H LYS A 29 35.155 -5.505 1.221 1.00 0.00 H new ATOM 0 HA LYS A 29 33.498 -4.228 3.224 1.00 0.00 H new ATOM 0 HB2 LYS A 29 36.225 -3.610 2.040 1.00 0.00 H new ATOM 0 HB3 LYS A 29 35.468 -2.572 3.232 1.00 0.00 H new ATOM 0 HG2 LYS A 29 35.928 -5.532 3.767 1.00 0.00 H new ATOM 0 HG3 LYS A 29 37.183 -4.343 4.054 1.00 0.00 H new ATOM 0 HD2 LYS A 29 35.813 -3.194 5.725 1.00 0.00 H new ATOM 0 HD3 LYS A 29 34.416 -4.177 5.334 1.00 0.00 H new ATOM 0 HE2 LYS A 29 35.642 -6.221 6.134 1.00 0.00 H new ATOM 0 HE3 LYS A 29 37.023 -5.224 6.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 35.625 -5.620 8.462 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 35.626 -3.967 8.071 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 34.288 -4.934 7.672 1.00 0.00 H new ATOM 487 N LEU A 30 33.691 -2.582 0.328 1.00 0.00 N ATOM 488 CA LEU A 30 32.836 -1.730 -0.555 1.00 0.00 C ATOM 489 C LEU A 30 31.356 -2.216 -0.729 1.00 0.00 C ATOM 490 O LEU A 30 30.440 -1.410 -0.559 1.00 0.00 O ATOM 491 CB LEU A 30 33.522 -1.544 -1.941 1.00 0.00 C ATOM 492 CG LEU A 30 34.897 -0.823 -1.991 1.00 0.00 C ATOM 493 CD1 LEU A 30 35.481 -0.909 -3.412 1.00 0.00 C ATOM 494 CD2 LEU A 30 34.813 0.654 -1.561 1.00 0.00 C ATOM 0 H LEU A 30 34.541 -2.919 -0.125 1.00 0.00 H new ATOM 0 HA LEU A 30 32.751 -0.774 -0.039 1.00 0.00 H new ATOM 0 HB2 LEU A 30 33.648 -2.532 -2.385 1.00 0.00 H new ATOM 0 HB3 LEU A 30 32.834 -0.992 -2.581 1.00 0.00 H new ATOM 0 HG LEU A 30 35.548 -1.332 -1.280 1.00 0.00 H new ATOM 0 HD11 LEU A 30 36.445 -0.402 -3.440 1.00 0.00 H new ATOM 0 HD12 LEU A 30 35.613 -1.955 -3.688 1.00 0.00 H new ATOM 0 HD13 LEU A 30 34.799 -0.431 -4.115 1.00 0.00 H new ATOM 0 HD21 LEU A 30 35.803 1.106 -1.616 1.00 0.00 H new ATOM 0 HD22 LEU A 30 34.133 1.188 -2.225 1.00 0.00 H new ATOM 0 HD23 LEU A 30 34.443 0.715 -0.538 1.00 0.00 H new ATOM 506 N ALA A 31 31.104 -3.505 -1.035 1.00 0.00 N ATOM 507 CA ALA A 31 29.729 -4.070 -1.058 1.00 0.00 C ATOM 508 C ALA A 31 28.989 -4.185 0.312 1.00 0.00 C ATOM 509 O ALA A 31 27.787 -3.921 0.336 1.00 0.00 O ATOM 510 CB ALA A 31 29.781 -5.401 -1.815 1.00 0.00 C ATOM 0 H ALA A 31 31.832 -4.179 -1.271 1.00 0.00 H new ATOM 0 HA ALA A 31 29.102 -3.343 -1.574 1.00 0.00 H new ATOM 0 HB1 ALA A 31 28.784 -5.840 -1.848 1.00 0.00 H new ATOM 0 HB2 ALA A 31 30.135 -5.228 -2.831 1.00 0.00 H new ATOM 0 HB3 ALA A 31 30.461 -6.083 -1.305 1.00 0.00 H new ATOM 516 N ALA A 32 29.655 -4.518 1.439 1.00 0.00 N ATOM 517 CA ALA A 32 29.074 -4.334 2.800 1.00 0.00 C ATOM 518 C ALA A 32 28.723 -2.861 3.184 1.00 0.00 C ATOM 519 O ALA A 32 27.598 -2.590 3.617 1.00 0.00 O ATOM 520 CB ALA A 32 29.979 -4.996 3.853 1.00 0.00 C ATOM 0 H ALA A 32 30.594 -4.916 1.440 1.00 0.00 H new ATOM 0 HA ALA A 32 28.106 -4.834 2.777 1.00 0.00 H new ATOM 0 HB1 ALA A 32 29.547 -4.856 4.844 1.00 0.00 H new ATOM 0 HB2 ALA A 32 30.064 -6.062 3.641 1.00 0.00 H new ATOM 0 HB3 ALA A 32 30.968 -4.539 3.821 1.00 0.00 H new ATOM 526 N HIS A 33 29.654 -1.911 2.987 1.00 0.00 N ATOM 527 CA HIS A 33 29.375 -0.457 3.136 1.00 0.00 C ATOM 528 C HIS A 33 28.950 0.189 1.769 1.00 0.00 C ATOM 529 O HIS A 33 29.576 1.142 1.292 1.00 0.00 O ATOM 530 CB HIS A 33 30.633 0.202 3.782 1.00 0.00 C ATOM 531 CG HIS A 33 31.052 -0.305 5.170 1.00 0.00 C ATOM 532 ND1 HIS A 33 32.217 -1.021 5.399 1.00 0.00 N ATOM 533 CD2 HIS A 33 30.290 -0.215 6.348 1.00 0.00 C ATOM 534 CE1 HIS A 33 32.030 -1.309 6.728 1.00 0.00 C ATOM 535 NE2 HIS A 33 30.913 -0.871 7.396 1.00 0.00 N ATOM 0 H HIS A 33 30.617 -2.119 2.722 1.00 0.00 H new ATOM 0 HA HIS A 33 28.522 -0.288 3.793 1.00 0.00 H new ATOM 0 HB2 HIS A 33 31.474 0.063 3.103 1.00 0.00 H new ATOM 0 HB3 HIS A 33 30.454 1.275 3.853 1.00 0.00 H new ATOM 0 HD2 HIS A 33 29.343 0.298 6.425 1.00 0.00 H new ATOM 0 HE1 HIS A 33 32.772 -1.889 7.256 1.00 0.00 H new ATOM 0 HE2 HIS A 33 30.629 -0.992 8.368 1.00 0.00 H new ATOM 542 N ASP A 34 27.846 -0.288 1.151 1.00 0.00 N ATOM 543 CA ASP A 34 27.339 0.242 -0.150 1.00 0.00 C ATOM 544 C ASP A 34 26.632 1.643 -0.076 1.00 0.00 C ATOM 545 O ASP A 34 26.668 2.406 -1.049 1.00 0.00 O ATOM 546 CB ASP A 34 26.503 -0.876 -0.847 1.00 0.00 C ATOM 547 CG ASP A 34 25.248 -1.425 -0.150 1.00 0.00 C ATOM 548 OD1 ASP A 34 24.662 -0.725 0.706 1.00 0.00 O ATOM 549 OD2 ASP A 34 24.841 -2.578 -0.417 1.00 0.00 O ATOM 0 H ASP A 34 27.280 -1.046 1.531 1.00 0.00 H new ATOM 0 HA ASP A 34 28.198 0.481 -0.777 1.00 0.00 H new ATOM 0 HB2 ASP A 34 26.196 -0.496 -1.821 1.00 0.00 H new ATOM 0 HB3 ASP A 34 27.171 -1.718 -1.029 1.00 0.00 H new ATOM 554 N ASN A 35 26.035 1.979 1.091 1.00 0.00 N ATOM 555 CA ASN A 35 25.401 3.295 1.396 1.00 0.00 C ATOM 556 C ASN A 35 24.169 3.672 0.500 1.00 0.00 C ATOM 557 O ASN A 35 23.985 4.843 0.150 1.00 0.00 O ATOM 558 CB ASN A 35 26.497 4.399 1.528 1.00 0.00 C ATOM 559 CG ASN A 35 27.407 4.312 2.761 1.00 0.00 C ATOM 560 OD1 ASN A 35 27.092 4.824 3.828 1.00 0.00 O ATOM 561 ND2 ASN A 35 28.559 3.691 2.673 1.00 0.00 N ATOM 0 H ASN A 35 25.976 1.327 1.873 1.00 0.00 H new ATOM 0 HA ASN A 35 24.919 3.203 2.369 1.00 0.00 H new ATOM 0 HB2 ASN A 35 27.124 4.366 0.637 1.00 0.00 H new ATOM 0 HB3 ASN A 35 26.004 5.371 1.535 1.00 0.00 H new ATOM 0 HD21 ASN A 35 29.175 3.641 3.485 1.00 0.00 H new ATOM 0 HD22 ASN A 35 28.839 3.258 1.793 1.00 0.00 H new ATOM 568 N LEU A 36 23.304 2.695 0.147 1.00 0.00 N ATOM 569 CA LEU A 36 22.248 2.920 -0.882 1.00 0.00 C ATOM 570 C LEU A 36 20.957 3.647 -0.375 1.00 0.00 C ATOM 571 O LEU A 36 20.559 3.577 0.795 1.00 0.00 O ATOM 572 CB LEU A 36 22.006 1.652 -1.758 1.00 0.00 C ATOM 573 CG LEU A 36 20.973 0.591 -1.308 1.00 0.00 C ATOM 574 CD1 LEU A 36 20.671 -0.395 -2.450 1.00 0.00 C ATOM 575 CD2 LEU A 36 21.475 -0.196 -0.092 1.00 0.00 C ATOM 0 H LEU A 36 23.310 1.757 0.548 1.00 0.00 H new ATOM 0 HA LEU A 36 22.655 3.669 -1.561 1.00 0.00 H new ATOM 0 HB2 LEU A 36 21.710 1.994 -2.750 1.00 0.00 H new ATOM 0 HB3 LEU A 36 22.965 1.146 -1.869 1.00 0.00 H new ATOM 0 HG LEU A 36 20.063 1.125 -1.035 1.00 0.00 H new ATOM 0 HD11 LEU A 36 19.943 -1.132 -2.111 1.00 0.00 H new ATOM 0 HD12 LEU A 36 20.267 0.149 -3.303 1.00 0.00 H new ATOM 0 HD13 LEU A 36 21.590 -0.902 -2.745 1.00 0.00 H new ATOM 0 HD21 LEU A 36 20.726 -0.933 0.199 1.00 0.00 H new ATOM 0 HD22 LEU A 36 22.405 -0.704 -0.346 1.00 0.00 H new ATOM 0 HD23 LEU A 36 21.651 0.489 0.737 1.00 0.00 H new ATOM 587 N LYS A 37 20.326 4.359 -1.319 1.00 0.00 N ATOM 588 CA LYS A 37 19.169 5.248 -1.062 1.00 0.00 C ATOM 589 C LYS A 37 18.013 4.867 -2.042 1.00 0.00 C ATOM 590 O LYS A 37 18.136 5.016 -3.261 1.00 0.00 O ATOM 591 CB LYS A 37 19.679 6.701 -1.238 1.00 0.00 C ATOM 592 CG LYS A 37 18.667 7.792 -0.830 1.00 0.00 C ATOM 593 CD LYS A 37 19.090 9.228 -1.210 1.00 0.00 C ATOM 594 CE LYS A 37 19.008 9.511 -2.722 1.00 0.00 C ATOM 595 NZ LYS A 37 19.307 10.928 -3.004 1.00 0.00 N ATOM 0 H LYS A 37 20.604 4.338 -2.300 1.00 0.00 H new ATOM 0 HA LYS A 37 18.762 5.145 -0.056 1.00 0.00 H new ATOM 0 HB2 LYS A 37 20.587 6.827 -0.648 1.00 0.00 H new ATOM 0 HB3 LYS A 37 19.954 6.851 -2.282 1.00 0.00 H new ATOM 0 HG2 LYS A 37 17.707 7.573 -1.298 1.00 0.00 H new ATOM 0 HG3 LYS A 37 18.515 7.744 0.248 1.00 0.00 H new ATOM 0 HD2 LYS A 37 18.455 9.938 -0.680 1.00 0.00 H new ATOM 0 HD3 LYS A 37 20.112 9.399 -0.871 1.00 0.00 H new ATOM 0 HE2 LYS A 37 19.712 8.872 -3.255 1.00 0.00 H new ATOM 0 HE3 LYS A 37 18.012 9.264 -3.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 19.247 11.098 -4.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 18.619 11.533 -2.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 20.266 11.153 -2.672 1.00 0.00 H new ATOM 608 N LEU A 38 16.888 4.359 -1.523 1.00 0.00 N ATOM 609 CA LEU A 38 15.811 3.768 -2.366 1.00 0.00 C ATOM 610 C LEU A 38 14.672 4.800 -2.633 1.00 0.00 C ATOM 611 O LEU A 38 13.788 4.974 -1.788 1.00 0.00 O ATOM 612 CB LEU A 38 15.255 2.485 -1.680 1.00 0.00 C ATOM 613 CG LEU A 38 16.217 1.300 -1.406 1.00 0.00 C ATOM 614 CD1 LEU A 38 15.497 0.246 -0.551 1.00 0.00 C ATOM 615 CD2 LEU A 38 16.721 0.639 -2.695 1.00 0.00 C ATOM 0 H LEU A 38 16.689 4.340 -0.523 1.00 0.00 H new ATOM 0 HA LEU A 38 16.233 3.496 -3.334 1.00 0.00 H new ATOM 0 HB2 LEU A 38 14.822 2.784 -0.726 1.00 0.00 H new ATOM 0 HB3 LEU A 38 14.439 2.110 -2.297 1.00 0.00 H new ATOM 0 HG LEU A 38 17.084 1.702 -0.881 1.00 0.00 H new ATOM 0 HD11 LEU A 38 16.172 -0.588 -0.357 1.00 0.00 H new ATOM 0 HD12 LEU A 38 15.191 0.692 0.395 1.00 0.00 H new ATOM 0 HD13 LEU A 38 14.617 -0.115 -1.083 1.00 0.00 H new ATOM 0 HD21 LEU A 38 17.390 -0.184 -2.444 1.00 0.00 H new ATOM 0 HD22 LEU A 38 15.873 0.257 -3.263 1.00 0.00 H new ATOM 0 HD23 LEU A 38 17.258 1.374 -3.295 1.00 0.00 H new ATOM 627 N THR A 39 14.663 5.461 -3.808 1.00 0.00 N ATOM 628 CA THR A 39 13.543 6.367 -4.218 1.00 0.00 C ATOM 629 C THR A 39 12.409 5.533 -4.901 1.00 0.00 C ATOM 630 O THR A 39 12.446 5.241 -6.101 1.00 0.00 O ATOM 631 CB THR A 39 14.103 7.569 -5.039 1.00 0.00 C ATOM 632 OG1 THR A 39 14.944 8.378 -4.219 1.00 0.00 O ATOM 633 CG2 THR A 39 13.048 8.526 -5.621 1.00 0.00 C ATOM 0 H THR A 39 15.412 5.392 -4.497 1.00 0.00 H new ATOM 0 HA THR A 39 13.064 6.827 -3.354 1.00 0.00 H new ATOM 0 HB THR A 39 14.624 7.090 -5.867 1.00 0.00 H new ATOM 0 HG1 THR A 39 14.391 8.933 -3.630 1.00 0.00 H new ATOM 0 HG21 THR A 39 13.545 9.324 -6.172 1.00 0.00 H new ATOM 0 HG22 THR A 39 12.390 7.976 -6.294 1.00 0.00 H new ATOM 0 HG23 THR A 39 12.461 8.957 -4.810 1.00 0.00 H new ATOM 641 N ILE A 40 11.408 5.150 -4.091 1.00 0.00 N ATOM 642 CA ILE A 40 10.245 4.324 -4.527 1.00 0.00 C ATOM 643 C ILE A 40 9.075 5.308 -4.868 1.00 0.00 C ATOM 644 O ILE A 40 8.657 6.081 -3.999 1.00 0.00 O ATOM 645 CB ILE A 40 9.883 3.280 -3.400 1.00 0.00 C ATOM 646 CG1 ILE A 40 11.064 2.334 -2.995 1.00 0.00 C ATOM 647 CG2 ILE A 40 8.625 2.458 -3.784 1.00 0.00 C ATOM 648 CD1 ILE A 40 10.825 1.376 -1.811 1.00 0.00 C ATOM 0 H ILE A 40 11.373 5.402 -3.103 1.00 0.00 H new ATOM 0 HA ILE A 40 10.467 3.736 -5.418 1.00 0.00 H new ATOM 0 HB ILE A 40 9.666 3.876 -2.513 1.00 0.00 H new ATOM 0 HG12 ILE A 40 11.331 1.735 -3.866 1.00 0.00 H new ATOM 0 HG13 ILE A 40 11.928 2.955 -2.758 1.00 0.00 H new ATOM 0 HG21 ILE A 40 8.399 1.747 -2.990 1.00 0.00 H new ATOM 0 HG22 ILE A 40 7.778 3.131 -3.921 1.00 0.00 H new ATOM 0 HG23 ILE A 40 8.813 1.918 -4.712 1.00 0.00 H new ATOM 0 HD11 ILE A 40 11.721 0.780 -1.638 1.00 0.00 H new ATOM 0 HD12 ILE A 40 10.595 1.954 -0.916 1.00 0.00 H new ATOM 0 HD13 ILE A 40 9.989 0.715 -2.041 1.00 0.00 H new ATOM 660 N THR A 41 8.549 5.280 -6.109 1.00 0.00 N ATOM 661 CA THR A 41 7.514 6.265 -6.560 1.00 0.00 C ATOM 662 C THR A 41 6.324 5.567 -7.299 1.00 0.00 C ATOM 663 O THR A 41 6.180 5.720 -8.518 1.00 0.00 O ATOM 664 CB THR A 41 8.240 7.412 -7.343 1.00 0.00 C ATOM 665 OG1 THR A 41 7.315 8.452 -7.629 1.00 0.00 O ATOM 666 CG2 THR A 41 8.940 7.062 -8.671 1.00 0.00 C ATOM 0 H THR A 41 8.813 4.597 -6.820 1.00 0.00 H new ATOM 0 HA THR A 41 7.016 6.735 -5.712 1.00 0.00 H new ATOM 0 HB THR A 41 9.042 7.688 -6.659 1.00 0.00 H new ATOM 0 HG1 THR A 41 7.770 9.170 -8.117 1.00 0.00 H new ATOM 0 HG21 THR A 41 9.394 7.960 -9.090 1.00 0.00 H new ATOM 0 HG22 THR A 41 9.713 6.315 -8.489 1.00 0.00 H new ATOM 0 HG23 THR A 41 8.208 6.663 -9.374 1.00 0.00 H new ATOM 674 N GLN A 42 5.475 4.789 -6.577 1.00 0.00 N ATOM 675 CA GLN A 42 4.519 3.831 -7.219 1.00 0.00 C ATOM 676 C GLN A 42 3.500 4.473 -8.229 1.00 0.00 C ATOM 677 O GLN A 42 2.581 5.203 -7.847 1.00 0.00 O ATOM 678 CB GLN A 42 3.793 3.022 -6.108 1.00 0.00 C ATOM 679 CG GLN A 42 3.036 1.762 -6.617 1.00 0.00 C ATOM 680 CD GLN A 42 2.232 0.993 -5.558 1.00 0.00 C ATOM 681 OE1 GLN A 42 1.947 1.440 -4.451 1.00 0.00 O ATOM 682 NE2 GLN A 42 1.820 -0.211 -5.873 1.00 0.00 N ATOM 0 H GLN A 42 5.428 4.802 -5.558 1.00 0.00 H new ATOM 0 HA GLN A 42 5.117 3.170 -7.847 1.00 0.00 H new ATOM 0 HB2 GLN A 42 4.526 2.713 -5.363 1.00 0.00 H new ATOM 0 HB3 GLN A 42 3.083 3.678 -5.604 1.00 0.00 H new ATOM 0 HG2 GLN A 42 2.356 2.066 -7.412 1.00 0.00 H new ATOM 0 HG3 GLN A 42 3.761 1.080 -7.061 1.00 0.00 H new ATOM 0 HE21 GLN A 42 2.044 -0.604 -6.787 1.00 0.00 H new ATOM 0 HE22 GLN A 42 1.275 -0.755 -5.204 1.00 0.00 H new ATOM 691 N GLU A 43 3.671 4.172 -9.526 1.00 0.00 N ATOM 692 CA GLU A 43 2.910 4.822 -10.631 1.00 0.00 C ATOM 693 C GLU A 43 1.658 3.998 -11.095 1.00 0.00 C ATOM 694 O GLU A 43 1.549 3.573 -12.249 1.00 0.00 O ATOM 695 CB GLU A 43 3.936 5.224 -11.737 1.00 0.00 C ATOM 696 CG GLU A 43 4.719 4.089 -12.453 1.00 0.00 C ATOM 697 CD GLU A 43 5.738 4.559 -13.476 1.00 0.00 C ATOM 698 OE1 GLU A 43 6.849 4.973 -13.072 1.00 0.00 O ATOM 699 OE2 GLU A 43 5.453 4.465 -14.688 1.00 0.00 O ATOM 0 H GLU A 43 4.339 3.472 -9.849 1.00 0.00 H new ATOM 0 HA GLU A 43 2.429 5.738 -10.289 1.00 0.00 H new ATOM 0 HB2 GLU A 43 3.401 5.792 -12.498 1.00 0.00 H new ATOM 0 HB3 GLU A 43 4.664 5.900 -11.288 1.00 0.00 H new ATOM 0 HG2 GLU A 43 5.232 3.491 -11.700 1.00 0.00 H new ATOM 0 HG3 GLU A 43 4.005 3.432 -12.949 1.00 0.00 H new ATOM 706 N GLY A 44 0.686 3.796 -10.177 1.00 0.00 N ATOM 707 CA GLY A 44 -0.543 2.996 -10.454 1.00 0.00 C ATOM 708 C GLY A 44 -0.307 1.476 -10.597 1.00 0.00 C ATOM 709 O GLY A 44 -0.085 1.007 -11.715 1.00 0.00 O ATOM 0 H GLY A 44 0.724 4.176 -9.231 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -1.258 3.164 -9.649 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -1.002 3.366 -11.371 1.00 0.00 H new ATOM 713 N ASN A 45 -0.274 0.719 -9.477 1.00 0.00 N ATOM 714 CA ASN A 45 0.360 -0.646 -9.426 1.00 0.00 C ATOM 715 C ASN A 45 1.919 -0.590 -9.529 1.00 0.00 C ATOM 716 O ASN A 45 2.624 -0.935 -8.580 1.00 0.00 O ATOM 717 CB ASN A 45 -0.276 -1.708 -10.392 1.00 0.00 C ATOM 718 CG ASN A 45 -1.004 -2.866 -9.709 1.00 0.00 C ATOM 719 OD1 ASN A 45 -2.030 -2.695 -9.059 1.00 0.00 O ATOM 720 ND2 ASN A 45 -0.516 -4.076 -9.834 1.00 0.00 N ATOM 0 H ASN A 45 -0.676 1.018 -8.588 1.00 0.00 H new ATOM 0 HA ASN A 45 0.121 -1.017 -8.429 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -0.978 -1.199 -11.052 1.00 0.00 H new ATOM 0 HB3 ASN A 45 0.513 -2.119 -11.022 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -0.989 -4.865 -9.393 1.00 0.00 H new ATOM 0 HD22 ASN A 45 0.337 -4.229 -10.372 1.00 0.00 H new ATOM 727 N LYS A 46 2.438 -0.161 -10.687 1.00 0.00 N ATOM 728 CA LYS A 46 3.832 -0.403 -11.117 1.00 0.00 C ATOM 729 C LYS A 46 4.895 0.354 -10.256 1.00 0.00 C ATOM 730 O LYS A 46 4.836 1.576 -10.085 1.00 0.00 O ATOM 731 CB LYS A 46 3.846 -0.011 -12.620 1.00 0.00 C ATOM 732 CG LYS A 46 4.890 -0.766 -13.459 1.00 0.00 C ATOM 733 CD LYS A 46 4.873 -0.417 -14.966 1.00 0.00 C ATOM 734 CE LYS A 46 5.305 1.018 -15.339 1.00 0.00 C ATOM 735 NZ LYS A 46 4.178 1.964 -15.459 1.00 0.00 N ATOM 0 H LYS A 46 1.896 0.373 -11.366 1.00 0.00 H new ATOM 0 HA LYS A 46 4.125 -1.443 -10.971 1.00 0.00 H new ATOM 0 HB2 LYS A 46 2.857 -0.194 -13.041 1.00 0.00 H new ATOM 0 HB3 LYS A 46 4.035 1.059 -12.703 1.00 0.00 H new ATOM 0 HG2 LYS A 46 5.882 -0.553 -13.060 1.00 0.00 H new ATOM 0 HG3 LYS A 46 4.724 -1.837 -13.345 1.00 0.00 H new ATOM 0 HD2 LYS A 46 5.526 -1.117 -15.487 1.00 0.00 H new ATOM 0 HD3 LYS A 46 3.864 -0.580 -15.344 1.00 0.00 H new ATOM 0 HE2 LYS A 46 5.999 1.387 -14.584 1.00 0.00 H new ATOM 0 HE3 LYS A 46 5.847 0.991 -16.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 4.499 2.920 -15.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 3.828 1.965 -16.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 3.412 1.674 -14.818 1.00 0.00 H new ATOM 748 N PHE A 47 5.849 -0.384 -9.674 1.00 0.00 N ATOM 749 CA PHE A 47 6.846 0.193 -8.736 1.00 0.00 C ATOM 750 C PHE A 47 8.122 0.653 -9.499 1.00 0.00 C ATOM 751 O PHE A 47 8.950 -0.159 -9.927 1.00 0.00 O ATOM 752 CB PHE A 47 7.168 -0.844 -7.626 1.00 0.00 C ATOM 753 CG PHE A 47 6.285 -0.823 -6.369 1.00 0.00 C ATOM 754 CD1 PHE A 47 6.329 0.282 -5.515 1.00 0.00 C ATOM 755 CD2 PHE A 47 5.507 -1.929 -6.016 1.00 0.00 C ATOM 756 CE1 PHE A 47 5.605 0.283 -4.327 1.00 0.00 C ATOM 757 CE2 PHE A 47 4.780 -1.926 -4.825 1.00 0.00 C ATOM 758 CZ PHE A 47 4.832 -0.821 -3.980 1.00 0.00 C ATOM 0 H PHE A 47 5.959 -1.386 -9.831 1.00 0.00 H new ATOM 0 HA PHE A 47 6.430 1.081 -8.261 1.00 0.00 H new ATOM 0 HB2 PHE A 47 7.107 -1.840 -8.066 1.00 0.00 H new ATOM 0 HB3 PHE A 47 8.202 -0.696 -7.315 1.00 0.00 H new ATOM 0 HD1 PHE A 47 6.929 1.141 -5.779 1.00 0.00 H new ATOM 0 HD2 PHE A 47 5.468 -2.789 -6.668 1.00 0.00 H new ATOM 0 HE1 PHE A 47 5.643 1.142 -3.673 1.00 0.00 H new ATOM 0 HE2 PHE A 47 4.177 -2.781 -4.559 1.00 0.00 H new ATOM 0 HZ PHE A 47 4.273 -0.820 -3.056 1.00 0.00 H new ATOM 768 N THR A 48 8.283 1.981 -9.610 1.00 0.00 N ATOM 769 CA THR A 48 9.511 2.616 -10.160 1.00 0.00 C ATOM 770 C THR A 48 10.475 2.879 -8.967 1.00 0.00 C ATOM 771 O THR A 48 10.266 3.803 -8.171 1.00 0.00 O ATOM 772 CB THR A 48 9.066 3.873 -10.965 1.00 0.00 C ATOM 773 OG1 THR A 48 8.369 3.423 -12.128 1.00 0.00 O ATOM 774 CG2 THR A 48 10.197 4.776 -11.483 1.00 0.00 C ATOM 0 H THR A 48 7.571 2.653 -9.324 1.00 0.00 H new ATOM 0 HA THR A 48 10.068 1.994 -10.861 1.00 0.00 H new ATOM 0 HB THR A 48 8.476 4.464 -10.264 1.00 0.00 H new ATOM 0 HG1 THR A 48 8.023 4.196 -12.622 1.00 0.00 H new ATOM 0 HG21 THR A 48 9.770 5.618 -12.028 1.00 0.00 H new ATOM 0 HG22 THR A 48 10.781 5.147 -10.641 1.00 0.00 H new ATOM 0 HG23 THR A 48 10.843 4.204 -12.148 1.00 0.00 H new ATOM 782 N VAL A 49 11.495 2.016 -8.818 1.00 0.00 N ATOM 783 CA VAL A 49 12.425 2.055 -7.654 1.00 0.00 C ATOM 784 C VAL A 49 13.826 2.487 -8.175 1.00 0.00 C ATOM 785 O VAL A 49 14.560 1.702 -8.786 1.00 0.00 O ATOM 786 CB VAL A 49 12.386 0.755 -6.768 1.00 0.00 C ATOM 787 CG1 VAL A 49 10.963 0.431 -6.267 1.00 0.00 C ATOM 788 CG2 VAL A 49 12.959 -0.538 -7.379 1.00 0.00 C ATOM 0 H VAL A 49 11.705 1.276 -9.488 1.00 0.00 H new ATOM 0 HA VAL A 49 12.097 2.804 -6.933 1.00 0.00 H new ATOM 0 HB VAL A 49 13.057 1.040 -5.957 1.00 0.00 H new ATOM 0 HG11 VAL A 49 10.988 -0.474 -5.660 1.00 0.00 H new ATOM 0 HG12 VAL A 49 10.591 1.261 -5.666 1.00 0.00 H new ATOM 0 HG13 VAL A 49 10.303 0.277 -7.121 1.00 0.00 H new ATOM 0 HG21 VAL A 49 12.867 -1.352 -6.660 1.00 0.00 H new ATOM 0 HG22 VAL A 49 12.406 -0.789 -8.284 1.00 0.00 H new ATOM 0 HG23 VAL A 49 14.010 -0.389 -7.626 1.00 0.00 H new ATOM 798 N LYS A 50 14.189 3.762 -7.956 1.00 0.00 N ATOM 799 CA LYS A 50 15.530 4.290 -8.324 1.00 0.00 C ATOM 800 C LYS A 50 16.511 3.981 -7.154 1.00 0.00 C ATOM 801 O LYS A 50 16.519 4.670 -6.125 1.00 0.00 O ATOM 802 CB LYS A 50 15.440 5.794 -8.704 1.00 0.00 C ATOM 803 CG LYS A 50 14.550 6.141 -9.928 1.00 0.00 C ATOM 804 CD LYS A 50 14.523 7.631 -10.334 1.00 0.00 C ATOM 805 CE LYS A 50 15.814 8.128 -11.008 1.00 0.00 C ATOM 806 NZ LYS A 50 15.684 9.549 -11.391 1.00 0.00 N ATOM 0 H LYS A 50 13.576 4.454 -7.525 1.00 0.00 H new ATOM 0 HA LYS A 50 15.920 3.800 -9.216 1.00 0.00 H new ATOM 0 HB2 LYS A 50 15.064 6.343 -7.841 1.00 0.00 H new ATOM 0 HB3 LYS A 50 16.448 6.159 -8.900 1.00 0.00 H new ATOM 0 HG2 LYS A 50 14.894 5.557 -10.782 1.00 0.00 H new ATOM 0 HG3 LYS A 50 13.530 5.823 -9.714 1.00 0.00 H new ATOM 0 HD2 LYS A 50 13.686 7.795 -11.013 1.00 0.00 H new ATOM 0 HD3 LYS A 50 14.336 8.234 -9.446 1.00 0.00 H new ATOM 0 HE2 LYS A 50 16.657 8.004 -10.328 1.00 0.00 H new ATOM 0 HE3 LYS A 50 16.025 7.525 -11.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 16.564 9.868 -11.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 14.892 9.658 -12.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 15.504 10.122 -10.542 1.00 0.00 H new ATOM 819 N GLU A 51 17.274 2.880 -7.294 1.00 0.00 N ATOM 820 CA GLU A 51 18.091 2.329 -6.178 1.00 0.00 C ATOM 821 C GLU A 51 19.505 2.981 -6.216 1.00 0.00 C ATOM 822 O GLU A 51 20.398 2.556 -6.960 1.00 0.00 O ATOM 823 CB GLU A 51 18.123 0.774 -6.170 1.00 0.00 C ATOM 824 CG GLU A 51 16.752 0.038 -6.266 1.00 0.00 C ATOM 825 CD GLU A 51 16.681 -1.373 -5.686 1.00 0.00 C ATOM 826 OE1 GLU A 51 17.656 -2.147 -5.767 1.00 0.00 O ATOM 827 OE2 GLU A 51 15.616 -1.743 -5.147 1.00 0.00 O ATOM 0 H GLU A 51 17.347 2.351 -8.163 1.00 0.00 H new ATOM 0 HA GLU A 51 17.622 2.590 -5.229 1.00 0.00 H new ATOM 0 HB2 GLU A 51 18.744 0.444 -7.003 1.00 0.00 H new ATOM 0 HB3 GLU A 51 18.618 0.450 -5.255 1.00 0.00 H new ATOM 0 HG2 GLU A 51 16.003 0.649 -5.762 1.00 0.00 H new ATOM 0 HG3 GLU A 51 16.468 -0.013 -7.317 1.00 0.00 H new ATOM 834 N SER A 52 19.668 4.075 -5.453 1.00 0.00 N ATOM 835 CA SER A 52 20.807 5.011 -5.611 1.00 0.00 C ATOM 836 C SER A 52 21.999 4.630 -4.690 1.00 0.00 C ATOM 837 O SER A 52 22.104 5.093 -3.551 1.00 0.00 O ATOM 838 CB SER A 52 20.279 6.448 -5.404 1.00 0.00 C ATOM 839 OG SER A 52 21.323 7.404 -5.585 1.00 0.00 O ATOM 0 H SER A 52 19.020 4.339 -4.711 1.00 0.00 H new ATOM 0 HA SER A 52 21.221 4.946 -6.617 1.00 0.00 H new ATOM 0 HB2 SER A 52 19.471 6.648 -6.108 1.00 0.00 H new ATOM 0 HB3 SER A 52 19.861 6.545 -4.402 1.00 0.00 H new ATOM 0 HG SER A 52 20.967 8.307 -5.451 1.00 0.00 H new ATOM 845 N SER A 53 22.896 3.780 -5.206 1.00 0.00 N ATOM 846 CA SER A 53 24.103 3.313 -4.473 1.00 0.00 C ATOM 847 C SER A 53 25.415 4.049 -4.880 1.00 0.00 C ATOM 848 O SER A 53 25.534 4.621 -5.969 1.00 0.00 O ATOM 849 CB SER A 53 24.200 1.777 -4.681 1.00 0.00 C ATOM 850 OG SER A 53 24.514 1.420 -6.028 1.00 0.00 O ATOM 0 H SER A 53 22.814 3.390 -6.145 1.00 0.00 H new ATOM 0 HA SER A 53 23.992 3.554 -3.416 1.00 0.00 H new ATOM 0 HB2 SER A 53 24.962 1.372 -4.015 1.00 0.00 H new ATOM 0 HB3 SER A 53 23.253 1.316 -4.399 1.00 0.00 H new ATOM 0 HG SER A 53 23.957 1.942 -6.643 1.00 0.00 H new ATOM 856 N THR A 54 26.449 3.939 -4.024 1.00 0.00 N ATOM 857 CA THR A 54 27.867 4.251 -4.392 1.00 0.00 C ATOM 858 C THR A 54 28.435 3.560 -5.687 1.00 0.00 C ATOM 859 O THR A 54 29.179 4.186 -6.444 1.00 0.00 O ATOM 860 CB THR A 54 28.781 3.967 -3.159 1.00 0.00 C ATOM 861 OG1 THR A 54 28.627 2.634 -2.671 1.00 0.00 O ATOM 862 CG2 THR A 54 28.599 4.932 -1.976 1.00 0.00 C ATOM 0 H THR A 54 26.338 3.633 -3.057 1.00 0.00 H new ATOM 0 HA THR A 54 27.867 5.307 -4.663 1.00 0.00 H new ATOM 0 HB THR A 54 29.784 4.120 -3.556 1.00 0.00 H new ATOM 0 HG1 THR A 54 27.867 2.597 -2.054 1.00 0.00 H new ATOM 0 HG21 THR A 54 29.277 4.652 -1.170 1.00 0.00 H new ATOM 0 HG22 THR A 54 28.820 5.949 -2.299 1.00 0.00 H new ATOM 0 HG23 THR A 54 27.570 4.880 -1.619 1.00 0.00 H new ATOM 870 N PHE A 55 28.049 2.301 -5.953 1.00 0.00 N ATOM 871 CA PHE A 55 28.292 1.612 -7.252 1.00 0.00 C ATOM 872 C PHE A 55 27.454 2.153 -8.466 1.00 0.00 C ATOM 873 O PHE A 55 27.988 2.265 -9.572 1.00 0.00 O ATOM 874 CB PHE A 55 27.986 0.092 -7.074 1.00 0.00 C ATOM 875 CG PHE A 55 28.903 -0.739 -6.162 1.00 0.00 C ATOM 876 CD1 PHE A 55 28.744 -0.695 -4.772 1.00 0.00 C ATOM 877 CD2 PHE A 55 29.851 -1.608 -6.715 1.00 0.00 C ATOM 878 CE1 PHE A 55 29.531 -1.493 -3.950 1.00 0.00 C ATOM 879 CE2 PHE A 55 30.620 -2.424 -5.891 1.00 0.00 C ATOM 880 CZ PHE A 55 30.461 -2.365 -4.510 1.00 0.00 C ATOM 0 H PHE A 55 27.556 1.720 -5.275 1.00 0.00 H new ATOM 0 HA PHE A 55 29.335 1.808 -7.501 1.00 0.00 H new ATOM 0 HB2 PHE A 55 26.969 0.001 -6.693 1.00 0.00 H new ATOM 0 HB3 PHE A 55 27.998 -0.367 -8.063 1.00 0.00 H new ATOM 0 HD1 PHE A 55 28.006 -0.038 -4.336 1.00 0.00 H new ATOM 0 HD2 PHE A 55 29.986 -1.645 -7.786 1.00 0.00 H new ATOM 0 HE1 PHE A 55 29.421 -1.437 -2.877 1.00 0.00 H new ATOM 0 HE2 PHE A 55 31.340 -3.103 -6.323 1.00 0.00 H new ATOM 0 HZ PHE A 55 31.060 -2.997 -3.871 1.00 0.00 H new ATOM 890 N ARG A 56 26.132 2.355 -8.298 1.00 0.00 N ATOM 891 CA ARG A 56 25.161 2.486 -9.420 1.00 0.00 C ATOM 892 C ARG A 56 23.821 3.130 -8.940 1.00 0.00 C ATOM 893 O ARG A 56 23.276 2.735 -7.901 1.00 0.00 O ATOM 894 CB ARG A 56 24.917 1.099 -10.102 1.00 0.00 C ATOM 895 CG ARG A 56 24.269 -0.027 -9.237 1.00 0.00 C ATOM 896 CD ARG A 56 24.428 -1.463 -9.776 1.00 0.00 C ATOM 897 NE ARG A 56 25.837 -1.899 -9.576 1.00 0.00 N ATOM 898 CZ ARG A 56 26.258 -3.151 -9.431 1.00 0.00 C ATOM 899 NH1 ARG A 56 25.495 -4.201 -9.599 1.00 0.00 N ATOM 900 NH2 ARG A 56 27.497 -3.333 -9.083 1.00 0.00 N ATOM 0 H ARG A 56 25.698 2.433 -7.378 1.00 0.00 H new ATOM 0 HA ARG A 56 25.592 3.156 -10.164 1.00 0.00 H new ATOM 0 HB2 ARG A 56 24.283 1.260 -10.974 1.00 0.00 H new ATOM 0 HB3 ARG A 56 25.875 0.732 -10.469 1.00 0.00 H new ATOM 0 HG2 ARG A 56 24.701 0.015 -8.237 1.00 0.00 H new ATOM 0 HG3 ARG A 56 23.205 0.187 -9.134 1.00 0.00 H new ATOM 0 HD2 ARG A 56 23.747 -2.138 -9.257 1.00 0.00 H new ATOM 0 HD3 ARG A 56 24.169 -1.500 -10.834 1.00 0.00 H new ATOM 0 HE ARG A 56 26.547 -1.167 -9.548 1.00 0.00 H new ATOM 0 HH11 ARG A 56 24.515 -4.083 -9.857 1.00 0.00 H new ATOM 0 HH12 ARG A 56 25.880 -5.137 -9.472 1.00 0.00 H new ATOM 0 HH21 ARG A 56 28.107 -2.530 -8.932 1.00 0.00 H new ATOM 0 HH22 ARG A 56 27.859 -4.279 -8.961 1.00 0.00 H new ATOM 914 N ASN A 57 23.250 4.055 -9.736 1.00 0.00 N ATOM 915 CA ASN A 57 21.825 4.469 -9.589 1.00 0.00 C ATOM 916 C ASN A 57 20.973 3.744 -10.673 1.00 0.00 C ATOM 917 O ASN A 57 20.995 4.113 -11.851 1.00 0.00 O ATOM 918 CB ASN A 57 21.724 6.018 -9.630 1.00 0.00 C ATOM 919 CG ASN A 57 20.374 6.608 -9.184 1.00 0.00 C ATOM 920 OD1 ASN A 57 19.377 5.932 -8.948 1.00 0.00 O ATOM 921 ND2 ASN A 57 20.307 7.907 -9.035 1.00 0.00 N ATOM 0 H ASN A 57 23.746 4.534 -10.488 1.00 0.00 H new ATOM 0 HA ASN A 57 21.420 4.169 -8.622 1.00 0.00 H new ATOM 0 HB2 ASN A 57 22.508 6.432 -8.997 1.00 0.00 H new ATOM 0 HB3 ASN A 57 21.927 6.351 -10.648 1.00 0.00 H new ATOM 0 HD21 ASN A 57 19.437 8.341 -8.728 1.00 0.00 H new ATOM 0 HD22 ASN A 57 21.125 8.485 -9.226 1.00 0.00 H new ATOM 928 N ILE A 58 20.259 2.684 -10.264 1.00 0.00 N ATOM 929 CA ILE A 58 19.488 1.809 -11.199 1.00 0.00 C ATOM 930 C ILE A 58 17.963 2.130 -11.100 1.00 0.00 C ATOM 931 O ILE A 58 17.320 1.860 -10.081 1.00 0.00 O ATOM 932 CB ILE A 58 19.826 0.281 -11.010 1.00 0.00 C ATOM 933 CG1 ILE A 58 19.724 -0.244 -9.545 1.00 0.00 C ATOM 934 CG2 ILE A 58 21.197 -0.065 -11.642 1.00 0.00 C ATOM 935 CD1 ILE A 58 19.794 -1.766 -9.342 1.00 0.00 C ATOM 0 H ILE A 58 20.191 2.400 -9.287 1.00 0.00 H new ATOM 0 HA ILE A 58 19.799 2.034 -12.219 1.00 0.00 H new ATOM 0 HB ILE A 58 19.039 -0.251 -11.545 1.00 0.00 H new ATOM 0 HG12 ILE A 58 20.526 0.212 -8.965 1.00 0.00 H new ATOM 0 HG13 ILE A 58 18.784 0.111 -9.123 1.00 0.00 H new ATOM 0 HG21 ILE A 58 21.407 -1.125 -11.498 1.00 0.00 H new ATOM 0 HG22 ILE A 58 21.173 0.159 -12.709 1.00 0.00 H new ATOM 0 HG23 ILE A 58 21.978 0.527 -11.165 1.00 0.00 H new ATOM 0 HD11 ILE A 58 19.711 -1.996 -8.280 1.00 0.00 H new ATOM 0 HD12 ILE A 58 18.976 -2.243 -9.881 1.00 0.00 H new ATOM 0 HD13 ILE A 58 20.745 -2.140 -9.721 1.00 0.00 H new ATOM 947 N GLU A 59 17.372 2.677 -12.180 1.00 0.00 N ATOM 948 CA GLU A 59 15.904 2.891 -12.287 1.00 0.00 C ATOM 949 C GLU A 59 15.141 1.567 -12.625 1.00 0.00 C ATOM 950 O GLU A 59 14.948 1.207 -13.791 1.00 0.00 O ATOM 951 CB GLU A 59 15.624 4.102 -13.234 1.00 0.00 C ATOM 952 CG GLU A 59 15.884 4.006 -14.769 1.00 0.00 C ATOM 953 CD GLU A 59 17.326 3.857 -15.271 1.00 0.00 C ATOM 954 OE1 GLU A 59 18.332 3.975 -14.577 1.00 0.00 O ATOM 955 OE2 GLU A 59 17.369 3.583 -16.604 1.00 0.00 O ATOM 0 H GLU A 59 17.891 2.984 -13.003 1.00 0.00 H new ATOM 0 HA GLU A 59 15.490 3.169 -11.318 1.00 0.00 H new ATOM 0 HB2 GLU A 59 14.575 4.371 -13.105 1.00 0.00 H new ATOM 0 HB3 GLU A 59 16.215 4.939 -12.863 1.00 0.00 H new ATOM 0 HG2 GLU A 59 15.315 3.157 -15.147 1.00 0.00 H new ATOM 0 HG3 GLU A 59 15.466 4.901 -15.230 1.00 0.00 H new ATOM 962 N VAL A 60 14.735 0.814 -11.587 1.00 0.00 N ATOM 963 CA VAL A 60 14.135 -0.542 -11.753 1.00 0.00 C ATOM 964 C VAL A 60 12.581 -0.383 -11.768 1.00 0.00 C ATOM 965 O VAL A 60 11.951 -0.132 -10.735 1.00 0.00 O ATOM 966 CB VAL A 60 14.668 -1.531 -10.659 1.00 0.00 C ATOM 967 CG1 VAL A 60 14.050 -2.944 -10.758 1.00 0.00 C ATOM 968 CG2 VAL A 60 16.202 -1.725 -10.664 1.00 0.00 C ATOM 0 H VAL A 60 14.808 1.115 -10.615 1.00 0.00 H new ATOM 0 HA VAL A 60 14.434 -0.992 -12.700 1.00 0.00 H new ATOM 0 HB VAL A 60 14.364 -1.037 -9.736 1.00 0.00 H new ATOM 0 HG11 VAL A 60 14.462 -3.577 -9.972 1.00 0.00 H new ATOM 0 HG12 VAL A 60 12.968 -2.877 -10.640 1.00 0.00 H new ATOM 0 HG13 VAL A 60 14.283 -3.376 -11.731 1.00 0.00 H new ATOM 0 HG21 VAL A 60 16.483 -2.424 -9.876 1.00 0.00 H new ATOM 0 HG22 VAL A 60 16.515 -2.122 -11.630 1.00 0.00 H new ATOM 0 HG23 VAL A 60 16.691 -0.766 -10.490 1.00 0.00 H new ATOM 978 N VAL A 61 11.973 -0.539 -12.954 1.00 0.00 N ATOM 979 CA VAL A 61 10.499 -0.396 -13.139 1.00 0.00 C ATOM 980 C VAL A 61 9.880 -1.831 -13.172 1.00 0.00 C ATOM 981 O VAL A 61 10.004 -2.538 -14.178 1.00 0.00 O ATOM 982 CB VAL A 61 10.184 0.457 -14.419 1.00 0.00 C ATOM 983 CG1 VAL A 61 8.668 0.675 -14.607 1.00 0.00 C ATOM 984 CG2 VAL A 61 10.831 1.864 -14.437 1.00 0.00 C ATOM 0 H VAL A 61 12.474 -0.766 -13.813 1.00 0.00 H new ATOM 0 HA VAL A 61 10.045 0.150 -12.312 1.00 0.00 H new ATOM 0 HB VAL A 61 10.613 -0.140 -15.223 1.00 0.00 H new ATOM 0 HG11 VAL A 61 8.494 1.270 -15.504 1.00 0.00 H new ATOM 0 HG12 VAL A 61 8.172 -0.290 -14.710 1.00 0.00 H new ATOM 0 HG13 VAL A 61 8.266 1.199 -13.740 1.00 0.00 H new ATOM 0 HG21 VAL A 61 10.558 2.378 -15.358 1.00 0.00 H new ATOM 0 HG22 VAL A 61 10.476 2.439 -13.582 1.00 0.00 H new ATOM 0 HG23 VAL A 61 11.915 1.767 -14.384 1.00 0.00 H new ATOM 994 N PHE A 62 9.224 -2.259 -12.078 1.00 0.00 N ATOM 995 CA PHE A 62 8.611 -3.615 -11.984 1.00 0.00 C ATOM 996 C PHE A 62 7.060 -3.552 -11.796 1.00 0.00 C ATOM 997 O PHE A 62 6.553 -2.859 -10.907 1.00 0.00 O ATOM 998 CB PHE A 62 9.347 -4.470 -10.908 1.00 0.00 C ATOM 999 CG PHE A 62 9.193 -4.108 -9.416 1.00 0.00 C ATOM 1000 CD1 PHE A 62 8.105 -4.596 -8.683 1.00 0.00 C ATOM 1001 CD2 PHE A 62 10.173 -3.352 -8.763 1.00 0.00 C ATOM 1002 CE1 PHE A 62 8.007 -4.344 -7.318 1.00 0.00 C ATOM 1003 CE2 PHE A 62 10.079 -3.112 -7.394 1.00 0.00 C ATOM 1004 CZ PHE A 62 9.000 -3.614 -6.671 1.00 0.00 C ATOM 0 H PHE A 62 9.100 -1.691 -11.240 1.00 0.00 H new ATOM 0 HA PHE A 62 8.750 -4.126 -12.937 1.00 0.00 H new ATOM 0 HB2 PHE A 62 9.018 -5.502 -11.030 1.00 0.00 H new ATOM 0 HB3 PHE A 62 10.411 -4.445 -11.142 1.00 0.00 H new ATOM 0 HD1 PHE A 62 7.337 -5.171 -9.179 1.00 0.00 H new ATOM 0 HD2 PHE A 62 11.006 -2.953 -9.323 1.00 0.00 H new ATOM 0 HE1 PHE A 62 7.160 -4.715 -6.760 1.00 0.00 H new ATOM 0 HE2 PHE A 62 10.843 -2.536 -6.893 1.00 0.00 H new ATOM 0 HZ PHE A 62 8.934 -3.437 -5.608 1.00 0.00 H new ATOM 1014 N GLU A 63 6.308 -4.343 -12.584 1.00 0.00 N ATOM 1015 CA GLU A 63 4.909 -4.719 -12.231 1.00 0.00 C ATOM 1016 C GLU A 63 4.879 -5.916 -11.214 1.00 0.00 C ATOM 1017 O GLU A 63 5.827 -6.701 -11.074 1.00 0.00 O ATOM 1018 CB GLU A 63 4.087 -4.993 -13.533 1.00 0.00 C ATOM 1019 CG GLU A 63 2.703 -4.287 -13.621 1.00 0.00 C ATOM 1020 CD GLU A 63 1.662 -4.628 -12.562 1.00 0.00 C ATOM 1021 OE1 GLU A 63 1.845 -4.239 -11.388 1.00 0.00 O ATOM 1022 OE2 GLU A 63 0.647 -5.268 -12.893 1.00 0.00 O ATOM 0 H GLU A 63 6.635 -4.737 -13.466 1.00 0.00 H new ATOM 0 HA GLU A 63 4.430 -3.885 -11.718 1.00 0.00 H new ATOM 0 HB2 GLU A 63 4.686 -4.685 -14.390 1.00 0.00 H new ATOM 0 HB3 GLU A 63 3.932 -6.068 -13.623 1.00 0.00 H new ATOM 0 HG2 GLU A 63 2.873 -3.211 -13.589 1.00 0.00 H new ATOM 0 HG3 GLU A 63 2.274 -4.512 -14.597 1.00 0.00 H new ATOM 1029 N LEU A 64 3.772 -6.045 -10.476 1.00 0.00 N ATOM 1030 CA LEU A 64 3.664 -6.968 -9.315 1.00 0.00 C ATOM 1031 C LEU A 64 3.414 -8.439 -9.778 1.00 0.00 C ATOM 1032 O LEU A 64 2.306 -8.807 -10.176 1.00 0.00 O ATOM 1033 CB LEU A 64 2.559 -6.428 -8.356 1.00 0.00 C ATOM 1034 CG LEU A 64 2.877 -5.203 -7.450 1.00 0.00 C ATOM 1035 CD1 LEU A 64 4.052 -5.474 -6.497 1.00 0.00 C ATOM 1036 CD2 LEU A 64 3.134 -3.896 -8.207 1.00 0.00 C ATOM 0 H LEU A 64 2.918 -5.517 -10.658 1.00 0.00 H new ATOM 0 HA LEU A 64 4.606 -6.998 -8.768 1.00 0.00 H new ATOM 0 HB2 LEU A 64 1.692 -6.170 -8.965 1.00 0.00 H new ATOM 0 HB3 LEU A 64 2.259 -7.249 -7.705 1.00 0.00 H new ATOM 0 HG LEU A 64 1.961 -5.064 -6.876 1.00 0.00 H new ATOM 0 HD11 LEU A 64 4.236 -4.590 -5.886 1.00 0.00 H new ATOM 0 HD12 LEU A 64 3.810 -6.318 -5.851 1.00 0.00 H new ATOM 0 HD13 LEU A 64 4.945 -5.706 -7.077 1.00 0.00 H new ATOM 0 HD21 LEU A 64 3.347 -3.099 -7.495 1.00 0.00 H new ATOM 0 HD22 LEU A 64 3.986 -4.024 -8.874 1.00 0.00 H new ATOM 0 HD23 LEU A 64 2.252 -3.634 -8.791 1.00 0.00 H new ATOM 1048 N GLY A 65 4.474 -9.269 -9.752 1.00 0.00 N ATOM 1049 CA GLY A 65 4.493 -10.559 -10.504 1.00 0.00 C ATOM 1050 C GLY A 65 5.277 -10.640 -11.839 1.00 0.00 C ATOM 1051 O GLY A 65 5.245 -11.710 -12.451 1.00 0.00 O ATOM 0 H GLY A 65 5.327 -9.080 -9.226 1.00 0.00 H new ATOM 0 HA2 GLY A 65 4.897 -11.322 -9.838 1.00 0.00 H new ATOM 0 HA3 GLY A 65 3.459 -10.833 -10.713 1.00 0.00 H new ATOM 1055 N VAL A 66 5.991 -9.592 -12.304 1.00 0.00 N ATOM 1056 CA VAL A 66 6.792 -9.658 -13.567 1.00 0.00 C ATOM 1057 C VAL A 66 8.125 -10.466 -13.383 1.00 0.00 C ATOM 1058 O VAL A 66 8.874 -10.240 -12.427 1.00 0.00 O ATOM 1059 CB VAL A 66 6.987 -8.221 -14.171 1.00 0.00 C ATOM 1060 CG1 VAL A 66 8.043 -7.333 -13.470 1.00 0.00 C ATOM 1061 CG2 VAL A 66 7.318 -8.263 -15.679 1.00 0.00 C ATOM 0 H VAL A 66 6.035 -8.689 -11.832 1.00 0.00 H new ATOM 0 HA VAL A 66 6.230 -10.228 -14.307 1.00 0.00 H new ATOM 0 HB VAL A 66 6.016 -7.758 -13.996 1.00 0.00 H new ATOM 0 HG11 VAL A 66 8.094 -6.365 -13.969 1.00 0.00 H new ATOM 0 HG12 VAL A 66 7.762 -7.189 -12.427 1.00 0.00 H new ATOM 0 HG13 VAL A 66 9.018 -7.819 -13.520 1.00 0.00 H new ATOM 0 HG21 VAL A 66 7.444 -7.247 -16.052 1.00 0.00 H new ATOM 0 HG22 VAL A 66 8.240 -8.823 -15.834 1.00 0.00 H new ATOM 0 HG23 VAL A 66 6.504 -8.749 -16.217 1.00 0.00 H new ATOM 1071 N THR A 67 8.428 -11.400 -14.302 1.00 0.00 N ATOM 1072 CA THR A 67 9.660 -12.244 -14.230 1.00 0.00 C ATOM 1073 C THR A 67 10.889 -11.482 -14.822 1.00 0.00 C ATOM 1074 O THR A 67 11.009 -11.376 -16.049 1.00 0.00 O ATOM 1075 CB THR A 67 9.460 -13.605 -14.968 1.00 0.00 C ATOM 1076 OG1 THR A 67 9.187 -13.387 -16.351 1.00 0.00 O ATOM 1077 CG2 THR A 67 8.360 -14.516 -14.404 1.00 0.00 C ATOM 0 H THR A 67 7.840 -11.599 -15.112 1.00 0.00 H new ATOM 0 HA THR A 67 9.854 -12.455 -13.178 1.00 0.00 H new ATOM 0 HB THR A 67 10.404 -14.127 -14.811 1.00 0.00 H new ATOM 0 HG1 THR A 67 9.780 -12.686 -16.695 1.00 0.00 H new ATOM 0 HG21 THR A 67 8.309 -15.432 -14.992 1.00 0.00 H new ATOM 0 HG22 THR A 67 8.588 -14.763 -13.367 1.00 0.00 H new ATOM 0 HG23 THR A 67 7.401 -14.000 -14.452 1.00 0.00 H new ATOM 1085 N PHE A 68 11.777 -10.949 -13.964 1.00 0.00 N ATOM 1086 CA PHE A 68 12.891 -10.055 -14.399 1.00 0.00 C ATOM 1087 C PHE A 68 14.240 -10.349 -13.653 1.00 0.00 C ATOM 1088 O PHE A 68 14.263 -10.863 -12.528 1.00 0.00 O ATOM 1089 CB PHE A 68 12.411 -8.566 -14.317 1.00 0.00 C ATOM 1090 CG PHE A 68 12.556 -7.843 -12.964 1.00 0.00 C ATOM 1091 CD1 PHE A 68 11.636 -8.046 -11.932 1.00 0.00 C ATOM 1092 CD2 PHE A 68 13.668 -7.022 -12.741 1.00 0.00 C ATOM 1093 CE1 PHE A 68 11.821 -7.430 -10.697 1.00 0.00 C ATOM 1094 CE2 PHE A 68 13.855 -6.414 -11.506 1.00 0.00 C ATOM 1095 CZ PHE A 68 12.930 -6.613 -10.486 1.00 0.00 C ATOM 0 H PHE A 68 11.753 -11.117 -12.958 1.00 0.00 H new ATOM 0 HA PHE A 68 13.136 -10.264 -15.440 1.00 0.00 H new ATOM 0 HB2 PHE A 68 12.961 -7.994 -15.064 1.00 0.00 H new ATOM 0 HB3 PHE A 68 11.360 -8.536 -14.603 1.00 0.00 H new ATOM 0 HD1 PHE A 68 10.779 -8.683 -12.093 1.00 0.00 H new ATOM 0 HD2 PHE A 68 14.384 -6.861 -13.533 1.00 0.00 H new ATOM 0 HE1 PHE A 68 11.105 -7.585 -9.903 1.00 0.00 H new ATOM 0 HE2 PHE A 68 14.718 -5.787 -11.338 1.00 0.00 H new ATOM 0 HZ PHE A 68 13.072 -6.133 -9.529 1.00 0.00 H new ATOM 1105 N ASN A 69 15.365 -9.949 -14.275 1.00 0.00 N ATOM 1106 CA ASN A 69 16.716 -10.030 -13.651 1.00 0.00 C ATOM 1107 C ASN A 69 17.017 -8.772 -12.765 1.00 0.00 C ATOM 1108 O ASN A 69 17.217 -7.663 -13.270 1.00 0.00 O ATOM 1109 CB ASN A 69 17.793 -10.227 -14.756 1.00 0.00 C ATOM 1110 CG ASN A 69 17.905 -11.637 -15.362 1.00 0.00 C ATOM 1111 OD1 ASN A 69 16.952 -12.399 -15.495 1.00 0.00 O ATOM 1112 ND2 ASN A 69 19.082 -12.025 -15.782 1.00 0.00 N ATOM 0 H ASN A 69 15.373 -9.562 -15.219 1.00 0.00 H new ATOM 0 HA ASN A 69 16.742 -10.892 -12.985 1.00 0.00 H new ATOM 0 HB2 ASN A 69 17.586 -9.524 -15.563 1.00 0.00 H new ATOM 0 HB3 ASN A 69 18.763 -9.957 -14.339 1.00 0.00 H new ATOM 0 HD21 ASN A 69 19.193 -12.944 -16.210 1.00 0.00 H new ATOM 0 HD22 ASN A 69 19.888 -11.408 -15.682 1.00 0.00 H new ATOM 1119 N TYR A 70 17.068 -8.970 -11.439 1.00 0.00 N ATOM 1120 CA TYR A 70 17.447 -7.924 -10.454 1.00 0.00 C ATOM 1121 C TYR A 70 18.929 -8.103 -9.998 1.00 0.00 C ATOM 1122 O TYR A 70 19.275 -9.076 -9.322 1.00 0.00 O ATOM 1123 CB TYR A 70 16.431 -8.032 -9.280 1.00 0.00 C ATOM 1124 CG TYR A 70 16.579 -7.029 -8.125 1.00 0.00 C ATOM 1125 CD1 TYR A 70 16.512 -5.647 -8.354 1.00 0.00 C ATOM 1126 CD2 TYR A 70 16.755 -7.499 -6.819 1.00 0.00 C ATOM 1127 CE1 TYR A 70 16.662 -4.757 -7.295 1.00 0.00 C ATOM 1128 CE2 TYR A 70 16.893 -6.605 -5.763 1.00 0.00 C ATOM 1129 CZ TYR A 70 16.865 -5.233 -6.003 1.00 0.00 C ATOM 1130 OH TYR A 70 17.085 -4.359 -4.970 1.00 0.00 O ATOM 0 H TYR A 70 16.846 -9.867 -11.008 1.00 0.00 H new ATOM 0 HA TYR A 70 17.400 -6.924 -10.886 1.00 0.00 H new ATOM 0 HB2 TYR A 70 15.427 -7.926 -9.692 1.00 0.00 H new ATOM 0 HB3 TYR A 70 16.501 -9.037 -8.865 1.00 0.00 H new ATOM 0 HD1 TYR A 70 16.344 -5.273 -9.353 1.00 0.00 H new ATOM 0 HD2 TYR A 70 16.784 -8.562 -6.630 1.00 0.00 H new ATOM 0 HE1 TYR A 70 16.621 -3.693 -7.476 1.00 0.00 H new ATOM 0 HE2 TYR A 70 17.022 -6.974 -4.756 1.00 0.00 H new ATOM 0 HH TYR A 70 17.749 -3.692 -5.242 1.00 0.00 H new ATOM 1140 N ASN A 71 19.809 -7.151 -10.341 1.00 0.00 N ATOM 1141 CA ASN A 71 21.250 -7.219 -9.965 1.00 0.00 C ATOM 1142 C ASN A 71 21.578 -6.625 -8.554 1.00 0.00 C ATOM 1143 O ASN A 71 21.265 -5.463 -8.271 1.00 0.00 O ATOM 1144 CB ASN A 71 22.122 -6.640 -11.117 1.00 0.00 C ATOM 1145 CG ASN A 71 21.939 -5.189 -11.589 1.00 0.00 C ATOM 1146 OD1 ASN A 71 21.659 -4.914 -12.748 1.00 0.00 O ATOM 1147 ND2 ASN A 71 22.099 -4.208 -10.738 1.00 0.00 N ATOM 0 H ASN A 71 19.559 -6.321 -10.878 1.00 0.00 H new ATOM 0 HA ASN A 71 21.510 -8.271 -9.845 1.00 0.00 H new ATOM 0 HB2 ASN A 71 23.164 -6.750 -10.816 1.00 0.00 H new ATOM 0 HB3 ASN A 71 21.972 -7.281 -11.986 1.00 0.00 H new ATOM 0 HD21 ASN A 71 21.990 -3.242 -11.047 1.00 0.00 H new ATOM 0 HD22 ASN A 71 22.333 -4.409 -9.766 1.00 0.00 H new ATOM 1154 N LEU A 72 22.289 -7.392 -7.707 1.00 0.00 N ATOM 1155 CA LEU A 72 22.896 -6.858 -6.449 1.00 0.00 C ATOM 1156 C LEU A 72 24.302 -6.200 -6.697 1.00 0.00 C ATOM 1157 O LEU A 72 24.917 -6.387 -7.754 1.00 0.00 O ATOM 1158 CB LEU A 72 22.983 -7.987 -5.379 1.00 0.00 C ATOM 1159 CG LEU A 72 21.720 -8.809 -4.996 1.00 0.00 C ATOM 1160 CD1 LEU A 72 22.007 -9.652 -3.739 1.00 0.00 C ATOM 1161 CD2 LEU A 72 20.474 -7.937 -4.743 1.00 0.00 C ATOM 0 H LEU A 72 22.464 -8.385 -7.861 1.00 0.00 H new ATOM 0 HA LEU A 72 22.246 -6.066 -6.076 1.00 0.00 H new ATOM 0 HB2 LEU A 72 23.737 -8.696 -5.720 1.00 0.00 H new ATOM 0 HB3 LEU A 72 23.362 -7.534 -4.463 1.00 0.00 H new ATOM 0 HG LEU A 72 21.498 -9.447 -5.852 1.00 0.00 H new ATOM 0 HD11 LEU A 72 21.119 -10.226 -3.475 1.00 0.00 H new ATOM 0 HD12 LEU A 72 22.833 -10.334 -3.939 1.00 0.00 H new ATOM 0 HD13 LEU A 72 22.272 -8.993 -2.912 1.00 0.00 H new ATOM 0 HD21 LEU A 72 19.630 -8.575 -4.481 1.00 0.00 H new ATOM 0 HD22 LEU A 72 20.674 -7.245 -3.925 1.00 0.00 H new ATOM 0 HD23 LEU A 72 20.235 -7.373 -5.645 1.00 0.00 H new ATOM 1202 N THR A 76 25.491 -10.793 -7.907 1.00 0.00 N ATOM 1203 CA THR A 76 24.827 -11.510 -9.041 1.00 0.00 C ATOM 1204 C THR A 76 23.487 -10.914 -9.599 1.00 0.00 C ATOM 1205 O THR A 76 22.805 -10.109 -8.953 1.00 0.00 O ATOM 1206 CB THR A 76 24.853 -13.068 -8.854 1.00 0.00 C ATOM 1207 OG1 THR A 76 25.084 -13.681 -10.119 1.00 0.00 O ATOM 1208 CG2 THR A 76 23.603 -13.749 -8.275 1.00 0.00 C ATOM 0 HA THR A 76 25.471 -11.291 -9.893 1.00 0.00 H new ATOM 0 HB THR A 76 25.639 -13.208 -8.112 1.00 0.00 H new ATOM 0 HG1 THR A 76 24.713 -14.588 -10.116 1.00 0.00 H new ATOM 0 HG21 THR A 76 23.773 -14.823 -8.206 1.00 0.00 H new ATOM 0 HG22 THR A 76 23.398 -13.350 -7.282 1.00 0.00 H new ATOM 0 HG23 THR A 76 22.750 -13.558 -8.926 1.00 0.00 H new ATOM 1216 N GLU A 77 23.108 -11.370 -10.810 1.00 0.00 N ATOM 1217 CA GLU A 77 21.738 -11.186 -11.364 1.00 0.00 C ATOM 1218 C GLU A 77 20.738 -12.236 -10.771 1.00 0.00 C ATOM 1219 O GLU A 77 20.878 -13.455 -10.943 1.00 0.00 O ATOM 1220 CB GLU A 77 21.753 -11.295 -12.912 1.00 0.00 C ATOM 1221 CG GLU A 77 22.251 -10.054 -13.689 1.00 0.00 C ATOM 1222 CD GLU A 77 22.133 -10.225 -15.195 1.00 0.00 C ATOM 1223 OE1 GLU A 77 21.012 -10.071 -15.725 1.00 0.00 O ATOM 1224 OE2 GLU A 77 23.150 -10.527 -15.850 1.00 0.00 O ATOM 0 H GLU A 77 23.736 -11.876 -11.435 1.00 0.00 H new ATOM 0 HA GLU A 77 21.402 -10.189 -11.079 1.00 0.00 H new ATOM 0 HB2 GLU A 77 22.379 -12.143 -13.188 1.00 0.00 H new ATOM 0 HB3 GLU A 77 20.741 -11.523 -13.247 1.00 0.00 H new ATOM 0 HG2 GLU A 77 21.677 -9.181 -13.379 1.00 0.00 H new ATOM 0 HG3 GLU A 77 23.292 -9.860 -13.429 1.00 0.00 H new ATOM 1231 N LEU A 78 19.706 -11.729 -10.088 1.00 0.00 N ATOM 1232 CA LEU A 78 18.643 -12.555 -9.474 1.00 0.00 C ATOM 1233 C LEU A 78 17.370 -12.560 -10.374 1.00 0.00 C ATOM 1234 O LEU A 78 16.687 -11.543 -10.514 1.00 0.00 O ATOM 1235 CB LEU A 78 18.344 -11.976 -8.066 1.00 0.00 C ATOM 1236 CG LEU A 78 19.450 -12.011 -6.978 1.00 0.00 C ATOM 1237 CD1 LEU A 78 18.884 -11.434 -5.669 1.00 0.00 C ATOM 1238 CD2 LEU A 78 20.013 -13.420 -6.719 1.00 0.00 C ATOM 0 H LEU A 78 19.578 -10.728 -9.941 1.00 0.00 H new ATOM 0 HA LEU A 78 18.968 -13.591 -9.379 1.00 0.00 H new ATOM 0 HB2 LEU A 78 18.046 -10.936 -8.197 1.00 0.00 H new ATOM 0 HB3 LEU A 78 17.479 -12.508 -7.670 1.00 0.00 H new ATOM 0 HG LEU A 78 20.281 -11.409 -7.347 1.00 0.00 H new ATOM 0 HD11 LEU A 78 19.655 -11.455 -4.899 1.00 0.00 H new ATOM 0 HD12 LEU A 78 18.563 -10.405 -5.834 1.00 0.00 H new ATOM 0 HD13 LEU A 78 18.032 -12.032 -5.346 1.00 0.00 H new ATOM 0 HD21 LEU A 78 20.781 -13.369 -5.947 1.00 0.00 H new ATOM 0 HD22 LEU A 78 19.209 -14.078 -6.388 1.00 0.00 H new ATOM 0 HD23 LEU A 78 20.448 -13.813 -7.638 1.00 0.00 H new ATOM 1250 N ARG A 79 17.041 -13.706 -10.986 1.00 0.00 N ATOM 1251 CA ARG A 79 15.912 -13.823 -11.950 1.00 0.00 C ATOM 1252 C ARG A 79 14.599 -14.322 -11.267 1.00 0.00 C ATOM 1253 O ARG A 79 14.549 -15.427 -10.716 1.00 0.00 O ATOM 1254 CB ARG A 79 16.393 -14.635 -13.181 1.00 0.00 C ATOM 1255 CG ARG A 79 16.661 -16.157 -13.020 1.00 0.00 C ATOM 1256 CD ARG A 79 17.507 -16.773 -14.153 1.00 0.00 C ATOM 1257 NE ARG A 79 16.842 -16.655 -15.482 1.00 0.00 N ATOM 1258 CZ ARG A 79 17.442 -16.318 -16.626 1.00 0.00 C ATOM 1259 NH1 ARG A 79 18.738 -16.151 -16.763 1.00 0.00 N ATOM 1260 NH2 ARG A 79 16.694 -16.149 -17.678 1.00 0.00 N ATOM 0 H ARG A 79 17.542 -14.582 -10.835 1.00 0.00 H new ATOM 0 HA ARG A 79 15.620 -12.842 -12.324 1.00 0.00 H new ATOM 0 HB2 ARG A 79 15.648 -14.513 -13.967 1.00 0.00 H new ATOM 0 HB3 ARG A 79 17.314 -14.175 -13.540 1.00 0.00 H new ATOM 0 HG2 ARG A 79 17.168 -16.327 -12.070 1.00 0.00 H new ATOM 0 HG3 ARG A 79 15.706 -16.679 -12.970 1.00 0.00 H new ATOM 0 HD2 ARG A 79 18.478 -16.278 -14.189 1.00 0.00 H new ATOM 0 HD3 ARG A 79 17.693 -17.824 -13.934 1.00 0.00 H new ATOM 0 HE ARG A 79 15.841 -16.849 -15.521 1.00 0.00 H new ATOM 0 HH11 ARG A 79 19.356 -16.280 -15.962 1.00 0.00 H new ATOM 0 HH12 ARG A 79 19.126 -15.893 -17.670 1.00 0.00 H new ATOM 0 HH21 ARG A 79 15.684 -16.274 -17.611 1.00 0.00 H new ATOM 0 HH22 ARG A 79 17.118 -15.891 -18.569 1.00 0.00 H new ATOM 1274 N GLY A 80 13.549 -13.484 -11.271 1.00 0.00 N ATOM 1275 CA GLY A 80 12.274 -13.798 -10.574 1.00 0.00 C ATOM 1276 C GLY A 80 11.328 -12.592 -10.384 1.00 0.00 C ATOM 1277 O GLY A 80 11.279 -11.691 -11.226 1.00 0.00 O ATOM 0 H GLY A 80 13.550 -12.582 -11.747 1.00 0.00 H new ATOM 0 HA2 GLY A 80 11.748 -14.569 -11.137 1.00 0.00 H new ATOM 0 HA3 GLY A 80 12.505 -14.219 -9.595 1.00 0.00 H new ATOM 1281 N THR A 81 10.519 -12.617 -9.313 1.00 0.00 N ATOM 1282 CA THR A 81 9.286 -11.772 -9.222 1.00 0.00 C ATOM 1283 C THR A 81 9.167 -11.046 -7.847 1.00 0.00 C ATOM 1284 O THR A 81 8.909 -11.713 -6.838 1.00 0.00 O ATOM 1285 CB THR A 81 7.985 -12.618 -9.435 1.00 0.00 C ATOM 1286 OG1 THR A 81 7.843 -13.599 -8.409 1.00 0.00 O ATOM 1287 CG2 THR A 81 7.839 -13.342 -10.779 1.00 0.00 C ATOM 0 H THR A 81 10.683 -13.204 -8.495 1.00 0.00 H new ATOM 0 HA THR A 81 9.383 -11.032 -10.016 1.00 0.00 H new ATOM 0 HB THR A 81 7.205 -11.857 -9.409 1.00 0.00 H new ATOM 0 HG1 THR A 81 8.287 -13.286 -7.593 1.00 0.00 H new ATOM 0 HG21 THR A 81 6.897 -13.890 -10.797 1.00 0.00 H new ATOM 0 HG22 THR A 81 7.850 -12.612 -11.589 1.00 0.00 H new ATOM 0 HG23 THR A 81 8.667 -14.040 -10.908 1.00 0.00 H new ATOM 1295 N TRP A 82 9.199 -9.698 -7.825 1.00 0.00 N ATOM 1296 CA TRP A 82 8.638 -8.906 -6.688 1.00 0.00 C ATOM 1297 C TRP A 82 7.069 -8.876 -6.742 1.00 0.00 C ATOM 1298 O TRP A 82 6.480 -8.373 -7.706 1.00 0.00 O ATOM 1299 CB TRP A 82 9.163 -7.444 -6.709 1.00 0.00 C ATOM 1300 CG TRP A 82 10.604 -7.121 -6.284 1.00 0.00 C ATOM 1301 CD1 TRP A 82 11.541 -6.467 -7.108 1.00 0.00 C ATOM 1302 CD2 TRP A 82 11.202 -7.175 -5.034 1.00 0.00 C ATOM 1303 NE1 TRP A 82 12.741 -6.174 -6.433 1.00 0.00 N ATOM 1304 CE2 TRP A 82 12.506 -6.619 -5.147 1.00 0.00 C ATOM 1305 CE3 TRP A 82 10.727 -7.627 -3.778 1.00 0.00 C ATOM 1306 CZ2 TRP A 82 13.355 -6.561 -4.019 1.00 0.00 C ATOM 1307 CZ3 TRP A 82 11.583 -7.553 -2.677 1.00 0.00 C ATOM 1308 CH2 TRP A 82 12.875 -7.031 -2.797 1.00 0.00 C ATOM 0 H TRP A 82 9.602 -9.130 -8.570 1.00 0.00 H new ATOM 0 HA TRP A 82 8.963 -9.395 -5.770 1.00 0.00 H new ATOM 0 HB2 TRP A 82 9.038 -7.073 -7.726 1.00 0.00 H new ATOM 0 HB3 TRP A 82 8.502 -6.857 -6.072 1.00 0.00 H new ATOM 0 HD1 TRP A 82 11.359 -6.218 -8.143 1.00 0.00 H new ATOM 0 HE1 TRP A 82 13.584 -5.737 -6.805 1.00 0.00 H new ATOM 0 HE3 TRP A 82 9.726 -8.020 -3.674 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 14.355 -6.161 -4.102 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 11.241 -7.905 -1.715 1.00 0.00 H new ATOM 0 HH2 TRP A 82 13.513 -6.991 -1.927 1.00 0.00 H new ATOM 1319 N SER A 83 6.403 -9.389 -5.694 1.00 0.00 N ATOM 1320 CA SER A 83 4.915 -9.370 -5.568 1.00 0.00 C ATOM 1321 C SER A 83 4.467 -8.866 -4.154 1.00 0.00 C ATOM 1322 O SER A 83 5.183 -9.016 -3.159 1.00 0.00 O ATOM 1323 CB SER A 83 4.362 -10.781 -5.888 1.00 0.00 C ATOM 1324 OG SER A 83 4.632 -11.166 -7.239 1.00 0.00 O ATOM 0 H SER A 83 6.871 -9.832 -4.903 1.00 0.00 H new ATOM 0 HA SER A 83 4.500 -8.663 -6.286 1.00 0.00 H new ATOM 0 HB2 SER A 83 4.806 -11.508 -5.208 1.00 0.00 H new ATOM 0 HB3 SER A 83 3.286 -10.797 -5.714 1.00 0.00 H new ATOM 0 HG SER A 83 4.270 -12.062 -7.403 1.00 0.00 H new ATOM 1330 N LEU A 84 3.282 -8.235 -4.058 1.00 0.00 N ATOM 1331 CA LEU A 84 2.826 -7.548 -2.813 1.00 0.00 C ATOM 1332 C LEU A 84 1.845 -8.435 -1.980 1.00 0.00 C ATOM 1333 O LEU A 84 0.654 -8.533 -2.292 1.00 0.00 O ATOM 1334 CB LEU A 84 2.233 -6.172 -3.236 1.00 0.00 C ATOM 1335 CG LEU A 84 1.798 -5.198 -2.109 1.00 0.00 C ATOM 1336 CD1 LEU A 84 2.970 -4.742 -1.224 1.00 0.00 C ATOM 1337 CD2 LEU A 84 1.122 -3.956 -2.717 1.00 0.00 C ATOM 0 H LEU A 84 2.613 -8.181 -4.826 1.00 0.00 H new ATOM 0 HA LEU A 84 3.661 -7.377 -2.133 1.00 0.00 H new ATOM 0 HB2 LEU A 84 2.974 -5.663 -3.852 1.00 0.00 H new ATOM 0 HB3 LEU A 84 1.366 -6.361 -3.870 1.00 0.00 H new ATOM 0 HG LEU A 84 1.100 -5.748 -1.478 1.00 0.00 H new ATOM 0 HD11 LEU A 84 2.602 -4.063 -0.455 1.00 0.00 H new ATOM 0 HD12 LEU A 84 3.429 -5.611 -0.752 1.00 0.00 H new ATOM 0 HD13 LEU A 84 3.711 -4.229 -1.837 1.00 0.00 H new ATOM 0 HD21 LEU A 84 0.820 -3.278 -1.918 1.00 0.00 H new ATOM 0 HD22 LEU A 84 1.823 -3.447 -3.379 1.00 0.00 H new ATOM 0 HD23 LEU A 84 0.243 -4.261 -3.285 1.00 0.00 H new ATOM 1349 N GLU A 85 2.350 -9.026 -0.885 1.00 0.00 N ATOM 1350 CA GLU A 85 1.512 -9.725 0.130 1.00 0.00 C ATOM 1351 C GLU A 85 1.099 -8.727 1.267 1.00 0.00 C ATOM 1352 O GLU A 85 1.726 -8.649 2.331 1.00 0.00 O ATOM 1353 CB GLU A 85 2.298 -10.973 0.640 1.00 0.00 C ATOM 1354 CG GLU A 85 2.282 -12.214 -0.291 1.00 0.00 C ATOM 1355 CD GLU A 85 0.963 -12.971 -0.359 1.00 0.00 C ATOM 1356 OE1 GLU A 85 0.744 -13.866 0.483 1.00 0.00 O ATOM 1357 OE2 GLU A 85 0.154 -12.685 -1.266 1.00 0.00 O ATOM 0 H GLU A 85 3.347 -9.038 -0.669 1.00 0.00 H new ATOM 0 HA GLU A 85 0.577 -10.081 -0.302 1.00 0.00 H new ATOM 0 HB2 GLU A 85 3.335 -10.682 0.806 1.00 0.00 H new ATOM 0 HB3 GLU A 85 1.890 -11.264 1.608 1.00 0.00 H new ATOM 0 HG2 GLU A 85 2.548 -11.893 -1.298 1.00 0.00 H new ATOM 0 HG3 GLU A 85 3.059 -12.903 0.040 1.00 0.00 H new ATOM 1364 N GLY A 86 0.043 -7.927 1.013 1.00 0.00 N ATOM 1365 CA GLY A 86 -0.450 -6.897 1.971 1.00 0.00 C ATOM 1366 C GLY A 86 0.452 -5.649 2.101 1.00 0.00 C ATOM 1367 O GLY A 86 0.505 -4.818 1.193 1.00 0.00 O ATOM 0 H GLY A 86 -0.494 -7.970 0.147 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -1.445 -6.578 1.660 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -0.555 -7.356 2.954 1.00 0.00 H new ATOM 1371 N ASN A 87 1.179 -5.549 3.222 1.00 0.00 N ATOM 1372 CA ASN A 87 2.315 -4.580 3.371 1.00 0.00 C ATOM 1373 C ASN A 87 3.753 -5.169 3.097 1.00 0.00 C ATOM 1374 O ASN A 87 4.744 -4.482 3.363 1.00 0.00 O ATOM 1375 CB ASN A 87 2.214 -3.934 4.788 1.00 0.00 C ATOM 1376 CG ASN A 87 1.006 -3.014 5.018 1.00 0.00 C ATOM 1377 OD1 ASN A 87 -0.028 -3.417 5.538 1.00 0.00 O ATOM 1378 ND2 ASN A 87 1.087 -1.760 4.641 1.00 0.00 N ATOM 0 H ASN A 87 1.014 -6.121 4.050 1.00 0.00 H new ATOM 0 HA ASN A 87 2.204 -3.832 2.586 1.00 0.00 H new ATOM 0 HB2 ASN A 87 2.185 -4.732 5.529 1.00 0.00 H new ATOM 0 HB3 ASN A 87 3.123 -3.361 4.971 1.00 0.00 H new ATOM 0 HD21 ASN A 87 0.295 -1.133 4.782 1.00 0.00 H new ATOM 0 HD22 ASN A 87 1.942 -1.412 4.207 1.00 0.00 H new ATOM 1385 N LYS A 88 3.883 -6.395 2.548 1.00 0.00 N ATOM 1386 CA LYS A 88 5.184 -7.074 2.319 1.00 0.00 C ATOM 1387 C LYS A 88 5.445 -7.224 0.791 1.00 0.00 C ATOM 1388 O LYS A 88 4.747 -7.961 0.089 1.00 0.00 O ATOM 1389 CB LYS A 88 5.161 -8.473 2.999 1.00 0.00 C ATOM 1390 CG LYS A 88 5.187 -8.474 4.545 1.00 0.00 C ATOM 1391 CD LYS A 88 5.052 -9.870 5.193 1.00 0.00 C ATOM 1392 CE LYS A 88 3.621 -10.314 5.553 1.00 0.00 C ATOM 1393 NZ LYS A 88 2.812 -10.691 4.377 1.00 0.00 N ATOM 0 H LYS A 88 3.082 -6.950 2.247 1.00 0.00 H new ATOM 0 HA LYS A 88 5.986 -6.476 2.752 1.00 0.00 H new ATOM 0 HB2 LYS A 88 4.266 -9.001 2.670 1.00 0.00 H new ATOM 0 HB3 LYS A 88 6.018 -9.044 2.640 1.00 0.00 H new ATOM 0 HG2 LYS A 88 6.121 -8.022 4.879 1.00 0.00 H new ATOM 0 HG3 LYS A 88 4.378 -7.840 4.909 1.00 0.00 H new ATOM 0 HD2 LYS A 88 5.479 -10.607 4.513 1.00 0.00 H new ATOM 0 HD3 LYS A 88 5.655 -9.887 6.101 1.00 0.00 H new ATOM 0 HE2 LYS A 88 3.672 -11.162 6.236 1.00 0.00 H new ATOM 0 HE3 LYS A 88 3.120 -9.505 6.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 1.935 -11.152 4.692 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 2.577 -9.839 3.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 3.353 -11.348 3.780 1.00 0.00 H new ATOM 1406 N LEU A 89 6.504 -6.584 0.278 1.00 0.00 N ATOM 1407 CA LEU A 89 7.074 -6.903 -1.058 1.00 0.00 C ATOM 1408 C LEU A 89 7.924 -8.213 -0.956 1.00 0.00 C ATOM 1409 O LEU A 89 9.086 -8.192 -0.539 1.00 0.00 O ATOM 1410 CB LEU A 89 7.892 -5.667 -1.564 1.00 0.00 C ATOM 1411 CG LEU A 89 7.131 -4.649 -2.454 1.00 0.00 C ATOM 1412 CD1 LEU A 89 7.978 -3.381 -2.673 1.00 0.00 C ATOM 1413 CD2 LEU A 89 6.772 -5.237 -3.830 1.00 0.00 C ATOM 0 H LEU A 89 6.994 -5.834 0.765 1.00 0.00 H new ATOM 0 HA LEU A 89 6.292 -7.094 -1.793 1.00 0.00 H new ATOM 0 HB2 LEU A 89 8.281 -5.136 -0.695 1.00 0.00 H new ATOM 0 HB3 LEU A 89 8.752 -6.034 -2.124 1.00 0.00 H new ATOM 0 HG LEU A 89 6.210 -4.403 -1.926 1.00 0.00 H new ATOM 0 HD11 LEU A 89 7.427 -2.679 -3.299 1.00 0.00 H new ATOM 0 HD12 LEU A 89 8.193 -2.917 -1.711 1.00 0.00 H new ATOM 0 HD13 LEU A 89 8.914 -3.649 -3.164 1.00 0.00 H new ATOM 0 HD21 LEU A 89 6.241 -4.489 -4.418 1.00 0.00 H new ATOM 0 HD22 LEU A 89 7.684 -5.527 -4.351 1.00 0.00 H new ATOM 0 HD23 LEU A 89 6.136 -6.112 -3.697 1.00 0.00 H new ATOM 1425 N ILE A 90 7.312 -9.356 -1.313 1.00 0.00 N ATOM 1426 CA ILE A 90 7.991 -10.681 -1.373 1.00 0.00 C ATOM 1427 C ILE A 90 8.613 -10.867 -2.795 1.00 0.00 C ATOM 1428 O ILE A 90 7.912 -11.008 -3.802 1.00 0.00 O ATOM 1429 CB ILE A 90 7.053 -11.855 -0.898 1.00 0.00 C ATOM 1430 CG1 ILE A 90 7.696 -13.274 -0.946 1.00 0.00 C ATOM 1431 CG2 ILE A 90 5.691 -11.953 -1.635 1.00 0.00 C ATOM 1432 CD1 ILE A 90 8.972 -13.489 -0.115 1.00 0.00 C ATOM 0 H ILE A 90 6.326 -9.396 -1.571 1.00 0.00 H new ATOM 0 HA ILE A 90 8.813 -10.713 -0.658 1.00 0.00 H new ATOM 0 HB ILE A 90 6.886 -11.561 0.138 1.00 0.00 H new ATOM 0 HG12 ILE A 90 6.950 -13.996 -0.614 1.00 0.00 H new ATOM 0 HG13 ILE A 90 7.925 -13.507 -1.986 1.00 0.00 H new ATOM 0 HG21 ILE A 90 5.121 -12.792 -1.235 1.00 0.00 H new ATOM 0 HG22 ILE A 90 5.130 -11.030 -1.488 1.00 0.00 H new ATOM 0 HG23 ILE A 90 5.864 -12.107 -2.700 1.00 0.00 H new ATOM 0 HD11 ILE A 90 9.316 -14.516 -0.236 1.00 0.00 H new ATOM 0 HD12 ILE A 90 9.748 -12.804 -0.456 1.00 0.00 H new ATOM 0 HD13 ILE A 90 8.757 -13.300 0.937 1.00 0.00 H new ATOM 1444 N GLY A 91 9.949 -10.863 -2.857 1.00 0.00 N ATOM 1445 CA GLY A 91 10.697 -11.204 -4.082 1.00 0.00 C ATOM 1446 C GLY A 91 11.220 -12.643 -4.047 1.00 0.00 C ATOM 1447 O GLY A 91 12.281 -12.903 -3.465 1.00 0.00 O ATOM 0 H GLY A 91 10.545 -10.625 -2.064 1.00 0.00 H new ATOM 0 HA2 GLY A 91 10.051 -11.073 -4.950 1.00 0.00 H new ATOM 0 HA3 GLY A 91 11.534 -10.516 -4.200 1.00 0.00 H new ATOM 1451 N LYS A 92 10.476 -13.549 -4.699 1.00 0.00 N ATOM 1452 CA LYS A 92 10.942 -14.936 -4.966 1.00 0.00 C ATOM 1453 C LYS A 92 11.927 -14.918 -6.177 1.00 0.00 C ATOM 1454 O LYS A 92 11.527 -14.716 -7.330 1.00 0.00 O ATOM 1455 CB LYS A 92 9.731 -15.873 -5.224 1.00 0.00 C ATOM 1456 CG LYS A 92 8.859 -16.226 -3.985 1.00 0.00 C ATOM 1457 CD LYS A 92 8.613 -17.742 -3.807 1.00 0.00 C ATOM 1458 CE LYS A 92 9.823 -18.466 -3.194 1.00 0.00 C ATOM 1459 NZ LYS A 92 9.731 -19.929 -3.357 1.00 0.00 N ATOM 0 H LYS A 92 9.541 -13.353 -5.057 1.00 0.00 H new ATOM 0 HA LYS A 92 11.470 -15.325 -4.095 1.00 0.00 H new ATOM 0 HB2 LYS A 92 9.090 -15.406 -5.972 1.00 0.00 H new ATOM 0 HB3 LYS A 92 10.103 -16.802 -5.657 1.00 0.00 H new ATOM 0 HG2 LYS A 92 9.344 -15.838 -3.089 1.00 0.00 H new ATOM 0 HG3 LYS A 92 7.898 -15.719 -4.072 1.00 0.00 H new ATOM 0 HD2 LYS A 92 7.742 -17.893 -3.170 1.00 0.00 H new ATOM 0 HD3 LYS A 92 8.380 -18.185 -4.775 1.00 0.00 H new ATOM 0 HE2 LYS A 92 10.738 -18.105 -3.664 1.00 0.00 H new ATOM 0 HE3 LYS A 92 9.892 -18.223 -2.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 9.779 -20.386 -2.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 8.829 -20.171 -3.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 10.520 -20.263 -3.947 1.00 0.00 H new ATOM 1472 N PHE A 93 13.225 -15.062 -5.877 1.00 0.00 N ATOM 1473 CA PHE A 93 14.320 -14.770 -6.836 1.00 0.00 C ATOM 1474 C PHE A 93 15.324 -15.957 -6.927 1.00 0.00 C ATOM 1475 O PHE A 93 15.789 -16.483 -5.913 1.00 0.00 O ATOM 1476 CB PHE A 93 15.026 -13.463 -6.364 1.00 0.00 C ATOM 1477 CG PHE A 93 14.441 -12.136 -6.887 1.00 0.00 C ATOM 1478 CD1 PHE A 93 14.412 -11.857 -8.257 1.00 0.00 C ATOM 1479 CD2 PHE A 93 13.957 -11.180 -5.992 1.00 0.00 C ATOM 1480 CE1 PHE A 93 13.868 -10.664 -8.728 1.00 0.00 C ATOM 1481 CE2 PHE A 93 13.422 -9.983 -6.459 1.00 0.00 C ATOM 1482 CZ PHE A 93 13.370 -9.729 -7.827 1.00 0.00 C ATOM 0 H PHE A 93 13.554 -15.383 -4.966 1.00 0.00 H new ATOM 0 HA PHE A 93 13.915 -14.634 -7.839 1.00 0.00 H new ATOM 0 HB2 PHE A 93 15.005 -13.439 -5.274 1.00 0.00 H new ATOM 0 HB3 PHE A 93 16.073 -13.515 -6.662 1.00 0.00 H new ATOM 0 HD1 PHE A 93 14.815 -12.574 -8.957 1.00 0.00 H new ATOM 0 HD2 PHE A 93 13.998 -11.371 -4.930 1.00 0.00 H new ATOM 0 HE1 PHE A 93 13.833 -10.466 -9.789 1.00 0.00 H new ATOM 0 HE2 PHE A 93 13.047 -9.251 -5.760 1.00 0.00 H new ATOM 0 HZ PHE A 93 12.943 -8.805 -8.189 1.00 0.00 H new ATOM 1492 N LYS A 94 15.706 -16.347 -8.153 1.00 0.00 N ATOM 1493 CA LYS A 94 16.705 -17.421 -8.392 1.00 0.00 C ATOM 1494 C LYS A 94 18.070 -16.829 -8.869 1.00 0.00 C ATOM 1495 O LYS A 94 18.114 -15.936 -9.721 1.00 0.00 O ATOM 1496 CB LYS A 94 16.062 -18.377 -9.431 1.00 0.00 C ATOM 1497 CG LYS A 94 16.845 -19.682 -9.691 1.00 0.00 C ATOM 1498 CD LYS A 94 16.155 -20.548 -10.768 1.00 0.00 C ATOM 1499 CE LYS A 94 16.925 -21.815 -11.176 1.00 0.00 C ATOM 1500 NZ LYS A 94 18.033 -21.514 -12.109 1.00 0.00 N ATOM 0 H LYS A 94 15.337 -15.933 -9.009 1.00 0.00 H new ATOM 0 HA LYS A 94 16.944 -17.966 -7.479 1.00 0.00 H new ATOM 0 HB2 LYS A 94 15.058 -18.635 -9.093 1.00 0.00 H new ATOM 0 HB3 LYS A 94 15.953 -17.843 -10.375 1.00 0.00 H new ATOM 0 HG2 LYS A 94 17.859 -19.442 -10.010 1.00 0.00 H new ATOM 0 HG3 LYS A 94 16.928 -20.249 -8.764 1.00 0.00 H new ATOM 0 HD2 LYS A 94 15.171 -20.841 -10.401 1.00 0.00 H new ATOM 0 HD3 LYS A 94 15.995 -19.937 -11.656 1.00 0.00 H new ATOM 0 HE2 LYS A 94 17.323 -22.300 -10.285 1.00 0.00 H new ATOM 0 HE3 LYS A 94 16.239 -22.521 -11.644 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 18.526 -22.395 -12.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 17.651 -21.075 -12.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 18.702 -20.860 -11.654 1.00 0.00 H new ATOM 1513 N ARG A 95 19.203 -17.381 -8.397 1.00 0.00 N ATOM 1514 CA ARG A 95 20.540 -17.069 -8.986 1.00 0.00 C ATOM 1515 C ARG A 95 20.686 -17.605 -10.448 1.00 0.00 C ATOM 1516 O ARG A 95 20.587 -18.817 -10.683 1.00 0.00 O ATOM 1517 CB ARG A 95 21.674 -17.668 -8.107 1.00 0.00 C ATOM 1518 CG ARG A 95 21.993 -16.890 -6.809 1.00 0.00 C ATOM 1519 CD ARG A 95 23.262 -17.365 -6.076 1.00 0.00 C ATOM 1520 NE ARG A 95 24.515 -17.141 -6.852 1.00 0.00 N ATOM 1521 CZ ARG A 95 25.733 -17.042 -6.330 1.00 0.00 C ATOM 1522 NH1 ARG A 95 26.030 -17.357 -5.095 1.00 0.00 N ATOM 1523 NH2 ARG A 95 26.684 -16.608 -7.099 1.00 0.00 N ATOM 0 H ARG A 95 19.231 -18.039 -7.618 1.00 0.00 H new ATOM 0 HA ARG A 95 20.624 -15.983 -9.015 1.00 0.00 H new ATOM 0 HB2 ARG A 95 21.402 -18.689 -7.840 1.00 0.00 H new ATOM 0 HB3 ARG A 95 22.582 -17.727 -8.707 1.00 0.00 H new ATOM 0 HG2 ARG A 95 22.103 -15.833 -7.051 1.00 0.00 H new ATOM 0 HG3 ARG A 95 21.144 -16.975 -6.131 1.00 0.00 H new ATOM 0 HD2 ARG A 95 23.337 -16.844 -5.121 1.00 0.00 H new ATOM 0 HD3 ARG A 95 23.167 -18.428 -5.853 1.00 0.00 H new ATOM 0 HE ARG A 95 24.431 -17.057 -7.865 1.00 0.00 H new ATOM 0 HH11 ARG A 95 25.304 -17.703 -4.468 1.00 0.00 H new ATOM 0 HH12 ARG A 95 26.988 -17.256 -4.759 1.00 0.00 H new ATOM 0 HH21 ARG A 95 26.483 -16.357 -8.067 1.00 0.00 H new ATOM 0 HH22 ARG A 95 27.633 -16.518 -6.735 1.00 0.00 H new ATOM 1537 N THR A 96 20.990 -16.713 -11.412 1.00 0.00 N ATOM 1538 CA THR A 96 21.395 -17.141 -12.791 1.00 0.00 C ATOM 1539 C THR A 96 22.726 -17.966 -12.927 1.00 0.00 C ATOM 1540 O THR A 96 22.864 -18.723 -13.891 1.00 0.00 O ATOM 1541 CB THR A 96 21.339 -15.932 -13.772 1.00 0.00 C ATOM 1542 OG1 THR A 96 21.263 -16.428 -15.104 1.00 0.00 O ATOM 1543 CG2 THR A 96 22.520 -14.949 -13.713 1.00 0.00 C ATOM 0 H THR A 96 20.967 -15.702 -11.277 1.00 0.00 H new ATOM 0 HA THR A 96 20.647 -17.883 -13.072 1.00 0.00 H new ATOM 0 HB THR A 96 20.462 -15.365 -13.459 1.00 0.00 H new ATOM 0 HG1 THR A 96 21.226 -15.676 -15.731 1.00 0.00 H new ATOM 0 HG21 THR A 96 22.367 -14.152 -14.441 1.00 0.00 H new ATOM 0 HG22 THR A 96 22.586 -14.520 -12.713 1.00 0.00 H new ATOM 0 HG23 THR A 96 23.445 -15.478 -13.943 1.00 0.00 H new ATOM 1551 N ASP A 97 23.677 -17.815 -11.988 1.00 0.00 N ATOM 1552 CA ASP A 97 24.945 -18.599 -11.937 1.00 0.00 C ATOM 1553 C ASP A 97 24.765 -20.148 -11.738 1.00 0.00 C ATOM 1554 O ASP A 97 25.465 -20.948 -12.362 1.00 0.00 O ATOM 1555 CB ASP A 97 25.866 -18.052 -10.796 1.00 0.00 C ATOM 1556 CG ASP A 97 26.002 -16.546 -10.578 1.00 0.00 C ATOM 1557 OD1 ASP A 97 26.534 -15.840 -11.450 1.00 0.00 O ATOM 1558 OD2 ASP A 97 25.558 -16.054 -9.514 1.00 0.00 O ATOM 0 H ASP A 97 23.595 -17.139 -11.229 1.00 0.00 H new ATOM 0 HA ASP A 97 25.395 -18.467 -12.921 1.00 0.00 H new ATOM 0 HB2 ASP A 97 25.513 -18.484 -9.860 1.00 0.00 H new ATOM 0 HB3 ASP A 97 26.867 -18.446 -10.971 1.00 0.00 H new ATOM 1563 N ASN A 98 23.883 -20.552 -10.801 1.00 0.00 N ATOM 1564 CA ASN A 98 23.892 -21.918 -10.193 1.00 0.00 C ATOM 1565 C ASN A 98 22.526 -22.477 -9.655 1.00 0.00 C ATOM 1566 O ASN A 98 22.496 -23.636 -9.235 1.00 0.00 O ATOM 1567 CB ASN A 98 25.040 -22.007 -9.133 1.00 0.00 C ATOM 1568 CG ASN A 98 25.180 -20.924 -8.046 1.00 0.00 C ATOM 1569 OD1 ASN A 98 26.158 -20.189 -7.976 1.00 0.00 O ATOM 1570 ND2 ASN A 98 24.235 -20.778 -7.157 1.00 0.00 N ATOM 0 H ASN A 98 23.143 -19.950 -10.439 1.00 0.00 H new ATOM 0 HA ASN A 98 24.084 -22.597 -11.024 1.00 0.00 H new ATOM 0 HB2 ASN A 98 24.935 -22.964 -8.623 1.00 0.00 H new ATOM 0 HB3 ASN A 98 25.982 -22.039 -9.680 1.00 0.00 H new ATOM 0 HD21 ASN A 98 24.323 -20.067 -6.431 1.00 0.00 H new ATOM 0 HD22 ASN A 98 23.408 -21.375 -7.189 1.00 0.00 H new ATOM 1577 N GLY A 99 21.412 -21.716 -9.649 1.00 0.00 N ATOM 1578 CA GLY A 99 20.074 -22.247 -9.247 1.00 0.00 C ATOM 1579 C GLY A 99 19.813 -22.539 -7.753 1.00 0.00 C ATOM 1580 O GLY A 99 19.400 -23.641 -7.392 1.00 0.00 O ATOM 0 H GLY A 99 21.403 -20.732 -9.916 1.00 0.00 H new ATOM 0 HA2 GLY A 99 19.321 -21.534 -9.581 1.00 0.00 H new ATOM 0 HA3 GLY A 99 19.905 -23.171 -9.799 1.00 0.00 H new ATOM 1584 N ASN A 100 20.026 -21.530 -6.904 1.00 0.00 N ATOM 1585 CA ASN A 100 19.983 -21.694 -5.415 1.00 0.00 C ATOM 1586 C ASN A 100 18.654 -21.270 -4.693 1.00 0.00 C ATOM 1587 O ASN A 100 18.389 -21.775 -3.600 1.00 0.00 O ATOM 1588 CB ASN A 100 21.207 -20.888 -4.886 1.00 0.00 C ATOM 1589 CG ASN A 100 21.784 -21.199 -3.501 1.00 0.00 C ATOM 1590 OD1 ASN A 100 22.991 -21.372 -3.350 1.00 0.00 O ATOM 1591 ND2 ASN A 100 21.021 -21.151 -2.439 1.00 0.00 N ATOM 0 H ASN A 100 20.233 -20.578 -7.207 1.00 0.00 H new ATOM 0 HA ASN A 100 20.021 -22.759 -5.184 1.00 0.00 H new ATOM 0 HB2 ASN A 100 22.014 -21.010 -5.609 1.00 0.00 H new ATOM 0 HB3 ASN A 100 20.930 -19.834 -4.893 1.00 0.00 H new ATOM 0 HD21 ASN A 100 21.431 -21.256 -1.511 1.00 0.00 H new ATOM 0 HD22 ASN A 100 20.016 -21.008 -2.539 1.00 0.00 H new ATOM 1598 N GLU A 101 17.899 -20.292 -5.226 1.00 0.00 N ATOM 1599 CA GLU A 101 16.874 -19.507 -4.479 1.00 0.00 C ATOM 1600 C GLU A 101 17.495 -18.497 -3.447 1.00 0.00 C ATOM 1601 O GLU A 101 18.091 -18.887 -2.437 1.00 0.00 O ATOM 1602 CB GLU A 101 15.663 -20.318 -3.909 1.00 0.00 C ATOM 1603 CG GLU A 101 14.292 -19.875 -4.492 1.00 0.00 C ATOM 1604 CD GLU A 101 13.056 -20.432 -3.804 1.00 0.00 C ATOM 1605 OE1 GLU A 101 12.838 -20.143 -2.608 1.00 0.00 O ATOM 1606 OE2 GLU A 101 12.255 -21.111 -4.477 1.00 0.00 O ATOM 0 H GLU A 101 17.978 -20.013 -6.204 1.00 0.00 H new ATOM 0 HA GLU A 101 16.411 -18.904 -5.260 1.00 0.00 H new ATOM 0 HB2 GLU A 101 15.813 -21.377 -4.119 1.00 0.00 H new ATOM 0 HB3 GLU A 101 15.640 -20.209 -2.825 1.00 0.00 H new ATOM 0 HG2 GLU A 101 14.241 -18.787 -4.458 1.00 0.00 H new ATOM 0 HG3 GLU A 101 14.258 -20.163 -5.543 1.00 0.00 H new ATOM 1613 N LEU A 102 17.333 -17.189 -3.707 1.00 0.00 N ATOM 1614 CA LEU A 102 17.562 -16.116 -2.698 1.00 0.00 C ATOM 1615 C LEU A 102 16.190 -15.432 -2.404 1.00 0.00 C ATOM 1616 O LEU A 102 15.592 -14.801 -3.283 1.00 0.00 O ATOM 1617 CB LEU A 102 18.650 -15.146 -3.240 1.00 0.00 C ATOM 1618 CG LEU A 102 19.333 -14.221 -2.192 1.00 0.00 C ATOM 1619 CD1 LEU A 102 20.673 -13.705 -2.742 1.00 0.00 C ATOM 1620 CD2 LEU A 102 18.479 -13.015 -1.767 1.00 0.00 C ATOM 0 H LEU A 102 17.040 -16.836 -4.618 1.00 0.00 H new ATOM 0 HA LEU A 102 17.939 -16.503 -1.751 1.00 0.00 H new ATOM 0 HB2 LEU A 102 19.423 -15.738 -3.729 1.00 0.00 H new ATOM 0 HB3 LEU A 102 18.197 -14.518 -4.007 1.00 0.00 H new ATOM 0 HG LEU A 102 19.477 -14.838 -1.305 1.00 0.00 H new ATOM 0 HD11 LEU A 102 21.145 -13.058 -2.002 1.00 0.00 H new ATOM 0 HD12 LEU A 102 21.328 -14.550 -2.956 1.00 0.00 H new ATOM 0 HD13 LEU A 102 20.497 -13.141 -3.658 1.00 0.00 H new ATOM 0 HD21 LEU A 102 19.027 -12.421 -1.035 1.00 0.00 H new ATOM 0 HD22 LEU A 102 18.257 -12.401 -2.640 1.00 0.00 H new ATOM 0 HD23 LEU A 102 17.547 -13.367 -1.324 1.00 0.00 H new ATOM 1632 N ASN A 103 15.682 -15.561 -1.167 1.00 0.00 N ATOM 1633 CA ASN A 103 14.347 -15.016 -0.785 1.00 0.00 C ATOM 1634 C ASN A 103 14.467 -13.590 -0.167 1.00 0.00 C ATOM 1635 O ASN A 103 15.338 -13.317 0.664 1.00 0.00 O ATOM 1636 CB ASN A 103 13.648 -16.022 0.167 1.00 0.00 C ATOM 1637 CG ASN A 103 13.004 -17.199 -0.573 1.00 0.00 C ATOM 1638 OD1 ASN A 103 11.914 -17.071 -1.115 1.00 0.00 O ATOM 1639 ND2 ASN A 103 13.657 -18.333 -0.655 1.00 0.00 N ATOM 0 H ASN A 103 16.168 -16.037 -0.407 1.00 0.00 H new ATOM 0 HA ASN A 103 13.731 -14.899 -1.676 1.00 0.00 H new ATOM 0 HB2 ASN A 103 14.377 -16.404 0.881 1.00 0.00 H new ATOM 0 HB3 ASN A 103 12.883 -15.499 0.741 1.00 0.00 H new ATOM 0 HD21 ASN A 103 13.257 -19.115 -1.173 1.00 0.00 H new ATOM 0 HD22 ASN A 103 14.565 -18.433 -0.201 1.00 0.00 H new ATOM 1646 N THR A 104 13.592 -12.672 -0.607 1.00 0.00 N ATOM 1647 CA THR A 104 13.744 -11.212 -0.329 1.00 0.00 C ATOM 1648 C THR A 104 12.404 -10.610 0.205 1.00 0.00 C ATOM 1649 O THR A 104 11.407 -10.587 -0.520 1.00 0.00 O ATOM 1650 CB THR A 104 14.255 -10.461 -1.602 1.00 0.00 C ATOM 1651 OG1 THR A 104 13.331 -10.537 -2.672 1.00 0.00 O ATOM 1652 CG2 THR A 104 15.606 -10.919 -2.176 1.00 0.00 C ATOM 0 H THR A 104 12.766 -12.903 -1.159 1.00 0.00 H new ATOM 0 HA THR A 104 14.493 -11.079 0.451 1.00 0.00 H new ATOM 0 HB THR A 104 14.378 -9.448 -1.218 1.00 0.00 H new ATOM 0 HG1 THR A 104 13.091 -11.474 -2.831 1.00 0.00 H new ATOM 0 HG21 THR A 104 15.849 -10.322 -3.055 1.00 0.00 H new ATOM 0 HG22 THR A 104 16.384 -10.790 -1.423 1.00 0.00 H new ATOM 0 HG23 THR A 104 15.544 -11.970 -2.457 1.00 0.00 H new ATOM 1660 N VAL A 105 12.362 -10.106 1.454 1.00 0.00 N ATOM 1661 CA VAL A 105 11.138 -9.448 2.020 1.00 0.00 C ATOM 1662 C VAL A 105 11.457 -7.935 2.265 1.00 0.00 C ATOM 1663 O VAL A 105 12.140 -7.589 3.233 1.00 0.00 O ATOM 1664 CB VAL A 105 10.599 -10.182 3.302 1.00 0.00 C ATOM 1665 CG1 VAL A 105 9.334 -9.512 3.896 1.00 0.00 C ATOM 1666 CG2 VAL A 105 10.231 -11.667 3.084 1.00 0.00 C ATOM 0 H VAL A 105 13.152 -10.135 2.099 1.00 0.00 H new ATOM 0 HA VAL A 105 10.321 -9.522 1.302 1.00 0.00 H new ATOM 0 HB VAL A 105 11.446 -10.108 3.984 1.00 0.00 H new ATOM 0 HG11 VAL A 105 9.010 -10.064 4.778 1.00 0.00 H new ATOM 0 HG12 VAL A 105 9.564 -8.484 4.175 1.00 0.00 H new ATOM 0 HG13 VAL A 105 8.537 -9.516 3.153 1.00 0.00 H new ATOM 0 HG21 VAL A 105 9.869 -12.093 4.020 1.00 0.00 H new ATOM 0 HG22 VAL A 105 9.451 -11.741 2.326 1.00 0.00 H new ATOM 0 HG23 VAL A 105 11.113 -12.216 2.753 1.00 0.00 H new ATOM 1676 N ARG A 106 10.917 -7.029 1.430 1.00 0.00 N ATOM 1677 CA ARG A 106 10.832 -5.578 1.769 1.00 0.00 C ATOM 1678 C ARG A 106 9.479 -5.270 2.492 1.00 0.00 C ATOM 1679 O ARG A 106 8.418 -5.509 1.915 1.00 0.00 O ATOM 1680 CB ARG A 106 11.015 -4.723 0.473 1.00 0.00 C ATOM 1681 CG ARG A 106 12.479 -4.335 0.148 1.00 0.00 C ATOM 1682 CD ARG A 106 12.646 -3.079 -0.732 1.00 0.00 C ATOM 1683 NE ARG A 106 12.561 -3.326 -2.200 1.00 0.00 N ATOM 1684 CZ ARG A 106 13.507 -3.005 -3.093 1.00 0.00 C ATOM 1685 NH1 ARG A 106 14.732 -2.669 -2.790 1.00 0.00 N ATOM 1686 NH2 ARG A 106 13.221 -3.022 -4.360 1.00 0.00 N ATOM 0 H ARG A 106 10.531 -7.265 0.516 1.00 0.00 H new ATOM 0 HA ARG A 106 11.634 -5.313 2.458 1.00 0.00 H new ATOM 0 HB2 ARG A 106 10.606 -5.278 -0.371 1.00 0.00 H new ATOM 0 HB3 ARG A 106 10.426 -3.811 0.571 1.00 0.00 H new ATOM 0 HG2 ARG A 106 13.012 -4.176 1.085 1.00 0.00 H new ATOM 0 HG3 ARG A 106 12.958 -5.176 -0.353 1.00 0.00 H new ATOM 0 HD2 ARG A 106 11.880 -2.355 -0.455 1.00 0.00 H new ATOM 0 HD3 ARG A 106 13.611 -2.623 -0.510 1.00 0.00 H new ATOM 0 HE ARG A 106 11.716 -3.775 -2.552 1.00 0.00 H new ATOM 0 HH11 ARG A 106 15.026 -2.638 -1.814 1.00 0.00 H new ATOM 0 HH12 ARG A 106 15.395 -2.438 -3.530 1.00 0.00 H new ATOM 0 HH21 ARG A 106 12.283 -3.278 -4.668 1.00 0.00 H new ATOM 0 HH22 ARG A 106 13.935 -2.779 -5.047 1.00 0.00 H new ATOM 1700 N GLU A 107 9.488 -4.716 3.722 1.00 0.00 N ATOM 1701 CA GLU A 107 8.227 -4.367 4.456 1.00 0.00 C ATOM 1702 C GLU A 107 8.335 -3.066 5.317 1.00 0.00 C ATOM 1703 O GLU A 107 9.376 -2.771 5.919 1.00 0.00 O ATOM 1704 CB GLU A 107 7.653 -5.578 5.245 1.00 0.00 C ATOM 1705 CG GLU A 107 8.460 -6.135 6.442 1.00 0.00 C ATOM 1706 CD GLU A 107 7.781 -7.281 7.173 1.00 0.00 C ATOM 1707 OE1 GLU A 107 7.006 -7.015 8.115 1.00 0.00 O ATOM 1708 OE2 GLU A 107 8.033 -8.451 6.818 1.00 0.00 O ATOM 0 H GLU A 107 10.342 -4.497 4.235 1.00 0.00 H new ATOM 0 HA GLU A 107 7.495 -4.124 3.686 1.00 0.00 H new ATOM 0 HB2 GLU A 107 6.667 -5.295 5.614 1.00 0.00 H new ATOM 0 HB3 GLU A 107 7.506 -6.394 4.537 1.00 0.00 H new ATOM 0 HG2 GLU A 107 9.433 -6.473 6.084 1.00 0.00 H new ATOM 0 HG3 GLU A 107 8.644 -5.326 7.149 1.00 0.00 H new ATOM 1715 N ILE A 108 7.230 -2.292 5.381 1.00 0.00 N ATOM 1716 CA ILE A 108 7.145 -1.059 6.225 1.00 0.00 C ATOM 1717 C ILE A 108 6.459 -1.422 7.583 1.00 0.00 C ATOM 1718 O ILE A 108 5.233 -1.558 7.652 1.00 0.00 O ATOM 1719 CB ILE A 108 6.429 0.147 5.500 1.00 0.00 C ATOM 1720 CG1 ILE A 108 6.908 0.477 4.055 1.00 0.00 C ATOM 1721 CG2 ILE A 108 6.478 1.453 6.345 1.00 0.00 C ATOM 1722 CD1 ILE A 108 8.422 0.679 3.896 1.00 0.00 C ATOM 0 H ILE A 108 6.376 -2.492 4.860 1.00 0.00 H new ATOM 0 HA ILE A 108 8.158 -0.705 6.413 1.00 0.00 H new ATOM 0 HB ILE A 108 5.408 -0.223 5.404 1.00 0.00 H new ATOM 0 HG12 ILE A 108 6.594 -0.330 3.393 1.00 0.00 H new ATOM 0 HG13 ILE A 108 6.400 1.381 3.719 1.00 0.00 H new ATOM 0 HG21 ILE A 108 5.973 2.254 5.806 1.00 0.00 H new ATOM 0 HG22 ILE A 108 5.979 1.288 7.300 1.00 0.00 H new ATOM 0 HG23 ILE A 108 7.516 1.733 6.522 1.00 0.00 H new ATOM 0 HD11 ILE A 108 8.652 0.904 2.854 1.00 0.00 H new ATOM 0 HD12 ILE A 108 8.747 1.507 4.526 1.00 0.00 H new ATOM 0 HD13 ILE A 108 8.944 -0.230 4.195 1.00 0.00 H new ATOM 1734 N ILE A 109 7.244 -1.522 8.669 1.00 0.00 N ATOM 1735 CA ILE A 109 6.714 -1.740 10.047 1.00 0.00 C ATOM 1736 C ILE A 109 6.166 -0.457 10.771 1.00 0.00 C ATOM 1737 O ILE A 109 5.173 -0.549 11.497 1.00 0.00 O ATOM 1738 CB ILE A 109 7.734 -2.550 10.918 1.00 0.00 C ATOM 1739 CG1 ILE A 109 9.033 -1.847 11.414 1.00 0.00 C ATOM 1740 CG2 ILE A 109 8.035 -3.972 10.374 1.00 0.00 C ATOM 1741 CD1 ILE A 109 10.060 -1.412 10.357 1.00 0.00 C ATOM 0 H ILE A 109 8.261 -1.456 8.628 1.00 0.00 H new ATOM 0 HA ILE A 109 5.818 -2.347 9.920 1.00 0.00 H new ATOM 0 HB ILE A 109 7.148 -2.631 11.833 1.00 0.00 H new ATOM 0 HG12 ILE A 109 8.740 -0.963 11.980 1.00 0.00 H new ATOM 0 HG13 ILE A 109 9.533 -2.520 12.110 1.00 0.00 H new ATOM 0 HG21 ILE A 109 8.749 -4.469 11.031 1.00 0.00 H new ATOM 0 HG22 ILE A 109 7.112 -4.550 10.337 1.00 0.00 H new ATOM 0 HG23 ILE A 109 8.456 -3.896 9.371 1.00 0.00 H new ATOM 0 HD11 ILE A 109 10.910 -0.938 10.849 1.00 0.00 H new ATOM 0 HD12 ILE A 109 10.403 -2.285 9.802 1.00 0.00 H new ATOM 0 HD13 ILE A 109 9.597 -0.704 9.670 1.00 0.00 H new ATOM 1753 N GLY A 110 6.806 0.714 10.598 1.00 0.00 N ATOM 1754 CA GLY A 110 6.302 1.998 11.148 1.00 0.00 C ATOM 1755 C GLY A 110 6.830 3.186 10.328 1.00 0.00 C ATOM 1756 O GLY A 110 6.296 3.484 9.258 1.00 0.00 O ATOM 0 H GLY A 110 7.679 0.803 10.079 1.00 0.00 H new ATOM 0 HA2 GLY A 110 5.212 2.000 11.139 1.00 0.00 H new ATOM 0 HA3 GLY A 110 6.613 2.101 12.188 1.00 0.00 H new ATOM 1760 N ASP A 111 7.909 3.826 10.804 1.00 0.00 N ATOM 1761 CA ASP A 111 8.681 4.820 9.991 1.00 0.00 C ATOM 1762 C ASP A 111 10.004 4.288 9.325 1.00 0.00 C ATOM 1763 O ASP A 111 10.916 5.088 9.076 1.00 0.00 O ATOM 1764 CB ASP A 111 8.882 6.089 10.872 1.00 0.00 C ATOM 1765 CG ASP A 111 9.869 6.000 12.042 1.00 0.00 C ATOM 1766 OD1 ASP A 111 11.169 5.952 11.617 1.00 0.00 O ATOM 1767 OD2 ASP A 111 9.519 5.984 13.218 1.00 0.00 O ATOM 0 H ASP A 111 8.278 3.684 11.744 1.00 0.00 H new ATOM 0 HA ASP A 111 8.093 5.062 9.105 1.00 0.00 H new ATOM 0 HB2 ASP A 111 9.207 6.900 10.221 1.00 0.00 H new ATOM 0 HB3 ASP A 111 7.910 6.374 11.275 1.00 0.00 H new ATOM 1772 N GLU A 112 10.125 2.974 9.062 1.00 0.00 N ATOM 1773 CA GLU A 112 11.363 2.346 8.526 1.00 0.00 C ATOM 1774 C GLU A 112 11.000 1.246 7.478 1.00 0.00 C ATOM 1775 O GLU A 112 9.975 0.560 7.569 1.00 0.00 O ATOM 1776 CB GLU A 112 12.237 1.766 9.680 1.00 0.00 C ATOM 1777 CG GLU A 112 12.976 2.820 10.548 1.00 0.00 C ATOM 1778 CD GLU A 112 13.872 2.287 11.654 1.00 0.00 C ATOM 1779 OE1 GLU A 112 14.704 1.392 11.413 1.00 0.00 O ATOM 1780 OE2 GLU A 112 13.829 2.830 12.775 1.00 0.00 O ATOM 0 H GLU A 112 9.367 2.308 9.214 1.00 0.00 H new ATOM 0 HA GLU A 112 11.953 3.112 8.023 1.00 0.00 H new ATOM 0 HB2 GLU A 112 11.600 1.167 10.330 1.00 0.00 H new ATOM 0 HB3 GLU A 112 12.977 1.091 9.249 1.00 0.00 H new ATOM 0 HG2 GLU A 112 13.583 3.440 9.888 1.00 0.00 H new ATOM 0 HG3 GLU A 112 12.229 3.473 11.000 1.00 0.00 H new ATOM 1787 N LEU A 113 11.890 1.058 6.492 1.00 0.00 N ATOM 1788 CA LEU A 113 11.834 -0.099 5.564 1.00 0.00 C ATOM 1789 C LEU A 113 12.868 -1.162 6.035 1.00 0.00 C ATOM 1790 O LEU A 113 14.081 -0.947 5.942 1.00 0.00 O ATOM 1791 CB LEU A 113 12.053 0.426 4.116 1.00 0.00 C ATOM 1792 CG LEU A 113 12.308 -0.611 2.988 1.00 0.00 C ATOM 1793 CD1 LEU A 113 11.229 -1.695 2.871 1.00 0.00 C ATOM 1794 CD2 LEU A 113 12.449 0.117 1.640 1.00 0.00 C ATOM 0 H LEU A 113 12.666 1.694 6.310 1.00 0.00 H new ATOM 0 HA LEU A 113 10.865 -0.598 5.567 1.00 0.00 H new ATOM 0 HB2 LEU A 113 11.176 1.011 3.838 1.00 0.00 H new ATOM 0 HB3 LEU A 113 12.900 1.111 4.135 1.00 0.00 H new ATOM 0 HG LEU A 113 13.230 -1.127 3.257 1.00 0.00 H new ATOM 0 HD11 LEU A 113 11.485 -2.377 2.060 1.00 0.00 H new ATOM 0 HD12 LEU A 113 11.169 -2.251 3.807 1.00 0.00 H new ATOM 0 HD13 LEU A 113 10.266 -1.229 2.663 1.00 0.00 H new ATOM 0 HD21 LEU A 113 12.628 -0.612 0.850 1.00 0.00 H new ATOM 0 HD22 LEU A 113 11.533 0.667 1.426 1.00 0.00 H new ATOM 0 HD23 LEU A 113 13.287 0.813 1.688 1.00 0.00 H new ATOM 1806 N VAL A 114 12.380 -2.321 6.502 1.00 0.00 N ATOM 1807 CA VAL A 114 13.243 -3.509 6.772 1.00 0.00 C ATOM 1808 C VAL A 114 13.315 -4.378 5.470 1.00 0.00 C ATOM 1809 O VAL A 114 12.294 -4.830 4.939 1.00 0.00 O ATOM 1810 CB VAL A 114 12.809 -4.306 8.055 1.00 0.00 C ATOM 1811 CG1 VAL A 114 12.996 -3.508 9.367 1.00 0.00 C ATOM 1812 CG2 VAL A 114 11.378 -4.882 8.034 1.00 0.00 C ATOM 0 H VAL A 114 11.392 -2.473 6.705 1.00 0.00 H new ATOM 0 HA VAL A 114 14.252 -3.177 7.016 1.00 0.00 H new ATOM 0 HB VAL A 114 13.498 -5.150 8.032 1.00 0.00 H new ATOM 0 HG11 VAL A 114 12.677 -4.118 10.212 1.00 0.00 H new ATOM 0 HG12 VAL A 114 14.047 -3.244 9.486 1.00 0.00 H new ATOM 0 HG13 VAL A 114 12.396 -2.599 9.329 1.00 0.00 H new ATOM 0 HG21 VAL A 114 11.185 -5.411 8.967 1.00 0.00 H new ATOM 0 HG22 VAL A 114 10.660 -4.069 7.923 1.00 0.00 H new ATOM 0 HG23 VAL A 114 11.276 -5.573 7.197 1.00 0.00 H new ATOM 1822 N GLN A 115 14.532 -4.572 4.936 1.00 0.00 N ATOM 1823 CA GLN A 115 14.773 -5.379 3.709 1.00 0.00 C ATOM 1824 C GLN A 115 15.514 -6.695 4.104 1.00 0.00 C ATOM 1825 O GLN A 115 16.747 -6.747 4.172 1.00 0.00 O ATOM 1826 CB GLN A 115 15.533 -4.446 2.733 1.00 0.00 C ATOM 1827 CG GLN A 115 15.937 -5.047 1.371 1.00 0.00 C ATOM 1828 CD GLN A 115 16.599 -4.059 0.402 1.00 0.00 C ATOM 1829 OE1 GLN A 115 15.951 -3.230 -0.228 1.00 0.00 O ATOM 1830 NE2 GLN A 115 17.896 -4.124 0.221 1.00 0.00 N ATOM 0 H GLN A 115 15.383 -4.177 5.337 1.00 0.00 H new ATOM 0 HA GLN A 115 13.868 -5.719 3.205 1.00 0.00 H new ATOM 0 HB2 GLN A 115 14.912 -3.570 2.547 1.00 0.00 H new ATOM 0 HB3 GLN A 115 16.437 -4.096 3.232 1.00 0.00 H new ATOM 0 HG2 GLN A 115 16.622 -5.877 1.545 1.00 0.00 H new ATOM 0 HG3 GLN A 115 15.048 -5.461 0.895 1.00 0.00 H new ATOM 0 HE21 GLN A 115 18.449 -4.808 0.737 1.00 0.00 H new ATOM 0 HE22 GLN A 115 18.352 -3.491 -0.436 1.00 0.00 H new ATOM 1839 N THR A 116 14.733 -7.751 4.374 1.00 0.00 N ATOM 1840 CA THR A 116 15.239 -9.044 4.912 1.00 0.00 C ATOM 1841 C THR A 116 15.631 -9.982 3.726 1.00 0.00 C ATOM 1842 O THR A 116 14.763 -10.572 3.070 1.00 0.00 O ATOM 1843 CB THR A 116 14.137 -9.655 5.835 1.00 0.00 C ATOM 1844 OG1 THR A 116 13.777 -8.754 6.879 1.00 0.00 O ATOM 1845 CG2 THR A 116 14.539 -10.956 6.539 1.00 0.00 C ATOM 0 H THR A 116 13.724 -7.742 4.228 1.00 0.00 H new ATOM 0 HA THR A 116 16.138 -8.904 5.512 1.00 0.00 H new ATOM 0 HB THR A 116 13.317 -9.855 5.146 1.00 0.00 H new ATOM 0 HG1 THR A 116 13.085 -9.163 7.439 1.00 0.00 H new ATOM 0 HG21 THR A 116 13.712 -11.306 7.157 1.00 0.00 H new ATOM 0 HG22 THR A 116 14.780 -11.714 5.793 1.00 0.00 H new ATOM 0 HG23 THR A 116 15.411 -10.775 7.168 1.00 0.00 H new ATOM 1853 N TYR A 117 16.938 -10.096 3.436 1.00 0.00 N ATOM 1854 CA TYR A 117 17.452 -10.934 2.315 1.00 0.00 C ATOM 1855 C TYR A 117 18.050 -12.266 2.869 1.00 0.00 C ATOM 1856 O TYR A 117 19.045 -12.247 3.597 1.00 0.00 O ATOM 1857 CB TYR A 117 18.484 -10.108 1.483 1.00 0.00 C ATOM 1858 CG TYR A 117 18.000 -9.019 0.491 1.00 0.00 C ATOM 1859 CD1 TYR A 117 16.666 -8.598 0.406 1.00 0.00 C ATOM 1860 CD2 TYR A 117 18.936 -8.470 -0.398 1.00 0.00 C ATOM 1861 CE1 TYR A 117 16.274 -7.684 -0.564 1.00 0.00 C ATOM 1862 CE2 TYR A 117 18.539 -7.544 -1.365 1.00 0.00 C ATOM 1863 CZ TYR A 117 17.204 -7.157 -1.447 1.00 0.00 C ATOM 1864 OH TYR A 117 16.788 -6.214 -2.351 1.00 0.00 O ATOM 0 H TYR A 117 17.671 -9.618 3.961 1.00 0.00 H new ATOM 0 HA TYR A 117 16.637 -11.211 1.646 1.00 0.00 H new ATOM 0 HB2 TYR A 117 19.155 -9.623 2.192 1.00 0.00 H new ATOM 0 HB3 TYR A 117 19.082 -10.819 0.914 1.00 0.00 H new ATOM 0 HD1 TYR A 117 15.936 -8.987 1.101 1.00 0.00 H new ATOM 0 HD2 TYR A 117 19.973 -8.766 -0.334 1.00 0.00 H new ATOM 0 HE1 TYR A 117 15.239 -7.382 -0.631 1.00 0.00 H new ATOM 0 HE2 TYR A 117 19.266 -7.129 -2.048 1.00 0.00 H new ATOM 0 HH TYR A 117 17.547 -5.934 -2.904 1.00 0.00 H new ATOM 1874 N VAL A 118 17.454 -13.420 2.517 1.00 0.00 N ATOM 1875 CA VAL A 118 17.864 -14.757 3.052 1.00 0.00 C ATOM 1876 C VAL A 118 18.522 -15.587 1.900 1.00 0.00 C ATOM 1877 O VAL A 118 17.901 -15.833 0.857 1.00 0.00 O ATOM 1878 CB VAL A 118 16.658 -15.504 3.727 1.00 0.00 C ATOM 1879 CG1 VAL A 118 17.073 -16.856 4.362 1.00 0.00 C ATOM 1880 CG2 VAL A 118 15.959 -14.703 4.854 1.00 0.00 C ATOM 0 H VAL A 118 16.677 -13.466 1.858 1.00 0.00 H new ATOM 0 HA VAL A 118 18.603 -14.623 3.842 1.00 0.00 H new ATOM 0 HB VAL A 118 15.970 -15.646 2.894 1.00 0.00 H new ATOM 0 HG11 VAL A 118 16.201 -17.329 4.814 1.00 0.00 H new ATOM 0 HG12 VAL A 118 17.482 -17.510 3.591 1.00 0.00 H new ATOM 0 HG13 VAL A 118 17.829 -16.682 5.128 1.00 0.00 H new ATOM 0 HG21 VAL A 118 15.139 -15.292 5.264 1.00 0.00 H new ATOM 0 HG22 VAL A 118 16.678 -14.482 5.643 1.00 0.00 H new ATOM 0 HG23 VAL A 118 15.568 -13.770 4.448 1.00 0.00 H new ATOM 1890 N TYR A 119 19.766 -16.049 2.119 1.00 0.00 N ATOM 1891 CA TYR A 119 20.491 -16.929 1.165 1.00 0.00 C ATOM 1892 C TYR A 119 20.987 -18.225 1.883 1.00 0.00 C ATOM 1893 O TYR A 119 21.884 -18.162 2.729 1.00 0.00 O ATOM 1894 CB TYR A 119 21.643 -16.099 0.530 1.00 0.00 C ATOM 1895 CG TYR A 119 22.379 -16.823 -0.602 1.00 0.00 C ATOM 1896 CD1 TYR A 119 21.706 -17.140 -1.788 1.00 0.00 C ATOM 1897 CD2 TYR A 119 23.696 -17.252 -0.426 1.00 0.00 C ATOM 1898 CE1 TYR A 119 22.343 -17.879 -2.773 1.00 0.00 C ATOM 1899 CE2 TYR A 119 24.326 -18.008 -1.412 1.00 0.00 C ATOM 1900 CZ TYR A 119 23.650 -18.316 -2.588 1.00 0.00 C ATOM 1901 OH TYR A 119 24.241 -19.122 -3.523 1.00 0.00 O ATOM 0 H TYR A 119 20.302 -15.828 2.958 1.00 0.00 H new ATOM 0 HA TYR A 119 19.833 -17.270 0.366 1.00 0.00 H new ATOM 0 HB2 TYR A 119 21.235 -15.164 0.145 1.00 0.00 H new ATOM 0 HB3 TYR A 119 22.361 -15.837 1.308 1.00 0.00 H new ATOM 0 HD1 TYR A 119 20.689 -16.808 -1.936 1.00 0.00 H new ATOM 0 HD2 TYR A 119 24.228 -16.997 0.478 1.00 0.00 H new ATOM 0 HE1 TYR A 119 21.822 -18.116 -3.688 1.00 0.00 H new ATOM 0 HE2 TYR A 119 25.338 -18.355 -1.264 1.00 0.00 H new ATOM 0 HH TYR A 119 24.109 -20.061 -3.276 1.00 0.00 H new ATOM 1911 N GLU A 120 20.414 -19.399 1.537 1.00 0.00 N ATOM 1912 CA GLU A 120 20.785 -20.719 2.147 1.00 0.00 C ATOM 1913 C GLU A 120 20.750 -20.789 3.719 1.00 0.00 C ATOM 1914 O GLU A 120 21.750 -21.080 4.383 1.00 0.00 O ATOM 1915 CB GLU A 120 22.093 -21.261 1.472 1.00 0.00 C ATOM 1916 CG GLU A 120 21.911 -22.560 0.648 1.00 0.00 C ATOM 1917 CD GLU A 120 21.650 -23.825 1.453 1.00 0.00 C ATOM 1918 OE1 GLU A 120 20.485 -24.050 1.843 1.00 0.00 O ATOM 1919 OE2 GLU A 120 22.598 -24.607 1.670 1.00 0.00 O ATOM 0 H GLU A 120 19.682 -19.471 0.830 1.00 0.00 H new ATOM 0 HA GLU A 120 19.980 -21.417 1.916 1.00 0.00 H new ATOM 0 HB2 GLU A 120 22.495 -20.487 0.819 1.00 0.00 H new ATOM 0 HB3 GLU A 120 22.837 -21.441 2.248 1.00 0.00 H new ATOM 0 HG2 GLU A 120 21.082 -22.415 -0.044 1.00 0.00 H new ATOM 0 HG3 GLU A 120 22.806 -22.714 0.045 1.00 0.00 H new ATOM 1926 N GLY A 121 19.604 -20.417 4.327 1.00 0.00 N ATOM 1927 CA GLY A 121 19.540 -20.130 5.792 1.00 0.00 C ATOM 1928 C GLY A 121 20.110 -18.786 6.330 1.00 0.00 C ATOM 1929 O GLY A 121 19.694 -18.351 7.405 1.00 0.00 O ATOM 0 H GLY A 121 18.715 -20.307 3.840 1.00 0.00 H new ATOM 0 HA2 GLY A 121 18.493 -20.185 6.091 1.00 0.00 H new ATOM 0 HA3 GLY A 121 20.062 -20.937 6.307 1.00 0.00 H new ATOM 1933 N VAL A 122 21.070 -18.152 5.635 1.00 0.00 N ATOM 1934 CA VAL A 122 21.833 -16.982 6.155 1.00 0.00 C ATOM 1935 C VAL A 122 21.064 -15.667 5.802 1.00 0.00 C ATOM 1936 O VAL A 122 20.998 -15.242 4.643 1.00 0.00 O ATOM 1937 CB VAL A 122 23.309 -17.006 5.626 1.00 0.00 C ATOM 1938 CG1 VAL A 122 24.166 -15.836 6.161 1.00 0.00 C ATOM 1939 CG2 VAL A 122 24.077 -18.302 5.978 1.00 0.00 C ATOM 0 H VAL A 122 21.347 -18.430 4.693 1.00 0.00 H new ATOM 0 HA VAL A 122 21.907 -17.030 7.241 1.00 0.00 H new ATOM 0 HB VAL A 122 23.179 -16.928 4.547 1.00 0.00 H new ATOM 0 HG11 VAL A 122 25.176 -15.911 5.758 1.00 0.00 H new ATOM 0 HG12 VAL A 122 23.722 -14.889 5.854 1.00 0.00 H new ATOM 0 HG13 VAL A 122 24.206 -15.882 7.249 1.00 0.00 H new ATOM 0 HG21 VAL A 122 25.090 -18.245 5.579 1.00 0.00 H new ATOM 0 HG22 VAL A 122 24.120 -18.417 7.061 1.00 0.00 H new ATOM 0 HG23 VAL A 122 23.563 -19.159 5.542 1.00 0.00 H new ATOM 1949 N GLU A 123 20.501 -15.034 6.838 1.00 0.00 N ATOM 1950 CA GLU A 123 19.746 -13.761 6.720 1.00 0.00 C ATOM 1951 C GLU A 123 20.673 -12.500 6.757 1.00 0.00 C ATOM 1952 O GLU A 123 21.662 -12.460 7.493 1.00 0.00 O ATOM 1953 CB GLU A 123 18.706 -13.809 7.876 1.00 0.00 C ATOM 1954 CG GLU A 123 17.679 -12.651 7.903 1.00 0.00 C ATOM 1955 CD GLU A 123 16.443 -12.931 8.744 1.00 0.00 C ATOM 1956 OE1 GLU A 123 15.552 -13.663 8.263 1.00 0.00 O ATOM 1957 OE2 GLU A 123 16.335 -12.390 9.864 1.00 0.00 O ATOM 0 H GLU A 123 20.552 -15.386 7.794 1.00 0.00 H new ATOM 0 HA GLU A 123 19.252 -13.666 5.753 1.00 0.00 H new ATOM 0 HB2 GLU A 123 18.162 -14.751 7.812 1.00 0.00 H new ATOM 0 HB3 GLU A 123 19.244 -13.815 8.824 1.00 0.00 H new ATOM 0 HG2 GLU A 123 18.169 -11.755 8.285 1.00 0.00 H new ATOM 0 HG3 GLU A 123 17.367 -12.433 6.881 1.00 0.00 H new ATOM 1964 N ALA A 124 20.333 -11.457 5.982 1.00 0.00 N ATOM 1965 CA ALA A 124 20.882 -10.091 6.180 1.00 0.00 C ATOM 1966 C ALA A 124 19.764 -9.020 6.036 1.00 0.00 C ATOM 1967 O ALA A 124 19.120 -8.894 4.987 1.00 0.00 O ATOM 1968 CB ALA A 124 22.034 -9.834 5.197 1.00 0.00 C ATOM 0 H ALA A 124 19.676 -11.528 5.205 1.00 0.00 H new ATOM 0 HA ALA A 124 21.278 -10.017 7.193 1.00 0.00 H new ATOM 0 HB1 ALA A 124 22.428 -8.830 5.352 1.00 0.00 H new ATOM 0 HB2 ALA A 124 22.826 -10.564 5.365 1.00 0.00 H new ATOM 0 HB3 ALA A 124 21.667 -9.926 4.175 1.00 0.00 H new ATOM 1974 N LYS A 125 19.555 -8.227 7.098 1.00 0.00 N ATOM 1975 CA LYS A 125 18.464 -7.220 7.151 1.00 0.00 C ATOM 1976 C LYS A 125 19.054 -5.815 6.849 1.00 0.00 C ATOM 1977 O LYS A 125 19.796 -5.259 7.664 1.00 0.00 O ATOM 1978 CB LYS A 125 17.763 -7.296 8.534 1.00 0.00 C ATOM 1979 CG LYS A 125 16.951 -8.593 8.778 1.00 0.00 C ATOM 1980 CD LYS A 125 16.448 -8.793 10.218 1.00 0.00 C ATOM 1981 CE LYS A 125 15.380 -7.778 10.654 1.00 0.00 C ATOM 1982 NZ LYS A 125 14.886 -8.135 11.995 1.00 0.00 N ATOM 0 H LYS A 125 20.128 -8.258 7.942 1.00 0.00 H new ATOM 0 HA LYS A 125 17.706 -7.423 6.395 1.00 0.00 H new ATOM 0 HB2 LYS A 125 18.518 -7.204 9.314 1.00 0.00 H new ATOM 0 HB3 LYS A 125 17.095 -6.441 8.635 1.00 0.00 H new ATOM 0 HG2 LYS A 125 16.092 -8.596 8.107 1.00 0.00 H new ATOM 0 HG3 LYS A 125 17.571 -9.447 8.505 1.00 0.00 H new ATOM 0 HD2 LYS A 125 16.039 -9.799 10.312 1.00 0.00 H new ATOM 0 HD3 LYS A 125 17.296 -8.729 10.900 1.00 0.00 H new ATOM 0 HE2 LYS A 125 15.801 -6.773 10.665 1.00 0.00 H new ATOM 0 HE3 LYS A 125 14.556 -7.771 9.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 14.163 -7.449 12.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 14.470 -9.088 11.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 15.676 -8.120 12.671 1.00 0.00 H new ATOM 1995 N ARG A 126 18.728 -5.236 5.679 1.00 0.00 N ATOM 1996 CA ARG A 126 19.119 -3.839 5.337 1.00 0.00 C ATOM 1997 C ARG A 126 17.992 -2.873 5.813 1.00 0.00 C ATOM 1998 O ARG A 126 16.883 -2.897 5.273 1.00 0.00 O ATOM 1999 CB ARG A 126 19.413 -3.683 3.817 1.00 0.00 C ATOM 2000 CG ARG A 126 20.432 -4.630 3.139 1.00 0.00 C ATOM 2001 CD ARG A 126 21.872 -4.642 3.691 1.00 0.00 C ATOM 2002 NE ARG A 126 22.550 -3.314 3.799 1.00 0.00 N ATOM 2003 CZ ARG A 126 23.035 -2.602 2.788 1.00 0.00 C ATOM 2004 NH1 ARG A 126 22.792 -2.861 1.534 1.00 0.00 N ATOM 2005 NH2 ARG A 126 23.820 -1.604 3.051 1.00 0.00 N ATOM 0 H ARG A 126 18.195 -5.707 4.948 1.00 0.00 H new ATOM 0 HA ARG A 126 20.046 -3.586 5.852 1.00 0.00 H new ATOM 0 HB2 ARG A 126 18.466 -3.789 3.288 1.00 0.00 H new ATOM 0 HB3 ARG A 126 19.757 -2.662 3.653 1.00 0.00 H new ATOM 0 HG2 ARG A 126 20.040 -5.645 3.201 1.00 0.00 H new ATOM 0 HG3 ARG A 126 20.480 -4.371 2.081 1.00 0.00 H new ATOM 0 HD2 ARG A 126 21.856 -5.099 4.680 1.00 0.00 H new ATOM 0 HD3 ARG A 126 22.478 -5.285 3.053 1.00 0.00 H new ATOM 0 HE ARG A 126 22.649 -2.919 4.734 1.00 0.00 H new ATOM 0 HH11 ARG A 126 22.198 -3.651 1.282 1.00 0.00 H new ATOM 0 HH12 ARG A 126 23.196 -2.274 0.804 1.00 0.00 H new ATOM 0 HH21 ARG A 126 24.053 -1.380 4.018 1.00 0.00 H new ATOM 0 HH22 ARG A 126 24.204 -1.043 2.291 1.00 0.00 H new ATOM 2019 N ILE A 127 18.237 -2.067 6.858 1.00 0.00 N ATOM 2020 CA ILE A 127 17.142 -1.321 7.553 1.00 0.00 C ATOM 2021 C ILE A 127 17.296 0.203 7.222 1.00 0.00 C ATOM 2022 O ILE A 127 18.310 0.837 7.544 1.00 0.00 O ATOM 2023 CB ILE A 127 17.066 -1.677 9.078 1.00 0.00 C ATOM 2024 CG1 ILE A 127 17.023 -3.212 9.378 1.00 0.00 C ATOM 2025 CG2 ILE A 127 15.837 -0.984 9.722 1.00 0.00 C ATOM 2026 CD1 ILE A 127 17.175 -3.626 10.853 1.00 0.00 C ATOM 0 H ILE A 127 19.166 -1.907 7.247 1.00 0.00 H new ATOM 0 HA ILE A 127 16.165 -1.630 7.182 1.00 0.00 H new ATOM 0 HB ILE A 127 17.993 -1.308 9.517 1.00 0.00 H new ATOM 0 HG12 ILE A 127 16.076 -3.606 9.009 1.00 0.00 H new ATOM 0 HG13 ILE A 127 17.814 -3.694 8.804 1.00 0.00 H new ATOM 0 HG21 ILE A 127 15.791 -1.236 10.781 1.00 0.00 H new ATOM 0 HG22 ILE A 127 15.928 0.096 9.610 1.00 0.00 H new ATOM 0 HG23 ILE A 127 14.927 -1.325 9.228 1.00 0.00 H new ATOM 0 HD11 ILE A 127 17.129 -4.712 10.933 1.00 0.00 H new ATOM 0 HD12 ILE A 127 18.134 -3.275 11.233 1.00 0.00 H new ATOM 0 HD13 ILE A 127 16.369 -3.185 11.440 1.00 0.00 H new ATOM 2038 N PHE A 128 16.277 0.768 6.551 1.00 0.00 N ATOM 2039 CA PHE A 128 16.354 2.112 5.921 1.00 0.00 C ATOM 2040 C PHE A 128 15.404 3.141 6.610 1.00 0.00 C ATOM 2041 O PHE A 128 14.270 2.826 6.988 1.00 0.00 O ATOM 2042 CB PHE A 128 15.982 2.045 4.413 1.00 0.00 C ATOM 2043 CG PHE A 128 16.762 1.137 3.453 1.00 0.00 C ATOM 2044 CD1 PHE A 128 16.532 -0.241 3.433 1.00 0.00 C ATOM 2045 CD2 PHE A 128 17.645 1.691 2.524 1.00 0.00 C ATOM 2046 CE1 PHE A 128 17.223 -1.053 2.540 1.00 0.00 C ATOM 2047 CE2 PHE A 128 18.324 0.881 1.624 1.00 0.00 C ATOM 2048 CZ PHE A 128 18.126 -0.495 1.643 1.00 0.00 C ATOM 0 H PHE A 128 15.374 0.311 6.426 1.00 0.00 H new ATOM 0 HA PHE A 128 17.386 2.442 6.041 1.00 0.00 H new ATOM 0 HB2 PHE A 128 14.934 1.749 4.354 1.00 0.00 H new ATOM 0 HB3 PHE A 128 16.050 3.060 4.021 1.00 0.00 H new ATOM 0 HD1 PHE A 128 15.815 -0.677 4.113 1.00 0.00 H new ATOM 0 HD2 PHE A 128 17.801 2.759 2.505 1.00 0.00 H new ATOM 0 HE1 PHE A 128 17.057 -2.120 2.544 1.00 0.00 H new ATOM 0 HE2 PHE A 128 19.005 1.319 0.910 1.00 0.00 H new ATOM 0 HZ PHE A 128 18.673 -1.129 0.962 1.00 0.00 H new ATOM 2058 N LYS A 129 15.856 4.401 6.680 1.00 0.00 N ATOM 2059 CA LYS A 129 15.082 5.532 7.269 1.00 0.00 C ATOM 2060 C LYS A 129 14.725 6.575 6.163 1.00 0.00 C ATOM 2061 O LYS A 129 15.554 6.906 5.305 1.00 0.00 O ATOM 2062 CB LYS A 129 15.953 6.178 8.379 1.00 0.00 C ATOM 2063 CG LYS A 129 16.152 5.315 9.652 1.00 0.00 C ATOM 2064 CD LYS A 129 17.412 5.704 10.443 1.00 0.00 C ATOM 2065 CE LYS A 129 17.244 6.877 11.416 1.00 0.00 C ATOM 2066 NZ LYS A 129 18.529 7.131 12.104 1.00 0.00 N ATOM 0 H LYS A 129 16.773 4.678 6.331 1.00 0.00 H new ATOM 0 HA LYS A 129 14.145 5.173 7.696 1.00 0.00 H new ATOM 0 HB2 LYS A 129 16.932 6.410 7.960 1.00 0.00 H new ATOM 0 HB3 LYS A 129 15.498 7.125 8.670 1.00 0.00 H new ATOM 0 HG2 LYS A 129 15.278 5.418 10.295 1.00 0.00 H new ATOM 0 HG3 LYS A 129 16.217 4.265 9.367 1.00 0.00 H new ATOM 0 HD2 LYS A 129 17.750 4.834 11.005 1.00 0.00 H new ATOM 0 HD3 LYS A 129 18.202 5.952 9.735 1.00 0.00 H new ATOM 0 HE2 LYS A 129 16.925 7.769 10.877 1.00 0.00 H new ATOM 0 HE3 LYS A 129 16.466 6.651 12.146 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 18.459 6.823 13.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 19.288 6.601 11.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 18.745 8.148 12.072 1.00 0.00 H new ATOM 2079 N LYS A 130 13.493 7.116 6.185 1.00 0.00 N ATOM 2080 CA LYS A 130 13.018 8.078 5.150 1.00 0.00 C ATOM 2081 C LYS A 130 13.748 9.466 5.182 1.00 0.00 C ATOM 2082 O LYS A 130 13.736 10.187 6.186 1.00 0.00 O ATOM 2083 CB LYS A 130 11.469 8.159 5.174 1.00 0.00 C ATOM 2084 CG LYS A 130 10.798 8.902 6.356 1.00 0.00 C ATOM 2085 CD LYS A 130 9.264 8.742 6.396 1.00 0.00 C ATOM 2086 CE LYS A 130 8.816 7.390 6.973 1.00 0.00 C ATOM 2087 NZ LYS A 130 7.346 7.314 7.044 1.00 0.00 N ATOM 0 H LYS A 130 12.801 6.909 6.905 1.00 0.00 H new ATOM 0 HA LYS A 130 13.305 7.688 4.174 1.00 0.00 H new ATOM 0 HB2 LYS A 130 11.145 8.639 4.251 1.00 0.00 H new ATOM 0 HB3 LYS A 130 11.081 7.141 5.156 1.00 0.00 H new ATOM 0 HG2 LYS A 130 11.218 8.533 7.292 1.00 0.00 H new ATOM 0 HG3 LYS A 130 11.043 9.962 6.293 1.00 0.00 H new ATOM 0 HD2 LYS A 130 8.836 9.546 6.995 1.00 0.00 H new ATOM 0 HD3 LYS A 130 8.867 8.850 5.387 1.00 0.00 H new ATOM 0 HE2 LYS A 130 9.197 6.580 6.351 1.00 0.00 H new ATOM 0 HE3 LYS A 130 9.240 7.255 7.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 7.065 6.393 7.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 6.988 8.075 7.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 6.946 7.420 6.090 1.00 0.00 H new ATOM 2100 N ASP A 131 14.437 9.790 4.078 1.00 0.00 N ATOM 2101 CA ASP A 131 15.285 10.995 3.963 1.00 0.00 C ATOM 2102 C ASP A 131 15.406 11.319 2.465 1.00 0.00 C ATOM 2103 O ASP A 131 14.711 12.219 1.939 1.00 0.00 O ATOM 2104 CB ASP A 131 16.660 10.696 4.618 1.00 0.00 C ATOM 2105 CG ASP A 131 17.535 11.917 4.874 1.00 0.00 C ATOM 2106 OD1 ASP A 131 17.054 12.685 5.898 1.00 0.00 O ATOM 2107 OD2 ASP A 131 18.559 12.160 4.243 1.00 0.00 O ATOM 0 H ASP A 131 14.424 9.222 3.231 1.00 0.00 H new ATOM 0 HA ASP A 131 14.862 11.858 4.477 1.00 0.00 H new ATOM 0 HB2 ASP A 131 16.490 10.186 5.566 1.00 0.00 H new ATOM 0 HB3 ASP A 131 17.207 10.004 3.977 1.00 0.00 H new