USER MOD reduce.3.24.130724 H: found=0, std=0, add=1175, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1174 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 32 ASN : amide:sc= -1.11 X(o=-2.1,f=-2.5) USER MOD Set 1.2: A 34 MET CE :methyl -178:sc= -1.02 (180deg=-1.07) USER MOD Set 2.1: A 29 SER OG : rot 180:sc= -0.0327 USER MOD Set 2.2: A 37 ASN : amide:sc= -0.153 X(o=-0.19,f=-0.033) USER MOD Set 3.1: A 1 MET CE :methyl -154:sc= -0.163 (180deg=-0.742) USER MOD Set 3.2: A 2 SER OG : rot 28:sc= 0.459 USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 THR OG1 : rot -138:sc= 0.414 USER MOD Single : A 10 MET CE :methyl -174:sc= -0.183 (180deg=-0.296) USER MOD Single : A 14 LYS NZ :NH3+ -145:sc= -1.49 (180deg=-3.47!) USER MOD Single : A 17 GLN : amide:sc=-0.00299 X(o=-0.003,f=0) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 31 ASN : amide:sc= -0.0369 X(o=-0.037,f=0) USER MOD Single : A 35 GLN : amide:sc= -1.7! K(o=-1.7!,f=0) USER MOD Single : A 46 THR OG1 : rot -61:sc= 0.422 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ -170:sc= -0.0138 (180deg=-0.148) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 ASN : amide:sc= -0.269 K(o=-0.27,f=-6.1!) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 MET CE :methyl -150:sc= 0 (180deg=-0.396) USER MOD Single : A 78 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 80 ASN : amide:sc= -0.764 K(o=-0.76,f=-4.9!) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 88 CYS SG : rot 180:sc= 0 USER MOD Single : A 93 GLN : amide:sc= -1.67 K(o=-1.7,f=-1.1) USER MOD Single : A 94 ASN : amide:sc= -1.02 K(o=-1,f=0) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= -0.481 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot -9:sc= 0.928 USER MOD Single : A 108 SER OG : rot 64:sc= 1.11 USER MOD Single : A 110 GLN : amide:sc= -2.81! K(o=-2.8!,f=-0.7) USER MOD Single : A 111 SER OG : rot -14:sc= 0.466 USER MOD Single : A 117 ASN : amide:sc= -3.46! K(o=-3.5!,f=-0.38) USER MOD Single : A 119 ASN : amide:sc= -1.69! K(o=-1.7!,f=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 123 ASN : amide:sc= -1.07 K(o=-1.1,f=-2.8) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 125 GLN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 GLN : amide:sc= -0.471 X(o=-0.47,f=-0.78) USER MOD Single : A 133 ASN : amide:sc= -6.35! K(o=-6.3!,f=-1.4) USER MOD Single : A 134 LYS NZ :NH3+ 164:sc= -0.0325 (180deg=-0.255) USER MOD Single : A 137 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 147 GLN : amide:sc= -0.969 K(o=-0.97,f=-5.5!) USER MOD Single : A 148 SER OG : rot -34:sc= 1.05 USER MOD Single : A 150 ASN : amide:sc= -0.159 X(o=-0.16,f=0) USER MOD Single : A 152 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -25.422 3.404 12.046 0.22 0.00 N ATOM 2 CA MET A 1 -25.806 2.058 11.547 0.14 0.00 C ATOM 3 C MET A 1 -25.699 1.992 10.028 0.06 0.00 C ATOM 4 O MET A 1 -25.075 1.084 9.478 1.00 0.00 O ATOM 5 CB MET A 1 -27.236 1.723 11.985 0.14 0.00 C ATOM 6 CG MET A 1 -27.660 0.295 11.672 0.19 0.00 C ATOM 7 SD MET A 1 -28.211 0.083 9.968 0.14 0.00 S ATOM 8 CE MET A 1 -29.716 1.054 9.979 0.46 0.00 C ATOM 0 H1 MET A 1 -25.502 3.426 13.083 0.22 0.00 H new ATOM 0 H2 MET A 1 -24.440 3.609 11.770 0.22 0.00 H new ATOM 0 H3 MET A 1 -26.054 4.120 11.635 0.22 0.00 H new ATOM 0 HA MET A 1 -25.119 1.326 11.973 0.14 0.00 H new ATOM 0 HB2 MET A 1 -27.325 1.891 13.058 0.14 0.00 H new ATOM 0 HB3 MET A 1 -27.926 2.411 11.496 0.14 0.00 H new ATOM 0 HG2 MET A 1 -26.824 -0.377 11.864 0.19 0.00 H new ATOM 0 HG3 MET A 1 -28.465 0.004 12.347 0.19 0.00 H new ATOM 0 HE1 MET A 1 -30.396 0.680 9.213 0.46 0.00 H new ATOM 0 HE2 MET A 1 -30.192 0.976 10.956 0.46 0.00 H new ATOM 0 HE3 MET A 1 -29.477 2.098 9.774 0.46 0.00 H new ATOM 20 N SER A 2 -26.309 2.964 9.355 0.44 0.00 N ATOM 21 CA SER A 2 -26.284 3.021 7.898 0.12 0.00 C ATOM 22 C SER A 2 -25.586 4.289 7.417 1.00 0.00 C ATOM 23 O SER A 2 -26.037 5.400 7.695 0.06 0.00 O ATOM 24 CB SER A 2 -27.707 2.966 7.342 0.15 0.00 C ATOM 25 OG SER A 2 -28.485 4.048 7.823 0.22 0.00 O ATOM 0 H SER A 2 -26.827 3.723 9.797 0.44 0.00 H new ATOM 0 HA SER A 2 -25.725 2.159 7.533 0.12 0.00 H new ATOM 0 HB2 SER A 2 -27.676 2.992 6.253 0.15 0.00 H new ATOM 0 HB3 SER A 2 -28.175 2.023 7.625 0.15 0.00 H new ATOM 0 HG SER A 2 -27.900 4.808 8.024 0.22 0.00 H new ATOM 31 N THR A 3 -24.485 4.116 6.692 1.00 0.00 N ATOM 32 CA THR A 3 -23.727 5.247 6.171 1.00 0.00 C ATOM 33 C THR A 3 -23.521 5.134 4.662 1.00 0.00 C ATOM 34 O THR A 3 -23.538 4.036 4.107 0.50 0.00 O ATOM 35 CB THR A 3 -22.353 5.373 6.857 0.32 0.00 C ATOM 36 OG1 THR A 3 -21.837 4.074 7.170 0.27 0.00 O ATOM 37 CG2 THR A 3 -22.458 6.209 8.123 1.00 0.00 C ATOM 0 H THR A 3 -24.098 3.203 6.452 1.00 0.00 H new ATOM 0 HA THR A 3 -24.315 6.139 6.386 1.00 0.00 H new ATOM 0 HB THR A 3 -21.671 5.872 6.169 0.32 0.00 H new ATOM 0 HG1 THR A 3 -21.437 4.088 8.065 0.27 0.00 H new ATOM 0 HG21 THR A 3 -21.477 6.285 8.591 1.00 0.00 H new ATOM 0 HG22 THR A 3 -22.818 7.206 7.871 1.00 0.00 H new ATOM 0 HG23 THR A 3 -23.154 5.735 8.815 1.00 0.00 H new ATOM 45 N PRO A 4 -23.324 6.277 3.978 1.00 0.00 N ATOM 46 CA PRO A 4 -23.115 6.305 2.526 1.00 0.00 C ATOM 47 C PRO A 4 -21.798 5.655 2.111 0.92 0.00 C ATOM 48 O PRO A 4 -21.722 4.997 1.073 0.26 0.00 O ATOM 49 CB PRO A 4 -23.098 7.801 2.196 1.00 0.00 C ATOM 50 CG PRO A 4 -22.704 8.466 3.469 0.06 0.00 C ATOM 51 CD PRO A 4 -23.293 7.630 4.566 0.13 0.00 C ATOM 0 HA PRO A 4 -23.886 5.745 1.997 1.00 0.00 H new ATOM 0 HB2 PRO A 4 -22.389 8.022 1.398 1.00 0.00 H new ATOM 0 HB3 PRO A 4 -24.076 8.143 1.857 1.00 0.00 H new ATOM 0 HG2 PRO A 4 -21.619 8.524 3.561 0.06 0.00 H new ATOM 0 HG3 PRO A 4 -23.082 9.488 3.510 0.06 0.00 H new ATOM 0 HD2 PRO A 4 -22.683 7.663 5.469 0.13 0.00 H new ATOM 0 HD3 PRO A 4 -24.290 7.972 4.842 0.13 0.00 H new ATOM 59 N ALA A 5 -20.765 5.840 2.927 0.05 0.00 N ATOM 60 CA ALA A 5 -19.450 5.274 2.641 0.08 0.00 C ATOM 61 C ALA A 5 -19.466 3.753 2.730 0.81 0.00 C ATOM 62 O ALA A 5 -18.823 3.069 1.934 1.00 0.00 O ATOM 63 CB ALA A 5 -18.410 5.842 3.593 0.42 0.00 C ATOM 0 H ALA A 5 -20.813 6.378 3.792 0.05 0.00 H new ATOM 0 HA ALA A 5 -19.187 5.549 1.620 0.08 0.00 H new ATOM 0 HB1 ALA A 5 -17.435 5.410 3.367 0.42 0.00 H new ATOM 0 HB2 ALA A 5 -18.363 6.925 3.477 0.42 0.00 H new ATOM 0 HB3 ALA A 5 -18.685 5.599 4.619 0.42 0.00 H new ATOM 69 N ARG A 6 -20.207 3.230 3.702 0.53 0.00 N ATOM 70 CA ARG A 6 -20.302 1.788 3.906 1.00 0.00 C ATOM 71 C ARG A 6 -20.800 1.079 2.648 0.63 0.00 C ATOM 72 O ARG A 6 -20.258 0.048 2.250 0.09 0.00 O ATOM 73 CB ARG A 6 -21.237 1.481 5.076 0.43 0.00 C ATOM 74 CG ARG A 6 -21.302 0.004 5.432 0.10 0.00 C ATOM 75 CD ARG A 6 -22.258 -0.249 6.586 0.63 0.00 C ATOM 76 NE ARG A 6 -22.296 -1.660 6.961 1.00 0.00 N ATOM 77 CZ ARG A 6 -23.291 -2.215 7.645 0.56 0.00 C ATOM 78 NH1 ARG A 6 -24.332 -1.483 8.023 0.15 0.00 N ATOM 79 NH2 ARG A 6 -23.250 -3.505 7.948 0.56 0.00 N ATOM 0 H ARG A 6 -20.752 3.785 4.362 0.53 0.00 H new ATOM 0 HA ARG A 6 -19.302 1.418 4.133 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -20.908 2.043 5.950 0.43 0.00 H new ATOM 0 HB3 ARG A 6 -22.240 1.832 4.831 0.43 0.00 H new ATOM 0 HG2 ARG A 6 -21.622 -0.568 4.561 0.10 0.00 H new ATOM 0 HG3 ARG A 6 -20.307 -0.351 5.698 0.10 0.00 H new ATOM 0 HD2 ARG A 6 -21.955 0.347 7.446 0.63 0.00 H new ATOM 0 HD3 ARG A 6 -23.259 0.080 6.307 0.63 0.00 H new ATOM 0 HE ARG A 6 -21.514 -2.253 6.682 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -24.370 -0.491 7.789 0.15 0.00 H new ATOM 0 HH12 ARG A 6 -25.094 -1.913 8.548 0.15 0.00 H new ATOM 0 HH21 ARG A 6 -22.454 -4.072 7.656 0.56 0.00 H new ATOM 0 HH22 ARG A 6 -24.014 -3.930 8.473 0.56 0.00 H new ATOM 93 N ARG A 7 -21.833 1.638 2.028 0.12 0.00 N ATOM 94 CA ARG A 7 -22.413 1.054 0.822 0.99 0.00 C ATOM 95 C ARG A 7 -21.439 1.116 -0.352 0.43 0.00 C ATOM 96 O ARG A 7 -21.174 0.104 -1.002 0.26 0.00 O ATOM 97 CB ARG A 7 -23.709 1.781 0.460 0.48 0.00 C ATOM 98 CG ARG A 7 -24.431 1.182 -0.734 0.11 0.00 C ATOM 99 CD ARG A 7 -25.677 1.978 -1.086 0.52 0.00 C ATOM 100 NE ARG A 7 -25.366 3.367 -1.413 0.59 0.00 N ATOM 101 CZ ARG A 7 -26.290 4.305 -1.603 0.16 0.00 C ATOM 102 NH1 ARG A 7 -27.577 4.004 -1.494 1.00 0.00 N ATOM 103 NH2 ARG A 7 -25.925 5.546 -1.899 0.18 0.00 N ATOM 0 H ARG A 7 -22.287 2.496 2.340 0.12 0.00 H new ATOM 0 HA ARG A 7 -22.628 0.005 1.028 0.99 0.00 H new ATOM 0 HB2 ARG A 7 -24.376 1.767 1.322 0.48 0.00 H new ATOM 0 HB3 ARG A 7 -23.482 2.826 0.250 0.48 0.00 H new ATOM 0 HG2 ARG A 7 -23.759 1.157 -1.592 0.11 0.00 H new ATOM 0 HG3 ARG A 7 -24.706 0.150 -0.514 0.11 0.00 H new ATOM 0 HD2 ARG A 7 -26.179 1.510 -1.933 0.52 0.00 H new ATOM 0 HD3 ARG A 7 -26.373 1.950 -0.248 0.52 0.00 H new ATOM 0 HE ARG A 7 -24.385 3.633 -1.501 0.59 0.00 H new ATOM 0 HH11 ARG A 7 -27.860 3.052 -1.264 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -28.284 4.725 -1.640 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -24.936 5.781 -1.981 0.18 0.00 H new ATOM 0 HH22 ARG A 7 -26.634 6.265 -2.045 0.18 0.00 H new ATOM 117 N ARG A 8 -20.909 2.307 -0.614 1.00 0.00 N ATOM 118 CA ARG A 8 -19.972 2.505 -1.717 0.48 0.00 C ATOM 119 C ARG A 8 -18.720 1.646 -1.557 0.22 0.00 C ATOM 120 O ARG A 8 -18.101 1.250 -2.546 1.00 0.00 O ATOM 121 CB ARG A 8 -19.575 3.981 -1.811 0.05 0.00 C ATOM 122 CG ARG A 8 -20.744 4.914 -2.089 0.09 0.00 C ATOM 123 CD ARG A 8 -21.309 4.702 -3.484 0.12 0.00 C ATOM 124 NE ARG A 8 -20.291 4.873 -4.516 0.17 0.00 N ATOM 125 CZ ARG A 8 -20.558 5.237 -5.768 1.00 0.00 C ATOM 126 NH1 ARG A 8 -21.808 5.473 -6.143 1.00 0.00 N ATOM 127 NH2 ARG A 8 -19.572 5.369 -6.645 0.30 0.00 N ATOM 0 H ARG A 8 -21.112 3.151 -0.078 1.00 0.00 H new ATOM 0 HA ARG A 8 -20.475 2.200 -2.635 0.48 0.00 H new ATOM 0 HB2 ARG A 8 -19.098 4.280 -0.878 0.05 0.00 H new ATOM 0 HB3 ARG A 8 -18.833 4.099 -2.600 0.05 0.00 H new ATOM 0 HG2 ARG A 8 -21.527 4.747 -1.349 0.09 0.00 H new ATOM 0 HG3 ARG A 8 -20.418 5.949 -1.981 0.09 0.00 H new ATOM 0 HD2 ARG A 8 -21.733 3.701 -3.555 0.12 0.00 H new ATOM 0 HD3 ARG A 8 -22.123 5.406 -3.657 0.12 0.00 H new ATOM 0 HE ARG A 8 -19.318 4.704 -4.263 0.17 0.00 H new ATOM 0 HH11 ARG A 8 -22.569 5.376 -5.471 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -22.008 5.752 -7.104 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -18.609 5.192 -6.360 0.30 0.00 H new ATOM 0 HH22 ARG A 8 -19.777 5.648 -7.604 0.30 0.00 H new ATOM 141 N LEU A 9 -18.352 1.356 -0.313 1.00 0.00 N ATOM 142 CA LEU A 9 -17.172 0.556 -0.031 0.71 0.00 C ATOM 143 C LEU A 9 -17.414 -0.909 -0.392 0.18 0.00 C ATOM 144 O LEU A 9 -16.549 -1.564 -0.975 0.79 0.00 O ATOM 145 CB LEU A 9 -16.787 0.712 1.448 0.73 0.00 C ATOM 146 CG LEU A 9 -16.605 -0.588 2.229 0.42 0.00 C ATOM 147 CD1 LEU A 9 -15.264 -1.227 1.900 0.68 0.00 C ATOM 148 CD2 LEU A 9 -16.725 -0.335 3.724 0.56 0.00 C ATOM 0 H LEU A 9 -18.858 1.666 0.517 1.00 0.00 H new ATOM 0 HA LEU A 9 -16.343 0.909 -0.644 0.71 0.00 H new ATOM 0 HB2 LEU A 9 -15.859 1.280 1.504 0.73 0.00 H new ATOM 0 HB3 LEU A 9 -17.555 1.306 1.943 0.73 0.00 H new ATOM 0 HG LEU A 9 -17.395 -1.279 1.934 0.42 0.00 H new ATOM 0 HD11 LEU A 9 -15.153 -2.152 2.466 0.68 0.00 H new ATOM 0 HD12 LEU A 9 -15.218 -1.447 0.833 0.68 0.00 H new ATOM 0 HD13 LEU A 9 -14.459 -0.541 2.164 0.68 0.00 H new ATOM 0 HD21 LEU A 9 -16.593 -1.273 4.264 0.56 0.00 H new ATOM 0 HD22 LEU A 9 -15.958 0.374 4.036 0.56 0.00 H new ATOM 0 HD23 LEU A 9 -17.710 0.075 3.946 0.56 0.00 H new ATOM 160 N MET A 10 -18.592 -1.416 -0.040 0.34 0.00 N ATOM 161 CA MET A 10 -18.942 -2.804 -0.327 0.06 0.00 C ATOM 162 C MET A 10 -18.997 -3.057 -1.829 0.18 0.00 C ATOM 163 O MET A 10 -18.717 -4.164 -2.290 0.05 0.00 O ATOM 164 CB MET A 10 -20.284 -3.164 0.315 1.00 0.00 C ATOM 165 CG MET A 10 -20.219 -3.294 1.828 0.09 0.00 C ATOM 166 SD MET A 10 -21.748 -3.935 2.539 0.35 0.00 S ATOM 167 CE MET A 10 -22.895 -2.622 2.128 1.00 0.00 C ATOM 0 H MET A 10 -19.319 -0.888 0.443 0.34 0.00 H new ATOM 0 HA MET A 10 -18.165 -3.438 0.099 0.06 0.00 H new ATOM 0 HB2 MET A 10 -21.018 -2.401 0.055 1.00 0.00 H new ATOM 0 HB3 MET A 10 -20.639 -4.104 -0.107 1.00 0.00 H new ATOM 0 HG2 MET A 10 -19.394 -3.954 2.097 0.09 0.00 H new ATOM 0 HG3 MET A 10 -20.002 -2.319 2.263 0.09 0.00 H new ATOM 0 HE1 MET A 10 -23.860 -2.823 2.594 1.00 0.00 H new ATOM 0 HE2 MET A 10 -22.506 -1.672 2.494 1.00 0.00 H new ATOM 0 HE3 MET A 10 -23.018 -2.572 1.046 1.00 0.00 H new ATOM 177 N ARG A 11 -19.359 -2.028 -2.588 0.47 0.00 N ATOM 178 CA ARG A 11 -19.444 -2.145 -4.039 0.10 0.00 C ATOM 179 C ARG A 11 -18.079 -2.480 -4.630 1.00 0.00 C ATOM 180 O ARG A 11 -17.988 -3.125 -5.676 0.21 0.00 O ATOM 181 CB ARG A 11 -19.974 -0.848 -4.651 0.10 0.00 C ATOM 182 CG ARG A 11 -21.387 -0.501 -4.211 0.10 0.00 C ATOM 183 CD ARG A 11 -21.882 0.769 -4.883 0.81 0.00 C ATOM 184 NE ARG A 11 -23.192 1.179 -4.383 0.16 0.00 N ATOM 185 CZ ARG A 11 -23.912 2.159 -4.922 0.37 0.00 C ATOM 186 NH1 ARG A 11 -23.456 2.818 -5.978 0.11 0.00 N ATOM 187 NH2 ARG A 11 -25.091 2.477 -4.405 0.07 0.00 N ATOM 0 H ARG A 11 -19.598 -1.106 -2.223 0.47 0.00 H new ATOM 0 HA ARG A 11 -20.136 -2.953 -4.275 0.10 0.00 H new ATOM 0 HB2 ARG A 11 -19.307 -0.029 -4.381 0.10 0.00 H new ATOM 0 HB3 ARG A 11 -19.951 -0.933 -5.737 0.10 0.00 H new ATOM 0 HG2 ARG A 11 -22.057 -1.326 -4.451 0.10 0.00 H new ATOM 0 HG3 ARG A 11 -21.412 -0.375 -3.129 0.10 0.00 H new ATOM 0 HD2 ARG A 11 -21.163 1.571 -4.716 0.81 0.00 H new ATOM 0 HD3 ARG A 11 -21.938 0.611 -5.960 0.81 0.00 H new ATOM 0 HE ARG A 11 -23.576 0.687 -3.576 0.16 0.00 H new ATOM 0 HH11 ARG A 11 -22.551 2.574 -6.380 0.11 0.00 H new ATOM 0 HH12 ARG A 11 -24.011 3.569 -6.389 0.11 0.00 H new ATOM 0 HH21 ARG A 11 -25.446 1.970 -3.594 0.07 0.00 H new ATOM 0 HH22 ARG A 11 -25.643 3.228 -4.818 0.07 0.00 H new ATOM 201 N ASP A 12 -17.023 -2.039 -3.955 0.10 0.00 N ATOM 202 CA ASP A 12 -15.661 -2.300 -4.415 0.75 0.00 C ATOM 203 C ASP A 12 -15.375 -3.796 -4.439 0.18 0.00 C ATOM 204 O ASP A 12 -14.749 -4.304 -5.369 0.14 0.00 O ATOM 205 CB ASP A 12 -14.649 -1.589 -3.516 0.41 0.00 C ATOM 206 CG ASP A 12 -14.807 -0.082 -3.548 0.06 0.00 C ATOM 207 OD1 ASP A 12 -14.199 0.560 -4.431 0.28 0.00 O ATOM 208 OD2 ASP A 12 -15.536 0.458 -2.691 0.67 0.00 O ATOM 0 H ASP A 12 -17.082 -1.501 -3.090 0.10 0.00 H new ATOM 0 HA ASP A 12 -15.567 -1.913 -5.430 0.75 0.00 H new ATOM 0 HB2 ASP A 12 -14.766 -1.942 -2.491 0.41 0.00 H new ATOM 0 HB3 ASP A 12 -13.639 -1.853 -3.831 0.41 0.00 H new ATOM 213 N PHE A 13 -15.841 -4.498 -3.410 1.00 0.00 N ATOM 214 CA PHE A 13 -15.642 -5.940 -3.313 0.46 0.00 C ATOM 215 C PHE A 13 -16.331 -6.658 -4.469 1.00 0.00 C ATOM 216 O PHE A 13 -15.762 -7.564 -5.077 1.00 0.00 O ATOM 217 CB PHE A 13 -16.174 -6.458 -1.975 0.08 0.00 C ATOM 218 CG PHE A 13 -16.050 -7.949 -1.807 1.00 0.00 C ATOM 219 CD1 PHE A 13 -14.812 -8.567 -1.882 0.83 0.00 C ATOM 220 CD2 PHE A 13 -17.171 -8.726 -1.570 1.00 0.00 C ATOM 221 CE1 PHE A 13 -14.697 -9.936 -1.723 0.14 0.00 C ATOM 222 CE2 PHE A 13 -17.061 -10.094 -1.410 0.83 0.00 C ATOM 223 CZ PHE A 13 -15.823 -10.701 -1.488 1.00 0.00 C ATOM 0 H PHE A 13 -16.359 -4.091 -2.631 1.00 0.00 H new ATOM 0 HA PHE A 13 -14.573 -6.145 -3.370 0.46 0.00 H new ATOM 0 HB2 PHE A 13 -15.636 -5.965 -1.165 0.08 0.00 H new ATOM 0 HB3 PHE A 13 -17.223 -6.177 -1.878 0.08 0.00 H new ATOM 0 HD1 PHE A 13 -13.928 -7.974 -2.066 0.83 0.00 H new ATOM 0 HD2 PHE A 13 -18.142 -8.258 -1.510 1.00 0.00 H new ATOM 0 HE1 PHE A 13 -13.727 -10.407 -1.783 0.14 0.00 H new ATOM 0 HE2 PHE A 13 -17.943 -10.689 -1.224 0.83 0.00 H new ATOM 0 HZ PHE A 13 -15.735 -11.770 -1.366 1.00 0.00 H new ATOM 233 N LYS A 14 -17.564 -6.247 -4.757 0.06 0.00 N ATOM 234 CA LYS A 14 -18.342 -6.835 -5.836 0.39 0.00 C ATOM 235 C LYS A 14 -17.550 -6.853 -7.140 0.16 0.00 C ATOM 236 O LYS A 14 -17.611 -7.816 -7.901 0.11 0.00 O ATOM 237 CB LYS A 14 -19.630 -6.039 -6.023 0.12 0.00 C ATOM 238 CG LYS A 14 -20.788 -6.874 -6.527 0.43 0.00 C ATOM 239 CD LYS A 14 -22.101 -6.117 -6.443 1.00 0.00 C ATOM 240 CE LYS A 14 -22.284 -5.162 -7.613 0.47 0.00 C ATOM 241 NZ LYS A 14 -21.289 -4.054 -7.594 1.00 0.00 N ATOM 0 H LYS A 14 -18.045 -5.503 -4.252 0.06 0.00 H new ATOM 0 HA LYS A 14 -18.578 -7.865 -5.571 0.39 0.00 H new ATOM 0 HB2 LYS A 14 -19.907 -5.583 -5.072 0.12 0.00 H new ATOM 0 HB3 LYS A 14 -19.446 -5.225 -6.725 0.12 0.00 H new ATOM 0 HG2 LYS A 14 -20.603 -7.168 -7.560 0.43 0.00 H new ATOM 0 HG3 LYS A 14 -20.858 -7.791 -5.942 0.43 0.00 H new ATOM 0 HD2 LYS A 14 -22.928 -6.827 -6.422 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -22.137 -5.557 -5.509 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -22.193 -5.714 -8.548 0.47 0.00 H new ATOM 0 HE3 LYS A 14 -23.291 -4.745 -7.586 0.47 0.00 H new ATOM 0 HZ1 LYS A 14 -21.732 -3.184 -7.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -20.960 -3.900 -6.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -20.480 -4.304 -8.198 1.00 0.00 H new ATOM 255 N ARG A 15 -16.811 -5.778 -7.390 0.55 0.00 N ATOM 256 CA ARG A 15 -16.008 -5.664 -8.602 0.37 0.00 C ATOM 257 C ARG A 15 -14.704 -6.445 -8.473 0.89 0.00 C ATOM 258 O ARG A 15 -14.122 -6.868 -9.471 0.10 0.00 O ATOM 259 CB ARG A 15 -15.710 -4.191 -8.899 0.31 0.00 C ATOM 260 CG ARG A 15 -14.943 -3.969 -10.193 0.15 0.00 C ATOM 261 CD ARG A 15 -15.758 -4.389 -11.407 0.55 0.00 C ATOM 262 NE ARG A 15 -15.065 -4.099 -12.657 0.52 0.00 N ATOM 263 CZ ARG A 15 -15.382 -4.652 -13.824 0.18 0.00 C ATOM 264 NH1 ARG A 15 -16.374 -5.531 -13.899 0.58 0.00 N ATOM 265 NH2 ARG A 15 -14.706 -4.330 -14.919 0.50 0.00 N ATOM 0 H ARG A 15 -16.751 -4.972 -6.768 0.55 0.00 H new ATOM 0 HA ARG A 15 -16.579 -6.089 -9.428 0.37 0.00 H new ATOM 0 HB2 ARG A 15 -16.650 -3.642 -8.946 0.31 0.00 H new ATOM 0 HB3 ARG A 15 -15.137 -3.772 -8.072 0.31 0.00 H new ATOM 0 HG2 ARG A 15 -14.674 -2.916 -10.281 0.15 0.00 H new ATOM 0 HG3 ARG A 15 -14.012 -4.535 -10.166 0.15 0.00 H new ATOM 0 HD2 ARG A 15 -15.970 -5.457 -11.349 0.55 0.00 H new ATOM 0 HD3 ARG A 15 -16.718 -3.872 -11.396 0.55 0.00 H new ATOM 0 HE ARG A 15 -14.292 -3.433 -12.635 0.52 0.00 H new ATOM 0 HH11 ARG A 15 -16.896 -5.784 -13.060 0.58 0.00 H new ATOM 0 HH12 ARG A 15 -16.615 -5.953 -14.796 0.58 0.00 H new ATOM 0 HH21 ARG A 15 -13.941 -3.657 -14.867 0.50 0.00 H new ATOM 0 HH22 ARG A 15 -14.951 -4.755 -15.813 0.50 0.00 H new ATOM 279 N LEU A 16 -14.253 -6.631 -7.237 0.42 0.00 N ATOM 280 CA LEU A 16 -13.012 -7.351 -6.974 0.08 0.00 C ATOM 281 C LEU A 16 -13.150 -8.834 -7.314 0.25 0.00 C ATOM 282 O LEU A 16 -12.272 -9.418 -7.948 0.51 0.00 O ATOM 283 CB LEU A 16 -12.607 -7.188 -5.504 0.08 0.00 C ATOM 284 CG LEU A 16 -11.106 -7.017 -5.249 1.00 0.00 C ATOM 285 CD1 LEU A 16 -10.325 -8.213 -5.774 0.70 0.00 C ATOM 286 CD2 LEU A 16 -10.601 -5.727 -5.881 0.18 0.00 C ATOM 0 H LEU A 16 -14.729 -6.293 -6.401 0.42 0.00 H new ATOM 0 HA LEU A 16 -12.236 -6.926 -7.611 0.08 0.00 H new ATOM 0 HB2 LEU A 16 -13.128 -6.322 -5.095 0.08 0.00 H new ATOM 0 HB3 LEU A 16 -12.955 -8.060 -4.950 0.08 0.00 H new ATOM 0 HG LEU A 16 -10.949 -6.959 -4.172 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -9.262 -8.067 -5.581 0.70 0.00 H new ATOM 0 HD12 LEU A 16 -10.664 -9.118 -5.271 0.70 0.00 H new ATOM 0 HD13 LEU A 16 -10.488 -8.312 -6.847 0.70 0.00 H new ATOM 0 HD21 LEU A 16 -9.533 -5.622 -5.690 0.18 0.00 H new ATOM 0 HD22 LEU A 16 -10.776 -5.756 -6.956 0.18 0.00 H new ATOM 0 HD23 LEU A 16 -11.132 -4.878 -5.450 0.18 0.00 H new ATOM 298 N GLN A 17 -14.257 -9.435 -6.889 0.52 0.00 N ATOM 299 CA GLN A 17 -14.508 -10.847 -7.137 0.15 0.00 C ATOM 300 C GLN A 17 -14.754 -11.122 -8.619 1.00 0.00 C ATOM 301 O GLN A 17 -14.393 -12.182 -9.129 0.09 0.00 O ATOM 302 CB GLN A 17 -15.707 -11.308 -6.310 0.19 0.00 C ATOM 303 CG GLN A 17 -16.969 -10.502 -6.563 0.68 0.00 C ATOM 304 CD GLN A 17 -18.135 -10.960 -5.710 0.91 0.00 C ATOM 305 OE1 GLN A 17 -18.893 -11.848 -6.100 0.10 0.00 O ATOM 306 NE2 GLN A 17 -18.285 -10.353 -4.539 1.00 0.00 N ATOM 0 H GLN A 17 -14.996 -8.962 -6.369 0.52 0.00 H new ATOM 0 HA GLN A 17 -13.621 -11.407 -6.840 0.15 0.00 H new ATOM 0 HB2 GLN A 17 -15.906 -12.357 -6.529 0.19 0.00 H new ATOM 0 HB3 GLN A 17 -15.453 -11.246 -5.252 0.19 0.00 H new ATOM 0 HG2 GLN A 17 -16.769 -9.449 -6.363 0.68 0.00 H new ATOM 0 HG3 GLN A 17 -17.241 -10.581 -7.616 0.68 0.00 H new ATOM 0 HE21 GLN A 17 -17.632 -9.622 -4.256 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -19.053 -10.618 -3.922 1.00 0.00 H new ATOM 315 N GLU A 18 -15.371 -10.165 -9.305 0.11 0.00 N ATOM 316 CA GLU A 18 -15.668 -10.313 -10.728 0.14 0.00 C ATOM 317 C GLU A 18 -14.423 -10.077 -11.576 1.00 0.00 C ATOM 318 O GLU A 18 -14.264 -10.675 -12.640 0.14 0.00 O ATOM 319 CB GLU A 18 -16.769 -9.341 -11.145 1.00 0.00 C ATOM 320 CG GLU A 18 -18.076 -9.551 -10.403 0.54 0.00 C ATOM 321 CD GLU A 18 -18.681 -10.916 -10.665 0.72 0.00 C ATOM 322 OE1 GLU A 18 -18.359 -11.863 -9.917 0.08 0.00 O ATOM 323 OE2 GLU A 18 -19.478 -11.040 -11.620 0.06 0.00 O ATOM 0 H GLU A 18 -15.675 -9.279 -8.900 0.11 0.00 H new ATOM 0 HA GLU A 18 -16.010 -11.335 -10.893 0.14 0.00 H new ATOM 0 HB2 GLU A 18 -16.425 -8.321 -10.976 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -16.948 -9.444 -12.215 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -17.905 -9.432 -9.333 0.54 0.00 H new ATOM 0 HG3 GLU A 18 -18.786 -8.779 -10.700 0.54 0.00 H new ATOM 330 N ASP A 19 -13.545 -9.204 -11.098 1.00 0.00 N ATOM 331 CA ASP A 19 -12.314 -8.889 -11.813 0.21 0.00 C ATOM 332 C ASP A 19 -11.276 -8.275 -10.872 0.24 0.00 C ATOM 333 O ASP A 19 -11.215 -7.055 -10.718 0.17 0.00 O ATOM 334 CB ASP A 19 -12.604 -7.930 -12.970 0.63 0.00 C ATOM 335 CG ASP A 19 -11.352 -7.565 -13.744 0.06 0.00 C ATOM 336 OD1 ASP A 19 -10.962 -8.341 -14.640 0.15 0.00 O ATOM 337 OD2 ASP A 19 -10.764 -6.503 -13.452 0.05 0.00 O ATOM 0 H ASP A 19 -13.662 -8.701 -10.218 1.00 0.00 H new ATOM 0 HA ASP A 19 -11.908 -9.818 -12.213 0.21 0.00 H new ATOM 0 HB2 ASP A 19 -13.326 -8.388 -13.646 0.63 0.00 H new ATOM 0 HB3 ASP A 19 -13.065 -7.022 -12.580 0.63 0.00 H new ATOM 342 N PRO A 20 -10.449 -9.118 -10.225 0.96 0.00 N ATOM 343 CA PRO A 20 -9.412 -8.649 -9.298 1.00 0.00 C ATOM 344 C PRO A 20 -8.336 -7.824 -10.001 0.13 0.00 C ATOM 345 O PRO A 20 -8.157 -7.933 -11.214 1.00 0.00 O ATOM 346 CB PRO A 20 -8.813 -9.945 -8.740 0.68 0.00 C ATOM 347 CG PRO A 20 -9.134 -10.984 -9.759 1.00 0.00 C ATOM 348 CD PRO A 20 -10.460 -10.587 -10.340 0.30 0.00 C ATOM 0 HA PRO A 20 -9.821 -7.991 -8.532 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -7.737 -9.853 -8.595 0.68 0.00 H new ATOM 0 HB3 PRO A 20 -9.245 -10.195 -7.771 0.68 0.00 H new ATOM 0 HG2 PRO A 20 -8.365 -11.026 -10.531 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -9.186 -11.974 -9.306 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -10.559 -10.909 -11.377 0.30 0.00 H new ATOM 0 HD3 PRO A 20 -11.290 -11.028 -9.788 0.30 0.00 H new ATOM 356 N PRO A 21 -7.600 -6.986 -9.244 0.34 0.00 N ATOM 357 CA PRO A 21 -6.540 -6.142 -9.804 0.33 0.00 C ATOM 358 C PRO A 21 -5.385 -6.966 -10.364 0.19 0.00 C ATOM 359 O PRO A 21 -5.208 -8.128 -10.004 0.88 0.00 O ATOM 360 CB PRO A 21 -6.066 -5.300 -8.611 0.36 0.00 C ATOM 361 CG PRO A 21 -7.131 -5.442 -7.576 0.19 0.00 C ATOM 362 CD PRO A 21 -7.740 -6.795 -7.793 1.00 0.00 C ATOM 0 HA PRO A 21 -6.902 -5.543 -10.640 0.33 0.00 H new ATOM 0 HB2 PRO A 21 -5.105 -5.655 -8.237 0.36 0.00 H new ATOM 0 HB3 PRO A 21 -5.932 -4.256 -8.896 0.36 0.00 H new ATOM 0 HG2 PRO A 21 -6.714 -5.358 -6.573 0.19 0.00 H new ATOM 0 HG3 PRO A 21 -7.880 -4.656 -7.676 0.19 0.00 H new ATOM 0 HD2 PRO A 21 -7.217 -7.569 -7.231 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -8.784 -6.824 -7.480 1.00 0.00 H new ATOM 370 N VAL A 22 -4.601 -6.354 -11.248 1.00 0.00 N ATOM 371 CA VAL A 22 -3.463 -7.032 -11.856 0.14 0.00 C ATOM 372 C VAL A 22 -2.192 -6.811 -11.040 0.47 0.00 C ATOM 373 O VAL A 22 -1.825 -5.674 -10.735 0.18 0.00 O ATOM 374 CB VAL A 22 -3.233 -6.557 -13.307 0.14 0.00 C ATOM 375 CG1 VAL A 22 -2.997 -5.054 -13.356 0.49 0.00 C ATOM 376 CG2 VAL A 22 -2.069 -7.308 -13.940 0.16 0.00 C ATOM 0 H VAL A 22 -4.734 -5.391 -11.558 1.00 0.00 H new ATOM 0 HA VAL A 22 -3.696 -8.097 -11.870 0.14 0.00 H new ATOM 0 HB VAL A 22 -4.133 -6.775 -13.882 0.14 0.00 H new ATOM 0 HG11 VAL A 22 -2.838 -4.744 -14.389 0.49 0.00 H new ATOM 0 HG12 VAL A 22 -3.867 -4.536 -12.952 0.49 0.00 H new ATOM 0 HG13 VAL A 22 -2.118 -4.804 -12.762 0.49 0.00 H new ATOM 0 HG21 VAL A 22 -1.923 -6.959 -14.962 0.16 0.00 H new ATOM 0 HG22 VAL A 22 -1.162 -7.128 -13.362 0.16 0.00 H new ATOM 0 HG23 VAL A 22 -2.287 -8.376 -13.949 0.16 0.00 H new ATOM 386 N GLY A 23 -1.528 -7.905 -10.683 1.00 0.00 N ATOM 387 CA GLY A 23 -0.305 -7.814 -9.908 0.22 0.00 C ATOM 388 C GLY A 23 -0.562 -7.761 -8.415 0.69 0.00 C ATOM 389 O GLY A 23 0.257 -8.228 -7.621 0.31 0.00 O ATOM 0 H GLY A 23 -1.816 -8.855 -10.917 1.00 0.00 H new ATOM 0 HA2 GLY A 23 0.328 -8.672 -10.133 0.22 0.00 H new ATOM 0 HA3 GLY A 23 0.246 -6.923 -10.210 0.22 0.00 H new ATOM 393 N VAL A 24 -1.702 -7.195 -8.027 0.07 0.00 N ATOM 394 CA VAL A 24 -2.060 -7.082 -6.618 0.32 0.00 C ATOM 395 C VAL A 24 -3.477 -7.585 -6.367 0.94 0.00 C ATOM 396 O VAL A 24 -4.347 -7.485 -7.232 0.20 0.00 O ATOM 397 CB VAL A 24 -1.948 -5.629 -6.121 1.00 0.00 C ATOM 398 CG1 VAL A 24 -0.512 -5.143 -6.209 1.00 0.00 C ATOM 399 CG2 VAL A 24 -2.873 -4.719 -6.912 1.00 0.00 C ATOM 0 H VAL A 24 -2.393 -6.808 -8.670 0.07 0.00 H new ATOM 0 HA VAL A 24 -1.354 -7.701 -6.065 0.32 0.00 H new ATOM 0 HB VAL A 24 -2.255 -5.600 -5.075 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -0.454 -4.114 -5.853 1.00 0.00 H new ATOM 0 HG12 VAL A 24 0.125 -5.777 -5.592 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -0.175 -5.188 -7.245 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -2.779 -3.697 -6.545 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -2.601 -4.752 -7.967 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -3.903 -5.054 -6.792 1.00 0.00 H new ATOM 409 N SER A 25 -3.699 -8.132 -5.175 0.24 0.00 N ATOM 410 CA SER A 25 -5.011 -8.644 -4.802 0.99 0.00 C ATOM 411 C SER A 25 -5.413 -8.130 -3.426 1.00 0.00 C ATOM 412 O SER A 25 -4.569 -7.969 -2.546 1.00 0.00 O ATOM 413 CB SER A 25 -5.009 -10.172 -4.807 0.54 0.00 C ATOM 414 OG SER A 25 -6.287 -10.687 -4.468 1.00 0.00 O ATOM 0 H SER A 25 -2.986 -8.231 -4.452 0.24 0.00 H new ATOM 0 HA SER A 25 -5.736 -8.290 -5.535 0.99 0.00 H new ATOM 0 HB2 SER A 25 -4.717 -10.535 -5.793 0.54 0.00 H new ATOM 0 HB3 SER A 25 -4.266 -10.540 -4.099 0.54 0.00 H new ATOM 0 HG SER A 25 -6.259 -11.667 -4.480 1.00 0.00 H new ATOM 420 N GLY A 26 -6.702 -7.870 -3.248 0.60 0.00 N ATOM 421 CA GLY A 26 -7.188 -7.375 -1.972 0.36 0.00 C ATOM 422 C GLY A 26 -8.643 -7.719 -1.725 0.69 0.00 C ATOM 423 O GLY A 26 -9.529 -7.261 -2.447 0.08 0.00 O ATOM 0 H GLY A 26 -7.420 -7.992 -3.962 0.60 0.00 H new ATOM 0 HA2 GLY A 26 -6.579 -7.792 -1.170 0.36 0.00 H new ATOM 0 HA3 GLY A 26 -7.064 -6.293 -1.936 0.36 0.00 H new ATOM 427 N ALA A 27 -8.890 -8.529 -0.700 0.98 0.00 N ATOM 428 CA ALA A 27 -10.246 -8.935 -0.352 0.15 0.00 C ATOM 429 C ALA A 27 -10.319 -9.403 1.101 0.22 0.00 C ATOM 430 O ALA A 27 -9.334 -9.904 1.644 1.00 0.00 O ATOM 431 CB ALA A 27 -10.726 -10.034 -1.291 0.19 0.00 C ATOM 0 H ALA A 27 -8.166 -8.918 -0.095 0.98 0.00 H new ATOM 0 HA ALA A 27 -10.901 -8.070 -0.462 0.15 0.00 H new ATOM 0 HB1 ALA A 27 -11.740 -10.327 -1.019 0.19 0.00 H new ATOM 0 HB2 ALA A 27 -10.717 -9.666 -2.317 0.19 0.00 H new ATOM 0 HB3 ALA A 27 -10.065 -10.897 -1.210 0.19 0.00 H new ATOM 437 N PRO A 28 -11.487 -9.248 1.753 0.11 0.00 N ATOM 438 CA PRO A 28 -11.666 -9.657 3.151 1.00 0.00 C ATOM 439 C PRO A 28 -11.568 -11.168 3.327 0.51 0.00 C ATOM 440 O PRO A 28 -12.403 -11.917 2.821 0.11 0.00 O ATOM 441 CB PRO A 28 -13.077 -9.168 3.495 0.06 0.00 C ATOM 442 CG PRO A 28 -13.774 -9.063 2.184 1.00 0.00 C ATOM 443 CD PRO A 28 -12.721 -8.670 1.187 0.06 0.00 C ATOM 0 HA PRO A 28 -10.892 -9.242 3.797 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -13.587 -9.866 4.159 0.06 0.00 H new ATOM 0 HB3 PRO A 28 -13.048 -8.206 4.006 0.06 0.00 H new ATOM 0 HG2 PRO A 28 -14.236 -10.012 1.910 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -14.571 -8.320 2.224 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -12.935 -9.070 0.196 0.06 0.00 H new ATOM 0 HD3 PRO A 28 -12.648 -7.587 1.084 0.06 0.00 H new ATOM 451 N SER A 29 -10.541 -11.609 4.050 0.17 0.00 N ATOM 452 CA SER A 29 -10.333 -13.032 4.292 1.00 0.00 C ATOM 453 C SER A 29 -10.811 -13.423 5.687 1.00 0.00 C ATOM 454 O SER A 29 -11.866 -14.037 5.842 1.00 0.00 O ATOM 455 CB SER A 29 -8.855 -13.392 4.126 0.21 0.00 C ATOM 456 OG SER A 29 -8.397 -13.079 2.822 0.48 0.00 O ATOM 0 H SER A 29 -9.842 -11.002 4.477 0.17 0.00 H new ATOM 0 HA SER A 29 -10.918 -13.587 3.558 1.00 0.00 H new ATOM 0 HB2 SER A 29 -8.261 -12.852 4.863 0.21 0.00 H new ATOM 0 HB3 SER A 29 -8.713 -14.455 4.319 0.21 0.00 H new ATOM 0 HG SER A 29 -7.450 -13.317 2.742 0.48 0.00 H new ATOM 462 N GLU A 30 -10.030 -13.060 6.701 0.67 0.00 N ATOM 463 CA GLU A 30 -10.378 -13.373 8.082 0.78 0.00 C ATOM 464 C GLU A 30 -10.947 -12.145 8.785 1.00 0.00 C ATOM 465 O GLU A 30 -11.947 -12.232 9.498 0.08 0.00 O ATOM 466 CB GLU A 30 -9.150 -13.888 8.835 0.09 0.00 C ATOM 467 CG GLU A 30 -9.459 -14.394 10.233 0.49 0.00 C ATOM 468 CD GLU A 30 -10.427 -15.563 10.228 0.06 0.00 C ATOM 469 OE1 GLU A 30 -9.963 -16.716 10.106 0.81 0.00 O ATOM 470 OE2 GLU A 30 -11.647 -15.323 10.342 1.00 0.00 O ATOM 0 H GLU A 30 -9.154 -12.550 6.592 0.67 0.00 H new ATOM 0 HA GLU A 30 -11.140 -14.152 8.075 0.78 0.00 H new ATOM 0 HB2 GLU A 30 -8.693 -14.693 8.260 0.09 0.00 H new ATOM 0 HB3 GLU A 30 -8.414 -13.087 8.903 0.09 0.00 H new ATOM 0 HG2 GLU A 30 -8.532 -14.697 10.719 0.49 0.00 H new ATOM 0 HG3 GLU A 30 -9.879 -13.581 10.825 0.49 0.00 H new ATOM 477 N ASN A 31 -10.299 -11.003 8.580 0.69 0.00 N ATOM 478 CA ASN A 31 -10.737 -9.752 9.186 0.60 0.00 C ATOM 479 C ASN A 31 -12.083 -9.317 8.614 0.09 0.00 C ATOM 480 O ASN A 31 -12.370 -9.546 7.439 0.11 0.00 O ATOM 481 CB ASN A 31 -9.694 -8.656 8.960 0.25 0.00 C ATOM 482 CG ASN A 31 -8.354 -8.994 9.584 1.00 0.00 C ATOM 483 OD1 ASN A 31 -8.097 -8.668 10.743 1.00 0.00 O ATOM 484 ND2 ASN A 31 -7.491 -9.648 8.816 0.62 0.00 N ATOM 0 H ASN A 31 -9.466 -10.919 7.997 0.69 0.00 H new ATOM 0 HA ASN A 31 -10.851 -9.916 10.258 0.60 0.00 H new ATOM 0 HB2 ASN A 31 -9.563 -8.498 7.889 0.25 0.00 H new ATOM 0 HB3 ASN A 31 -10.060 -7.718 9.378 0.25 0.00 H new ATOM 0 HD21 ASN A 31 -6.573 -9.900 9.181 0.62 0.00 H new ATOM 0 HD22 ASN A 31 -7.746 -9.898 7.861 0.62 0.00 H new ATOM 491 N ASN A 32 -12.905 -8.692 9.452 0.28 0.00 N ATOM 492 CA ASN A 32 -14.225 -8.225 9.032 0.33 0.00 C ATOM 493 C ASN A 32 -14.118 -7.205 7.901 1.00 0.00 C ATOM 494 O ASN A 32 -13.034 -6.957 7.371 0.48 0.00 O ATOM 495 CB ASN A 32 -14.974 -7.611 10.216 0.48 0.00 C ATOM 496 CG ASN A 32 -15.226 -8.606 11.331 1.00 0.00 C ATOM 497 OD1 ASN A 32 -15.279 -8.240 12.506 0.05 0.00 O ATOM 498 ND2 ASN A 32 -15.386 -9.876 10.972 0.06 0.00 N ATOM 0 H ASN A 32 -12.681 -8.496 10.428 0.28 0.00 H new ATOM 0 HA ASN A 32 -14.781 -9.087 8.663 0.33 0.00 H new ATOM 0 HB2 ASN A 32 -14.400 -6.771 10.607 0.48 0.00 H new ATOM 0 HB3 ASN A 32 -15.927 -7.211 9.869 0.48 0.00 H new ATOM 0 HD21 ASN A 32 -15.560 -10.588 11.681 0.06 0.00 H new ATOM 0 HD22 ASN A 32 -15.335 -10.138 9.988 0.06 0.00 H new ATOM 505 N ILE A 33 -15.252 -6.613 7.538 1.00 0.00 N ATOM 506 CA ILE A 33 -15.298 -5.621 6.467 0.20 0.00 C ATOM 507 C ILE A 33 -14.343 -4.459 6.737 0.13 0.00 C ATOM 508 O ILE A 33 -13.857 -3.818 5.806 0.22 0.00 O ATOM 509 CB ILE A 33 -16.726 -5.071 6.273 0.38 0.00 C ATOM 510 CG1 ILE A 33 -16.773 -4.110 5.082 1.00 0.00 C ATOM 511 CG2 ILE A 33 -17.203 -4.378 7.542 1.00 0.00 C ATOM 512 CD1 ILE A 33 -18.174 -3.675 4.708 0.40 0.00 C ATOM 0 H ILE A 33 -16.155 -6.804 7.972 1.00 0.00 H new ATOM 0 HA ILE A 33 -14.985 -6.130 5.555 0.20 0.00 H new ATOM 0 HB ILE A 33 -17.395 -5.906 6.064 0.38 0.00 H new ATOM 0 HG12 ILE A 33 -16.178 -3.227 5.315 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -16.309 -4.590 4.220 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -18.212 -3.995 7.390 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -17.206 -5.091 8.367 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -16.533 -3.551 7.779 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -18.129 -2.996 3.857 0.40 0.00 H new ATOM 0 HD12 ILE A 33 -18.768 -4.550 4.443 0.40 0.00 H new ATOM 0 HD13 ILE A 33 -18.635 -3.166 5.554 0.40 0.00 H new ATOM 524 N MET A 34 -14.079 -4.190 8.013 0.05 0.00 N ATOM 525 CA MET A 34 -13.185 -3.100 8.388 0.08 0.00 C ATOM 526 C MET A 34 -11.794 -3.300 7.793 1.00 0.00 C ATOM 527 O MET A 34 -11.331 -2.487 6.994 0.05 0.00 O ATOM 528 CB MET A 34 -13.094 -2.982 9.912 0.87 0.00 C ATOM 529 CG MET A 34 -14.370 -2.468 10.560 0.11 0.00 C ATOM 530 SD MET A 34 -15.642 -3.737 10.713 0.09 0.00 S ATOM 531 CE MET A 34 -14.992 -4.706 12.071 0.85 0.00 C ATOM 0 H MET A 34 -14.469 -4.709 8.800 0.05 0.00 H new ATOM 0 HA MET A 34 -13.598 -2.175 7.986 0.08 0.00 H new ATOM 0 HB2 MET A 34 -12.852 -3.959 10.330 0.87 0.00 H new ATOM 0 HB3 MET A 34 -12.272 -2.314 10.168 0.87 0.00 H new ATOM 0 HG2 MET A 34 -14.136 -2.075 11.549 0.11 0.00 H new ATOM 0 HG3 MET A 34 -14.761 -1.638 9.971 0.11 0.00 H new ATOM 0 HE1 MET A 34 -15.651 -5.553 12.262 0.85 0.00 H new ATOM 0 HE2 MET A 34 -13.998 -5.071 11.814 0.85 0.00 H new ATOM 0 HE3 MET A 34 -14.931 -4.085 12.965 0.85 0.00 H new ATOM 541 N GLN A 35 -11.132 -4.384 8.186 1.00 0.00 N ATOM 542 CA GLN A 35 -9.792 -4.684 7.688 0.20 0.00 C ATOM 543 C GLN A 35 -9.840 -5.709 6.561 0.37 0.00 C ATOM 544 O GLN A 35 -10.537 -6.720 6.651 0.06 0.00 O ATOM 545 CB GLN A 35 -8.905 -5.191 8.823 0.05 0.00 C ATOM 546 CG GLN A 35 -8.271 -4.073 9.633 0.10 0.00 C ATOM 547 CD GLN A 35 -7.523 -4.582 10.847 0.16 0.00 C ATOM 548 OE1 GLN A 35 -8.087 -4.700 11.935 0.40 0.00 O ATOM 549 NE2 GLN A 35 -6.243 -4.887 10.667 0.16 0.00 N ATOM 0 H GLN A 35 -11.500 -5.069 8.847 1.00 0.00 H new ATOM 0 HA GLN A 35 -9.367 -3.762 7.290 0.20 0.00 H new ATOM 0 HB2 GLN A 35 -9.499 -5.820 9.486 0.05 0.00 H new ATOM 0 HB3 GLN A 35 -8.118 -5.821 8.407 0.05 0.00 H new ATOM 0 HG2 GLN A 35 -7.585 -3.513 8.997 0.10 0.00 H new ATOM 0 HG3 GLN A 35 -9.047 -3.378 9.954 0.10 0.00 H new ATOM 0 HE21 GLN A 35 -5.816 -4.774 9.748 0.16 0.00 H new ATOM 0 HE22 GLN A 35 -5.687 -5.235 11.448 0.16 0.00 H new ATOM 558 N TRP A 36 -9.087 -5.438 5.501 1.00 0.00 N ATOM 559 CA TRP A 36 -9.038 -6.326 4.343 0.69 0.00 C ATOM 560 C TRP A 36 -7.665 -6.982 4.206 0.90 0.00 C ATOM 561 O TRP A 36 -6.650 -6.412 4.605 1.00 0.00 O ATOM 562 CB TRP A 36 -9.365 -5.548 3.066 0.12 0.00 C ATOM 563 CG TRP A 36 -10.825 -5.246 2.893 1.00 0.00 C ATOM 564 CD1 TRP A 36 -11.750 -5.045 3.879 0.06 0.00 C ATOM 565 CD2 TRP A 36 -11.526 -5.106 1.653 0.42 0.00 C ATOM 566 NE1 TRP A 36 -12.982 -4.793 3.326 0.48 0.00 N ATOM 567 CE2 TRP A 36 -12.872 -4.825 1.961 0.89 0.00 C ATOM 568 CE3 TRP A 36 -11.148 -5.194 0.309 0.89 0.00 C ATOM 569 CZ2 TRP A 36 -13.836 -4.629 0.977 0.26 0.00 C ATOM 570 CZ3 TRP A 36 -12.108 -4.999 -0.666 1.00 0.00 C ATOM 571 CH2 TRP A 36 -13.438 -4.719 -0.328 0.92 0.00 C ATOM 0 H TRP A 36 -8.500 -4.608 5.419 1.00 0.00 H new ATOM 0 HA TRP A 36 -9.781 -7.110 4.492 0.69 0.00 H new ATOM 0 HB2 TRP A 36 -8.809 -4.611 3.071 0.12 0.00 H new ATOM 0 HB3 TRP A 36 -9.018 -6.120 2.205 0.12 0.00 H new ATOM 0 HD1 TRP A 36 -11.543 -5.079 4.938 0.06 0.00 H new ATOM 0 HE1 TRP A 36 -13.840 -4.611 3.847 0.48 0.00 H new ATOM 0 HE3 TRP A 36 -10.125 -5.410 0.038 0.89 0.00 H new ATOM 0 HZ2 TRP A 36 -14.862 -4.413 1.235 0.26 0.00 H new ATOM 0 HZ3 TRP A 36 -11.828 -5.064 -1.707 1.00 0.00 H new ATOM 0 HH2 TRP A 36 -14.164 -4.571 -1.114 0.92 0.00 H new ATOM 582 N ASN A 37 -7.645 -8.182 3.633 0.17 0.00 N ATOM 583 CA ASN A 37 -6.399 -8.916 3.433 1.00 0.00 C ATOM 584 C ASN A 37 -5.928 -8.783 1.988 0.30 0.00 C ATOM 585 O ASN A 37 -6.529 -9.348 1.076 0.58 0.00 O ATOM 586 CB ASN A 37 -6.587 -10.394 3.785 1.00 0.00 C ATOM 587 CG ASN A 37 -5.332 -11.211 3.543 0.88 0.00 C ATOM 588 OD1 ASN A 37 -4.483 -11.344 4.425 0.08 0.00 O ATOM 589 ND2 ASN A 37 -5.209 -11.763 2.342 0.14 0.00 N ATOM 0 H ASN A 37 -8.478 -8.667 3.299 0.17 0.00 H new ATOM 0 HA ASN A 37 -5.642 -8.490 4.091 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -6.878 -10.481 4.832 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -7.404 -10.805 3.192 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -4.386 -12.324 2.120 0.14 0.00 H new ATOM 0 HD22 ASN A 37 -5.937 -11.627 1.641 0.14 0.00 H new ATOM 596 N ALA A 38 -4.851 -8.028 1.789 0.10 0.00 N ATOM 597 CA ALA A 38 -4.307 -7.816 0.452 1.00 0.00 C ATOM 598 C ALA A 38 -2.839 -8.217 0.373 0.16 0.00 C ATOM 599 O ALA A 38 -2.103 -8.121 1.354 0.23 0.00 O ATOM 600 CB ALA A 38 -4.477 -6.361 0.045 0.40 0.00 C ATOM 0 H ALA A 38 -4.340 -7.555 2.534 0.10 0.00 H new ATOM 0 HA ALA A 38 -4.861 -8.451 -0.239 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -4.068 -6.213 -0.954 0.40 0.00 H new ATOM 0 HB2 ALA A 38 -5.536 -6.105 0.045 0.40 0.00 H new ATOM 0 HB3 ALA A 38 -3.949 -5.721 0.752 0.40 0.00 H new ATOM 606 N VAL A 39 -2.424 -8.669 -0.808 0.72 0.00 N ATOM 607 CA VAL A 39 -1.045 -9.083 -1.032 1.00 0.00 C ATOM 608 C VAL A 39 -0.469 -8.404 -2.270 0.15 0.00 C ATOM 609 O VAL A 39 -0.995 -8.554 -3.372 0.49 0.00 O ATOM 610 CB VAL A 39 -0.940 -10.611 -1.203 0.66 0.00 C ATOM 611 CG1 VAL A 39 0.510 -11.036 -1.368 0.05 0.00 C ATOM 612 CG2 VAL A 39 -1.581 -11.324 -0.022 0.25 0.00 C ATOM 0 H VAL A 39 -3.027 -8.757 -1.626 0.72 0.00 H new ATOM 0 HA VAL A 39 -0.473 -8.784 -0.154 1.00 0.00 H new ATOM 0 HB VAL A 39 -1.479 -10.893 -2.107 0.66 0.00 H new ATOM 0 HG11 VAL A 39 0.561 -12.118 -1.487 0.05 0.00 H new ATOM 0 HG12 VAL A 39 0.932 -10.554 -2.250 0.05 0.00 H new ATOM 0 HG13 VAL A 39 1.078 -10.741 -0.486 0.05 0.00 H new ATOM 0 HG21 VAL A 39 -1.498 -12.402 -0.159 0.25 0.00 H new ATOM 0 HG22 VAL A 39 -1.072 -11.035 0.897 0.25 0.00 H new ATOM 0 HG23 VAL A 39 -2.633 -11.047 0.043 0.25 0.00 H new ATOM 622 N ILE A 40 0.615 -7.659 -2.079 0.22 0.00 N ATOM 623 CA ILE A 40 1.261 -6.954 -3.179 0.13 0.00 C ATOM 624 C ILE A 40 2.614 -7.572 -3.501 1.00 0.00 C ATOM 625 O ILE A 40 3.415 -7.845 -2.606 1.00 0.00 O ATOM 626 CB ILE A 40 1.453 -5.457 -2.854 0.93 0.00 C ATOM 627 CG1 ILE A 40 0.091 -4.772 -2.694 0.06 0.00 C ATOM 628 CG2 ILE A 40 2.275 -4.776 -3.941 0.39 0.00 C ATOM 629 CD1 ILE A 40 0.187 -3.299 -2.356 0.35 0.00 C ATOM 0 H ILE A 40 1.064 -7.528 -1.173 0.22 0.00 H new ATOM 0 HA ILE A 40 0.606 -7.046 -4.045 0.13 0.00 H new ATOM 0 HB ILE A 40 1.996 -5.370 -1.913 0.93 0.00 H new ATOM 0 HG12 ILE A 40 -0.475 -4.888 -3.618 0.06 0.00 H new ATOM 0 HG13 ILE A 40 -0.471 -5.280 -1.910 0.06 0.00 H new ATOM 0 HG21 ILE A 40 2.400 -3.721 -3.695 0.39 0.00 H new ATOM 0 HG22 ILE A 40 3.253 -5.252 -4.009 0.39 0.00 H new ATOM 0 HG23 ILE A 40 1.760 -4.867 -4.897 0.39 0.00 H new ATOM 0 HD11 ILE A 40 -0.815 -2.882 -2.258 0.35 0.00 H new ATOM 0 HD12 ILE A 40 0.725 -3.176 -1.416 0.35 0.00 H new ATOM 0 HD13 ILE A 40 0.721 -2.777 -3.150 0.35 0.00 H new ATOM 641 N PHE A 41 2.864 -7.791 -4.787 0.25 0.00 N ATOM 642 CA PHE A 41 4.122 -8.375 -5.233 0.24 0.00 C ATOM 643 C PHE A 41 5.027 -7.306 -5.834 0.06 0.00 C ATOM 644 O PHE A 41 4.584 -6.485 -6.638 0.62 0.00 O ATOM 645 CB PHE A 41 3.859 -9.480 -6.256 0.23 0.00 C ATOM 646 CG PHE A 41 2.925 -10.549 -5.759 1.00 0.00 C ATOM 647 CD1 PHE A 41 3.232 -11.283 -4.625 1.00 0.00 C ATOM 648 CD2 PHE A 41 1.740 -10.817 -6.428 0.44 0.00 C ATOM 649 CE1 PHE A 41 2.375 -12.265 -4.165 0.13 0.00 C ATOM 650 CE2 PHE A 41 0.881 -11.799 -5.973 1.00 0.00 C ATOM 651 CZ PHE A 41 1.198 -12.523 -4.840 0.20 0.00 C ATOM 0 H PHE A 41 2.211 -7.572 -5.539 0.25 0.00 H new ATOM 0 HA PHE A 41 4.626 -8.808 -4.369 0.24 0.00 H new ATOM 0 HB2 PHE A 41 3.442 -9.036 -7.160 0.23 0.00 H new ATOM 0 HB3 PHE A 41 4.808 -9.939 -6.535 0.23 0.00 H new ATOM 0 HD1 PHE A 41 4.152 -11.086 -4.094 1.00 0.00 H new ATOM 0 HD2 PHE A 41 1.486 -10.253 -7.313 0.44 0.00 H new ATOM 0 HE1 PHE A 41 2.625 -12.830 -3.279 0.13 0.00 H new ATOM 0 HE2 PHE A 41 -0.038 -12.001 -6.503 1.00 0.00 H new ATOM 0 HZ PHE A 41 0.526 -13.290 -4.483 0.20 0.00 H new ATOM 661 N GLY A 42 6.296 -7.320 -5.437 0.11 0.00 N ATOM 662 CA GLY A 42 7.243 -6.347 -5.944 0.83 0.00 C ATOM 663 C GLY A 42 7.355 -6.381 -7.461 0.13 0.00 C ATOM 664 O GLY A 42 7.325 -7.457 -8.055 1.00 0.00 O ATOM 0 H GLY A 42 6.684 -7.989 -4.772 0.11 0.00 H new ATOM 0 HA2 GLY A 42 6.939 -5.349 -5.627 0.83 0.00 H new ATOM 0 HA3 GLY A 42 8.223 -6.536 -5.506 0.83 0.00 H new ATOM 668 N PRO A 43 7.489 -5.212 -8.119 0.08 0.00 N ATOM 669 CA PRO A 43 7.604 -5.141 -9.580 1.00 0.00 C ATOM 670 C PRO A 43 8.858 -5.840 -10.093 0.32 0.00 C ATOM 671 O PRO A 43 9.618 -6.418 -9.317 1.00 0.00 O ATOM 672 CB PRO A 43 7.670 -3.637 -9.869 1.00 0.00 C ATOM 673 CG PRO A 43 8.112 -3.017 -8.587 0.23 0.00 C ATOM 674 CD PRO A 43 7.540 -3.876 -7.497 0.46 0.00 C ATOM 0 HA PRO A 43 6.773 -5.642 -10.077 1.00 0.00 H new ATOM 0 HB2 PRO A 43 8.371 -3.420 -10.675 1.00 0.00 H new ATOM 0 HB3 PRO A 43 6.699 -3.252 -10.180 1.00 0.00 H new ATOM 0 HG2 PRO A 43 9.200 -2.980 -8.525 0.23 0.00 H new ATOM 0 HG3 PRO A 43 7.753 -1.991 -8.505 0.23 0.00 H new ATOM 0 HD2 PRO A 43 8.168 -3.869 -6.606 0.46 0.00 H new ATOM 0 HD3 PRO A 43 6.551 -3.535 -7.192 0.46 0.00 H new ATOM 682 N GLU A 44 9.068 -5.785 -11.404 0.12 0.00 N ATOM 683 CA GLU A 44 10.233 -6.416 -12.015 0.09 0.00 C ATOM 684 C GLU A 44 11.426 -5.467 -12.010 1.00 0.00 C ATOM 685 O GLU A 44 11.270 -4.259 -11.827 0.07 0.00 O ATOM 686 CB GLU A 44 9.914 -6.849 -13.447 0.12 0.00 C ATOM 687 CG GLU A 44 9.685 -5.685 -14.398 0.44 0.00 C ATOM 688 CD GLU A 44 9.177 -6.133 -15.755 0.77 0.00 C ATOM 689 OE1 GLU A 44 10.001 -6.572 -16.584 0.24 0.00 O ATOM 690 OE2 GLU A 44 7.952 -6.045 -15.988 0.13 0.00 O ATOM 0 H GLU A 44 8.449 -5.312 -12.062 0.12 0.00 H new ATOM 0 HA GLU A 44 10.489 -7.298 -11.428 0.09 0.00 H new ATOM 0 HB2 GLU A 44 10.734 -7.460 -13.824 0.12 0.00 H new ATOM 0 HB3 GLU A 44 9.025 -7.480 -13.437 0.12 0.00 H new ATOM 0 HG2 GLU A 44 8.967 -4.994 -13.955 0.44 0.00 H new ATOM 0 HG3 GLU A 44 10.618 -5.136 -14.526 0.44 0.00 H new ATOM 697 N GLY A 45 12.615 -6.023 -12.214 0.07 0.00 N ATOM 698 CA GLY A 45 13.823 -5.215 -12.230 1.00 0.00 C ATOM 699 C GLY A 45 14.056 -4.487 -10.921 0.58 0.00 C ATOM 700 O GLY A 45 14.773 -3.486 -10.881 1.00 0.00 O ATOM 0 H GLY A 45 12.765 -7.020 -12.369 0.07 0.00 H new ATOM 0 HA2 GLY A 45 14.680 -5.854 -12.443 1.00 0.00 H new ATOM 0 HA3 GLY A 45 13.758 -4.488 -13.039 1.00 0.00 H new ATOM 704 N THR A 46 13.450 -4.987 -9.849 1.00 0.00 N ATOM 705 CA THR A 46 13.598 -4.376 -8.533 1.00 0.00 C ATOM 706 C THR A 46 14.058 -5.404 -7.501 0.86 0.00 C ATOM 707 O THR A 46 13.840 -6.602 -7.678 1.00 0.00 O ATOM 708 CB THR A 46 12.274 -3.745 -8.055 1.00 0.00 C ATOM 709 OG1 THR A 46 11.244 -4.738 -8.014 0.85 0.00 O ATOM 710 CG2 THR A 46 11.854 -2.608 -8.973 0.13 0.00 C ATOM 0 H THR A 46 12.852 -5.813 -9.866 1.00 0.00 H new ATOM 0 HA THR A 46 14.352 -3.594 -8.628 1.00 0.00 H new ATOM 0 HB THR A 46 12.430 -3.343 -7.054 1.00 0.00 H new ATOM 0 HG1 THR A 46 11.105 -5.102 -8.913 0.85 0.00 H new ATOM 0 HG21 THR A 46 10.918 -2.179 -8.616 0.13 0.00 H new ATOM 0 HG22 THR A 46 12.627 -1.840 -8.978 0.13 0.00 H new ATOM 0 HG23 THR A 46 11.715 -2.989 -9.985 0.13 0.00 H new ATOM 718 N PRO A 47 14.706 -4.954 -6.410 0.13 0.00 N ATOM 719 CA PRO A 47 15.188 -5.857 -5.360 0.23 0.00 C ATOM 720 C PRO A 47 14.045 -6.490 -4.571 1.00 0.00 C ATOM 721 O PRO A 47 14.271 -7.318 -3.689 0.05 0.00 O ATOM 722 CB PRO A 47 16.022 -4.947 -4.456 1.00 0.00 C ATOM 723 CG PRO A 47 15.467 -3.583 -4.676 0.09 0.00 C ATOM 724 CD PRO A 47 15.022 -3.542 -6.111 0.11 0.00 C ATOM 0 HA PRO A 47 15.749 -6.695 -5.773 0.23 0.00 H new ATOM 0 HB2 PRO A 47 15.939 -5.244 -3.411 1.00 0.00 H new ATOM 0 HB3 PRO A 47 17.079 -4.991 -4.717 1.00 0.00 H new ATOM 0 HG2 PRO A 47 14.632 -3.389 -4.003 0.09 0.00 H new ATOM 0 HG3 PRO A 47 16.219 -2.819 -4.479 0.09 0.00 H new ATOM 0 HD2 PRO A 47 14.152 -2.898 -6.244 0.11 0.00 H new ATOM 0 HD3 PRO A 47 15.806 -3.158 -6.764 0.11 0.00 H new ATOM 732 N PHE A 48 12.817 -6.096 -4.897 1.00 0.00 N ATOM 733 CA PHE A 48 11.639 -6.627 -4.220 0.26 0.00 C ATOM 734 C PHE A 48 10.953 -7.683 -5.082 1.00 0.00 C ATOM 735 O PHE A 48 10.019 -8.350 -4.637 0.48 0.00 O ATOM 736 CB PHE A 48 10.653 -5.501 -3.903 0.48 0.00 C ATOM 737 CG PHE A 48 11.306 -4.261 -3.362 0.37 0.00 C ATOM 738 CD1 PHE A 48 11.658 -4.173 -2.025 1.00 0.00 C ATOM 739 CD2 PHE A 48 11.565 -3.181 -4.193 0.18 0.00 C ATOM 740 CE1 PHE A 48 12.258 -3.033 -1.526 0.16 0.00 C ATOM 741 CE2 PHE A 48 12.165 -2.038 -3.699 0.46 0.00 C ATOM 742 CZ PHE A 48 12.512 -1.964 -2.365 0.22 0.00 C ATOM 0 H PHE A 48 12.612 -5.412 -5.625 1.00 0.00 H new ATOM 0 HA PHE A 48 11.964 -7.090 -3.288 0.26 0.00 H new ATOM 0 HB2 PHE A 48 10.103 -5.246 -4.809 0.48 0.00 H new ATOM 0 HB3 PHE A 48 9.923 -5.862 -3.178 0.48 0.00 H new ATOM 0 HD1 PHE A 48 11.461 -5.005 -1.365 1.00 0.00 H new ATOM 0 HD2 PHE A 48 11.295 -3.234 -5.237 0.18 0.00 H new ATOM 0 HE1 PHE A 48 12.528 -2.977 -0.482 0.16 0.00 H new ATOM 0 HE2 PHE A 48 12.362 -1.204 -4.356 0.46 0.00 H new ATOM 0 HZ PHE A 48 12.981 -1.072 -1.977 0.22 0.00 H new ATOM 752 N GLU A 49 11.426 -7.826 -6.315 0.12 0.00 N ATOM 753 CA GLU A 49 10.859 -8.794 -7.249 1.00 0.00 C ATOM 754 C GLU A 49 10.972 -10.216 -6.702 1.00 0.00 C ATOM 755 O GLU A 49 10.145 -11.076 -7.008 0.13 0.00 O ATOM 756 CB GLU A 49 11.571 -8.701 -8.602 0.14 0.00 C ATOM 757 CG GLU A 49 12.955 -9.334 -8.611 0.38 0.00 C ATOM 758 CD GLU A 49 13.662 -9.171 -9.941 0.28 0.00 C ATOM 759 OE1 GLU A 49 13.480 -10.038 -10.821 0.08 0.00 O ATOM 760 OE2 GLU A 49 14.399 -8.176 -10.103 0.20 0.00 O ATOM 0 H GLU A 49 12.202 -7.283 -6.692 0.12 0.00 H new ATOM 0 HA GLU A 49 9.803 -8.558 -7.379 1.00 0.00 H new ATOM 0 HB2 GLU A 49 10.955 -9.185 -9.360 0.14 0.00 H new ATOM 0 HB3 GLU A 49 11.659 -7.652 -8.885 0.14 0.00 H new ATOM 0 HG2 GLU A 49 13.561 -8.885 -7.824 0.38 0.00 H new ATOM 0 HG3 GLU A 49 12.867 -10.395 -8.378 0.38 0.00 H new ATOM 767 N ASP A 50 11.998 -10.453 -5.892 1.00 0.00 N ATOM 768 CA ASP A 50 12.227 -11.771 -5.312 0.29 0.00 C ATOM 769 C ASP A 50 11.413 -11.968 -4.037 1.00 0.00 C ATOM 770 O ASP A 50 10.963 -13.075 -3.743 1.00 0.00 O ATOM 771 CB ASP A 50 13.715 -11.961 -5.011 0.47 0.00 C ATOM 772 CG ASP A 50 14.578 -11.827 -6.250 0.88 0.00 C ATOM 773 OD1 ASP A 50 15.006 -10.695 -6.557 1.00 0.00 O ATOM 774 OD2 ASP A 50 14.827 -12.856 -6.915 0.14 0.00 O ATOM 0 H ASP A 50 12.685 -9.749 -5.622 1.00 0.00 H new ATOM 0 HA ASP A 50 11.904 -12.516 -6.039 0.29 0.00 H new ATOM 0 HB2 ASP A 50 14.030 -11.225 -4.271 0.47 0.00 H new ATOM 0 HB3 ASP A 50 13.870 -12.945 -4.568 0.47 0.00 H new ATOM 779 N GLY A 51 11.226 -10.888 -3.283 0.19 0.00 N ATOM 780 CA GLY A 51 10.474 -10.971 -2.044 0.85 0.00 C ATOM 781 C GLY A 51 9.010 -10.614 -2.212 0.06 0.00 C ATOM 782 O GLY A 51 8.577 -10.229 -3.298 0.11 0.00 O ATOM 0 H GLY A 51 11.581 -9.959 -3.508 0.19 0.00 H new ATOM 0 HA2 GLY A 51 10.552 -11.983 -1.646 0.85 0.00 H new ATOM 0 HA3 GLY A 51 10.923 -10.303 -1.308 0.85 0.00 H new ATOM 786 N THR A 52 8.251 -10.744 -1.129 1.00 0.00 N ATOM 787 CA THR A 52 6.825 -10.431 -1.143 0.08 0.00 C ATOM 788 C THR A 52 6.431 -9.649 0.107 0.21 0.00 C ATOM 789 O THR A 52 6.956 -9.895 1.193 1.00 0.00 O ATOM 790 CB THR A 52 5.969 -11.710 -1.225 1.00 0.00 C ATOM 791 OG1 THR A 52 6.306 -12.595 -0.149 0.48 0.00 O ATOM 792 CG2 THR A 52 6.177 -12.419 -2.554 0.87 0.00 C ATOM 0 H THR A 52 8.601 -11.065 -0.226 1.00 0.00 H new ATOM 0 HA THR A 52 6.639 -9.824 -2.029 0.08 0.00 H new ATOM 0 HB THR A 52 4.920 -11.423 -1.146 1.00 0.00 H new ATOM 0 HG1 THR A 52 5.757 -13.405 -0.207 0.48 0.00 H new ATOM 0 HG21 THR A 52 5.562 -13.318 -2.587 0.87 0.00 H new ATOM 0 HG22 THR A 52 5.892 -11.754 -3.369 0.87 0.00 H new ATOM 0 HG23 THR A 52 7.227 -12.693 -2.660 0.87 0.00 H new ATOM 800 N PHE A 53 5.504 -8.708 -0.053 0.35 0.00 N ATOM 801 CA PHE A 53 5.048 -7.888 1.066 0.34 0.00 C ATOM 802 C PHE A 53 3.536 -7.984 1.244 0.07 0.00 C ATOM 803 O PHE A 53 2.789 -8.098 0.273 0.12 0.00 O ATOM 804 CB PHE A 53 5.454 -6.428 0.857 0.13 0.00 C ATOM 805 CG PHE A 53 6.910 -6.163 1.120 0.11 0.00 C ATOM 806 CD1 PHE A 53 7.862 -6.418 0.145 0.36 0.00 C ATOM 807 CD2 PHE A 53 7.325 -5.657 2.341 0.06 0.00 C ATOM 808 CE1 PHE A 53 9.202 -6.172 0.386 1.00 0.00 C ATOM 809 CE2 PHE A 53 8.661 -5.408 2.587 0.30 0.00 C ATOM 810 CZ PHE A 53 9.601 -5.667 1.607 0.06 0.00 C ATOM 0 H PHE A 53 5.055 -8.495 -0.944 0.35 0.00 H new ATOM 0 HA PHE A 53 5.524 -8.268 1.970 0.34 0.00 H new ATOM 0 HB2 PHE A 53 5.220 -6.138 -0.167 0.13 0.00 H new ATOM 0 HB3 PHE A 53 4.854 -5.796 1.512 0.13 0.00 H new ATOM 0 HD1 PHE A 53 7.555 -6.813 -0.812 0.36 0.00 H new ATOM 0 HD2 PHE A 53 6.595 -5.455 3.110 0.06 0.00 H new ATOM 0 HE1 PHE A 53 9.935 -6.375 -0.381 1.00 0.00 H new ATOM 0 HE2 PHE A 53 8.971 -5.012 3.543 0.30 0.00 H new ATOM 0 HZ PHE A 53 10.647 -5.474 1.797 0.06 0.00 H new ATOM 820 N LYS A 54 3.095 -7.935 2.499 0.82 0.00 N ATOM 821 CA LYS A 54 1.675 -8.011 2.824 1.00 0.00 C ATOM 822 C LYS A 54 1.228 -6.753 3.564 0.12 0.00 C ATOM 823 O LYS A 54 1.923 -6.273 4.460 0.31 0.00 O ATOM 824 CB LYS A 54 1.392 -9.251 3.677 0.96 0.00 C ATOM 825 CG LYS A 54 1.850 -10.551 3.038 1.00 0.00 C ATOM 826 CD LYS A 54 1.588 -11.742 3.946 0.31 0.00 C ATOM 827 CE LYS A 54 2.123 -13.032 3.344 1.00 0.00 C ATOM 828 NZ LYS A 54 1.472 -13.348 2.042 0.23 0.00 N ATOM 0 H LYS A 54 3.706 -7.842 3.311 0.82 0.00 H new ATOM 0 HA LYS A 54 1.112 -8.087 1.894 1.00 0.00 H new ATOM 0 HB2 LYS A 54 1.886 -9.137 4.642 0.96 0.00 H new ATOM 0 HB3 LYS A 54 0.321 -9.310 3.872 0.96 0.00 H new ATOM 0 HG2 LYS A 54 1.331 -10.694 2.090 1.00 0.00 H new ATOM 0 HG3 LYS A 54 2.915 -10.491 2.813 1.00 0.00 H new ATOM 0 HD2 LYS A 54 2.055 -11.571 4.916 0.31 0.00 H new ATOM 0 HD3 LYS A 54 0.516 -11.838 4.121 0.31 0.00 H new ATOM 0 HE2 LYS A 54 3.200 -12.946 3.200 1.00 0.00 H new ATOM 0 HE3 LYS A 54 1.959 -13.854 4.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 1.735 -14.310 1.747 0.23 0.00 H new ATOM 0 HZ2 LYS A 54 0.439 -13.288 2.147 0.23 0.00 H new ATOM 0 HZ3 LYS A 54 1.787 -12.667 1.322 0.23 0.00 H new ATOM 842 N LEU A 55 0.069 -6.222 3.186 0.68 0.00 N ATOM 843 CA LEU A 55 -0.458 -5.017 3.817 0.13 0.00 C ATOM 844 C LEU A 55 -1.962 -5.122 4.054 0.20 0.00 C ATOM 845 O LEU A 55 -2.632 -5.988 3.490 0.05 0.00 O ATOM 846 CB LEU A 55 -0.141 -3.766 2.977 0.98 0.00 C ATOM 847 CG LEU A 55 -0.249 -3.909 1.447 1.00 0.00 C ATOM 848 CD1 LEU A 55 0.912 -4.723 0.894 0.42 0.00 C ATOM 849 CD2 LEU A 55 -1.577 -4.533 1.040 0.78 0.00 C ATOM 0 H LEU A 55 -0.521 -6.606 2.448 0.68 0.00 H new ATOM 0 HA LEU A 55 0.034 -4.920 4.785 0.13 0.00 H new ATOM 0 HB2 LEU A 55 -0.812 -2.967 3.291 0.98 0.00 H new ATOM 0 HB3 LEU A 55 0.872 -3.444 3.217 0.98 0.00 H new ATOM 0 HG LEU A 55 -0.203 -2.907 1.020 1.00 0.00 H new ATOM 0 HD11 LEU A 55 0.813 -4.810 -0.188 0.42 0.00 H new ATOM 0 HD12 LEU A 55 1.852 -4.226 1.134 0.42 0.00 H new ATOM 0 HD13 LEU A 55 0.904 -5.718 1.340 0.42 0.00 H new ATOM 0 HD21 LEU A 55 -1.621 -4.620 -0.046 0.78 0.00 H new ATOM 0 HD22 LEU A 55 -1.666 -5.523 1.487 0.78 0.00 H new ATOM 0 HD23 LEU A 55 -2.396 -3.903 1.387 0.78 0.00 H new ATOM 861 N VAL A 56 -2.481 -4.237 4.897 0.17 0.00 N ATOM 862 CA VAL A 56 -3.903 -4.216 5.215 0.87 0.00 C ATOM 863 C VAL A 56 -4.513 -2.854 4.896 0.13 0.00 C ATOM 864 O VAL A 56 -3.910 -1.814 5.167 0.30 0.00 O ATOM 865 CB VAL A 56 -4.150 -4.550 6.699 1.00 0.00 C ATOM 866 CG1 VAL A 56 -3.420 -3.566 7.600 1.00 0.00 C ATOM 867 CG2 VAL A 56 -5.640 -4.564 7.009 0.17 0.00 C ATOM 0 H VAL A 56 -1.934 -3.521 5.375 0.17 0.00 H new ATOM 0 HA VAL A 56 -4.381 -4.977 4.599 0.87 0.00 H new ATOM 0 HB VAL A 56 -3.755 -5.547 6.894 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -3.608 -3.820 8.643 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -2.349 -3.616 7.401 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -3.779 -2.556 7.402 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -5.790 -4.802 8.062 0.17 0.00 H new ATOM 0 HG22 VAL A 56 -6.066 -3.584 6.794 0.17 0.00 H new ATOM 0 HG23 VAL A 56 -6.133 -5.316 6.393 0.17 0.00 H new ATOM 877 N ILE A 57 -5.711 -2.865 4.320 0.19 0.00 N ATOM 878 CA ILE A 57 -6.400 -1.630 3.967 0.90 0.00 C ATOM 879 C ILE A 57 -7.574 -1.373 4.906 0.16 0.00 C ATOM 880 O ILE A 57 -8.579 -2.082 4.869 0.21 0.00 O ATOM 881 CB ILE A 57 -6.918 -1.652 2.514 0.36 0.00 C ATOM 882 CG1 ILE A 57 -5.770 -1.909 1.532 0.98 0.00 C ATOM 883 CG2 ILE A 57 -7.618 -0.344 2.177 0.93 0.00 C ATOM 884 CD1 ILE A 57 -5.388 -3.368 1.408 1.00 0.00 C ATOM 0 H ILE A 57 -6.224 -3.715 4.088 0.19 0.00 H new ATOM 0 HA ILE A 57 -5.668 -0.828 4.064 0.90 0.00 H new ATOM 0 HB ILE A 57 -7.638 -2.466 2.422 0.36 0.00 H new ATOM 0 HG12 ILE A 57 -6.054 -1.532 0.549 0.98 0.00 H new ATOM 0 HG13 ILE A 57 -4.897 -1.340 1.851 0.98 0.00 H new ATOM 0 HG21 ILE A 57 -7.977 -0.378 1.148 0.93 0.00 H new ATOM 0 HG22 ILE A 57 -8.462 -0.199 2.851 0.93 0.00 H new ATOM 0 HG23 ILE A 57 -6.917 0.483 2.290 0.93 0.00 H new ATOM 0 HD11 ILE A 57 -4.569 -3.470 0.696 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -5.072 -3.745 2.381 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -6.247 -3.941 1.058 1.00 0.00 H new ATOM 896 N GLU A 58 -7.436 -0.352 5.745 1.00 0.00 N ATOM 897 CA GLU A 58 -8.483 0.006 6.695 0.32 0.00 C ATOM 898 C GLU A 58 -9.295 1.195 6.188 0.43 0.00 C ATOM 899 O GLU A 58 -8.743 2.144 5.633 1.00 0.00 O ATOM 900 CB GLU A 58 -7.873 0.336 8.060 0.90 0.00 C ATOM 901 CG GLU A 58 -8.905 0.682 9.120 0.35 0.00 C ATOM 902 CD GLU A 58 -8.275 1.038 10.453 1.00 0.00 C ATOM 903 OE1 GLU A 58 -8.029 0.116 11.259 0.12 0.00 O ATOM 904 OE2 GLU A 58 -8.026 2.238 10.688 0.31 0.00 O ATOM 0 H GLU A 58 -6.608 0.243 5.786 1.00 0.00 H new ATOM 0 HA GLU A 58 -9.150 -0.849 6.800 0.32 0.00 H new ATOM 0 HB2 GLU A 58 -7.285 -0.516 8.402 0.90 0.00 H new ATOM 0 HB3 GLU A 58 -7.185 1.174 7.948 0.90 0.00 H new ATOM 0 HG2 GLU A 58 -9.510 1.520 8.773 0.35 0.00 H new ATOM 0 HG3 GLU A 58 -9.579 -0.164 9.255 0.35 0.00 H new ATOM 911 N PHE A 59 -10.609 1.130 6.382 1.00 0.00 N ATOM 912 CA PHE A 59 -11.501 2.200 5.949 0.41 0.00 C ATOM 913 C PHE A 59 -12.143 2.884 7.154 0.90 0.00 C ATOM 914 O PHE A 59 -12.540 2.223 8.112 0.38 0.00 O ATOM 915 CB PHE A 59 -12.587 1.647 5.026 0.23 0.00 C ATOM 916 CG PHE A 59 -12.052 1.027 3.765 0.06 0.00 C ATOM 917 CD1 PHE A 59 -11.636 -0.295 3.749 0.28 0.00 C ATOM 918 CD2 PHE A 59 -11.966 1.767 2.598 0.19 0.00 C ATOM 919 CE1 PHE A 59 -11.145 -0.868 2.590 0.49 0.00 C ATOM 920 CE2 PHE A 59 -11.477 1.201 1.437 0.06 0.00 C ATOM 921 CZ PHE A 59 -11.065 -0.118 1.433 0.24 0.00 C ATOM 0 H PHE A 59 -11.079 0.347 6.836 1.00 0.00 H new ATOM 0 HA PHE A 59 -10.911 2.935 5.401 0.41 0.00 H new ATOM 0 HB2 PHE A 59 -13.167 0.901 5.569 0.23 0.00 H new ATOM 0 HB3 PHE A 59 -13.272 2.453 4.762 0.23 0.00 H new ATOM 0 HD1 PHE A 59 -11.696 -0.884 4.652 0.28 0.00 H new ATOM 0 HD2 PHE A 59 -12.285 2.799 2.596 0.19 0.00 H new ATOM 0 HE1 PHE A 59 -10.825 -1.899 2.590 0.49 0.00 H new ATOM 0 HE2 PHE A 59 -11.417 1.789 0.533 0.06 0.00 H new ATOM 0 HZ PHE A 59 -10.681 -0.562 0.526 0.24 0.00 H new ATOM 931 N SER A 60 -12.240 4.208 7.097 0.31 0.00 N ATOM 932 CA SER A 60 -12.833 4.976 8.186 0.08 0.00 C ATOM 933 C SER A 60 -14.196 5.524 7.782 0.34 0.00 C ATOM 934 O SER A 60 -14.322 6.219 6.773 0.30 0.00 O ATOM 935 CB SER A 60 -11.906 6.122 8.595 0.35 0.00 C ATOM 936 OG SER A 60 -10.641 5.636 9.008 0.11 0.00 O ATOM 0 H SER A 60 -11.916 4.771 6.310 0.31 0.00 H new ATOM 0 HA SER A 60 -12.968 4.310 9.038 0.08 0.00 H new ATOM 0 HB2 SER A 60 -11.779 6.807 7.757 0.35 0.00 H new ATOM 0 HB3 SER A 60 -12.362 6.691 9.405 0.35 0.00 H new ATOM 0 HG SER A 60 -10.068 6.389 9.262 0.11 0.00 H new ATOM 942 N GLU A 61 -15.214 5.205 8.575 1.00 0.00 N ATOM 943 CA GLU A 61 -16.569 5.667 8.302 0.90 0.00 C ATOM 944 C GLU A 61 -16.642 7.189 8.352 0.13 0.00 C ATOM 945 O GLU A 61 -16.798 7.779 9.421 0.06 0.00 O ATOM 946 CB GLU A 61 -17.551 5.060 9.307 0.42 0.00 C ATOM 947 CG GLU A 61 -18.992 5.493 9.094 0.22 0.00 C ATOM 948 CD GLU A 61 -19.935 4.905 10.125 0.06 0.00 C ATOM 949 OE1 GLU A 61 -20.110 5.526 11.194 0.31 0.00 O ATOM 950 OE2 GLU A 61 -20.500 3.823 9.862 0.48 0.00 O ATOM 0 H GLU A 61 -15.126 4.628 9.412 1.00 0.00 H new ATOM 0 HA GLU A 61 -16.844 5.341 7.299 0.90 0.00 H new ATOM 0 HB2 GLU A 61 -17.495 3.973 9.245 0.42 0.00 H new ATOM 0 HB3 GLU A 61 -17.243 5.338 10.315 0.42 0.00 H new ATOM 0 HG2 GLU A 61 -19.050 6.581 9.132 0.22 0.00 H new ATOM 0 HG3 GLU A 61 -19.315 5.191 8.098 0.22 0.00 H new ATOM 957 N GLU A 62 -16.520 7.816 7.188 0.07 0.00 N ATOM 958 CA GLU A 62 -16.566 9.270 7.087 0.06 0.00 C ATOM 959 C GLU A 62 -17.359 9.705 5.860 0.08 0.00 C ATOM 960 O GLU A 62 -18.521 10.098 5.967 0.73 0.00 O ATOM 961 CB GLU A 62 -15.146 9.840 7.029 0.20 0.00 C ATOM 962 CG GLU A 62 -14.444 9.866 8.376 0.46 0.00 C ATOM 963 CD GLU A 62 -15.136 10.770 9.378 0.90 0.00 C ATOM 964 OE1 GLU A 62 -14.804 11.973 9.420 0.12 0.00 O ATOM 965 OE2 GLU A 62 -16.011 10.275 10.119 0.15 0.00 O ATOM 0 H GLU A 62 -16.388 7.338 6.297 0.07 0.00 H new ATOM 0 HA GLU A 62 -17.068 9.659 7.973 0.06 0.00 H new ATOM 0 HB2 GLU A 62 -14.554 9.247 6.332 0.20 0.00 H new ATOM 0 HB3 GLU A 62 -15.187 10.854 6.631 0.20 0.00 H new ATOM 0 HG2 GLU A 62 -14.398 8.854 8.777 0.46 0.00 H new ATOM 0 HG3 GLU A 62 -13.416 10.201 8.239 0.46 0.00 H new ATOM 972 N TYR A 63 -16.724 9.631 4.694 0.07 0.00 N ATOM 973 CA TYR A 63 -17.369 10.013 3.443 0.06 0.00 C ATOM 974 C TYR A 63 -16.922 9.100 2.302 0.17 0.00 C ATOM 975 O TYR A 63 -15.831 8.529 2.351 0.18 0.00 O ATOM 976 CB TYR A 63 -17.044 11.468 3.098 0.85 0.00 C ATOM 977 CG TYR A 63 -17.600 12.469 4.086 0.37 0.00 C ATOM 978 CD1 TYR A 63 -18.942 12.825 4.063 0.11 0.00 C ATOM 979 CD2 TYR A 63 -16.781 13.059 5.042 0.10 0.00 C ATOM 980 CE1 TYR A 63 -19.452 13.741 4.962 0.07 0.00 C ATOM 981 CE2 TYR A 63 -17.284 13.975 5.945 0.37 0.00 C ATOM 982 CZ TYR A 63 -18.620 14.313 5.900 0.24 0.00 C ATOM 983 OH TYR A 63 -19.126 15.226 6.796 0.15 0.00 O ATOM 0 H TYR A 63 -15.762 9.309 4.590 0.07 0.00 H new ATOM 0 HA TYR A 63 -18.446 9.909 3.573 0.06 0.00 H new ATOM 0 HB2 TYR A 63 -15.962 11.586 3.046 0.85 0.00 H new ATOM 0 HB3 TYR A 63 -17.437 11.693 2.107 0.85 0.00 H new ATOM 0 HD1 TYR A 63 -19.598 12.378 3.330 0.11 0.00 H new ATOM 0 HD2 TYR A 63 -15.734 12.797 5.079 0.10 0.00 H new ATOM 0 HE1 TYR A 63 -20.498 14.008 4.930 0.07 0.00 H new ATOM 0 HE2 TYR A 63 -16.635 14.424 6.682 0.37 0.00 H new ATOM 0 HH TYR A 63 -18.410 15.533 7.390 0.15 0.00 H new ATOM 993 N PRO A 64 -17.757 8.948 1.258 1.00 0.00 N ATOM 994 CA PRO A 64 -17.429 8.102 0.107 1.00 0.00 C ATOM 995 C PRO A 64 -16.276 8.665 -0.719 0.06 0.00 C ATOM 996 O PRO A 64 -15.778 8.011 -1.635 1.00 0.00 O ATOM 997 CB PRO A 64 -18.721 8.091 -0.716 0.12 0.00 C ATOM 998 CG PRO A 64 -19.435 9.339 -0.322 0.30 0.00 C ATOM 999 CD PRO A 64 -19.084 9.579 1.118 0.07 0.00 C ATOM 0 HA PRO A 64 -17.100 7.110 0.417 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -18.509 8.078 -1.785 0.12 0.00 H new ATOM 0 HB3 PRO A 64 -19.321 7.207 -0.499 0.12 0.00 H new ATOM 0 HG2 PRO A 64 -19.126 10.179 -0.944 0.30 0.00 H new ATOM 0 HG3 PRO A 64 -20.512 9.229 -0.448 0.30 0.00 H new ATOM 0 HD2 PRO A 64 -19.049 10.643 1.351 0.07 0.00 H new ATOM 0 HD3 PRO A 64 -19.815 9.130 1.790 0.07 0.00 H new ATOM 1007 N ASN A 65 -15.857 9.883 -0.388 0.09 0.00 N ATOM 1008 CA ASN A 65 -14.760 10.533 -1.101 1.00 0.00 C ATOM 1009 C ASN A 65 -13.609 10.852 -0.152 1.00 0.00 C ATOM 1010 O ASN A 65 -12.666 11.554 -0.520 0.68 0.00 O ATOM 1011 CB ASN A 65 -15.249 11.817 -1.775 0.24 0.00 C ATOM 1012 CG ASN A 65 -15.680 12.873 -0.776 0.43 0.00 C ATOM 1013 OD1 ASN A 65 -16.165 12.557 0.310 1.00 0.00 O ATOM 1014 ND2 ASN A 65 -15.505 14.137 -1.141 0.06 0.00 N ATOM 0 H ASN A 65 -16.259 10.439 0.367 0.09 0.00 H new ATOM 0 HA ASN A 65 -14.399 9.845 -1.865 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -14.454 12.219 -2.402 0.24 0.00 H new ATOM 0 HB3 ASN A 65 -16.086 11.582 -2.433 0.24 0.00 H new ATOM 0 HD21 ASN A 65 -15.777 14.892 -0.511 0.06 0.00 H new ATOM 0 HD22 ASN A 65 -15.099 14.353 -2.051 0.06 0.00 H new ATOM 1021 N LYS A 66 -13.690 10.329 1.068 0.13 0.00 N ATOM 1022 CA LYS A 66 -12.654 10.555 2.067 1.00 0.00 C ATOM 1023 C LYS A 66 -11.485 9.589 1.860 1.00 0.00 C ATOM 1024 O LYS A 66 -11.695 8.387 1.700 1.00 0.00 O ATOM 1025 CB LYS A 66 -13.233 10.381 3.474 0.76 0.00 C ATOM 1026 CG LYS A 66 -12.253 10.717 4.586 0.21 0.00 C ATOM 1027 CD LYS A 66 -12.018 12.216 4.691 1.00 0.00 C ATOM 1028 CE LYS A 66 -10.962 12.541 5.736 1.00 0.00 C ATOM 1029 NZ LYS A 66 -10.745 14.008 5.870 1.00 0.00 N ATOM 0 H LYS A 66 -14.463 9.746 1.387 0.13 0.00 H new ATOM 0 HA LYS A 66 -12.285 11.575 1.956 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -14.114 11.015 3.575 0.76 0.00 H new ATOM 0 HB3 LYS A 66 -13.566 9.350 3.595 0.76 0.00 H new ATOM 0 HG2 LYS A 66 -12.635 10.341 5.535 0.21 0.00 H new ATOM 0 HG3 LYS A 66 -11.305 10.212 4.401 0.21 0.00 H new ATOM 0 HD2 LYS A 66 -11.705 12.605 3.722 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -12.952 12.715 4.948 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -11.266 12.130 6.699 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -10.023 12.059 5.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -10.018 14.187 6.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -10.431 14.397 4.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -11.635 14.466 6.154 1.00 0.00 H new ATOM 1043 N PRO A 67 -10.236 10.100 1.858 1.00 0.00 N ATOM 1044 CA PRO A 67 -9.044 9.261 1.665 0.18 0.00 C ATOM 1045 C PRO A 67 -8.980 8.104 2.664 0.37 0.00 C ATOM 1046 O PRO A 67 -9.222 8.295 3.855 0.76 0.00 O ATOM 1047 CB PRO A 67 -7.882 10.233 1.897 0.15 0.00 C ATOM 1048 CG PRO A 67 -8.447 11.576 1.601 0.31 0.00 C ATOM 1049 CD PRO A 67 -9.882 11.521 2.041 0.38 0.00 C ATOM 0 HA PRO A 67 -9.033 8.790 0.682 0.18 0.00 H new ATOM 0 HB2 PRO A 67 -7.516 10.175 2.922 0.15 0.00 H new ATOM 0 HB3 PRO A 67 -7.039 10.005 1.244 0.15 0.00 H new ATOM 0 HG2 PRO A 67 -7.904 12.355 2.135 0.31 0.00 H new ATOM 0 HG3 PRO A 67 -8.372 11.806 0.538 0.31 0.00 H new ATOM 0 HD2 PRO A 67 -9.997 11.834 3.079 0.38 0.00 H new ATOM 0 HD3 PRO A 67 -10.513 12.174 1.439 0.38 0.00 H new ATOM 1057 N PRO A 68 -8.653 6.883 2.192 0.08 0.00 N ATOM 1058 CA PRO A 68 -8.566 5.704 3.056 0.09 0.00 C ATOM 1059 C PRO A 68 -7.259 5.649 3.838 0.06 0.00 C ATOM 1060 O PRO A 68 -6.416 6.538 3.722 0.19 0.00 O ATOM 1061 CB PRO A 68 -8.640 4.547 2.063 0.71 0.00 C ATOM 1062 CG PRO A 68 -8.019 5.081 0.819 0.13 0.00 C ATOM 1063 CD PRO A 68 -8.341 6.554 0.784 0.07 0.00 C ATOM 0 HA PRO A 68 -9.348 5.692 3.815 0.09 0.00 H new ATOM 0 HB2 PRO A 68 -8.102 3.673 2.431 0.71 0.00 H new ATOM 0 HB3 PRO A 68 -9.671 4.238 1.891 0.71 0.00 H new ATOM 0 HG2 PRO A 68 -6.941 4.919 0.822 0.13 0.00 H new ATOM 0 HG3 PRO A 68 -8.415 4.575 -0.062 0.13 0.00 H new ATOM 0 HD2 PRO A 68 -7.499 7.139 0.414 0.07 0.00 H new ATOM 0 HD3 PRO A 68 -9.186 6.763 0.128 0.07 0.00 H new ATOM 1071 N THR A 69 -7.101 4.598 4.637 1.00 0.00 N ATOM 1072 CA THR A 69 -5.899 4.415 5.440 0.30 0.00 C ATOM 1073 C THR A 69 -5.332 3.010 5.252 0.09 0.00 C ATOM 1074 O THR A 69 -5.962 2.024 5.630 0.73 0.00 O ATOM 1075 CB THR A 69 -6.184 4.651 6.936 0.08 0.00 C ATOM 1076 OG1 THR A 69 -6.682 5.979 7.137 1.00 0.00 O ATOM 1077 CG2 THR A 69 -4.930 4.446 7.772 1.00 0.00 C ATOM 0 H THR A 69 -7.794 3.858 4.745 1.00 0.00 H new ATOM 0 HA THR A 69 -5.168 5.149 5.101 0.30 0.00 H new ATOM 0 HB THR A 69 -6.934 3.927 7.254 0.08 0.00 H new ATOM 0 HG1 THR A 69 -6.862 6.120 8.090 1.00 0.00 H new ATOM 0 HG21 THR A 69 -5.161 4.619 8.823 1.00 0.00 H new ATOM 0 HG22 THR A 69 -4.570 3.425 7.643 1.00 0.00 H new ATOM 0 HG23 THR A 69 -4.159 5.146 7.450 1.00 0.00 H new ATOM 1085 N VAL A 70 -4.141 2.927 4.665 0.79 0.00 N ATOM 1086 CA VAL A 70 -3.496 1.640 4.421 0.30 0.00 C ATOM 1087 C VAL A 70 -2.079 1.614 4.986 1.00 0.00 C ATOM 1088 O VAL A 70 -1.373 2.623 4.969 0.35 0.00 O ATOM 1089 CB VAL A 70 -3.449 1.318 2.913 0.30 0.00 C ATOM 1090 CG1 VAL A 70 -2.682 2.392 2.158 0.17 0.00 C ATOM 1091 CG2 VAL A 70 -2.833 -0.053 2.675 1.00 0.00 C ATOM 0 H VAL A 70 -3.604 3.735 4.350 0.79 0.00 H new ATOM 0 HA VAL A 70 -4.093 0.883 4.929 0.30 0.00 H new ATOM 0 HB VAL A 70 -4.471 1.302 2.535 0.30 0.00 H new ATOM 0 HG11 VAL A 70 -2.661 2.146 1.096 0.17 0.00 H new ATOM 0 HG12 VAL A 70 -3.173 3.355 2.297 0.17 0.00 H new ATOM 0 HG13 VAL A 70 -1.662 2.446 2.538 0.17 0.00 H new ATOM 0 HG21 VAL A 70 -2.809 -0.261 1.605 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -1.817 -0.069 3.070 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -3.431 -0.813 3.179 1.00 0.00 H new ATOM 1101 N ARG A 71 -1.671 0.452 5.490 1.00 0.00 N ATOM 1102 CA ARG A 71 -0.337 0.285 6.060 0.63 0.00 C ATOM 1103 C ARG A 71 0.085 -1.182 6.036 0.51 0.00 C ATOM 1104 O ARG A 71 -0.753 -2.080 6.119 1.00 0.00 O ATOM 1105 CB ARG A 71 -0.299 0.814 7.495 0.13 0.00 C ATOM 1106 CG ARG A 71 -1.266 0.110 8.432 0.16 0.00 C ATOM 1107 CD ARG A 71 -1.155 0.647 9.850 0.06 0.00 C ATOM 1108 NE ARG A 71 -2.060 -0.040 10.769 0.38 0.00 N ATOM 1109 CZ ARG A 71 -1.953 0.021 12.093 1.00 0.00 C ATOM 1110 NH1 ARG A 71 -0.984 0.735 12.651 0.62 0.00 N ATOM 1111 NH2 ARG A 71 -2.813 -0.633 12.861 0.16 0.00 N ATOM 0 H ARG A 71 -2.247 -0.390 5.515 1.00 0.00 H new ATOM 0 HA ARG A 71 0.363 0.858 5.452 0.63 0.00 H new ATOM 0 HB2 ARG A 71 0.713 0.708 7.885 0.13 0.00 H new ATOM 0 HB3 ARG A 71 -0.527 1.880 7.486 0.13 0.00 H new ATOM 0 HG2 ARG A 71 -2.286 0.241 8.070 0.16 0.00 H new ATOM 0 HG3 ARG A 71 -1.062 -0.961 8.430 0.16 0.00 H new ATOM 0 HD2 ARG A 71 -0.129 0.535 10.201 0.06 0.00 H new ATOM 0 HD3 ARG A 71 -1.378 1.714 9.852 0.06 0.00 H new ATOM 0 HE ARG A 71 -2.816 -0.598 10.372 0.38 0.00 H new ATOM 0 HH11 ARG A 71 -0.319 1.239 12.064 0.62 0.00 H new ATOM 0 HH12 ARG A 71 -0.904 0.780 13.667 0.62 0.00 H new ATOM 0 HH21 ARG A 71 -3.559 -1.184 12.437 0.16 0.00 H new ATOM 0 HH22 ARG A 71 -2.729 -0.585 13.876 0.16 0.00 H new ATOM 1125 N PHE A 72 1.389 -1.417 5.923 1.00 0.00 N ATOM 1126 CA PHE A 72 1.922 -2.775 5.889 0.07 0.00 C ATOM 1127 C PHE A 72 1.812 -3.443 7.256 1.00 0.00 C ATOM 1128 O PHE A 72 1.960 -2.792 8.290 0.18 0.00 O ATOM 1129 CB PHE A 72 3.383 -2.765 5.436 0.42 0.00 C ATOM 1130 CG PHE A 72 3.566 -2.445 3.980 0.10 0.00 C ATOM 1131 CD1 PHE A 72 3.454 -1.142 3.523 1.00 0.00 C ATOM 1132 CD2 PHE A 72 3.853 -3.448 3.069 0.14 0.00 C ATOM 1133 CE1 PHE A 72 3.624 -0.847 2.182 0.35 0.00 C ATOM 1134 CE2 PHE A 72 4.024 -3.159 1.728 0.45 0.00 C ATOM 1135 CZ PHE A 72 3.910 -1.857 1.284 1.00 0.00 C ATOM 0 H PHE A 72 2.096 -0.685 5.853 1.00 0.00 H new ATOM 0 HA PHE A 72 1.329 -3.347 5.175 0.07 0.00 H new ATOM 0 HB2 PHE A 72 3.933 -2.035 6.030 0.42 0.00 H new ATOM 0 HB3 PHE A 72 3.824 -3.740 5.642 0.42 0.00 H new ATOM 0 HD1 PHE A 72 3.232 -0.348 4.221 1.00 0.00 H new ATOM 0 HD2 PHE A 72 3.944 -4.469 3.411 0.14 0.00 H new ATOM 0 HE1 PHE A 72 3.533 0.173 1.837 0.35 0.00 H new ATOM 0 HE2 PHE A 72 4.247 -3.951 1.028 0.45 0.00 H new ATOM 0 HZ PHE A 72 4.044 -1.628 0.237 1.00 0.00 H new ATOM 1145 N LEU A 73 1.553 -4.748 7.252 0.58 0.00 N ATOM 1146 CA LEU A 73 1.429 -5.509 8.488 0.10 0.00 C ATOM 1147 C LEU A 73 2.804 -5.898 9.021 0.21 0.00 C ATOM 1148 O LEU A 73 3.038 -5.893 10.230 1.00 0.00 O ATOM 1149 CB LEU A 73 0.585 -6.764 8.259 0.43 0.00 C ATOM 1150 CG LEU A 73 -0.906 -6.511 8.021 0.09 0.00 C ATOM 1151 CD1 LEU A 73 -1.596 -7.787 7.567 1.00 0.00 C ATOM 1152 CD2 LEU A 73 -1.561 -5.969 9.283 0.10 0.00 C ATOM 0 H LEU A 73 1.425 -5.300 6.404 0.58 0.00 H new ATOM 0 HA LEU A 73 0.934 -4.879 9.227 0.10 0.00 H new ATOM 0 HB2 LEU A 73 0.988 -7.302 7.401 0.43 0.00 H new ATOM 0 HB3 LEU A 73 0.693 -7.418 9.124 0.43 0.00 H new ATOM 0 HG LEU A 73 -1.009 -5.766 7.232 0.09 0.00 H new ATOM 0 HD11 LEU A 73 -2.655 -7.589 7.402 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -1.143 -8.135 6.638 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -1.485 -8.553 8.334 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -2.621 -5.795 9.097 0.10 0.00 H new ATOM 0 HD22 LEU A 73 -1.449 -6.692 10.091 0.10 0.00 H new ATOM 0 HD23 LEU A 73 -1.083 -5.031 9.567 0.10 0.00 H new ATOM 1164 N SER A 74 3.710 -6.236 8.108 0.47 0.00 N ATOM 1165 CA SER A 74 5.064 -6.631 8.482 0.11 0.00 C ATOM 1166 C SER A 74 6.016 -5.441 8.423 0.07 0.00 C ATOM 1167 O SER A 74 5.625 -4.336 8.048 0.61 0.00 O ATOM 1168 CB SER A 74 5.567 -7.744 7.559 0.33 0.00 C ATOM 1169 OG SER A 74 4.740 -8.891 7.647 0.11 0.00 O ATOM 0 H SER A 74 3.531 -6.244 7.104 0.47 0.00 H new ATOM 0 HA SER A 74 5.036 -7.001 9.507 0.11 0.00 H new ATOM 0 HB2 SER A 74 5.589 -7.385 6.530 0.33 0.00 H new ATOM 0 HB3 SER A 74 6.590 -8.008 7.826 0.33 0.00 H new ATOM 0 HG SER A 74 5.081 -9.587 7.047 0.11 0.00 H new ATOM 1175 N LYS A 75 7.271 -5.678 8.796 1.00 0.00 N ATOM 1176 CA LYS A 75 8.286 -4.632 8.788 1.00 0.00 C ATOM 1177 C LYS A 75 8.696 -4.281 7.362 1.00 0.00 C ATOM 1178 O LYS A 75 8.910 -5.165 6.531 0.43 0.00 O ATOM 1179 CB LYS A 75 9.513 -5.080 9.586 0.08 0.00 C ATOM 1180 CG LYS A 75 9.225 -5.372 11.052 1.00 0.00 C ATOM 1181 CD LYS A 75 9.057 -4.093 11.861 1.00 0.00 C ATOM 1182 CE LYS A 75 7.603 -3.648 11.920 1.00 0.00 C ATOM 1183 NZ LYS A 75 7.441 -2.397 12.710 1.00 0.00 N ATOM 0 H LYS A 75 7.609 -6.588 9.108 1.00 0.00 H new ATOM 0 HA LYS A 75 7.860 -3.743 9.253 1.00 0.00 H new ATOM 0 HB2 LYS A 75 9.928 -5.975 9.123 0.08 0.00 H new ATOM 0 HB3 LYS A 75 10.277 -4.305 9.524 0.08 0.00 H new ATOM 0 HG2 LYS A 75 8.320 -5.974 11.132 1.00 0.00 H new ATOM 0 HG3 LYS A 75 10.039 -5.963 11.472 1.00 0.00 H new ATOM 0 HD2 LYS A 75 9.430 -4.251 12.873 1.00 0.00 H new ATOM 0 HD3 LYS A 75 9.662 -3.301 11.419 1.00 0.00 H new ATOM 0 HE2 LYS A 75 7.230 -3.490 10.908 1.00 0.00 H new ATOM 0 HE3 LYS A 75 6.998 -4.439 12.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 6.437 -2.125 12.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 7.774 -2.555 13.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 7.998 -1.636 12.273 1.00 0.00 H new ATOM 1197 N MET A 76 8.805 -2.985 7.083 0.42 0.00 N ATOM 1198 CA MET A 76 9.192 -2.515 5.759 1.00 0.00 C ATOM 1199 C MET A 76 9.985 -1.216 5.849 0.16 0.00 C ATOM 1200 O MET A 76 9.932 -0.513 6.859 1.00 0.00 O ATOM 1201 CB MET A 76 7.955 -2.323 4.877 0.30 0.00 C ATOM 1202 CG MET A 76 6.820 -1.574 5.562 1.00 0.00 C ATOM 1203 SD MET A 76 7.160 0.185 5.763 0.18 0.00 S ATOM 1204 CE MET A 76 5.677 0.724 6.611 0.16 0.00 C ATOM 0 H MET A 76 8.630 -2.241 7.759 0.42 0.00 H new ATOM 0 HA MET A 76 9.832 -3.272 5.306 1.00 0.00 H new ATOM 0 HB2 MET A 76 8.243 -1.781 3.976 0.30 0.00 H new ATOM 0 HB3 MET A 76 7.592 -3.300 4.559 0.30 0.00 H new ATOM 0 HG2 MET A 76 5.907 -1.698 4.980 1.00 0.00 H new ATOM 0 HG3 MET A 76 6.637 -2.018 6.541 1.00 0.00 H new ATOM 0 HE1 MET A 76 5.465 1.761 6.350 0.16 0.00 H new ATOM 0 HE2 MET A 76 4.838 0.096 6.312 0.16 0.00 H new ATOM 0 HE3 MET A 76 5.824 0.644 7.688 0.16 0.00 H new ATOM 1214 N PHE A 77 10.720 -0.902 4.786 0.36 0.00 N ATOM 1215 CA PHE A 77 11.527 0.311 4.746 0.10 0.00 C ATOM 1216 C PHE A 77 11.434 0.982 3.378 1.00 0.00 C ATOM 1217 O PHE A 77 11.857 0.418 2.370 0.07 0.00 O ATOM 1218 CB PHE A 77 12.986 -0.013 5.072 0.05 0.00 C ATOM 1219 CG PHE A 77 13.850 1.202 5.258 0.11 0.00 C ATOM 1220 CD1 PHE A 77 13.693 2.015 6.368 0.06 0.00 C ATOM 1221 CD2 PHE A 77 14.821 1.529 4.324 0.29 0.00 C ATOM 1222 CE1 PHE A 77 14.486 3.132 6.544 1.00 0.00 C ATOM 1223 CE2 PHE A 77 15.617 2.646 4.494 0.51 0.00 C ATOM 1224 CZ PHE A 77 15.451 3.447 5.606 0.06 0.00 C ATOM 0 H PHE A 77 10.773 -1.471 3.941 0.36 0.00 H new ATOM 0 HA PHE A 77 11.140 1.002 5.495 0.10 0.00 H new ATOM 0 HB2 PHE A 77 13.021 -0.614 5.980 0.05 0.00 H new ATOM 0 HB3 PHE A 77 13.401 -0.623 4.270 0.05 0.00 H new ATOM 0 HD1 PHE A 77 12.941 1.773 7.105 0.06 0.00 H new ATOM 0 HD2 PHE A 77 14.957 0.904 3.454 0.29 0.00 H new ATOM 0 HE1 PHE A 77 14.352 3.759 7.413 1.00 0.00 H new ATOM 0 HE2 PHE A 77 16.368 2.892 3.758 0.51 0.00 H new ATOM 0 HZ PHE A 77 16.074 4.318 5.743 0.06 0.00 H new ATOM 1234 N HIS A 78 10.877 2.190 3.354 0.17 0.00 N ATOM 1235 CA HIS A 78 10.728 2.939 2.111 0.71 0.00 C ATOM 1236 C HIS A 78 11.263 4.363 2.266 1.00 0.00 C ATOM 1237 O HIS A 78 11.357 4.877 3.382 0.26 0.00 O ATOM 1238 CB HIS A 78 9.258 2.974 1.687 0.45 0.00 C ATOM 1239 CG HIS A 78 8.706 1.628 1.334 0.16 0.00 C ATOM 1240 ND1 HIS A 78 7.771 0.957 2.090 0.34 0.00 N ATOM 1241 CD2 HIS A 78 8.975 0.825 0.273 0.10 0.00 C ATOM 1242 CE1 HIS A 78 7.507 -0.207 1.481 0.45 0.00 C ATOM 1243 NE2 HIS A 78 8.212 -0.335 0.372 0.14 0.00 N ATOM 0 H HIS A 78 10.522 2.670 4.181 0.17 0.00 H new ATOM 0 HA HIS A 78 11.309 2.435 1.338 0.71 0.00 H new ATOM 0 HB2 HIS A 78 8.665 3.400 2.496 0.45 0.00 H new ATOM 0 HB3 HIS A 78 9.151 3.638 0.829 0.45 0.00 H new ATOM 0 HD2 HIS A 78 9.671 1.050 -0.522 0.10 0.00 H new ATOM 0 HE1 HIS A 78 6.809 -0.944 1.849 0.45 0.00 H new ATOM 0 HE2 HIS A 78 8.200 -1.121 -0.278 0.14 0.00 H new ATOM 1251 N PRO A 79 11.622 5.021 1.145 0.13 0.00 N ATOM 1252 CA PRO A 79 12.150 6.389 1.169 0.08 0.00 C ATOM 1253 C PRO A 79 11.163 7.379 1.777 0.55 0.00 C ATOM 1254 O PRO A 79 11.558 8.422 2.300 0.11 0.00 O ATOM 1255 CB PRO A 79 12.396 6.715 -0.309 0.59 0.00 C ATOM 1256 CG PRO A 79 11.571 5.733 -1.067 0.21 0.00 C ATOM 1257 CD PRO A 79 11.543 4.491 -0.226 1.00 0.00 C ATOM 0 HA PRO A 79 13.047 6.464 1.784 0.08 0.00 H new ATOM 0 HB2 PRO A 79 12.102 7.739 -0.541 0.59 0.00 H new ATOM 0 HB3 PRO A 79 13.452 6.621 -0.563 0.59 0.00 H new ATOM 0 HG2 PRO A 79 10.564 6.115 -1.235 0.21 0.00 H new ATOM 0 HG3 PRO A 79 12.003 5.532 -2.047 0.21 0.00 H new ATOM 0 HD2 PRO A 79 10.631 3.916 -0.385 1.00 0.00 H new ATOM 0 HD3 PRO A 79 12.380 3.830 -0.453 1.00 0.00 H new ATOM 1265 N ASN A 80 9.876 7.046 1.707 1.00 0.00 N ATOM 1266 CA ASN A 80 8.832 7.904 2.251 0.19 0.00 C ATOM 1267 C ASN A 80 7.817 7.083 3.040 0.18 0.00 C ATOM 1268 O ASN A 80 7.167 6.190 2.495 0.10 0.00 O ATOM 1269 CB ASN A 80 8.124 8.660 1.123 0.89 0.00 C ATOM 1270 CG ASN A 80 9.080 9.484 0.281 0.37 0.00 C ATOM 1271 OD1 ASN A 80 10.101 9.968 0.772 0.06 0.00 O ATOM 1272 ND2 ASN A 80 8.753 9.649 -0.995 0.05 0.00 N ATOM 0 H ASN A 80 9.533 6.186 1.278 1.00 0.00 H new ATOM 0 HA ASN A 80 9.299 8.623 2.924 0.19 0.00 H new ATOM 0 HB2 ASN A 80 7.605 7.947 0.483 0.89 0.00 H new ATOM 0 HB3 ASN A 80 7.365 9.315 1.551 0.89 0.00 H new ATOM 0 HD21 ASN A 80 9.357 10.194 -1.610 0.05 0.00 H new ATOM 0 HD22 ASN A 80 7.898 9.230 -1.361 0.05 0.00 H new ATOM 1279 N VAL A 81 7.687 7.392 4.326 0.14 0.00 N ATOM 1280 CA VAL A 81 6.748 6.686 5.192 0.55 0.00 C ATOM 1281 C VAL A 81 6.297 7.573 6.350 0.06 0.00 C ATOM 1282 O VAL A 81 7.054 8.416 6.831 1.00 0.00 O ATOM 1283 CB VAL A 81 7.365 5.390 5.754 0.83 0.00 C ATOM 1284 CG1 VAL A 81 8.526 5.700 6.685 0.06 0.00 C ATOM 1285 CG2 VAL A 81 6.305 4.561 6.467 0.19 0.00 C ATOM 0 H VAL A 81 8.220 8.126 4.792 0.14 0.00 H new ATOM 0 HA VAL A 81 5.884 6.427 4.580 0.55 0.00 H new ATOM 0 HB VAL A 81 7.753 4.807 4.919 0.83 0.00 H new ATOM 0 HG11 VAL A 81 8.944 4.769 7.068 0.06 0.00 H new ATOM 0 HG12 VAL A 81 9.295 6.245 6.138 0.06 0.00 H new ATOM 0 HG13 VAL A 81 8.172 6.309 7.517 0.06 0.00 H new ATOM 0 HG21 VAL A 81 6.758 3.650 6.858 0.19 0.00 H new ATOM 0 HG22 VAL A 81 5.884 5.139 7.290 0.19 0.00 H new ATOM 0 HG23 VAL A 81 5.513 4.301 5.764 0.19 0.00 H new ATOM 1295 N TYR A 82 5.057 7.378 6.792 0.23 0.00 N ATOM 1296 CA TYR A 82 4.504 8.163 7.892 0.93 0.00 C ATOM 1297 C TYR A 82 4.808 7.517 9.240 1.00 0.00 C ATOM 1298 O TYR A 82 5.568 6.552 9.322 0.39 0.00 O ATOM 1299 CB TYR A 82 2.994 8.330 7.717 0.18 0.00 C ATOM 1300 CG TYR A 82 2.617 9.201 6.538 0.70 0.00 C ATOM 1301 CD1 TYR A 82 2.553 8.675 5.254 0.22 0.00 C ATOM 1302 CD2 TYR A 82 2.327 10.548 6.710 1.00 0.00 C ATOM 1303 CE1 TYR A 82 2.211 9.468 4.174 0.06 0.00 C ATOM 1304 CE2 TYR A 82 1.986 11.348 5.636 0.09 0.00 C ATOM 1305 CZ TYR A 82 1.928 10.802 4.371 0.08 0.00 C ATOM 1306 OH TYR A 82 1.589 11.595 3.299 0.10 0.00 O ATOM 0 H TYR A 82 4.417 6.684 6.406 0.23 0.00 H new ATOM 0 HA TYR A 82 4.976 9.145 7.874 0.93 0.00 H new ATOM 0 HB2 TYR A 82 2.539 7.347 7.593 0.18 0.00 H new ATOM 0 HB3 TYR A 82 2.576 8.762 8.626 0.18 0.00 H new ATOM 0 HD1 TYR A 82 2.774 7.630 5.097 0.22 0.00 H new ATOM 0 HD2 TYR A 82 2.369 10.978 7.700 1.00 0.00 H new ATOM 0 HE1 TYR A 82 2.166 9.044 3.182 0.06 0.00 H new ATOM 0 HE2 TYR A 82 1.766 12.395 5.786 0.09 0.00 H new ATOM 0 HH TYR A 82 1.419 12.509 3.609 0.10 0.00 H new ATOM 1316 N ALA A 83 4.207 8.060 10.296 0.19 0.00 N ATOM 1317 CA ALA A 83 4.413 7.548 11.646 0.08 0.00 C ATOM 1318 C ALA A 83 3.707 6.212 11.851 0.57 0.00 C ATOM 1319 O ALA A 83 4.269 5.286 12.435 0.63 0.00 O ATOM 1320 CB ALA A 83 3.930 8.563 12.671 0.57 0.00 C ATOM 0 H ALA A 83 3.572 8.856 10.241 0.19 0.00 H new ATOM 0 HA ALA A 83 5.482 7.383 11.782 0.08 0.00 H new ATOM 0 HB1 ALA A 83 4.089 8.170 13.675 0.57 0.00 H new ATOM 0 HB2 ALA A 83 4.487 9.493 12.553 0.57 0.00 H new ATOM 0 HB3 ALA A 83 2.868 8.755 12.520 0.57 0.00 H new ATOM 1326 N ASP A 84 2.472 6.118 11.368 0.58 0.00 N ATOM 1327 CA ASP A 84 1.687 4.896 11.507 1.00 0.00 C ATOM 1328 C ASP A 84 2.053 3.880 10.429 0.21 0.00 C ATOM 1329 O ASP A 84 1.362 2.877 10.248 0.76 0.00 O ATOM 1330 CB ASP A 84 0.194 5.217 11.436 1.00 0.00 C ATOM 1331 CG ASP A 84 -0.219 5.765 10.084 0.77 0.00 C ATOM 1332 OD1 ASP A 84 -0.118 6.994 9.885 0.10 0.00 O ATOM 1333 OD2 ASP A 84 -0.641 4.965 9.225 1.00 0.00 O ATOM 0 H ASP A 84 1.993 6.873 10.877 0.58 0.00 H new ATOM 0 HA ASP A 84 1.915 4.459 12.479 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -0.379 4.314 11.649 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -0.055 5.943 12.210 1.00 0.00 H new ATOM 1338 N GLY A 85 3.144 4.144 9.716 0.18 0.00 N ATOM 1339 CA GLY A 85 3.582 3.243 8.666 1.00 0.00 C ATOM 1340 C GLY A 85 2.762 3.389 7.400 0.69 0.00 C ATOM 1341 O GLY A 85 2.792 2.520 6.527 1.00 0.00 O ATOM 0 H GLY A 85 3.733 4.967 9.847 0.18 0.00 H new ATOM 0 HA2 GLY A 85 4.631 3.435 8.440 1.00 0.00 H new ATOM 0 HA3 GLY A 85 3.516 2.215 9.022 1.00 0.00 H new ATOM 1345 N SER A 86 2.023 4.490 7.301 0.13 0.00 N ATOM 1346 CA SER A 86 1.192 4.749 6.131 1.00 0.00 C ATOM 1347 C SER A 86 2.052 4.947 4.888 1.00 0.00 C ATOM 1348 O SER A 86 3.206 5.370 4.982 0.10 0.00 O ATOM 1349 CB SER A 86 0.319 5.983 6.361 0.69 0.00 C ATOM 1350 OG SER A 86 -0.488 6.256 5.230 1.00 0.00 O ATOM 0 H SER A 86 1.983 5.216 8.016 0.13 0.00 H new ATOM 0 HA SER A 86 0.550 3.883 5.974 1.00 0.00 H new ATOM 0 HB2 SER A 86 -0.315 5.826 7.234 0.69 0.00 H new ATOM 0 HB3 SER A 86 0.951 6.844 6.577 0.69 0.00 H new ATOM 0 HG SER A 86 -1.038 7.049 5.404 1.00 0.00 H new ATOM 1356 N ILE A 87 1.486 4.641 3.726 1.00 0.00 N ATOM 1357 CA ILE A 87 2.202 4.785 2.465 0.84 0.00 C ATOM 1358 C ILE A 87 1.940 6.151 1.840 0.62 0.00 C ATOM 1359 O ILE A 87 0.813 6.648 1.860 1.00 0.00 O ATOM 1360 CB ILE A 87 1.804 3.686 1.455 1.00 0.00 C ATOM 1361 CG1 ILE A 87 2.038 2.295 2.049 0.19 0.00 C ATOM 1362 CG2 ILE A 87 2.586 3.847 0.161 1.00 0.00 C ATOM 1363 CD1 ILE A 87 0.904 1.807 2.924 0.26 0.00 C ATOM 0 H ILE A 87 0.532 4.291 3.632 1.00 0.00 H new ATOM 0 HA ILE A 87 3.263 4.686 2.694 0.84 0.00 H new ATOM 0 HB ILE A 87 0.741 3.791 1.236 1.00 0.00 H new ATOM 0 HG12 ILE A 87 2.190 1.584 1.237 0.19 0.00 H new ATOM 0 HG13 ILE A 87 2.957 2.310 2.635 0.19 0.00 H new ATOM 0 HG21 ILE A 87 2.294 3.065 -0.540 1.00 0.00 H new ATOM 0 HG22 ILE A 87 2.372 4.823 -0.274 1.00 0.00 H new ATOM 0 HG23 ILE A 87 3.653 3.768 0.369 1.00 0.00 H new ATOM 0 HD11 ILE A 87 1.142 0.815 3.308 0.26 0.00 H new ATOM 0 HD12 ILE A 87 0.765 2.496 3.757 0.26 0.00 H new ATOM 0 HD13 ILE A 87 -0.013 1.758 2.337 0.26 0.00 H new ATOM 1375 N CYS A 88 2.987 6.753 1.285 0.12 0.00 N ATOM 1376 CA CYS A 88 2.870 8.061 0.652 0.06 0.00 C ATOM 1377 C CYS A 88 2.555 7.917 -0.833 0.16 0.00 C ATOM 1378 O CYS A 88 3.347 7.360 -1.594 0.16 0.00 O ATOM 1379 CB CYS A 88 4.161 8.860 0.837 0.58 0.00 C ATOM 1380 SG CYS A 88 4.121 10.507 0.090 0.45 0.00 S ATOM 0 H CYS A 88 3.926 6.355 1.261 0.12 0.00 H new ATOM 0 HA CYS A 88 2.050 8.597 1.130 0.06 0.00 H new ATOM 0 HB2 CYS A 88 4.364 8.961 1.903 0.58 0.00 H new ATOM 0 HB3 CYS A 88 4.989 8.297 0.407 0.58 0.00 H new ATOM 0 HG CYS A 88 5.255 11.107 0.300 0.45 0.00 H new ATOM 1386 N LEU A 89 1.396 8.425 -1.238 0.40 0.00 N ATOM 1387 CA LEU A 89 0.974 8.355 -2.633 0.09 0.00 C ATOM 1388 C LEU A 89 0.181 9.600 -3.016 0.06 0.00 C ATOM 1389 O LEU A 89 -0.635 10.092 -2.237 0.60 0.00 O ATOM 1390 CB LEU A 89 0.130 7.098 -2.869 1.00 0.00 C ATOM 1391 CG LEU A 89 0.408 6.353 -4.180 0.52 0.00 C ATOM 1392 CD1 LEU A 89 0.133 7.245 -5.381 0.24 0.00 C ATOM 1393 CD2 LEU A 89 1.843 5.843 -4.212 0.08 0.00 C ATOM 0 H LEU A 89 0.731 8.890 -0.620 0.40 0.00 H new ATOM 0 HA LEU A 89 1.864 8.305 -3.260 0.09 0.00 H new ATOM 0 HB2 LEU A 89 0.294 6.411 -2.039 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -0.923 7.379 -2.847 1.00 0.00 H new ATOM 0 HG LEU A 89 -0.265 5.497 -4.232 0.52 0.00 H new ATOM 0 HD11 LEU A 89 0.338 6.693 -6.298 0.24 0.00 H new ATOM 0 HD12 LEU A 89 -0.911 7.557 -5.371 0.24 0.00 H new ATOM 0 HD13 LEU A 89 0.775 8.125 -5.336 0.24 0.00 H new ATOM 0 HD21 LEU A 89 2.021 5.317 -5.150 0.08 0.00 H new ATOM 0 HD22 LEU A 89 2.530 6.685 -4.132 0.08 0.00 H new ATOM 0 HD23 LEU A 89 2.006 5.161 -3.377 0.08 0.00 H new ATOM 1405 N ASP A 90 0.427 10.105 -4.221 0.37 0.00 N ATOM 1406 CA ASP A 90 -0.261 11.296 -4.709 0.15 0.00 C ATOM 1407 C ASP A 90 -1.767 11.067 -4.797 1.00 0.00 C ATOM 1408 O ASP A 90 -2.551 12.013 -4.719 1.00 0.00 O ATOM 1409 CB ASP A 90 0.286 11.701 -6.078 1.00 0.00 C ATOM 1410 CG ASP A 90 1.760 12.051 -6.031 0.44 0.00 C ATOM 1411 OD1 ASP A 90 2.592 11.124 -6.132 1.00 0.00 O ATOM 1412 OD2 ASP A 90 2.083 13.250 -5.895 1.00 0.00 O ATOM 0 H ASP A 90 1.098 9.708 -4.878 0.37 0.00 H new ATOM 0 HA ASP A 90 -0.080 12.102 -3.998 0.15 0.00 H new ATOM 0 HB2 ASP A 90 0.132 10.885 -6.784 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -0.276 12.557 -6.452 1.00 0.00 H new ATOM 1417 N ILE A 91 -2.166 9.809 -4.959 0.29 0.00 N ATOM 1418 CA ILE A 91 -3.582 9.466 -5.058 0.83 0.00 C ATOM 1419 C ILE A 91 -4.285 9.669 -3.720 1.00 0.00 C ATOM 1420 O ILE A 91 -5.506 9.821 -3.664 0.09 0.00 O ATOM 1421 CB ILE A 91 -3.783 8.009 -5.521 1.00 0.00 C ATOM 1422 CG1 ILE A 91 -5.248 7.767 -5.896 0.75 0.00 C ATOM 1423 CG2 ILE A 91 -3.342 7.038 -4.434 0.22 0.00 C ATOM 1424 CD1 ILE A 91 -5.497 6.426 -6.553 1.00 0.00 C ATOM 0 H ILE A 91 -1.532 9.013 -5.024 0.29 0.00 H new ATOM 0 HA ILE A 91 -4.019 10.132 -5.802 0.83 0.00 H new ATOM 0 HB ILE A 91 -3.167 7.838 -6.404 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -5.860 7.840 -4.997 0.75 0.00 H new ATOM 0 HG13 ILE A 91 -5.576 8.558 -6.570 0.75 0.00 H new ATOM 0 HG21 ILE A 91 -3.491 6.015 -4.778 0.22 0.00 H new ATOM 0 HG22 ILE A 91 -2.287 7.196 -4.211 0.22 0.00 H new ATOM 0 HG23 ILE A 91 -3.932 7.208 -3.533 0.22 0.00 H new ATOM 0 HD11 ILE A 91 -6.557 6.328 -6.789 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -4.913 6.356 -7.471 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -5.201 5.627 -5.873 1.00 0.00 H new ATOM 1436 N LEU A 92 -3.503 9.670 -2.645 0.54 0.00 N ATOM 1437 CA LEU A 92 -4.046 9.856 -1.304 0.49 0.00 C ATOM 1438 C LEU A 92 -4.335 11.330 -1.040 0.09 0.00 C ATOM 1439 O LEU A 92 -5.088 11.673 -0.129 1.00 0.00 O ATOM 1440 CB LEU A 92 -3.068 9.313 -0.257 0.05 0.00 C ATOM 1441 CG LEU A 92 -3.581 9.326 1.186 0.08 0.00 C ATOM 1442 CD1 LEU A 92 -4.792 8.418 1.334 0.42 0.00 C ATOM 1443 CD2 LEU A 92 -2.477 8.905 2.144 0.44 0.00 C ATOM 0 H LEU A 92 -2.491 9.544 -2.676 0.54 0.00 H new ATOM 0 HA LEU A 92 -4.983 9.303 -1.232 0.49 0.00 H new ATOM 0 HB2 LEU A 92 -2.808 8.289 -0.524 0.05 0.00 H new ATOM 0 HB3 LEU A 92 -2.149 9.898 -0.304 0.05 0.00 H new ATOM 0 HG LEU A 92 -3.886 10.343 1.434 0.08 0.00 H new ATOM 0 HD11 LEU A 92 -5.141 8.442 2.366 0.42 0.00 H new ATOM 0 HD12 LEU A 92 -5.588 8.763 0.674 0.42 0.00 H new ATOM 0 HD13 LEU A 92 -4.516 7.398 1.068 0.42 0.00 H new ATOM 0 HD21 LEU A 92 -2.857 8.919 3.166 0.44 0.00 H new ATOM 0 HD22 LEU A 92 -2.144 7.898 1.895 0.44 0.00 H new ATOM 0 HD23 LEU A 92 -1.638 9.596 2.059 0.44 0.00 H new ATOM 1455 N GLN A 93 -3.731 12.196 -1.848 0.07 0.00 N ATOM 1456 CA GLN A 93 -3.920 13.636 -1.710 0.36 0.00 C ATOM 1457 C GLN A 93 -5.329 14.040 -2.131 0.07 0.00 C ATOM 1458 O GLN A 93 -6.224 13.200 -2.230 0.11 0.00 O ATOM 1459 CB GLN A 93 -2.891 14.387 -2.555 1.00 0.00 C ATOM 1460 CG GLN A 93 -1.451 14.049 -2.207 1.00 0.00 C ATOM 1461 CD GLN A 93 -0.452 14.808 -3.059 1.00 0.00 C ATOM 1462 OE1 GLN A 93 -0.707 15.938 -3.478 0.17 0.00 O ATOM 1463 NE2 GLN A 93 0.691 14.188 -3.324 1.00 0.00 N ATOM 0 H GLN A 93 -3.105 11.925 -2.607 0.07 0.00 H new ATOM 0 HA GLN A 93 -3.782 13.898 -0.661 0.36 0.00 H new ATOM 0 HB2 GLN A 93 -3.064 14.161 -3.607 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -3.044 15.459 -2.430 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -1.272 14.275 -1.156 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -1.292 12.978 -2.334 1.00 0.00 H new ATOM 0 HE21 GLN A 93 0.861 13.252 -2.956 1.00 0.00 H new ATOM 0 HE22 GLN A 93 1.400 14.648 -3.895 1.00 0.00 H new ATOM 1472 N ASN A 94 -5.519 15.333 -2.377 0.07 0.00 N ATOM 1473 CA ASN A 94 -6.817 15.854 -2.788 0.25 0.00 C ATOM 1474 C ASN A 94 -7.183 15.372 -4.189 0.59 0.00 C ATOM 1475 O ASN A 94 -8.279 15.645 -4.682 1.00 0.00 O ATOM 1476 CB ASN A 94 -6.809 17.382 -2.748 0.07 0.00 C ATOM 1477 CG ASN A 94 -6.530 17.927 -1.359 0.23 0.00 C ATOM 1478 OD1 ASN A 94 -5.929 18.990 -1.207 1.00 0.00 O ATOM 1479 ND2 ASN A 94 -6.971 17.201 -0.336 1.00 0.00 N ATOM 0 H ASN A 94 -4.788 16.040 -2.298 0.07 0.00 H new ATOM 0 HA ASN A 94 -7.567 15.481 -2.091 0.25 0.00 H new ATOM 0 HB2 ASN A 94 -6.054 17.756 -3.440 0.07 0.00 H new ATOM 0 HB3 ASN A 94 -7.772 17.756 -3.095 0.07 0.00 H new ATOM 0 HD21 ASN A 94 -6.815 17.520 0.620 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -7.465 16.325 -0.508 1.00 0.00 H new ATOM 1486 N ARG A 95 -6.262 14.655 -4.827 0.05 0.00 N ATOM 1487 CA ARG A 95 -6.490 14.135 -6.170 0.39 0.00 C ATOM 1488 C ARG A 95 -7.419 12.924 -6.134 0.46 0.00 C ATOM 1489 O ARG A 95 -7.938 12.496 -7.164 0.09 0.00 O ATOM 1490 CB ARG A 95 -5.160 13.755 -6.826 0.65 0.00 C ATOM 1491 CG ARG A 95 -5.291 13.360 -8.288 0.86 0.00 C ATOM 1492 CD ARG A 95 -3.941 13.022 -8.900 0.12 0.00 C ATOM 1493 NE ARG A 95 -3.330 11.854 -8.273 0.08 0.00 N ATOM 1494 CZ ARG A 95 -2.333 11.160 -8.819 1.00 0.00 C ATOM 1495 NH1 ARG A 95 -1.846 11.513 -10.001 0.24 0.00 N ATOM 1496 NH2 ARG A 95 -1.826 10.113 -8.184 0.38 0.00 N ATOM 0 H ARG A 95 -5.350 14.421 -4.434 0.05 0.00 H new ATOM 0 HA ARG A 95 -6.966 14.918 -6.760 0.39 0.00 H new ATOM 0 HB2 ARG A 95 -4.472 14.597 -6.746 0.65 0.00 H new ATOM 0 HB3 ARG A 95 -4.716 12.927 -6.273 0.65 0.00 H new ATOM 0 HG2 ARG A 95 -5.956 12.501 -8.375 0.86 0.00 H new ATOM 0 HG3 ARG A 95 -5.750 14.176 -8.846 0.86 0.00 H new ATOM 0 HD2 ARG A 95 -4.063 12.837 -9.967 0.12 0.00 H new ATOM 0 HD3 ARG A 95 -3.273 13.878 -8.799 0.12 0.00 H new ATOM 0 HE ARG A 95 -3.686 11.553 -7.366 0.08 0.00 H new ATOM 0 HH11 ARG A 95 -2.235 12.317 -10.493 0.24 0.00 H new ATOM 0 HH12 ARG A 95 -1.082 10.980 -10.418 0.24 0.00 H new ATOM 0 HH21 ARG A 95 -2.199 9.838 -7.276 0.38 0.00 H new ATOM 0 HH22 ARG A 95 -1.062 9.583 -8.604 0.38 0.00 H new ATOM 1510 N TRP A 96 -7.623 12.379 -4.939 1.00 0.00 N ATOM 1511 CA TRP A 96 -8.489 11.216 -4.768 0.07 0.00 C ATOM 1512 C TRP A 96 -9.900 11.509 -5.269 0.15 0.00 C ATOM 1513 O TRP A 96 -10.395 12.628 -5.144 1.00 0.00 O ATOM 1514 CB TRP A 96 -8.532 10.794 -3.297 0.10 0.00 C ATOM 1515 CG TRP A 96 -9.519 9.699 -3.021 0.10 0.00 C ATOM 1516 CD1 TRP A 96 -10.629 9.777 -2.229 1.00 0.00 C ATOM 1517 CD2 TRP A 96 -9.488 8.364 -3.539 1.00 0.00 C ATOM 1518 NE1 TRP A 96 -11.289 8.571 -2.222 0.08 0.00 N ATOM 1519 CE2 TRP A 96 -10.608 7.688 -3.019 1.00 0.00 C ATOM 1520 CE3 TRP A 96 -8.621 7.675 -4.392 0.27 0.00 C ATOM 1521 CZ2 TRP A 96 -10.883 6.358 -3.325 0.44 0.00 C ATOM 1522 CZ3 TRP A 96 -8.896 6.355 -4.696 0.68 0.00 C ATOM 1523 CH2 TRP A 96 -10.017 5.707 -4.163 0.34 0.00 C ATOM 0 H TRP A 96 -7.202 12.723 -4.076 1.00 0.00 H new ATOM 0 HA TRP A 96 -8.076 10.398 -5.359 0.07 0.00 H new ATOM 0 HB2 TRP A 96 -7.539 10.464 -2.992 0.10 0.00 H new ATOM 0 HB3 TRP A 96 -8.781 11.661 -2.685 0.10 0.00 H new ATOM 0 HD1 TRP A 96 -10.942 10.657 -1.687 1.00 0.00 H new ATOM 0 HE1 TRP A 96 -12.146 8.367 -1.708 0.08 0.00 H new ATOM 0 HE3 TRP A 96 -7.752 8.165 -4.806 0.27 0.00 H new ATOM 0 HZ2 TRP A 96 -11.748 5.857 -2.916 0.44 0.00 H new ATOM 0 HZ3 TRP A 96 -8.235 5.814 -5.356 0.68 0.00 H new ATOM 0 HH2 TRP A 96 -10.202 4.674 -4.418 0.34 0.00 H new ATOM 1534 N SER A 97 -10.538 10.491 -5.836 1.00 0.00 N ATOM 1535 CA SER A 97 -11.893 10.629 -6.356 0.62 0.00 C ATOM 1536 C SER A 97 -12.740 9.412 -5.981 0.17 0.00 C ATOM 1537 O SER A 97 -12.223 8.298 -5.889 0.60 0.00 O ATOM 1538 CB SER A 97 -11.861 10.798 -7.877 0.33 0.00 C ATOM 1539 OG SER A 97 -11.128 11.953 -8.247 0.14 0.00 O ATOM 0 H SER A 97 -10.137 9.560 -5.947 1.00 0.00 H new ATOM 0 HA SER A 97 -12.344 11.516 -5.911 0.62 0.00 H new ATOM 0 HB2 SER A 97 -11.412 9.917 -8.334 0.33 0.00 H new ATOM 0 HB3 SER A 97 -12.879 10.872 -8.259 0.33 0.00 H new ATOM 0 HG SER A 97 -11.121 12.037 -9.223 0.14 0.00 H new ATOM 1545 N PRO A 98 -14.055 9.606 -5.756 1.00 0.00 N ATOM 1546 CA PRO A 98 -14.957 8.512 -5.383 0.27 0.00 C ATOM 1547 C PRO A 98 -15.267 7.585 -6.553 1.00 0.00 C ATOM 1548 O PRO A 98 -15.929 6.560 -6.384 0.16 0.00 O ATOM 1549 CB PRO A 98 -16.222 9.241 -4.929 0.61 0.00 C ATOM 1550 CG PRO A 98 -16.211 10.521 -5.688 1.00 0.00 C ATOM 1551 CD PRO A 98 -14.762 10.900 -5.848 1.00 0.00 C ATOM 0 HA PRO A 98 -14.520 7.866 -4.621 0.27 0.00 H new ATOM 0 HB2 PRO A 98 -17.116 8.658 -5.149 0.61 0.00 H new ATOM 0 HB3 PRO A 98 -16.213 9.418 -3.853 0.61 0.00 H new ATOM 0 HG2 PRO A 98 -16.692 10.402 -6.659 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -16.760 11.296 -5.153 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -14.579 11.391 -6.804 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -14.439 11.590 -5.069 1.00 0.00 H new ATOM 1559 N THR A 99 -14.787 7.947 -7.738 0.12 0.00 N ATOM 1560 CA THR A 99 -15.016 7.142 -8.932 0.42 0.00 C ATOM 1561 C THR A 99 -14.117 5.913 -8.947 0.22 0.00 C ATOM 1562 O THR A 99 -14.517 4.845 -9.412 0.13 0.00 O ATOM 1563 CB THR A 99 -14.780 7.954 -10.215 0.18 0.00 C ATOM 1564 OG1 THR A 99 -14.913 7.109 -11.363 0.10 0.00 O ATOM 1565 CG2 THR A 99 -13.401 8.581 -10.194 0.27 0.00 C ATOM 0 H THR A 99 -14.238 8.792 -7.897 0.12 0.00 H new ATOM 0 HA THR A 99 -16.059 6.826 -8.902 0.42 0.00 H new ATOM 0 HB THR A 99 -15.526 8.747 -10.268 0.18 0.00 H new ATOM 0 HG1 THR A 99 -14.762 7.635 -12.176 0.10 0.00 H new ATOM 0 HG21 THR A 99 -13.247 9.153 -11.109 0.27 0.00 H new ATOM 0 HG22 THR A 99 -13.316 9.244 -9.333 0.27 0.00 H new ATOM 0 HG23 THR A 99 -12.646 7.798 -10.125 0.27 0.00 H new ATOM 1573 N TYR A 100 -12.900 6.068 -8.433 0.06 0.00 N ATOM 1574 CA TYR A 100 -11.945 4.969 -8.385 1.00 0.00 C ATOM 1575 C TYR A 100 -12.404 3.898 -7.403 0.59 0.00 C ATOM 1576 O TYR A 100 -13.443 4.037 -6.758 0.06 0.00 O ATOM 1577 CB TYR A 100 -10.560 5.481 -7.989 0.61 0.00 C ATOM 1578 CG TYR A 100 -9.961 6.445 -8.989 1.00 0.00 C ATOM 1579 CD1 TYR A 100 -9.555 6.010 -10.243 1.00 0.00 C ATOM 1580 CD2 TYR A 100 -9.800 7.790 -8.677 0.15 0.00 C ATOM 1581 CE1 TYR A 100 -9.006 6.887 -11.159 0.12 0.00 C ATOM 1582 CE2 TYR A 100 -9.253 8.674 -9.588 0.13 0.00 C ATOM 1583 CZ TYR A 100 -8.857 8.216 -10.827 0.84 0.00 C ATOM 1584 OH TYR A 100 -8.310 9.093 -11.736 0.30 0.00 O ATOM 0 H TYR A 100 -12.553 6.945 -8.044 0.06 0.00 H new ATOM 0 HA TYR A 100 -11.887 4.527 -9.380 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -10.628 5.973 -7.019 0.61 0.00 H new ATOM 0 HB3 TYR A 100 -9.888 4.631 -7.869 0.61 0.00 H new ATOM 0 HD1 TYR A 100 -9.670 4.969 -10.507 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -10.107 8.150 -7.706 0.15 0.00 H new ATOM 0 HE1 TYR A 100 -8.695 6.532 -12.131 0.12 0.00 H new ATOM 0 HE2 TYR A 100 -9.137 9.717 -9.331 0.13 0.00 H new ATOM 0 HH TYR A 100 -8.277 9.991 -11.345 0.30 0.00 H new ATOM 1594 N ASP A 101 -11.622 2.828 -7.292 0.08 0.00 N ATOM 1595 CA ASP A 101 -11.950 1.734 -6.387 1.00 0.00 C ATOM 1596 C ASP A 101 -10.720 1.281 -5.611 0.07 0.00 C ATOM 1597 O ASP A 101 -9.619 1.794 -5.815 1.00 0.00 O ATOM 1598 CB ASP A 101 -12.536 0.555 -7.167 1.00 0.00 C ATOM 1599 CG ASP A 101 -13.804 0.923 -7.910 0.19 0.00 C ATOM 1600 OD1 ASP A 101 -14.888 0.890 -7.289 0.45 0.00 O ATOM 1601 OD2 ASP A 101 -13.716 1.242 -9.115 0.08 0.00 O ATOM 0 H ASP A 101 -10.758 2.696 -7.818 0.08 0.00 H new ATOM 0 HA ASP A 101 -12.693 2.097 -5.677 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -11.795 0.190 -7.878 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -12.747 -0.263 -6.478 1.00 0.00 H new ATOM 1606 N VAL A 102 -10.916 0.316 -4.720 1.00 0.00 N ATOM 1607 CA VAL A 102 -9.826 -0.219 -3.913 0.22 0.00 C ATOM 1608 C VAL A 102 -8.752 -0.843 -4.802 1.00 0.00 C ATOM 1609 O VAL A 102 -7.597 -0.983 -4.395 0.77 0.00 O ATOM 1610 CB VAL A 102 -10.346 -1.269 -2.907 0.41 0.00 C ATOM 1611 CG1 VAL A 102 -11.002 -2.434 -3.630 1.00 0.00 C ATOM 1612 CG2 VAL A 102 -9.224 -1.756 -2.002 0.10 0.00 C ATOM 0 H VAL A 102 -11.823 -0.113 -4.538 1.00 0.00 H new ATOM 0 HA VAL A 102 -9.388 0.610 -3.357 0.22 0.00 H new ATOM 0 HB VAL A 102 -11.101 -0.791 -2.282 0.41 0.00 H new ATOM 0 HG11 VAL A 102 -11.360 -3.160 -2.900 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -11.842 -2.069 -4.221 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -10.275 -2.910 -4.288 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -9.615 -2.495 -1.303 0.10 0.00 H new ATOM 0 HG22 VAL A 102 -8.439 -2.210 -2.607 0.10 0.00 H new ATOM 0 HG23 VAL A 102 -8.812 -0.913 -1.447 0.10 0.00 H new ATOM 1622 N SER A 103 -9.140 -1.213 -6.019 0.73 0.00 N ATOM 1623 CA SER A 103 -8.217 -1.820 -6.970 0.13 0.00 C ATOM 1624 C SER A 103 -7.173 -0.812 -7.450 1.00 0.00 C ATOM 1625 O SER A 103 -6.026 -1.173 -7.713 0.87 0.00 O ATOM 1626 CB SER A 103 -8.988 -2.377 -8.169 0.06 0.00 C ATOM 1627 OG SER A 103 -8.103 -2.880 -9.155 0.26 0.00 O ATOM 0 H SER A 103 -10.091 -1.102 -6.370 0.73 0.00 H new ATOM 0 HA SER A 103 -7.699 -2.633 -6.462 0.13 0.00 H new ATOM 0 HB2 SER A 103 -9.658 -3.171 -7.838 0.06 0.00 H new ATOM 0 HB3 SER A 103 -9.611 -1.594 -8.601 0.06 0.00 H new ATOM 0 HG SER A 103 -8.620 -3.231 -9.910 0.26 0.00 H new ATOM 1633 N SER A 104 -7.580 0.449 -7.559 0.23 0.00 N ATOM 1634 CA SER A 104 -6.681 1.507 -8.011 1.00 0.00 C ATOM 1635 C SER A 104 -5.589 1.787 -6.982 0.45 0.00 C ATOM 1636 O SER A 104 -4.406 1.825 -7.314 1.00 0.00 O ATOM 1637 CB SER A 104 -7.469 2.787 -8.293 1.00 0.00 C ATOM 1638 OG SER A 104 -6.611 3.833 -8.720 0.05 0.00 O ATOM 0 H SER A 104 -8.525 0.764 -7.341 0.23 0.00 H new ATOM 0 HA SER A 104 -6.203 1.167 -8.930 1.00 0.00 H new ATOM 0 HB2 SER A 104 -8.220 2.594 -9.059 1.00 0.00 H new ATOM 0 HB3 SER A 104 -8.002 3.095 -7.394 1.00 0.00 H new ATOM 0 HG SER A 104 -7.140 4.639 -8.895 0.05 0.00 H new ATOM 1644 N ILE A 105 -5.997 1.983 -5.731 0.58 0.00 N ATOM 1645 CA ILE A 105 -5.053 2.265 -4.656 1.00 0.00 C ATOM 1646 C ILE A 105 -4.108 1.087 -4.425 0.28 0.00 C ATOM 1647 O ILE A 105 -2.935 1.278 -4.099 0.16 0.00 O ATOM 1648 CB ILE A 105 -5.794 2.612 -3.343 1.00 0.00 C ATOM 1649 CG1 ILE A 105 -4.811 3.128 -2.276 0.37 0.00 C ATOM 1650 CG2 ILE A 105 -6.583 1.411 -2.837 0.11 0.00 C ATOM 1651 CD1 ILE A 105 -4.168 2.048 -1.424 0.06 0.00 C ATOM 0 H ILE A 105 -6.974 1.952 -5.438 0.58 0.00 H new ATOM 0 HA ILE A 105 -4.461 3.128 -4.962 1.00 0.00 H new ATOM 0 HB ILE A 105 -6.503 3.413 -3.552 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -4.024 3.696 -2.772 0.37 0.00 H new ATOM 0 HG13 ILE A 105 -5.339 3.821 -1.621 0.37 0.00 H new ATOM 0 HG21 ILE A 105 -7.097 1.676 -1.913 0.11 0.00 H new ATOM 0 HG22 ILE A 105 -7.316 1.115 -3.587 0.11 0.00 H new ATOM 0 HG23 ILE A 105 -5.902 0.581 -2.648 0.11 0.00 H new ATOM 0 HD11 ILE A 105 -3.493 2.508 -0.702 0.06 0.00 H new ATOM 0 HD12 ILE A 105 -4.942 1.493 -0.894 0.06 0.00 H new ATOM 0 HD13 ILE A 105 -3.607 1.366 -2.063 0.06 0.00 H new ATOM 1663 N LEU A 106 -4.616 -0.129 -4.608 0.07 0.00 N ATOM 1664 CA LEU A 106 -3.810 -1.331 -4.415 0.18 0.00 C ATOM 1665 C LEU A 106 -2.620 -1.345 -5.368 1.00 0.00 C ATOM 1666 O LEU A 106 -1.500 -1.674 -4.975 0.08 0.00 O ATOM 1667 CB LEU A 106 -4.662 -2.588 -4.622 1.00 0.00 C ATOM 1668 CG LEU A 106 -4.550 -3.645 -3.518 1.00 0.00 C ATOM 1669 CD1 LEU A 106 -4.884 -3.047 -2.159 0.29 0.00 C ATOM 1670 CD2 LEU A 106 -5.464 -4.822 -3.820 0.08 0.00 C ATOM 0 H LEU A 106 -5.580 -0.308 -4.889 0.07 0.00 H new ATOM 0 HA LEU A 106 -3.435 -1.324 -3.392 0.18 0.00 H new ATOM 0 HB2 LEU A 106 -5.706 -2.288 -4.711 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -4.380 -3.046 -5.570 1.00 0.00 H new ATOM 0 HG LEU A 106 -3.520 -4.001 -3.488 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -4.798 -3.816 -1.392 0.29 0.00 H new ATOM 0 HD12 LEU A 106 -4.191 -2.235 -1.938 0.29 0.00 H new ATOM 0 HD13 LEU A 106 -5.903 -2.661 -2.172 0.29 0.00 H new ATOM 0 HD21 LEU A 106 -5.374 -5.565 -3.028 0.08 0.00 H new ATOM 0 HD22 LEU A 106 -6.496 -4.476 -3.878 0.08 0.00 H new ATOM 0 HD23 LEU A 106 -5.178 -5.270 -4.772 0.08 0.00 H new ATOM 1682 N THR A 107 -2.869 -0.984 -6.621 1.00 0.00 N ATOM 1683 CA THR A 107 -1.818 -0.951 -7.632 0.27 0.00 C ATOM 1684 C THR A 107 -0.900 0.250 -7.431 0.07 0.00 C ATOM 1685 O THR A 107 0.272 0.216 -7.806 0.43 0.00 O ATOM 1686 CB THR A 107 -2.408 -0.900 -9.053 0.08 0.00 C ATOM 1687 OG1 THR A 107 -3.267 0.239 -9.188 0.21 0.00 O ATOM 1688 CG2 THR A 107 -3.191 -2.168 -9.359 0.45 0.00 C ATOM 0 H THR A 107 -3.790 -0.710 -6.962 1.00 0.00 H new ATOM 0 HA THR A 107 -1.241 -1.869 -7.519 0.27 0.00 H new ATOM 0 HB THR A 107 -1.583 -0.819 -9.761 0.08 0.00 H new ATOM 0 HG1 THR A 107 -3.410 0.647 -8.308 0.21 0.00 H new ATOM 0 HG21 THR A 107 -3.599 -2.109 -10.368 0.45 0.00 H new ATOM 0 HG22 THR A 107 -2.529 -3.031 -9.284 0.45 0.00 H new ATOM 0 HG23 THR A 107 -4.007 -2.273 -8.644 0.45 0.00 H new ATOM 1696 N SER A 108 -1.440 1.309 -6.837 0.10 0.00 N ATOM 1697 CA SER A 108 -0.672 2.523 -6.586 1.00 0.00 C ATOM 1698 C SER A 108 0.512 2.239 -5.667 1.00 0.00 C ATOM 1699 O SER A 108 1.584 2.823 -5.821 0.06 0.00 O ATOM 1700 CB SER A 108 -1.565 3.600 -5.968 0.49 0.00 C ATOM 1701 OG SER A 108 -2.636 3.934 -6.835 0.86 0.00 O ATOM 0 H SER A 108 -2.409 1.351 -6.520 0.10 0.00 H new ATOM 0 HA SER A 108 -0.289 2.883 -7.541 1.00 0.00 H new ATOM 0 HB2 SER A 108 -1.961 3.247 -5.016 0.49 0.00 H new ATOM 0 HB3 SER A 108 -0.973 4.490 -5.756 0.49 0.00 H new ATOM 0 HG SER A 108 -3.213 3.151 -6.959 0.86 0.00 H new ATOM 1707 N ILE A 109 0.308 1.340 -4.709 1.00 0.00 N ATOM 1708 CA ILE A 109 1.357 0.976 -3.766 1.00 0.00 C ATOM 1709 C ILE A 109 2.417 0.109 -4.438 1.00 0.00 C ATOM 1710 O ILE A 109 3.614 0.271 -4.190 1.00 0.00 O ATOM 1711 CB ILE A 109 0.781 0.222 -2.550 0.10 0.00 C ATOM 1712 CG1 ILE A 109 -0.275 1.077 -1.844 1.00 0.00 C ATOM 1713 CG2 ILE A 109 1.897 -0.155 -1.582 0.15 0.00 C ATOM 1714 CD1 ILE A 109 -1.065 0.324 -0.795 0.32 0.00 C ATOM 0 H ILE A 109 -0.575 0.850 -4.566 1.00 0.00 H new ATOM 0 HA ILE A 109 1.815 1.903 -3.422 1.00 0.00 H new ATOM 0 HB ILE A 109 0.305 -0.693 -2.902 0.10 0.00 H new ATOM 0 HG12 ILE A 109 0.215 1.930 -1.374 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -0.964 1.476 -2.588 1.00 0.00 H new ATOM 0 HG21 ILE A 109 1.475 -0.686 -0.729 0.15 0.00 H new ATOM 0 HG22 ILE A 109 2.617 -0.797 -2.089 0.15 0.00 H new ATOM 0 HG23 ILE A 109 2.398 0.749 -1.235 0.15 0.00 H new ATOM 0 HD11 ILE A 109 -1.793 0.994 -0.338 0.32 0.00 H new ATOM 0 HD12 ILE A 109 -1.584 -0.513 -1.262 0.32 0.00 H new ATOM 0 HD13 ILE A 109 -0.387 -0.052 -0.029 0.32 0.00 H new ATOM 1726 N GLN A 110 1.974 -0.813 -5.290 0.05 0.00 N ATOM 1727 CA GLN A 110 2.889 -1.701 -5.999 0.07 0.00 C ATOM 1728 C GLN A 110 3.828 -0.901 -6.896 0.42 0.00 C ATOM 1729 O GLN A 110 5.026 -1.176 -6.960 0.64 0.00 O ATOM 1730 CB GLN A 110 2.108 -2.717 -6.837 1.00 0.00 C ATOM 1731 CG GLN A 110 2.999 -3.658 -7.631 1.00 0.00 C ATOM 1732 CD GLN A 110 2.212 -4.637 -8.480 0.36 0.00 C ATOM 1733 OE1 GLN A 110 1.864 -4.345 -9.623 1.00 0.00 O ATOM 1734 NE2 GLN A 110 1.935 -5.811 -7.924 0.13 0.00 N ATOM 0 H GLN A 110 0.988 -0.964 -5.505 0.05 0.00 H new ATOM 0 HA GLN A 110 3.484 -2.236 -5.259 0.07 0.00 H new ATOM 0 HB2 GLN A 110 1.468 -3.304 -6.179 1.00 0.00 H new ATOM 0 HB3 GLN A 110 1.453 -2.182 -7.525 1.00 0.00 H new ATOM 0 HG2 GLN A 110 3.656 -3.072 -8.274 1.00 0.00 H new ATOM 0 HG3 GLN A 110 3.638 -4.212 -6.944 1.00 0.00 H new ATOM 0 HE21 GLN A 110 2.244 -6.010 -6.972 0.13 0.00 H new ATOM 0 HE22 GLN A 110 1.414 -6.513 -8.449 0.13 0.00 H new ATOM 1743 N SER A 111 3.273 0.089 -7.587 0.11 0.00 N ATOM 1744 CA SER A 111 4.059 0.938 -8.475 1.00 0.00 C ATOM 1745 C SER A 111 5.010 1.817 -7.671 0.23 0.00 C ATOM 1746 O SER A 111 6.082 2.190 -8.147 0.99 0.00 O ATOM 1747 CB SER A 111 3.135 1.809 -9.330 0.12 0.00 C ATOM 1748 OG SER A 111 2.311 2.627 -8.519 0.66 0.00 O ATOM 0 H SER A 111 2.281 0.323 -7.549 0.11 0.00 H new ATOM 0 HA SER A 111 4.648 0.298 -9.131 1.00 0.00 H new ATOM 0 HB2 SER A 111 3.731 2.434 -9.995 0.12 0.00 H new ATOM 0 HB3 SER A 111 2.514 1.174 -9.962 0.12 0.00 H new ATOM 0 HG SER A 111 2.346 2.310 -7.592 0.66 0.00 H new ATOM 1754 N LEU A 112 4.603 2.145 -6.448 0.72 0.00 N ATOM 1755 CA LEU A 112 5.409 2.977 -5.562 0.14 0.00 C ATOM 1756 C LEU A 112 6.768 2.329 -5.317 0.26 0.00 C ATOM 1757 O LEU A 112 7.795 3.009 -5.277 0.26 0.00 O ATOM 1758 CB LEU A 112 4.666 3.190 -4.234 1.00 0.00 C ATOM 1759 CG LEU A 112 5.196 4.310 -3.325 1.00 0.00 C ATOM 1760 CD1 LEU A 112 6.476 3.883 -2.623 1.00 0.00 C ATOM 1761 CD2 LEU A 112 5.418 5.592 -4.115 0.32 0.00 C ATOM 0 H LEU A 112 3.714 1.845 -6.047 0.72 0.00 H new ATOM 0 HA LEU A 112 5.573 3.946 -6.034 0.14 0.00 H new ATOM 0 HB2 LEU A 112 3.620 3.398 -4.458 1.00 0.00 H new ATOM 0 HB3 LEU A 112 4.692 2.255 -3.674 1.00 0.00 H new ATOM 0 HG LEU A 112 4.442 4.506 -2.563 1.00 0.00 H new ATOM 0 HD11 LEU A 112 6.830 4.694 -1.986 1.00 0.00 H new ATOM 0 HD12 LEU A 112 6.280 3.002 -2.013 1.00 0.00 H new ATOM 0 HD13 LEU A 112 7.237 3.647 -3.366 1.00 0.00 H new ATOM 0 HD21 LEU A 112 5.793 6.369 -3.449 0.32 0.00 H new ATOM 0 HD22 LEU A 112 6.145 5.410 -4.907 0.32 0.00 H new ATOM 0 HD23 LEU A 112 4.475 5.916 -4.556 0.32 0.00 H new ATOM 1773 N LEU A 113 6.766 1.008 -5.166 0.10 0.00 N ATOM 1774 CA LEU A 113 7.997 0.261 -4.927 1.00 0.00 C ATOM 1775 C LEU A 113 8.974 0.451 -6.076 0.12 0.00 C ATOM 1776 O LEU A 113 10.167 0.661 -5.864 0.05 0.00 O ATOM 1777 CB LEU A 113 7.696 -1.229 -4.762 0.47 0.00 C ATOM 1778 CG LEU A 113 6.328 -1.563 -4.163 0.07 0.00 C ATOM 1779 CD1 LEU A 113 6.121 -3.068 -4.126 1.00 0.00 C ATOM 1780 CD2 LEU A 113 6.192 -0.967 -2.770 0.62 0.00 C ATOM 0 H LEU A 113 5.925 0.432 -5.205 0.10 0.00 H new ATOM 0 HA LEU A 113 8.446 0.643 -4.010 1.00 0.00 H new ATOM 0 HB2 LEU A 113 7.772 -1.707 -5.738 0.47 0.00 H new ATOM 0 HB3 LEU A 113 8.467 -1.670 -4.130 0.47 0.00 H new ATOM 0 HG LEU A 113 5.557 -1.124 -4.796 0.07 0.00 H new ATOM 0 HD11 LEU A 113 5.144 -3.290 -3.697 1.00 0.00 H new ATOM 0 HD12 LEU A 113 6.172 -3.467 -5.139 1.00 0.00 H new ATOM 0 HD13 LEU A 113 6.898 -3.527 -3.515 1.00 0.00 H new ATOM 0 HD21 LEU A 113 5.212 -1.216 -2.362 0.62 0.00 H new ATOM 0 HD22 LEU A 113 6.969 -1.374 -2.123 0.62 0.00 H new ATOM 0 HD23 LEU A 113 6.297 0.116 -2.826 0.62 0.00 H new ATOM 1792 N ASP A 114 8.453 0.370 -7.297 1.00 0.00 N ATOM 1793 CA ASP A 114 9.276 0.519 -8.488 0.06 0.00 C ATOM 1794 C ASP A 114 10.008 1.859 -8.488 0.88 0.00 C ATOM 1795 O ASP A 114 11.228 1.908 -8.648 1.00 0.00 O ATOM 1796 CB ASP A 114 8.414 0.396 -9.747 0.29 0.00 C ATOM 1797 CG ASP A 114 9.235 0.460 -11.020 0.30 0.00 C ATOM 1798 OD1 ASP A 114 9.455 1.579 -11.528 0.09 0.00 O ATOM 1799 OD2 ASP A 114 9.658 -0.609 -11.508 1.00 0.00 O ATOM 0 H ASP A 114 7.465 0.202 -7.485 1.00 0.00 H new ATOM 0 HA ASP A 114 10.020 -0.277 -8.483 0.06 0.00 H new ATOM 0 HB2 ASP A 114 7.867 -0.546 -9.718 0.29 0.00 H new ATOM 0 HB3 ASP A 114 7.673 1.195 -9.756 0.29 0.00 H new ATOM 1804 N GLU A 115 9.258 2.943 -8.307 0.75 0.00 N ATOM 1805 CA GLU A 115 9.841 4.281 -8.290 0.91 0.00 C ATOM 1806 C GLU A 115 8.907 5.285 -7.608 0.71 0.00 C ATOM 1807 O GLU A 115 7.806 5.542 -8.094 0.10 0.00 O ATOM 1808 CB GLU A 115 10.149 4.738 -9.718 1.00 0.00 C ATOM 1809 CG GLU A 115 8.973 4.604 -10.673 0.50 0.00 C ATOM 1810 CD GLU A 115 9.316 5.046 -12.082 0.37 0.00 C ATOM 1811 OE1 GLU A 115 9.774 4.197 -12.877 0.28 0.00 O ATOM 1812 OE2 GLU A 115 9.125 6.241 -12.392 0.18 0.00 O ATOM 0 H GLU A 115 8.247 2.921 -8.170 0.75 0.00 H new ATOM 0 HA GLU A 115 10.768 4.238 -7.718 0.91 0.00 H new ATOM 0 HB2 GLU A 115 10.469 5.780 -9.695 1.00 0.00 H new ATOM 0 HB3 GLU A 115 10.986 4.156 -10.103 1.00 0.00 H new ATOM 0 HG2 GLU A 115 8.641 3.566 -10.692 0.50 0.00 H new ATOM 0 HG3 GLU A 115 8.138 5.199 -10.302 0.50 0.00 H new ATOM 1819 N PRO A 116 9.331 5.864 -6.467 0.05 0.00 N ATOM 1820 CA PRO A 116 8.525 6.844 -5.736 0.05 0.00 C ATOM 1821 C PRO A 116 8.650 8.247 -6.318 0.35 0.00 C ATOM 1822 O PRO A 116 9.271 8.446 -7.362 1.00 0.00 O ATOM 1823 CB PRO A 116 9.122 6.794 -4.334 1.00 0.00 C ATOM 1824 CG PRO A 116 10.559 6.467 -4.553 0.13 0.00 C ATOM 1825 CD PRO A 116 10.620 5.606 -5.790 0.79 0.00 C ATOM 0 HA PRO A 116 7.460 6.617 -5.776 0.05 0.00 H new ATOM 0 HB2 PRO A 116 9.006 7.747 -3.819 1.00 0.00 H new ATOM 0 HB3 PRO A 116 8.632 6.038 -3.720 1.00 0.00 H new ATOM 0 HG2 PRO A 116 11.148 7.375 -4.683 0.13 0.00 H new ATOM 0 HG3 PRO A 116 10.972 5.940 -3.693 0.13 0.00 H new ATOM 0 HD2 PRO A 116 11.465 5.876 -6.423 0.79 0.00 H new ATOM 0 HD3 PRO A 116 10.735 4.552 -5.538 0.79 0.00 H new ATOM 1833 N ASN A 117 8.058 9.218 -5.630 0.19 0.00 N ATOM 1834 CA ASN A 117 8.104 10.608 -6.070 0.31 0.00 C ATOM 1835 C ASN A 117 9.077 11.420 -5.214 0.25 0.00 C ATOM 1836 O ASN A 117 8.773 11.751 -4.068 0.36 0.00 O ATOM 1837 CB ASN A 117 6.708 11.233 -6.000 0.22 0.00 C ATOM 1838 CG ASN A 117 5.793 10.758 -7.116 0.38 0.00 C ATOM 1839 OD1 ASN A 117 4.931 11.502 -7.583 1.00 0.00 O ATOM 1840 ND2 ASN A 117 5.969 9.513 -7.545 0.39 0.00 N ATOM 0 H ASN A 117 7.540 9.068 -4.764 0.19 0.00 H new ATOM 0 HA ASN A 117 8.453 10.624 -7.102 0.31 0.00 H new ATOM 0 HB2 ASN A 117 6.255 10.993 -5.038 0.22 0.00 H new ATOM 0 HB3 ASN A 117 6.798 12.318 -6.047 0.22 0.00 H new ATOM 0 HD21 ASN A 117 5.378 9.141 -8.288 0.39 0.00 H new ATOM 0 HD22 ASN A 117 6.695 8.929 -7.131 0.39 0.00 H new ATOM 1847 N PRO A 118 10.270 11.750 -5.754 1.00 0.00 N ATOM 1848 CA PRO A 118 11.277 12.528 -5.024 0.18 0.00 C ATOM 1849 C PRO A 118 10.940 14.016 -4.964 0.18 0.00 C ATOM 1850 O PRO A 118 11.819 14.851 -4.751 0.16 0.00 O ATOM 1851 CB PRO A 118 12.545 12.305 -5.845 0.10 0.00 C ATOM 1852 CG PRO A 118 12.052 12.104 -7.235 0.59 0.00 C ATOM 1853 CD PRO A 118 10.736 11.383 -7.108 0.08 0.00 C ATOM 0 HA PRO A 118 11.357 12.216 -3.983 0.18 0.00 H new ATOM 0 HB2 PRO A 118 13.216 13.161 -5.781 0.10 0.00 H new ATOM 0 HB3 PRO A 118 13.101 11.437 -5.491 0.10 0.00 H new ATOM 0 HG2 PRO A 118 11.926 13.058 -7.746 0.59 0.00 H new ATOM 0 HG3 PRO A 118 12.762 11.520 -7.820 0.59 0.00 H new ATOM 0 HD2 PRO A 118 10.029 11.700 -7.875 0.08 0.00 H new ATOM 0 HD3 PRO A 118 10.857 10.305 -7.212 0.08 0.00 H new ATOM 1861 N ASN A 119 9.665 14.340 -5.151 0.15 0.00 N ATOM 1862 CA ASN A 119 9.217 15.730 -5.120 1.00 0.00 C ATOM 1863 C ASN A 119 8.970 16.192 -3.688 0.67 0.00 C ATOM 1864 O ASN A 119 9.249 17.340 -3.339 0.08 0.00 O ATOM 1865 CB ASN A 119 7.943 15.895 -5.949 0.11 0.00 C ATOM 1866 CG ASN A 119 8.130 15.456 -7.389 0.53 0.00 C ATOM 1867 OD1 ASN A 119 8.522 16.250 -8.244 1.00 0.00 O ATOM 1868 ND2 ASN A 119 7.851 14.188 -7.662 1.00 0.00 N ATOM 0 H ASN A 119 8.924 13.661 -5.325 0.15 0.00 H new ATOM 0 HA ASN A 119 10.005 16.349 -5.550 1.00 0.00 H new ATOM 0 HB2 ASN A 119 7.140 15.314 -5.496 0.11 0.00 H new ATOM 0 HB3 ASN A 119 7.631 16.939 -5.928 0.11 0.00 H new ATOM 0 HD21 ASN A 119 7.959 13.835 -8.613 1.00 0.00 H new ATOM 0 HD22 ASN A 119 7.529 13.566 -6.921 1.00 0.00 H new ATOM 1875 N SER A 120 8.445 15.293 -2.861 0.12 0.00 N ATOM 1876 CA SER A 120 8.162 15.610 -1.467 0.15 0.00 C ATOM 1877 C SER A 120 8.515 14.432 -0.557 0.06 0.00 C ATOM 1878 O SER A 120 7.654 13.610 -0.238 0.40 0.00 O ATOM 1879 CB SER A 120 6.686 15.977 -1.297 0.64 0.00 C ATOM 1880 OG SER A 120 6.386 16.273 0.056 0.06 0.00 O ATOM 0 H SER A 120 8.207 14.339 -3.133 0.12 0.00 H new ATOM 0 HA SER A 120 8.777 16.463 -1.181 0.15 0.00 H new ATOM 0 HB2 SER A 120 6.448 16.838 -1.922 0.64 0.00 H new ATOM 0 HB3 SER A 120 6.061 15.152 -1.639 0.64 0.00 H new ATOM 0 HG SER A 120 5.438 16.506 0.137 0.06 0.00 H new ATOM 1886 N PRO A 121 9.790 14.332 -0.134 0.06 0.00 N ATOM 1887 CA PRO A 121 10.250 13.244 0.739 0.10 0.00 C ATOM 1888 C PRO A 121 9.563 13.264 2.101 0.06 0.00 C ATOM 1889 O PRO A 121 9.442 14.314 2.730 0.45 0.00 O ATOM 1890 CB PRO A 121 11.752 13.511 0.898 0.30 0.00 C ATOM 1891 CG PRO A 121 12.107 14.434 -0.218 1.00 0.00 C ATOM 1892 CD PRO A 121 10.882 15.260 -0.471 0.06 0.00 C ATOM 0 HA PRO A 121 10.023 12.266 0.315 0.10 0.00 H new ATOM 0 HB2 PRO A 121 11.971 13.961 1.866 0.30 0.00 H new ATOM 0 HB3 PRO A 121 12.325 12.585 0.840 0.30 0.00 H new ATOM 0 HG2 PRO A 121 12.955 15.064 0.051 1.00 0.00 H new ATOM 0 HG3 PRO A 121 12.394 13.877 -1.110 1.00 0.00 H new ATOM 0 HD2 PRO A 121 10.861 16.154 0.152 0.06 0.00 H new ATOM 0 HD3 PRO A 121 10.825 15.593 -1.507 0.06 0.00 H new ATOM 1900 N ALA A 122 9.114 12.095 2.550 0.20 0.00 N ATOM 1901 CA ALA A 122 8.445 11.976 3.839 0.89 0.00 C ATOM 1902 C ALA A 122 9.430 11.571 4.930 0.77 0.00 C ATOM 1903 O ALA A 122 9.387 12.092 6.044 0.11 0.00 O ATOM 1904 CB ALA A 122 7.305 10.971 3.755 0.26 0.00 C ATOM 0 H ALA A 122 9.202 11.217 2.039 0.20 0.00 H new ATOM 0 HA ALA A 122 8.033 12.951 4.098 0.89 0.00 H new ATOM 0 HB1 ALA A 122 6.816 10.894 4.726 0.26 0.00 H new ATOM 0 HB2 ALA A 122 6.582 11.302 3.010 0.26 0.00 H new ATOM 0 HB3 ALA A 122 7.700 9.996 3.469 0.26 0.00 H new ATOM 1910 N ASN A 123 10.320 10.637 4.599 0.36 0.00 N ATOM 1911 CA ASN A 123 11.323 10.164 5.548 0.74 0.00 C ATOM 1912 C ASN A 123 12.691 10.753 5.224 1.00 0.00 C ATOM 1913 O ASN A 123 13.291 10.428 4.199 0.29 0.00 O ATOM 1914 CB ASN A 123 11.392 8.635 5.529 0.85 0.00 C ATOM 1915 CG ASN A 123 12.308 8.083 6.606 0.16 0.00 C ATOM 1916 OD1 ASN A 123 12.949 7.048 6.419 0.52 0.00 O ATOM 1917 ND2 ASN A 123 12.372 8.769 7.742 0.16 0.00 N ATOM 0 H ASN A 123 10.366 10.194 3.681 0.36 0.00 H new ATOM 0 HA ASN A 123 11.032 10.493 6.546 0.74 0.00 H new ATOM 0 HB2 ASN A 123 10.390 8.227 5.664 0.85 0.00 H new ATOM 0 HB3 ASN A 123 11.743 8.302 4.552 0.85 0.00 H new ATOM 0 HD21 ASN A 123 12.969 8.443 8.502 0.16 0.00 H new ATOM 0 HD22 ASN A 123 11.824 9.622 7.854 0.16 0.00 H new ATOM 1924 N SER A 124 13.176 11.623 6.103 0.49 0.00 N ATOM 1925 CA SER A 124 14.471 12.269 5.912 0.39 0.00 C ATOM 1926 C SER A 124 15.622 11.282 6.090 0.86 0.00 C ATOM 1927 O SER A 124 16.670 11.419 5.461 0.25 0.00 O ATOM 1928 CB SER A 124 14.629 13.431 6.894 1.00 0.00 C ATOM 1929 OG SER A 124 14.510 12.987 8.235 0.37 0.00 O ATOM 0 H SER A 124 12.691 11.898 6.957 0.49 0.00 H new ATOM 0 HA SER A 124 14.505 12.647 4.890 0.39 0.00 H new ATOM 0 HB2 SER A 124 15.600 13.904 6.749 1.00 0.00 H new ATOM 0 HB3 SER A 124 13.872 14.189 6.690 1.00 0.00 H new ATOM 0 HG SER A 124 14.617 13.749 8.842 0.37 0.00 H new ATOM 1935 N GLN A 125 15.420 10.286 6.946 1.00 0.00 N ATOM 1936 CA GLN A 125 16.450 9.286 7.214 0.40 0.00 C ATOM 1937 C GLN A 125 16.752 8.448 5.974 1.00 0.00 C ATOM 1938 O GLN A 125 17.907 8.328 5.564 1.00 0.00 O ATOM 1939 CB GLN A 125 16.013 8.372 8.360 1.00 0.00 C ATOM 1940 CG GLN A 125 17.039 7.312 8.722 0.06 0.00 C ATOM 1941 CD GLN A 125 16.578 6.417 9.856 0.07 0.00 C ATOM 1942 OE1 GLN A 125 15.382 6.172 10.020 0.19 0.00 O ATOM 1943 NE2 GLN A 125 17.524 5.927 10.646 0.05 0.00 N ATOM 0 H GLN A 125 14.553 10.149 7.466 1.00 0.00 H new ATOM 0 HA GLN A 125 17.360 9.816 7.497 0.40 0.00 H new ATOM 0 HB2 GLN A 125 15.807 8.981 9.240 1.00 0.00 H new ATOM 0 HB3 GLN A 125 15.079 7.882 8.086 1.00 0.00 H new ATOM 0 HG2 GLN A 125 17.250 6.701 7.844 0.06 0.00 H new ATOM 0 HG3 GLN A 125 17.973 7.797 9.004 0.06 0.00 H new ATOM 0 HE21 GLN A 125 18.503 6.157 10.473 0.05 0.00 H new ATOM 0 HE22 GLN A 125 17.273 5.321 11.427 0.05 0.00 H new ATOM 1952 N ALA A 126 15.712 7.872 5.381 0.07 0.00 N ATOM 1953 CA ALA A 126 15.873 7.041 4.194 0.14 0.00 C ATOM 1954 C ALA A 126 16.384 7.850 3.006 0.70 0.00 C ATOM 1955 O ALA A 126 17.343 7.453 2.341 0.27 0.00 O ATOM 1956 CB ALA A 126 14.558 6.362 3.844 0.76 0.00 C ATOM 0 H ALA A 126 14.749 7.965 5.703 0.07 0.00 H new ATOM 0 HA ALA A 126 16.619 6.279 4.421 0.14 0.00 H new ATOM 0 HB1 ALA A 126 14.692 5.745 2.956 0.76 0.00 H new ATOM 0 HB2 ALA A 126 14.239 5.735 4.677 0.76 0.00 H new ATOM 0 HB3 ALA A 126 13.799 7.119 3.648 0.76 0.00 H new ATOM 1962 N ALA A 127 15.740 8.981 2.746 0.14 0.00 N ATOM 1963 CA ALA A 127 16.124 9.843 1.631 1.00 0.00 C ATOM 1964 C ALA A 127 17.584 10.277 1.731 0.38 0.00 C ATOM 1965 O ALA A 127 18.293 10.335 0.727 0.06 0.00 O ATOM 1966 CB ALA A 127 15.215 11.061 1.571 1.00 0.00 C ATOM 0 H ALA A 127 14.949 9.324 3.291 0.14 0.00 H new ATOM 0 HA ALA A 127 16.012 9.267 0.712 1.00 0.00 H new ATOM 0 HB1 ALA A 127 15.512 11.696 0.736 1.00 0.00 H new ATOM 0 HB2 ALA A 127 14.183 10.738 1.433 1.00 0.00 H new ATOM 0 HB3 ALA A 127 15.298 11.623 2.501 1.00 0.00 H new ATOM 1972 N GLN A 128 18.027 10.580 2.947 0.58 0.00 N ATOM 1973 CA GLN A 128 19.402 11.013 3.176 0.11 0.00 C ATOM 1974 C GLN A 128 20.390 9.876 2.937 0.41 0.00 C ATOM 1975 O GLN A 128 21.386 10.043 2.233 0.35 0.00 O ATOM 1976 CB GLN A 128 19.558 11.548 4.601 0.16 0.00 C ATOM 1977 CG GLN A 128 20.952 12.071 4.910 0.10 0.00 C ATOM 1978 CD GLN A 128 21.078 12.586 6.331 0.59 0.00 C ATOM 1979 OE1 GLN A 128 21.427 11.838 7.245 0.59 0.00 O ATOM 1980 NE2 GLN A 128 20.793 13.867 6.522 0.07 0.00 N ATOM 0 H GLN A 128 17.454 10.534 3.790 0.58 0.00 H new ATOM 0 HA GLN A 128 19.623 11.810 2.466 0.11 0.00 H new ATOM 0 HB2 GLN A 128 18.836 12.349 4.760 0.16 0.00 H new ATOM 0 HB3 GLN A 128 19.313 10.754 5.306 0.16 0.00 H new ATOM 0 HG2 GLN A 128 21.679 11.275 4.750 0.10 0.00 H new ATOM 0 HG3 GLN A 128 21.198 12.872 4.213 0.10 0.00 H new ATOM 0 HE21 GLN A 128 20.508 14.449 5.734 0.07 0.00 H new ATOM 0 HE22 GLN A 128 20.859 14.270 7.457 0.07 0.00 H new ATOM 1989 N LEU A 129 20.110 8.718 3.529 0.08 0.00 N ATOM 1990 CA LEU A 129 20.981 7.553 3.388 0.05 0.00 C ATOM 1991 C LEU A 129 21.119 7.129 1.929 0.52 0.00 C ATOM 1992 O LEU A 129 22.158 6.610 1.521 0.53 0.00 O ATOM 1993 CB LEU A 129 20.440 6.387 4.217 1.00 0.00 C ATOM 1994 CG LEU A 129 20.592 6.541 5.732 0.05 0.00 C ATOM 1995 CD1 LEU A 129 19.852 5.429 6.457 0.09 0.00 C ATOM 1996 CD2 LEU A 129 22.063 6.545 6.122 0.77 0.00 C ATOM 0 H LEU A 129 19.287 8.561 4.111 0.08 0.00 H new ATOM 0 HA LEU A 129 21.969 7.833 3.754 0.05 0.00 H new ATOM 0 HB2 LEU A 129 19.383 6.256 3.985 1.00 0.00 H new ATOM 0 HB3 LEU A 129 20.949 5.474 3.907 1.00 0.00 H new ATOM 0 HG LEU A 129 20.155 7.495 6.027 0.05 0.00 H new ATOM 0 HD11 LEU A 129 19.971 5.554 7.533 0.09 0.00 H new ATOM 0 HD12 LEU A 129 18.793 5.470 6.202 0.09 0.00 H new ATOM 0 HD13 LEU A 129 20.261 4.464 6.157 0.09 0.00 H new ATOM 0 HD21 LEU A 129 22.153 6.655 7.203 0.77 0.00 H new ATOM 0 HD22 LEU A 129 22.524 5.607 5.814 0.77 0.00 H new ATOM 0 HD23 LEU A 129 22.568 7.376 5.629 0.77 0.00 H new ATOM 2008 N TYR A 130 20.067 7.347 1.147 1.00 0.00 N ATOM 2009 CA TYR A 130 20.076 6.978 -0.264 1.00 0.00 C ATOM 2010 C TYR A 130 21.133 7.762 -1.038 0.12 0.00 C ATOM 2011 O TYR A 130 21.756 7.234 -1.960 0.12 0.00 O ATOM 2012 CB TYR A 130 18.696 7.211 -0.880 0.06 0.00 C ATOM 2013 CG TYR A 130 18.613 6.817 -2.339 0.71 0.00 C ATOM 2014 CD1 TYR A 130 18.441 5.490 -2.710 0.58 0.00 C ATOM 2015 CD2 TYR A 130 18.709 7.774 -3.340 0.62 0.00 C ATOM 2016 CE1 TYR A 130 18.369 5.128 -4.042 0.31 0.00 C ATOM 2017 CE2 TYR A 130 18.637 7.418 -4.675 1.00 0.00 C ATOM 2018 CZ TYR A 130 18.467 6.094 -5.019 0.14 0.00 C ATOM 2019 OH TYR A 130 18.397 5.736 -6.345 0.79 0.00 O ATOM 0 H TYR A 130 19.199 7.777 1.466 1.00 0.00 H new ATOM 0 HA TYR A 130 20.325 5.919 -0.330 1.00 0.00 H new ATOM 0 HB2 TYR A 130 17.955 6.645 -0.316 0.06 0.00 H new ATOM 0 HB3 TYR A 130 18.436 8.265 -0.781 0.06 0.00 H new ATOM 0 HD1 TYR A 130 18.362 4.730 -1.947 0.58 0.00 H new ATOM 0 HD2 TYR A 130 18.842 8.812 -3.073 0.62 0.00 H new ATOM 0 HE1 TYR A 130 18.236 4.092 -4.316 0.31 0.00 H new ATOM 0 HE2 TYR A 130 18.714 8.173 -5.443 1.00 0.00 H new ATOM 0 HH TYR A 130 18.482 6.536 -6.905 0.79 0.00 H new ATOM 2029 N GLN A 131 21.334 9.020 -0.658 0.30 0.00 N ATOM 2030 CA GLN A 131 22.311 9.874 -1.326 0.35 0.00 C ATOM 2031 C GLN A 131 23.623 9.939 -0.547 0.09 0.00 C ATOM 2032 O GLN A 131 24.636 10.413 -1.061 1.00 0.00 O ATOM 2033 CB GLN A 131 21.748 11.285 -1.509 1.00 0.00 C ATOM 2034 CG GLN A 131 21.239 11.908 -0.222 1.00 0.00 C ATOM 2035 CD GLN A 131 20.761 13.335 -0.414 0.43 0.00 C ATOM 2036 OE1 GLN A 131 21.274 14.065 -1.262 0.83 0.00 O ATOM 2037 NE2 GLN A 131 19.768 13.734 0.371 0.83 0.00 N ATOM 0 H GLN A 131 20.834 9.471 0.108 0.30 0.00 H new ATOM 0 HA GLN A 131 22.516 9.437 -2.303 0.35 0.00 H new ATOM 0 HB2 GLN A 131 22.523 11.925 -1.931 1.00 0.00 H new ATOM 0 HB3 GLN A 131 20.934 11.251 -2.233 1.00 0.00 H new ATOM 0 HG2 GLN A 131 20.421 11.304 0.171 1.00 0.00 H new ATOM 0 HG3 GLN A 131 22.033 11.892 0.524 1.00 0.00 H new ATOM 0 HE21 GLN A 131 19.374 13.094 1.060 0.83 0.00 H new ATOM 0 HE22 GLN A 131 19.399 14.681 0.285 0.83 0.00 H new ATOM 2046 N GLU A 132 23.600 9.464 0.693 1.00 0.00 N ATOM 2047 CA GLU A 132 24.790 9.473 1.535 0.48 0.00 C ATOM 2048 C GLU A 132 25.500 8.123 1.499 0.93 0.00 C ATOM 2049 O GLU A 132 26.530 7.972 0.842 1.00 0.00 O ATOM 2050 CB GLU A 132 24.423 9.835 2.975 0.98 0.00 C ATOM 2051 CG GLU A 132 24.039 11.296 3.158 1.00 0.00 C ATOM 2052 CD GLU A 132 25.186 12.241 2.858 1.00 0.00 C ATOM 2053 OE1 GLU A 132 26.065 12.401 3.730 0.64 0.00 O ATOM 2054 OE2 GLU A 132 25.202 12.824 1.753 1.00 0.00 O ATOM 0 H GLU A 132 22.771 9.068 1.137 1.00 0.00 H new ATOM 0 HA GLU A 132 25.472 10.228 1.142 0.48 0.00 H new ATOM 0 HB2 GLU A 132 23.593 9.207 3.298 0.98 0.00 H new ATOM 0 HB3 GLU A 132 25.268 9.606 3.625 0.98 0.00 H new ATOM 0 HG2 GLU A 132 23.198 11.532 2.505 1.00 0.00 H new ATOM 0 HG3 GLU A 132 23.701 11.454 4.182 1.00 0.00 H new ATOM 2061 N ASN A 133 24.942 7.145 2.205 0.24 0.00 N ATOM 2062 CA ASN A 133 25.525 5.809 2.252 0.08 0.00 C ATOM 2063 C ASN A 133 24.601 4.793 1.588 0.37 0.00 C ATOM 2064 O ASN A 133 23.604 4.371 2.173 1.00 0.00 O ATOM 2065 CB ASN A 133 25.795 5.399 3.702 0.57 0.00 C ATOM 2066 CG ASN A 133 26.917 4.382 3.828 0.21 0.00 C ATOM 2067 OD1 ASN A 133 27.621 4.344 4.836 0.51 0.00 O ATOM 2068 ND2 ASN A 133 27.089 3.554 2.805 1.00 0.00 N ATOM 0 H ASN A 133 24.088 7.252 2.752 0.24 0.00 H new ATOM 0 HA ASN A 133 26.468 5.829 1.706 0.08 0.00 H new ATOM 0 HB2 ASN A 133 26.047 6.285 4.284 0.57 0.00 H new ATOM 0 HB3 ASN A 133 24.884 4.983 4.133 0.57 0.00 H new ATOM 0 HD21 ASN A 133 27.828 2.852 2.836 1.00 0.00 H new ATOM 0 HD22 ASN A 133 26.482 3.620 1.988 1.00 0.00 H new ATOM 2075 N LYS A 134 24.939 4.406 0.361 0.06 0.00 N ATOM 2076 CA LYS A 134 24.139 3.440 -0.384 1.00 0.00 C ATOM 2077 C LYS A 134 24.250 2.052 0.236 0.67 0.00 C ATOM 2078 O LYS A 134 23.326 1.244 0.145 1.00 0.00 O ATOM 2079 CB LYS A 134 24.590 3.392 -1.846 1.00 0.00 C ATOM 2080 CG LYS A 134 24.472 4.726 -2.567 0.79 0.00 C ATOM 2081 CD LYS A 134 24.956 4.626 -4.006 1.00 0.00 C ATOM 2082 CE LYS A 134 24.029 3.767 -4.852 1.00 0.00 C ATOM 2083 NZ LYS A 134 22.677 4.378 -4.985 0.21 0.00 N ATOM 0 H LYS A 134 25.761 4.747 -0.138 0.06 0.00 H new ATOM 0 HA LYS A 134 23.097 3.758 -0.341 1.00 0.00 H new ATOM 0 HB2 LYS A 134 25.627 3.058 -1.886 1.00 0.00 H new ATOM 0 HB3 LYS A 134 23.995 2.649 -2.376 1.00 0.00 H new ATOM 0 HG2 LYS A 134 23.434 5.058 -2.553 0.79 0.00 H new ATOM 0 HG3 LYS A 134 25.055 5.480 -2.037 0.79 0.00 H new ATOM 0 HD2 LYS A 134 25.022 5.625 -4.438 1.00 0.00 H new ATOM 0 HD3 LYS A 134 25.961 4.204 -4.024 1.00 0.00 H new ATOM 0 HE2 LYS A 134 24.464 3.628 -5.842 1.00 0.00 H new ATOM 0 HE3 LYS A 134 23.938 2.778 -4.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 22.166 3.924 -5.769 0.21 0.00 H new ATOM 0 HZ2 LYS A 134 22.146 4.242 -4.101 0.21 0.00 H new ATOM 0 HZ3 LYS A 134 22.773 5.395 -5.178 0.21 0.00 H new ATOM 2097 N ARG A 135 25.389 1.784 0.867 0.27 0.00 N ATOM 2098 CA ARG A 135 25.634 0.493 1.503 0.46 0.00 C ATOM 2099 C ARG A 135 24.627 0.225 2.620 1.00 0.00 C ATOM 2100 O ARG A 135 24.240 -0.919 2.853 1.00 0.00 O ATOM 2101 CB ARG A 135 27.058 0.445 2.060 1.00 0.00 C ATOM 2102 CG ARG A 135 27.381 -0.837 2.808 0.88 0.00 C ATOM 2103 CD ARG A 135 28.815 -0.838 3.312 0.65 0.00 C ATOM 2104 NE ARG A 135 29.119 0.358 4.093 0.60 0.00 N ATOM 2105 CZ ARG A 135 30.353 0.790 4.332 0.22 0.00 C ATOM 2106 NH1 ARG A 135 31.398 0.120 3.862 0.25 0.00 N ATOM 2107 NH2 ARG A 135 30.544 1.894 5.043 1.00 0.00 N ATOM 0 H ARG A 135 26.160 2.446 0.952 0.27 0.00 H new ATOM 0 HA ARG A 135 25.515 -0.283 0.747 0.46 0.00 H new ATOM 0 HB2 ARG A 135 27.764 0.563 1.238 1.00 0.00 H new ATOM 0 HB3 ARG A 135 27.205 1.292 2.730 1.00 0.00 H new ATOM 0 HG2 ARG A 135 26.698 -0.951 3.650 0.88 0.00 H new ATOM 0 HG3 ARG A 135 27.224 -1.693 2.151 0.88 0.00 H new ATOM 0 HD2 ARG A 135 28.984 -1.724 3.924 0.65 0.00 H new ATOM 0 HD3 ARG A 135 29.498 -0.901 2.465 0.65 0.00 H new ATOM 0 HE ARG A 135 28.340 0.892 4.477 0.60 0.00 H new ATOM 0 HH11 ARG A 135 31.255 -0.729 3.315 0.25 0.00 H new ATOM 0 HH12 ARG A 135 32.344 0.454 4.047 0.25 0.00 H new ATOM 0 HH21 ARG A 135 29.744 2.411 5.406 1.00 0.00 H new ATOM 0 HH22 ARG A 135 31.491 2.225 5.226 1.00 0.00 H new ATOM 2121 N GLU A 136 24.207 1.283 3.305 0.74 0.00 N ATOM 2122 CA GLU A 136 23.251 1.149 4.400 0.27 0.00 C ATOM 2123 C GLU A 136 21.833 0.938 3.877 0.09 0.00 C ATOM 2124 O GLU A 136 21.006 0.314 4.540 1.00 0.00 O ATOM 2125 CB GLU A 136 23.300 2.383 5.303 1.00 0.00 C ATOM 2126 CG GLU A 136 24.639 2.571 5.997 1.00 0.00 C ATOM 2127 CD GLU A 136 24.624 3.706 7.003 0.08 0.00 C ATOM 2128 OE1 GLU A 136 24.921 4.853 6.609 1.00 0.00 O ATOM 2129 OE2 GLU A 136 24.316 3.447 8.185 0.64 0.00 O ATOM 0 H GLU A 136 24.511 2.239 3.123 0.74 0.00 H new ATOM 0 HA GLU A 136 23.531 0.270 4.981 0.27 0.00 H new ATOM 0 HB2 GLU A 136 23.081 3.269 4.707 1.00 0.00 H new ATOM 0 HB3 GLU A 136 22.517 2.304 6.057 1.00 0.00 H new ATOM 0 HG2 GLU A 136 24.914 1.646 6.504 1.00 0.00 H new ATOM 0 HG3 GLU A 136 25.407 2.765 5.248 1.00 0.00 H new ATOM 2136 N TYR A 137 21.559 1.458 2.684 1.00 0.00 N ATOM 2137 CA TYR A 137 20.237 1.326 2.077 1.00 0.00 C ATOM 2138 C TYR A 137 20.007 -0.090 1.553 0.22 0.00 C ATOM 2139 O TYR A 137 18.979 -0.705 1.841 0.57 0.00 O ATOM 2140 CB TYR A 137 20.075 2.336 0.939 1.00 0.00 C ATOM 2141 CG TYR A 137 18.659 2.445 0.417 1.00 0.00 C ATOM 2142 CD1 TYR A 137 17.656 3.020 1.187 1.00 0.00 C ATOM 2143 CD2 TYR A 137 18.325 1.978 -0.849 0.12 0.00 C ATOM 2144 CE1 TYR A 137 16.362 3.126 0.714 0.13 0.00 C ATOM 2145 CE2 TYR A 137 17.035 2.080 -1.330 0.09 0.00 C ATOM 2146 CZ TYR A 137 16.056 2.654 -0.546 0.30 0.00 C ATOM 2147 OH TYR A 137 14.770 2.759 -1.022 0.20 0.00 O ATOM 0 H TYR A 137 22.233 1.974 2.119 1.00 0.00 H new ATOM 0 HA TYR A 137 19.493 1.529 2.847 1.00 0.00 H new ATOM 0 HB2 TYR A 137 20.401 3.316 1.287 1.00 0.00 H new ATOM 0 HB3 TYR A 137 20.734 2.054 0.118 1.00 0.00 H new ATOM 0 HD1 TYR A 137 17.892 3.391 2.173 1.00 0.00 H new ATOM 0 HD2 TYR A 137 19.088 1.528 -1.467 0.12 0.00 H new ATOM 0 HE1 TYR A 137 15.595 3.576 1.327 0.13 0.00 H new ATOM 0 HE2 TYR A 137 16.793 1.712 -2.316 0.09 0.00 H new ATOM 0 HH TYR A 137 14.723 2.380 -1.925 0.20 0.00 H new ATOM 2157 N GLU A 138 20.965 -0.600 0.787 0.13 0.00 N ATOM 2158 CA GLU A 138 20.862 -1.942 0.217 0.28 0.00 C ATOM 2159 C GLU A 138 20.659 -2.995 1.305 0.50 0.00 C ATOM 2160 O GLU A 138 19.814 -3.881 1.172 0.07 0.00 O ATOM 2161 CB GLU A 138 22.111 -2.274 -0.604 1.00 0.00 C ATOM 2162 CG GLU A 138 23.411 -2.125 0.170 1.00 0.00 C ATOM 2163 CD GLU A 138 24.622 -2.548 -0.638 0.08 0.00 C ATOM 2164 OE1 GLU A 138 25.179 -1.696 -1.363 0.37 0.00 O ATOM 2165 OE2 GLU A 138 25.011 -3.731 -0.546 0.17 0.00 O ATOM 0 H GLU A 138 21.823 -0.105 0.545 0.13 0.00 H new ATOM 0 HA GLU A 138 19.991 -1.956 -0.438 0.28 0.00 H new ATOM 0 HB2 GLU A 138 22.032 -3.298 -0.970 1.00 0.00 H new ATOM 0 HB3 GLU A 138 22.143 -1.624 -1.478 1.00 0.00 H new ATOM 0 HG2 GLU A 138 23.529 -1.086 0.478 1.00 0.00 H new ATOM 0 HG3 GLU A 138 23.359 -2.723 1.080 1.00 0.00 H new ATOM 2172 N LYS A 139 21.437 -2.895 2.380 0.14 0.00 N ATOM 2173 CA LYS A 139 21.343 -3.842 3.486 0.28 0.00 C ATOM 2174 C LYS A 139 19.939 -3.862 4.081 0.11 0.00 C ATOM 2175 O LYS A 139 19.463 -4.900 4.541 0.23 0.00 O ATOM 2176 CB LYS A 139 22.357 -3.491 4.573 1.00 0.00 C ATOM 2177 CG LYS A 139 23.801 -3.715 4.154 1.00 0.00 C ATOM 2178 CD LYS A 139 24.760 -3.493 5.314 1.00 0.00 C ATOM 2179 CE LYS A 139 24.780 -2.037 5.757 0.39 0.00 C ATOM 2180 NZ LYS A 139 25.689 -1.823 6.919 0.11 0.00 N ATOM 0 H LYS A 139 22.140 -2.167 2.508 0.14 0.00 H new ATOM 0 HA LYS A 139 21.563 -4.834 3.092 0.28 0.00 H new ATOM 0 HB2 LYS A 139 22.227 -2.446 4.855 1.00 0.00 H new ATOM 0 HB3 LYS A 139 22.148 -4.089 5.460 1.00 0.00 H new ATOM 0 HG2 LYS A 139 23.917 -4.730 3.774 1.00 0.00 H new ATOM 0 HG3 LYS A 139 24.053 -3.038 3.338 1.00 0.00 H new ATOM 0 HD2 LYS A 139 24.469 -4.125 6.153 1.00 0.00 H new ATOM 0 HD3 LYS A 139 25.764 -3.798 5.019 1.00 0.00 H new ATOM 0 HE2 LYS A 139 25.099 -1.409 4.926 0.39 0.00 H new ATOM 0 HE3 LYS A 139 23.770 -1.724 6.023 0.39 0.00 H new ATOM 0 HZ1 LYS A 139 25.675 -0.819 7.191 0.11 0.00 H new ATOM 0 HZ2 LYS A 139 25.370 -2.403 7.721 0.11 0.00 H new ATOM 0 HZ3 LYS A 139 26.657 -2.097 6.657 0.11 0.00 H new ATOM 2194 N ARG A 140 19.278 -2.710 4.068 0.10 0.00 N ATOM 2195 CA ARG A 140 17.929 -2.593 4.610 0.65 0.00 C ATOM 2196 C ARG A 140 16.911 -3.290 3.713 1.00 0.00 C ATOM 2197 O ARG A 140 15.937 -3.865 4.199 1.00 0.00 O ATOM 2198 CB ARG A 140 17.552 -1.120 4.778 0.99 0.00 C ATOM 2199 CG ARG A 140 18.318 -0.412 5.886 1.00 0.00 C ATOM 2200 CD ARG A 140 17.839 -0.838 7.265 1.00 0.00 C ATOM 2201 NE ARG A 140 18.332 -2.161 7.638 0.41 0.00 N ATOM 2202 CZ ARG A 140 18.224 -2.670 8.863 0.05 0.00 C ATOM 2203 NH1 ARG A 140 17.636 -1.972 9.825 0.87 0.00 N ATOM 2204 NH2 ARG A 140 18.703 -3.880 9.124 0.34 0.00 N ATOM 0 H ARG A 140 19.655 -1.842 3.687 0.10 0.00 H new ATOM 0 HA ARG A 140 17.916 -3.081 5.584 0.65 0.00 H new ATOM 0 HB2 ARG A 140 17.729 -0.600 3.837 0.99 0.00 H new ATOM 0 HB3 ARG A 140 16.484 -1.049 4.985 0.99 0.00 H new ATOM 0 HG2 ARG A 140 19.382 -0.628 5.788 1.00 0.00 H new ATOM 0 HG3 ARG A 140 18.201 0.666 5.777 1.00 0.00 H new ATOM 0 HD2 ARG A 140 18.170 -0.108 8.004 1.00 0.00 H new ATOM 0 HD3 ARG A 140 16.749 -0.840 7.284 1.00 0.00 H new ATOM 0 HE ARG A 140 18.784 -2.727 6.920 0.41 0.00 H new ATOM 0 HH11 ARG A 140 17.265 -1.043 9.627 0.87 0.00 H new ATOM 0 HH12 ARG A 140 17.555 -2.364 10.763 0.87 0.00 H new ATOM 0 HH21 ARG A 140 19.154 -4.420 8.386 0.34 0.00 H new ATOM 0 HH22 ARG A 140 18.620 -4.270 10.063 0.34 0.00 H new ATOM 2218 N VAL A 141 17.141 -3.236 2.404 0.06 0.00 N ATOM 2219 CA VAL A 141 16.237 -3.862 1.444 0.07 0.00 C ATOM 2220 C VAL A 141 16.132 -5.367 1.680 0.11 0.00 C ATOM 2221 O VAL A 141 15.034 -5.912 1.781 0.33 0.00 O ATOM 2222 CB VAL A 141 16.694 -3.608 -0.006 0.36 0.00 C ATOM 2223 CG1 VAL A 141 15.717 -4.227 -0.994 0.05 0.00 C ATOM 2224 CG2 VAL A 141 16.848 -2.117 -0.262 0.83 0.00 C ATOM 0 H VAL A 141 17.944 -2.766 1.985 0.06 0.00 H new ATOM 0 HA VAL A 141 15.257 -3.409 1.593 0.07 0.00 H new ATOM 0 HB VAL A 141 17.665 -4.082 -0.148 0.36 0.00 H new ATOM 0 HG11 VAL A 141 16.058 -4.036 -2.011 0.05 0.00 H new ATOM 0 HG12 VAL A 141 15.662 -5.303 -0.826 0.05 0.00 H new ATOM 0 HG13 VAL A 141 14.730 -3.787 -0.854 0.05 0.00 H new ATOM 0 HG21 VAL A 141 17.171 -1.956 -1.290 0.83 0.00 H new ATOM 0 HG22 VAL A 141 15.892 -1.619 -0.100 0.83 0.00 H new ATOM 0 HG23 VAL A 141 17.592 -1.706 0.421 0.83 0.00 H new ATOM 2234 N SER A 142 17.279 -6.032 1.769 0.09 0.00 N ATOM 2235 CA SER A 142 17.310 -7.474 1.994 0.26 0.00 C ATOM 2236 C SER A 142 16.809 -7.825 3.392 1.00 0.00 C ATOM 2237 O SER A 142 16.244 -8.896 3.608 1.00 0.00 O ATOM 2238 CB SER A 142 18.727 -8.014 1.797 0.07 0.00 C ATOM 2239 OG SER A 142 18.772 -9.416 1.993 0.12 0.00 O ATOM 0 H SER A 142 18.198 -5.597 1.689 0.09 0.00 H new ATOM 0 HA SER A 142 16.646 -7.940 1.266 0.26 0.00 H new ATOM 0 HB2 SER A 142 19.075 -7.773 0.792 0.07 0.00 H new ATOM 0 HB3 SER A 142 19.406 -7.524 2.495 0.07 0.00 H new ATOM 0 HG SER A 142 19.689 -9.736 1.860 0.12 0.00 H new ATOM 2245 N ALA A 143 17.023 -6.915 4.339 0.61 0.00 N ATOM 2246 CA ALA A 143 16.600 -7.131 5.717 0.14 0.00 C ATOM 2247 C ALA A 143 15.078 -7.176 5.838 0.08 0.00 C ATOM 2248 O ALA A 143 14.517 -8.150 6.340 0.41 0.00 O ATOM 2249 CB ALA A 143 17.168 -6.042 6.616 0.15 0.00 C ATOM 0 H ALA A 143 17.487 -6.021 4.176 0.61 0.00 H new ATOM 0 HA ALA A 143 16.986 -8.099 6.037 0.14 0.00 H new ATOM 0 HB1 ALA A 143 16.846 -6.213 7.643 0.15 0.00 H new ATOM 0 HB2 ALA A 143 18.257 -6.063 6.569 0.15 0.00 H new ATOM 0 HB3 ALA A 143 16.809 -5.069 6.280 0.15 0.00 H new ATOM 2255 N ILE A 144 14.417 -6.117 5.378 0.54 0.00 N ATOM 2256 CA ILE A 144 12.961 -6.031 5.445 0.82 0.00 C ATOM 2257 C ILE A 144 12.292 -7.176 4.692 0.45 0.00 C ATOM 2258 O ILE A 144 11.221 -7.642 5.082 0.80 0.00 O ATOM 2259 CB ILE A 144 12.449 -4.690 4.884 0.09 0.00 C ATOM 2260 CG1 ILE A 144 12.878 -4.525 3.423 0.36 0.00 C ATOM 2261 CG2 ILE A 144 12.965 -3.536 5.731 0.19 0.00 C ATOM 2262 CD1 ILE A 144 12.323 -3.280 2.763 0.31 0.00 C ATOM 0 H ILE A 144 14.867 -5.306 4.954 0.54 0.00 H new ATOM 0 HA ILE A 144 12.697 -6.102 6.500 0.82 0.00 H new ATOM 0 HB ILE A 144 11.360 -4.685 4.922 0.09 0.00 H new ATOM 0 HG12 ILE A 144 13.967 -4.497 3.374 0.36 0.00 H new ATOM 0 HG13 ILE A 144 12.556 -5.400 2.858 0.36 0.00 H new ATOM 0 HG21 ILE A 144 12.597 -2.594 5.325 0.19 0.00 H new ATOM 0 HG22 ILE A 144 12.613 -3.652 6.756 0.19 0.00 H new ATOM 0 HG23 ILE A 144 14.055 -3.535 5.719 0.19 0.00 H new ATOM 0 HD11 ILE A 144 12.669 -3.230 1.731 0.31 0.00 H new ATOM 0 HD12 ILE A 144 11.234 -3.314 2.779 0.31 0.00 H new ATOM 0 HD13 ILE A 144 12.666 -2.398 3.303 0.31 0.00 H new ATOM 2274 N VAL A 145 12.924 -7.625 3.615 0.22 0.00 N ATOM 2275 CA VAL A 145 12.382 -8.717 2.815 0.07 0.00 C ATOM 2276 C VAL A 145 12.587 -10.058 3.508 1.00 0.00 C ATOM 2277 O VAL A 145 11.718 -10.928 3.466 0.05 0.00 O ATOM 2278 CB VAL A 145 13.023 -8.762 1.412 0.44 0.00 C ATOM 2279 CG1 VAL A 145 12.585 -10.008 0.655 0.07 0.00 C ATOM 2280 CG2 VAL A 145 12.672 -7.507 0.626 0.78 0.00 C ATOM 0 H VAL A 145 13.810 -7.251 3.276 0.22 0.00 H new ATOM 0 HA VAL A 145 11.314 -8.531 2.706 0.07 0.00 H new ATOM 0 HB VAL A 145 14.105 -8.803 1.533 0.44 0.00 H new ATOM 0 HG11 VAL A 145 13.050 -10.017 -0.331 0.07 0.00 H new ATOM 0 HG12 VAL A 145 12.890 -10.896 1.208 0.07 0.00 H new ATOM 0 HG13 VAL A 145 11.501 -10.004 0.545 0.07 0.00 H new ATOM 0 HG21 VAL A 145 13.132 -7.555 -0.361 0.78 0.00 H new ATOM 0 HG22 VAL A 145 11.590 -7.436 0.519 0.78 0.00 H new ATOM 0 HG23 VAL A 145 13.043 -6.630 1.157 0.78 0.00 H new ATOM 2290 N GLU A 146 13.741 -10.216 4.150 1.00 0.00 N ATOM 2291 CA GLU A 146 14.064 -11.453 4.851 0.13 0.00 C ATOM 2292 C GLU A 146 13.045 -11.740 5.949 0.12 0.00 C ATOM 2293 O GLU A 146 12.603 -12.876 6.118 0.29 0.00 O ATOM 2294 CB GLU A 146 15.469 -11.371 5.451 0.27 0.00 C ATOM 2295 CG GLU A 146 15.908 -12.648 6.151 1.00 0.00 C ATOM 2296 CD GLU A 146 17.289 -12.530 6.765 1.00 0.00 C ATOM 2297 OE1 GLU A 146 18.283 -12.701 6.030 0.25 0.00 O ATOM 2298 OE2 GLU A 146 17.375 -12.268 7.983 0.82 0.00 O ATOM 0 H GLU A 146 14.468 -9.502 4.199 1.00 0.00 H new ATOM 0 HA GLU A 146 14.031 -12.269 4.129 0.13 0.00 H new ATOM 0 HB2 GLU A 146 16.180 -11.138 4.659 0.27 0.00 H new ATOM 0 HB3 GLU A 146 15.503 -10.546 6.163 0.27 0.00 H new ATOM 0 HG2 GLU A 146 15.188 -12.897 6.930 1.00 0.00 H new ATOM 0 HG3 GLU A 146 15.901 -13.471 5.436 1.00 0.00 H new ATOM 2305 N GLN A 147 12.676 -10.701 6.693 0.39 0.00 N ATOM 2306 CA GLN A 147 11.711 -10.840 7.777 0.20 0.00 C ATOM 2307 C GLN A 147 10.356 -11.300 7.247 1.00 0.00 C ATOM 2308 O GLN A 147 9.643 -12.054 7.909 1.00 0.00 O ATOM 2309 CB GLN A 147 11.556 -9.514 8.524 0.07 0.00 C ATOM 2310 CG GLN A 147 12.849 -9.007 9.148 0.73 0.00 C ATOM 2311 CD GLN A 147 13.293 -9.836 10.340 0.34 0.00 C ATOM 2312 OE1 GLN A 147 13.032 -11.037 10.414 0.62 0.00 O ATOM 2313 NE2 GLN A 147 13.970 -9.193 11.286 0.42 0.00 N ATOM 0 H GLN A 147 13.031 -9.754 6.564 0.39 0.00 H new ATOM 0 HA GLN A 147 12.086 -11.596 8.467 0.20 0.00 H new ATOM 0 HB2 GLN A 147 11.177 -8.761 7.834 0.07 0.00 H new ATOM 0 HB3 GLN A 147 10.808 -9.634 9.307 0.07 0.00 H new ATOM 0 HG2 GLN A 147 13.637 -9.012 8.395 0.73 0.00 H new ATOM 0 HG3 GLN A 147 12.714 -7.972 9.461 0.73 0.00 H new ATOM 0 HE21 GLN A 147 14.165 -8.197 11.186 0.42 0.00 H new ATOM 0 HE22 GLN A 147 14.294 -9.696 12.112 0.42 0.00 H new ATOM 2322 N SER A 148 10.006 -10.841 6.049 0.11 0.00 N ATOM 2323 CA SER A 148 8.734 -11.205 5.432 0.19 0.00 C ATOM 2324 C SER A 148 8.924 -12.320 4.406 0.13 0.00 C ATOM 2325 O SER A 148 8.038 -12.580 3.591 0.08 0.00 O ATOM 2326 CB SER A 148 8.100 -9.983 4.764 0.85 0.00 C ATOM 2327 OG SER A 148 6.838 -10.304 4.204 0.14 0.00 O ATOM 0 H SER A 148 10.584 -10.217 5.486 0.11 0.00 H new ATOM 0 HA SER A 148 8.069 -11.568 6.216 0.19 0.00 H new ATOM 0 HB2 SER A 148 7.984 -9.184 5.496 0.85 0.00 H new ATOM 0 HB3 SER A 148 8.762 -9.607 3.984 0.85 0.00 H new ATOM 0 HG SER A 148 6.852 -11.226 3.872 0.14 0.00 H new ATOM 2333 N TRP A 149 10.076 -12.978 4.455 0.30 0.00 N ATOM 2334 CA TRP A 149 10.376 -14.064 3.526 1.00 0.00 C ATOM 2335 C TRP A 149 10.045 -15.418 4.149 0.29 0.00 C ATOM 2336 O TRP A 149 10.674 -15.832 5.124 0.12 0.00 O ATOM 2337 CB TRP A 149 11.851 -14.024 3.120 0.06 0.00 C ATOM 2338 CG TRP A 149 12.095 -14.503 1.722 1.00 0.00 C ATOM 2339 CD1 TRP A 149 12.020 -13.762 0.578 0.41 0.00 C ATOM 2340 CD2 TRP A 149 12.451 -15.829 1.319 0.13 0.00 C ATOM 2341 NE1 TRP A 149 12.310 -14.546 -0.512 0.17 0.00 N ATOM 2342 CE2 TRP A 149 12.578 -15.820 -0.085 0.41 0.00 C ATOM 2343 CE3 TRP A 149 12.679 -17.025 2.007 1.00 0.00 C ATOM 2344 CZ2 TRP A 149 12.921 -16.958 -0.809 0.08 0.00 C ATOM 2345 CZ3 TRP A 149 13.019 -18.154 1.286 0.10 0.00 C ATOM 2346 CH2 TRP A 149 13.137 -18.114 -0.110 0.07 0.00 C ATOM 0 H TRP A 149 10.818 -12.780 5.127 0.30 0.00 H new ATOM 0 HA TRP A 149 9.758 -13.931 2.638 1.00 0.00 H new ATOM 0 HB2 TRP A 149 12.219 -13.003 3.216 0.06 0.00 H new ATOM 0 HB3 TRP A 149 12.428 -14.637 3.812 0.06 0.00 H new ATOM 0 HD1 TRP A 149 11.769 -12.712 0.536 0.41 0.00 H new ATOM 0 HE1 TRP A 149 12.324 -14.231 -1.482 0.17 0.00 H new ATOM 0 HE3 TRP A 149 12.591 -17.066 3.083 1.00 0.00 H new ATOM 0 HZ2 TRP A 149 13.013 -16.930 -1.885 0.08 0.00 H new ATOM 0 HZ3 TRP A 149 13.197 -19.083 1.807 0.10 0.00 H new ATOM 0 HH2 TRP A 149 13.404 -19.014 -0.645 0.07 0.00 H new ATOM 2357 N ASN A 150 9.056 -16.101 3.582 1.00 0.00 N ATOM 2358 CA ASN A 150 8.642 -17.408 4.082 0.21 0.00 C ATOM 2359 C ASN A 150 9.135 -18.523 3.166 0.13 0.00 C ATOM 2360 O ASN A 150 8.973 -18.456 1.948 1.00 0.00 O ATOM 2361 CB ASN A 150 7.119 -17.471 4.206 0.88 0.00 C ATOM 2362 CG ASN A 150 6.636 -18.817 4.711 0.80 0.00 C ATOM 2363 OD1 ASN A 150 6.513 -19.033 5.917 0.07 0.00 O ATOM 2364 ND2 ASN A 150 6.359 -19.731 3.788 0.29 0.00 N ATOM 0 H ASN A 150 8.526 -15.771 2.775 1.00 0.00 H new ATOM 0 HA ASN A 150 9.086 -17.549 5.067 0.21 0.00 H new ATOM 0 HB2 ASN A 150 6.780 -16.688 4.884 0.88 0.00 H new ATOM 0 HB3 ASN A 150 6.669 -17.268 3.234 0.88 0.00 H new ATOM 0 HD21 ASN A 150 6.030 -20.655 4.068 0.29 0.00 H new ATOM 0 HD22 ASN A 150 6.475 -19.509 2.799 0.29 0.00 H new ATOM 2371 N ASP A 151 9.735 -19.549 3.763 0.10 0.00 N ATOM 2372 CA ASP A 151 10.252 -20.681 3.002 0.17 0.00 C ATOM 2373 C ASP A 151 9.424 -21.937 3.263 0.05 0.00 C ATOM 2374 O ASP A 151 8.623 -21.980 4.198 1.00 0.00 O ATOM 2375 CB ASP A 151 11.716 -20.939 3.361 0.09 0.00 C ATOM 2376 CG ASP A 151 11.909 -21.217 4.839 1.00 0.00 C ATOM 2377 OD1 ASP A 151 12.081 -20.248 5.607 0.08 0.00 O ATOM 2378 OD2 ASP A 151 11.887 -22.403 5.227 0.11 0.00 O ATOM 0 H ASP A 151 9.875 -19.619 4.771 0.10 0.00 H new ATOM 0 HA ASP A 151 10.183 -20.435 1.942 0.17 0.00 H new ATOM 0 HB2 ASP A 151 12.085 -21.787 2.784 0.09 0.00 H new ATOM 0 HB3 ASP A 151 12.315 -20.074 3.076 0.09 0.00 H new ATOM 2383 N SER A 152 9.623 -22.955 2.430 1.00 0.00 N ATOM 2384 CA SER A 152 8.896 -24.213 2.570 0.06 0.00 C ATOM 2385 C SER A 152 9.816 -25.317 3.083 0.21 0.00 C ATOM 2386 O SER A 152 9.889 -25.503 4.315 0.17 0.00 O ATOM 2387 CB SER A 152 8.279 -24.625 1.233 0.57 0.00 C ATOM 2388 OG SER A 152 7.376 -23.639 0.762 0.37 0.00 O ATOM 2389 OXT SER A 152 10.457 -25.989 2.245 0.16 0.00 O ATOM 0 H SER A 152 10.281 -22.933 1.651 1.00 0.00 H new ATOM 0 HA SER A 152 8.097 -24.063 3.296 0.06 0.00 H new ATOM 0 HB2 SER A 152 9.068 -24.781 0.497 0.57 0.00 H new ATOM 0 HB3 SER A 152 7.757 -25.575 1.347 0.57 0.00 H new ATOM 0 HG SER A 152 6.997 -23.926 -0.095 0.37 0.00 H new TER 2395 SER A 152