USER MOD reduce.3.24.130724 H: found=0, std=0, add=1057, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1054 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 65 ASN : amide:sc= -0.0922 X(o=-0.035,f=0.056) USER MOD Set 1.2: A 130 SER OG : rot 93:sc= 0.0574 USER MOD Set 2.1: A -4 SER OG : rot 180:sc= -0.0407 USER MOD Set 2.2: A 125 MET CE :methyl 167:sc= -0.265 (180deg=-0.784) USER MOD Set 3.1: A 99 ASN : amide:sc= -1.1 K(o=-1.2,f=0.12) USER MOD Set 3.2: A 103 THR OG1 : rot 180:sc= -0.0498 USER MOD Set 4.1: A 36 TYR OH : rot -26:sc= 1.26 USER MOD Set 4.2: A 43 GLN : amide:sc= 0.979 K(o=2.2,f=2.8) USER MOD Set 5.1: A 34 LYS NZ :NH3+ 144:sc= 0.782 (180deg=-0.314) USER MOD Set 5.2: A 71 GLN : amide:sc= 0.901 K(o=1.7,f=-6.1!) USER MOD Set 6.1: A 29 CYS SG : rot 100:sc= -0.932 USER MOD Set 6.2: A 115 MET CE :methyl 169:sc= -1.82! (180deg=-1.86) USER MOD Set 7.1: A 10 SER OG : rot 153:sc= 0.451 USER MOD Set 7.2: A 11 ASN : amide:sc= 0.495 X(o=0.95,f=1.2) USER MOD Single : A 1 MET CE :methyl -167:sc= -1.63 (180deg=-2.5!) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A -1 SER OG : rot 180:sc= 0 USER MOD Single : A -2 SER OG : rot 180:sc= 0 USER MOD Single : A -5 SER OG : rot 180:sc= 0 USER MOD Single : A -6 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 CYS SG : rot 180:sc= -0.408 USER MOD Single : A 16 SER OG : rot 180:sc= -0.102 USER MOD Single : A 17 CYS SG : rot 180:sc= 0.014 USER MOD Single : A 18 GLN : amide:sc= -0.0319 K(o=-0.032,f=-0.63) USER MOD Single : A 19 SER OG : rot -55:sc= 0.0616 USER MOD Single : A 20 CYS SG : rot 180:sc= -0.105 USER MOD Single : A 21 GLN : amide:sc= -0.383 K(o=-0.38,f=-2.4!) USER MOD Single : A 26 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc=6.43e-05 USER MOD Single : A 41 ASN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 44 MET CE :methyl -105:sc= -0.213 (180deg=-1.56!) USER MOD Single : A 45 TYR OH : rot 54:sc= 2.01 USER MOD Single : A 47 GLN : amide:sc= -0.574 X(o=-0.57,f=-0.52) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0.0142 USER MOD Single : A 52 MET CE :methyl -160:sc= -0.0237 (180deg=-0.701) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 HIS : no HD1:sc=-0.00367 X(o=-0.0037,f=-0.11) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 MET CE :methyl -179:sc= -1.23 (180deg=-1.24) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 83 SER OG : rot 180:sc= -0.0596 USER MOD Single : A 85 THR OG1 : rot 180:sc=-0.00133 USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 96 CYS SG : rot 67:sc= 0.712 USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 ASN : amide:sc= -0.135 K(o=-0.13,f=-1.1) USER MOD Single : A 102 LYS NZ :NH3+ 153:sc= 0.0285 (180deg=0) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 117 MET CE :methyl 152:sc= -0.0738 (180deg=-0.861) USER MOD Single : A 118 ASN : amide:sc= -3.68! C(o=-3.7!,f=-1.5!) USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= -0.0717 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -6 9.968 -25.850 21.466 1.00 0.00 N ATOM 2 CA GLY A -6 9.057 -25.431 20.416 1.00 0.00 C ATOM 3 C GLY A -6 7.764 -26.221 20.422 1.00 0.00 C ATOM 4 O GLY A -6 7.678 -27.288 19.815 1.00 0.00 O ATOM 0 H1 GLY A -6 10.837 -25.280 21.420 1.00 0.00 H new ATOM 0 H2 GLY A -6 9.515 -25.716 22.393 1.00 0.00 H new ATOM 0 H3 GLY A -6 10.206 -26.854 21.339 1.00 0.00 H new ATOM 0 HA2 GLY A -6 8.832 -24.371 20.536 1.00 0.00 H new ATOM 0 HA3 GLY A -6 9.545 -25.546 19.448 1.00 0.00 H new ATOM 8 N SER A -5 6.755 -25.697 21.110 1.00 0.00 N ATOM 9 CA SER A -5 5.461 -26.364 21.197 1.00 0.00 C ATOM 10 C SER A -5 4.334 -25.420 20.787 1.00 0.00 C ATOM 11 O SER A -5 3.417 -25.157 21.564 1.00 0.00 O ATOM 12 CB SER A -5 5.221 -26.875 22.619 1.00 0.00 C ATOM 13 OG SER A -5 5.548 -25.886 23.579 1.00 0.00 O ATOM 0 H SER A -5 6.808 -24.813 21.615 1.00 0.00 H new ATOM 0 HA SER A -5 5.470 -27.211 20.511 1.00 0.00 H new ATOM 0 HB2 SER A -5 4.177 -27.165 22.733 1.00 0.00 H new ATOM 0 HB3 SER A -5 5.821 -27.768 22.794 1.00 0.00 H new ATOM 0 HG SER A -5 5.384 -26.237 24.479 1.00 0.00 H new ATOM 19 N SER A -4 4.412 -24.913 19.561 1.00 0.00 N ATOM 20 CA SER A -4 3.403 -23.994 19.048 1.00 0.00 C ATOM 21 C SER A -4 2.244 -24.759 18.416 1.00 0.00 C ATOM 22 O SER A -4 1.112 -24.701 18.896 1.00 0.00 O ATOM 23 CB SER A -4 4.022 -23.044 18.021 1.00 0.00 C ATOM 24 OG SER A -4 3.031 -22.229 17.418 1.00 0.00 O ATOM 0 H SER A -4 5.164 -25.123 18.904 1.00 0.00 H new ATOM 0 HA SER A -4 3.018 -23.411 19.885 1.00 0.00 H new ATOM 0 HB2 SER A -4 4.769 -22.415 18.506 1.00 0.00 H new ATOM 0 HB3 SER A -4 4.540 -23.620 17.254 1.00 0.00 H new ATOM 0 HG SER A -4 3.452 -21.630 16.767 1.00 0.00 H new ATOM 30 N GLY A -3 2.535 -25.476 17.335 1.00 0.00 N ATOM 31 CA GLY A -3 1.508 -26.243 16.654 1.00 0.00 C ATOM 32 C GLY A -3 1.951 -26.717 15.284 1.00 0.00 C ATOM 33 O GLY A -3 2.097 -27.917 15.053 1.00 0.00 O ATOM 0 H GLY A -3 3.464 -25.539 16.918 1.00 0.00 H new ATOM 0 HA2 GLY A -3 1.239 -27.105 17.264 1.00 0.00 H new ATOM 0 HA3 GLY A -3 0.611 -25.632 16.551 1.00 0.00 H new ATOM 37 N SER A -2 2.164 -25.773 14.373 1.00 0.00 N ATOM 38 CA SER A -2 2.587 -26.101 13.017 1.00 0.00 C ATOM 39 C SER A -2 1.559 -26.992 12.327 1.00 0.00 C ATOM 40 O SER A -2 1.906 -27.834 11.499 1.00 0.00 O ATOM 41 CB SER A -2 3.949 -26.798 13.040 1.00 0.00 C ATOM 42 OG SER A -2 4.780 -26.260 14.054 1.00 0.00 O ATOM 0 H SER A -2 2.051 -24.775 14.550 1.00 0.00 H new ATOM 0 HA SER A -2 2.671 -25.171 12.454 1.00 0.00 H new ATOM 0 HB2 SER A -2 3.812 -27.866 13.207 1.00 0.00 H new ATOM 0 HB3 SER A -2 4.434 -26.687 12.070 1.00 0.00 H new ATOM 0 HG SER A -2 5.644 -26.723 14.049 1.00 0.00 H new ATOM 48 N SER A -1 0.291 -26.801 12.676 1.00 0.00 N ATOM 49 CA SER A -1 -0.789 -27.590 12.095 1.00 0.00 C ATOM 50 C SER A -1 -1.627 -26.744 11.140 1.00 0.00 C ATOM 51 O SER A -1 -2.328 -25.824 11.560 1.00 0.00 O ATOM 52 CB SER A -1 -1.679 -28.166 13.198 1.00 0.00 C ATOM 53 OG SER A -1 -2.360 -29.326 12.750 1.00 0.00 O ATOM 0 H SER A -1 -0.014 -26.107 13.358 1.00 0.00 H new ATOM 0 HA SER A -1 -0.344 -28.410 11.532 1.00 0.00 H new ATOM 0 HB2 SER A -1 -1.071 -28.411 14.069 1.00 0.00 H new ATOM 0 HB3 SER A -1 -2.403 -27.415 13.515 1.00 0.00 H new ATOM 0 HG SER A -1 -2.921 -29.676 13.474 1.00 0.00 H new ATOM 59 N GLY A 0 -1.547 -27.062 9.852 1.00 0.00 N ATOM 60 CA GLY A 0 -2.301 -26.323 8.857 1.00 0.00 C ATOM 61 C GLY A 0 -2.033 -24.832 8.916 1.00 0.00 C ATOM 62 O GLY A 0 -2.703 -24.103 9.648 1.00 0.00 O ATOM 0 H GLY A 0 -0.973 -27.819 9.480 1.00 0.00 H new ATOM 0 HA2 GLY A 0 -2.049 -26.695 7.864 1.00 0.00 H new ATOM 0 HA3 GLY A 0 -3.366 -26.504 9.004 1.00 0.00 H new ATOM 66 N MET A 1 -1.051 -24.378 8.145 1.00 0.00 N ATOM 67 CA MET A 1 -0.696 -22.964 8.113 1.00 0.00 C ATOM 68 C MET A 1 -0.709 -22.432 6.684 1.00 0.00 C ATOM 69 O MET A 1 -0.159 -23.054 5.775 1.00 0.00 O ATOM 70 CB MET A 1 0.684 -22.748 8.738 1.00 0.00 C ATOM 71 CG MET A 1 1.772 -23.611 8.120 1.00 0.00 C ATOM 72 SD MET A 1 3.242 -23.723 9.158 1.00 0.00 S ATOM 73 CE MET A 1 4.401 -22.739 8.210 1.00 0.00 C ATOM 0 H MET A 1 -0.487 -24.968 7.534 1.00 0.00 H new ATOM 0 HA MET A 1 -1.439 -22.416 8.692 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.961 -21.699 8.634 1.00 0.00 H new ATOM 0 HB3 MET A 1 0.627 -22.958 9.806 1.00 0.00 H new ATOM 0 HG2 MET A 1 1.380 -24.612 7.943 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.048 -23.201 7.149 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.410 -22.897 8.591 1.00 0.00 H new ATOM 0 HE2 MET A 1 4.358 -23.036 7.162 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.141 -21.684 8.299 1.00 0.00 H new ATOM 83 N SER A 2 -1.341 -21.278 6.492 1.00 0.00 N ATOM 84 CA SER A 2 -1.428 -20.665 5.172 1.00 0.00 C ATOM 85 C SER A 2 -0.611 -19.378 5.115 1.00 0.00 C ATOM 86 O SER A 2 -0.714 -18.504 5.976 1.00 0.00 O ATOM 87 CB SER A 2 -2.888 -20.371 4.819 1.00 0.00 C ATOM 88 OG SER A 2 -3.094 -20.427 3.418 1.00 0.00 O ATOM 0 H SER A 2 -1.800 -20.749 7.234 1.00 0.00 H new ATOM 0 HA SER A 2 -1.019 -21.367 4.445 1.00 0.00 H new ATOM 0 HB2 SER A 2 -3.538 -21.092 5.315 1.00 0.00 H new ATOM 0 HB3 SER A 2 -3.164 -19.385 5.191 1.00 0.00 H new ATOM 0 HG SER A 2 -4.034 -20.237 3.218 1.00 0.00 H new ATOM 94 N PRO A 3 0.226 -19.255 4.074 1.00 0.00 N ATOM 95 CA PRO A 3 1.030 -18.033 3.984 1.00 0.00 C ATOM 96 C PRO A 3 0.184 -16.806 3.657 1.00 0.00 C ATOM 97 O PRO A 3 -0.922 -16.925 3.130 1.00 0.00 O ATOM 98 CB PRO A 3 2.003 -18.332 2.840 1.00 0.00 C ATOM 99 CG PRO A 3 1.304 -19.348 2.004 1.00 0.00 C ATOM 100 CD PRO A 3 0.488 -20.177 2.957 1.00 0.00 C ATOM 0 HA PRO A 3 1.521 -17.797 4.928 1.00 0.00 H new ATOM 0 HB2 PRO A 3 2.227 -17.433 2.266 1.00 0.00 H new ATOM 0 HB3 PRO A 3 2.952 -18.714 3.217 1.00 0.00 H new ATOM 0 HG2 PRO A 3 0.668 -18.870 1.259 1.00 0.00 H new ATOM 0 HG3 PRO A 3 2.019 -19.967 1.462 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -0.437 -20.524 2.497 1.00 0.00 H new ATOM 0 HD3 PRO A 3 1.032 -21.063 3.286 1.00 0.00 H new ATOM 108 N PHE A 4 0.713 -15.628 3.972 1.00 0.00 N ATOM 109 CA PHE A 4 0.006 -14.379 3.711 1.00 0.00 C ATOM 110 C PHE A 4 0.971 -13.297 3.236 1.00 0.00 C ATOM 111 O PHE A 4 2.172 -13.358 3.504 1.00 0.00 O ATOM 112 CB PHE A 4 -0.723 -13.909 4.972 1.00 0.00 C ATOM 113 CG PHE A 4 0.195 -13.367 6.029 1.00 0.00 C ATOM 114 CD1 PHE A 4 0.532 -12.023 6.050 1.00 0.00 C ATOM 115 CD2 PHE A 4 0.720 -14.201 7.003 1.00 0.00 C ATOM 116 CE1 PHE A 4 1.378 -11.522 7.021 1.00 0.00 C ATOM 117 CE2 PHE A 4 1.566 -13.705 7.977 1.00 0.00 C ATOM 118 CZ PHE A 4 1.895 -12.364 7.987 1.00 0.00 C ATOM 0 H PHE A 4 1.628 -15.512 4.408 1.00 0.00 H new ATOM 0 HA PHE A 4 -0.724 -14.561 2.923 1.00 0.00 H new ATOM 0 HB2 PHE A 4 -1.444 -13.139 4.699 1.00 0.00 H new ATOM 0 HB3 PHE A 4 -1.289 -14.743 5.387 1.00 0.00 H new ATOM 0 HD1 PHE A 4 0.129 -11.360 5.299 1.00 0.00 H new ATOM 0 HD2 PHE A 4 0.465 -15.251 7.001 1.00 0.00 H new ATOM 0 HE1 PHE A 4 1.635 -10.473 7.025 1.00 0.00 H new ATOM 0 HE2 PHE A 4 1.969 -14.366 8.730 1.00 0.00 H new ATOM 0 HZ PHE A 4 2.555 -11.974 8.748 1.00 0.00 H new ATOM 128 N LEU A 5 0.439 -12.308 2.527 1.00 0.00 N ATOM 129 CA LEU A 5 1.252 -11.212 2.012 1.00 0.00 C ATOM 130 C LEU A 5 0.995 -9.929 2.797 1.00 0.00 C ATOM 131 O LEU A 5 -0.147 -9.491 2.934 1.00 0.00 O ATOM 132 CB LEU A 5 0.956 -10.984 0.529 1.00 0.00 C ATOM 133 CG LEU A 5 1.816 -11.774 -0.456 1.00 0.00 C ATOM 134 CD1 LEU A 5 1.377 -11.502 -1.887 1.00 0.00 C ATOM 135 CD2 LEU A 5 3.288 -11.431 -0.274 1.00 0.00 C ATOM 0 H LEU A 5 -0.552 -12.242 2.295 1.00 0.00 H new ATOM 0 HA LEU A 5 2.301 -11.484 2.129 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -0.090 -11.230 0.346 1.00 0.00 H new ATOM 0 HB3 LEU A 5 1.076 -9.922 0.314 1.00 0.00 H new ATOM 0 HG LEU A 5 1.683 -12.837 -0.253 1.00 0.00 H new ATOM 0 HD11 LEU A 5 2.001 -12.073 -2.574 1.00 0.00 H new ATOM 0 HD12 LEU A 5 0.336 -11.799 -2.011 1.00 0.00 H new ATOM 0 HD13 LEU A 5 1.479 -10.439 -2.103 1.00 0.00 H new ATOM 0 HD21 LEU A 5 3.885 -12.003 -0.984 1.00 0.00 H new ATOM 0 HD22 LEU A 5 3.438 -10.366 -0.449 1.00 0.00 H new ATOM 0 HD23 LEU A 5 3.596 -11.678 0.742 1.00 0.00 H new ATOM 147 N ARG A 6 2.066 -9.330 3.308 1.00 0.00 N ATOM 148 CA ARG A 6 1.957 -8.097 4.078 1.00 0.00 C ATOM 149 C ARG A 6 2.288 -6.884 3.212 1.00 0.00 C ATOM 150 O ARG A 6 3.454 -6.519 3.058 1.00 0.00 O ATOM 151 CB ARG A 6 2.891 -8.142 5.288 1.00 0.00 C ATOM 152 CG ARG A 6 2.831 -6.892 6.151 1.00 0.00 C ATOM 153 CD ARG A 6 3.807 -6.971 7.315 1.00 0.00 C ATOM 154 NE ARG A 6 3.240 -7.681 8.458 1.00 0.00 N ATOM 155 CZ ARG A 6 2.248 -7.204 9.201 1.00 0.00 C ATOM 156 NH1 ARG A 6 1.716 -6.021 8.923 1.00 0.00 N ATOM 157 NH2 ARG A 6 1.786 -7.909 10.226 1.00 0.00 N ATOM 0 H ARG A 6 3.019 -9.679 3.203 1.00 0.00 H new ATOM 0 HA ARG A 6 0.928 -8.005 4.425 1.00 0.00 H new ATOM 0 HB2 ARG A 6 2.638 -9.008 5.900 1.00 0.00 H new ATOM 0 HB3 ARG A 6 3.914 -8.285 4.941 1.00 0.00 H new ATOM 0 HG2 ARG A 6 3.059 -6.017 5.542 1.00 0.00 H new ATOM 0 HG3 ARG A 6 1.818 -6.760 6.532 1.00 0.00 H new ATOM 0 HD2 ARG A 6 4.718 -7.475 6.991 1.00 0.00 H new ATOM 0 HD3 ARG A 6 4.091 -5.963 7.619 1.00 0.00 H new ATOM 0 HE ARG A 6 3.627 -8.593 8.699 1.00 0.00 H new ATOM 0 HH11 ARG A 6 2.069 -5.475 8.137 1.00 0.00 H new ATOM 0 HH12 ARG A 6 0.954 -5.657 9.495 1.00 0.00 H new ATOM 0 HH21 ARG A 6 2.193 -8.819 10.444 1.00 0.00 H new ATOM 0 HH22 ARG A 6 1.024 -7.541 10.796 1.00 0.00 H new ATOM 171 N ILE A 7 1.255 -6.267 2.649 1.00 0.00 N ATOM 172 CA ILE A 7 1.436 -5.096 1.800 1.00 0.00 C ATOM 173 C ILE A 7 1.389 -3.810 2.618 1.00 0.00 C ATOM 174 O ILE A 7 0.529 -3.643 3.482 1.00 0.00 O ATOM 175 CB ILE A 7 0.363 -5.029 0.697 1.00 0.00 C ATOM 176 CG1 ILE A 7 0.412 -6.289 -0.170 1.00 0.00 C ATOM 177 CG2 ILE A 7 0.558 -3.785 -0.157 1.00 0.00 C ATOM 178 CD1 ILE A 7 -0.415 -7.432 0.379 1.00 0.00 C ATOM 0 H ILE A 7 0.284 -6.558 2.765 1.00 0.00 H new ATOM 0 HA ILE A 7 2.418 -5.192 1.336 1.00 0.00 H new ATOM 0 HB ILE A 7 -0.618 -4.973 1.168 1.00 0.00 H new ATOM 0 HG12 ILE A 7 0.060 -6.045 -1.172 1.00 0.00 H new ATOM 0 HG13 ILE A 7 1.448 -6.614 -0.267 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -0.208 -3.752 -0.932 1.00 0.00 H new ATOM 0 HG22 ILE A 7 0.478 -2.897 0.470 1.00 0.00 H new ATOM 0 HG23 ILE A 7 1.543 -3.814 -0.622 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -0.334 -8.292 -0.286 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -0.049 -7.703 1.369 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -1.459 -7.125 0.449 1.00 0.00 H new ATOM 190 N GLY A 8 2.319 -2.902 2.339 1.00 0.00 N ATOM 191 CA GLY A 8 2.365 -1.642 3.056 1.00 0.00 C ATOM 192 C GLY A 8 2.495 -0.451 2.128 1.00 0.00 C ATOM 193 O GLY A 8 3.135 -0.538 1.080 1.00 0.00 O ATOM 0 H GLY A 8 3.042 -3.017 1.629 1.00 0.00 H new ATOM 0 HA2 GLY A 8 1.460 -1.535 3.655 1.00 0.00 H new ATOM 0 HA3 GLY A 8 3.206 -1.652 3.749 1.00 0.00 H new ATOM 197 N LEU A 9 1.886 0.666 2.512 1.00 0.00 N ATOM 198 CA LEU A 9 1.935 1.880 1.706 1.00 0.00 C ATOM 199 C LEU A 9 2.773 2.955 2.391 1.00 0.00 C ATOM 200 O LEU A 9 2.592 3.237 3.575 1.00 0.00 O ATOM 201 CB LEU A 9 0.521 2.405 1.452 1.00 0.00 C ATOM 202 CG LEU A 9 -0.421 1.462 0.703 1.00 0.00 C ATOM 203 CD1 LEU A 9 -1.818 2.056 0.620 1.00 0.00 C ATOM 204 CD2 LEU A 9 0.118 1.166 -0.690 1.00 0.00 C ATOM 0 H LEU A 9 1.353 0.755 3.377 1.00 0.00 H new ATOM 0 HA LEU A 9 2.402 1.634 0.752 1.00 0.00 H new ATOM 0 HB2 LEU A 9 0.068 2.651 2.413 1.00 0.00 H new ATOM 0 HB3 LEU A 9 0.596 3.335 0.888 1.00 0.00 H new ATOM 0 HG LEU A 9 -0.480 0.524 1.256 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -2.474 1.370 0.083 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -2.206 2.216 1.626 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -1.778 3.008 0.091 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -0.565 0.493 -1.209 1.00 0.00 H new ATOM 0 HD22 LEU A 9 0.207 2.096 -1.251 1.00 0.00 H new ATOM 0 HD23 LEU A 9 1.098 0.696 -0.609 1.00 0.00 H new ATOM 216 N SER A 10 3.690 3.554 1.637 1.00 0.00 N ATOM 217 CA SER A 10 4.557 4.597 2.171 1.00 0.00 C ATOM 218 C SER A 10 4.908 5.617 1.093 1.00 0.00 C ATOM 219 O SER A 10 4.847 5.322 -0.100 1.00 0.00 O ATOM 220 CB SER A 10 5.836 3.982 2.744 1.00 0.00 C ATOM 221 OG SER A 10 6.791 3.749 1.724 1.00 0.00 O ATOM 0 H SER A 10 3.851 3.334 0.654 1.00 0.00 H new ATOM 0 HA SER A 10 4.019 5.109 2.969 1.00 0.00 H new ATOM 0 HB2 SER A 10 6.258 4.648 3.496 1.00 0.00 H new ATOM 0 HB3 SER A 10 5.599 3.044 3.246 1.00 0.00 H new ATOM 0 HG SER A 10 7.693 3.778 2.107 1.00 0.00 H new ATOM 227 N ASN A 11 5.277 6.819 1.522 1.00 0.00 N ATOM 228 CA ASN A 11 5.638 7.885 0.594 1.00 0.00 C ATOM 229 C ASN A 11 4.531 8.113 -0.430 1.00 0.00 C ATOM 230 O ASN A 11 4.798 8.327 -1.613 1.00 0.00 O ATOM 231 CB ASN A 11 6.948 7.545 -0.121 1.00 0.00 C ATOM 232 CG ASN A 11 8.119 7.439 0.836 1.00 0.00 C ATOM 233 OD1 ASN A 11 8.845 8.409 1.056 1.00 0.00 O ATOM 234 ND2 ASN A 11 8.308 6.257 1.411 1.00 0.00 N ATOM 0 H ASN A 11 5.334 7.080 2.506 1.00 0.00 H new ATOM 0 HA ASN A 11 5.772 8.802 1.168 1.00 0.00 H new ATOM 0 HB2 ASN A 11 6.833 6.602 -0.655 1.00 0.00 H new ATOM 0 HB3 ASN A 11 7.161 8.310 -0.867 1.00 0.00 H new ATOM 0 HD21 ASN A 11 9.080 6.125 2.065 1.00 0.00 H new ATOM 0 HD22 ASN A 11 7.681 5.481 1.199 1.00 0.00 H new ATOM 241 N PHE A 12 3.286 8.065 0.032 1.00 0.00 N ATOM 242 CA PHE A 12 2.137 8.266 -0.843 1.00 0.00 C ATOM 243 C PHE A 12 2.198 9.634 -1.515 1.00 0.00 C ATOM 244 O PHE A 12 2.606 10.621 -0.902 1.00 0.00 O ATOM 245 CB PHE A 12 0.835 8.132 -0.050 1.00 0.00 C ATOM 246 CG PHE A 12 -0.387 8.509 -0.836 1.00 0.00 C ATOM 247 CD1 PHE A 12 -0.624 7.954 -2.084 1.00 0.00 C ATOM 248 CD2 PHE A 12 -1.300 9.419 -0.329 1.00 0.00 C ATOM 249 CE1 PHE A 12 -1.748 8.298 -2.810 1.00 0.00 C ATOM 250 CE2 PHE A 12 -2.426 9.767 -1.050 1.00 0.00 C ATOM 251 CZ PHE A 12 -2.650 9.207 -2.293 1.00 0.00 C ATOM 0 H PHE A 12 3.047 7.889 1.008 1.00 0.00 H new ATOM 0 HA PHE A 12 2.163 7.499 -1.617 1.00 0.00 H new ATOM 0 HB2 PHE A 12 0.733 7.103 0.294 1.00 0.00 H new ATOM 0 HB3 PHE A 12 0.894 8.761 0.839 1.00 0.00 H new ATOM 0 HD1 PHE A 12 0.079 7.244 -2.494 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -1.130 9.862 0.641 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -1.921 7.857 -3.780 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -3.131 10.476 -0.642 1.00 0.00 H new ATOM 0 HZ PHE A 12 -3.528 9.479 -2.859 1.00 0.00 H new ATOM 261 N ASP A 13 1.789 9.685 -2.778 1.00 0.00 N ATOM 262 CA ASP A 13 1.796 10.932 -3.534 1.00 0.00 C ATOM 263 C ASP A 13 0.401 11.257 -4.059 1.00 0.00 C ATOM 264 O ASP A 13 -0.158 10.512 -4.865 1.00 0.00 O ATOM 265 CB ASP A 13 2.784 10.842 -4.697 1.00 0.00 C ATOM 266 CG ASP A 13 2.819 12.111 -5.527 1.00 0.00 C ATOM 267 OD1 ASP A 13 2.741 13.209 -4.937 1.00 0.00 O ATOM 268 OD2 ASP A 13 2.924 12.006 -6.767 1.00 0.00 O ATOM 0 H ASP A 13 1.448 8.877 -3.300 1.00 0.00 H new ATOM 0 HA ASP A 13 2.108 11.733 -2.864 1.00 0.00 H new ATOM 0 HB2 ASP A 13 3.781 10.638 -4.308 1.00 0.00 H new ATOM 0 HB3 ASP A 13 2.513 10.001 -5.336 1.00 0.00 H new ATOM 273 N CYS A 14 -0.155 12.371 -3.597 1.00 0.00 N ATOM 274 CA CYS A 14 -1.486 12.793 -4.019 1.00 0.00 C ATOM 275 C CYS A 14 -1.408 14.030 -4.908 1.00 0.00 C ATOM 276 O CYS A 14 -2.289 14.272 -5.732 1.00 0.00 O ATOM 277 CB CYS A 14 -2.363 13.082 -2.800 1.00 0.00 C ATOM 278 SG CYS A 14 -4.138 12.990 -3.128 1.00 0.00 S ATOM 0 H CYS A 14 0.295 12.998 -2.930 1.00 0.00 H new ATOM 0 HA CYS A 14 -1.932 11.981 -4.594 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -2.113 12.373 -2.010 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -2.125 14.077 -2.423 1.00 0.00 H new ATOM 0 HG CYS A 14 -4.795 13.248 -2.036 1.00 0.00 H new ATOM 284 N GLY A 15 -0.346 14.811 -4.734 1.00 0.00 N ATOM 285 CA GLY A 15 -0.173 16.015 -5.527 1.00 0.00 C ATOM 286 C GLY A 15 0.214 17.213 -4.684 1.00 0.00 C ATOM 287 O GLY A 15 1.314 17.264 -4.133 1.00 0.00 O ATOM 0 H GLY A 15 0.397 14.632 -4.059 1.00 0.00 H new ATOM 0 HA2 GLY A 15 0.594 15.842 -6.282 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -1.099 16.233 -6.059 1.00 0.00 H new ATOM 291 N SER A 16 -0.691 18.182 -4.584 1.00 0.00 N ATOM 292 CA SER A 16 -0.436 19.389 -3.806 1.00 0.00 C ATOM 293 C SER A 16 -1.721 19.905 -3.168 1.00 0.00 C ATOM 294 O SER A 16 -2.785 19.891 -3.788 1.00 0.00 O ATOM 295 CB SER A 16 0.178 20.473 -4.694 1.00 0.00 C ATOM 296 OG SER A 16 1.029 19.907 -5.675 1.00 0.00 O ATOM 0 H SER A 16 -1.607 18.155 -5.032 1.00 0.00 H new ATOM 0 HA SER A 16 0.268 19.139 -3.012 1.00 0.00 H new ATOM 0 HB2 SER A 16 -0.615 21.041 -5.180 1.00 0.00 H new ATOM 0 HB3 SER A 16 0.742 21.174 -4.079 1.00 0.00 H new ATOM 0 HG SER A 16 1.408 20.620 -6.230 1.00 0.00 H new ATOM 302 N CYS A 17 -1.615 20.361 -1.924 1.00 0.00 N ATOM 303 CA CYS A 17 -2.769 20.882 -1.200 1.00 0.00 C ATOM 304 C CYS A 17 -3.017 22.345 -1.552 1.00 0.00 C ATOM 305 O CYS A 17 -2.091 23.071 -1.912 1.00 0.00 O ATOM 306 CB CYS A 17 -2.559 20.736 0.308 1.00 0.00 C ATOM 307 SG CYS A 17 -1.173 21.698 0.957 1.00 0.00 S ATOM 0 H CYS A 17 -0.742 20.380 -1.397 1.00 0.00 H new ATOM 0 HA CYS A 17 -3.644 20.303 -1.496 1.00 0.00 H new ATOM 0 HB2 CYS A 17 -3.471 21.040 0.822 1.00 0.00 H new ATOM 0 HB3 CYS A 17 -2.398 19.684 0.541 1.00 0.00 H new ATOM 0 HG CYS A 17 -1.078 21.511 2.240 1.00 0.00 H new ATOM 313 N GLN A 18 -4.272 22.769 -1.446 1.00 0.00 N ATOM 314 CA GLN A 18 -4.641 24.145 -1.756 1.00 0.00 C ATOM 315 C GLN A 18 -6.071 24.438 -1.313 1.00 0.00 C ATOM 316 O GLN A 18 -6.923 23.551 -1.306 1.00 0.00 O ATOM 317 CB GLN A 18 -4.495 24.410 -3.256 1.00 0.00 C ATOM 318 CG GLN A 18 -4.333 25.881 -3.601 1.00 0.00 C ATOM 319 CD GLN A 18 -2.889 26.340 -3.538 1.00 0.00 C ATOM 320 OE1 GLN A 18 -1.985 25.647 -4.006 1.00 0.00 O ATOM 321 NE2 GLN A 18 -2.665 27.513 -2.958 1.00 0.00 N ATOM 0 H GLN A 18 -5.050 22.180 -1.148 1.00 0.00 H new ATOM 0 HA GLN A 18 -3.968 24.806 -1.210 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -3.632 23.860 -3.631 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -5.371 24.019 -3.773 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -4.724 26.061 -4.603 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -4.931 26.479 -2.914 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -3.445 28.054 -2.584 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -1.713 27.873 -2.887 1.00 0.00 H new ATOM 330 N SER A 19 -6.326 25.689 -0.943 1.00 0.00 N ATOM 331 CA SER A 19 -7.651 26.099 -0.494 1.00 0.00 C ATOM 332 C SER A 19 -8.115 25.244 0.682 1.00 0.00 C ATOM 333 O SER A 19 -9.296 24.917 0.798 1.00 0.00 O ATOM 334 CB SER A 19 -8.657 25.994 -1.643 1.00 0.00 C ATOM 335 OG SER A 19 -9.809 26.777 -1.385 1.00 0.00 O ATOM 0 H SER A 19 -5.632 26.436 -0.945 1.00 0.00 H new ATOM 0 HA SER A 19 -7.591 27.137 -0.166 1.00 0.00 H new ATOM 0 HB2 SER A 19 -8.190 26.324 -2.571 1.00 0.00 H new ATOM 0 HB3 SER A 19 -8.945 24.952 -1.784 1.00 0.00 H new ATOM 0 HG SER A 19 -10.191 26.522 -0.519 1.00 0.00 H new ATOM 341 N CYS A 20 -7.176 24.886 1.550 1.00 0.00 N ATOM 342 CA CYS A 20 -7.486 24.069 2.718 1.00 0.00 C ATOM 343 C CYS A 20 -8.448 24.797 3.651 1.00 0.00 C ATOM 344 O CYS A 20 -8.771 25.965 3.436 1.00 0.00 O ATOM 345 CB CYS A 20 -6.204 23.707 3.468 1.00 0.00 C ATOM 346 SG CYS A 20 -5.173 22.486 2.623 1.00 0.00 S ATOM 0 H CYS A 20 -6.194 25.148 1.467 1.00 0.00 H new ATOM 0 HA CYS A 20 -7.967 23.154 2.373 1.00 0.00 H new ATOM 0 HB2 CYS A 20 -5.620 24.614 3.625 1.00 0.00 H new ATOM 0 HB3 CYS A 20 -6.468 23.324 4.453 1.00 0.00 H new ATOM 0 HG CYS A 20 -4.111 22.247 3.335 1.00 0.00 H new ATOM 352 N GLN A 21 -8.902 24.098 4.687 1.00 0.00 N ATOM 353 CA GLN A 21 -9.829 24.678 5.651 1.00 0.00 C ATOM 354 C GLN A 21 -9.156 24.869 7.006 1.00 0.00 C ATOM 355 O GLN A 21 -9.759 24.625 8.050 1.00 0.00 O ATOM 356 CB GLN A 21 -11.064 23.787 5.803 1.00 0.00 C ATOM 357 CG GLN A 21 -10.755 22.410 6.367 1.00 0.00 C ATOM 358 CD GLN A 21 -10.576 21.363 5.286 1.00 0.00 C ATOM 359 OE1 GLN A 21 -10.709 21.653 4.097 1.00 0.00 O ATOM 360 NE2 GLN A 21 -10.274 20.136 5.694 1.00 0.00 N ATOM 0 H GLN A 21 -8.643 23.130 4.880 1.00 0.00 H new ATOM 0 HA GLN A 21 -10.138 25.655 5.278 1.00 0.00 H new ATOM 0 HB2 GLN A 21 -11.783 24.284 6.454 1.00 0.00 H new ATOM 0 HB3 GLN A 21 -11.542 23.673 4.830 1.00 0.00 H new ATOM 0 HG2 GLN A 21 -9.848 22.464 6.969 1.00 0.00 H new ATOM 0 HG3 GLN A 21 -11.562 22.105 7.033 1.00 0.00 H new ATOM 0 HE21 GLN A 21 -10.173 19.940 6.690 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -10.143 19.389 5.011 1.00 0.00 H new ATOM 369 N GLY A 22 -7.901 25.307 6.981 1.00 0.00 N ATOM 370 CA GLY A 22 -7.166 25.523 8.214 1.00 0.00 C ATOM 371 C GLY A 22 -6.609 24.236 8.790 1.00 0.00 C ATOM 372 O GLY A 22 -5.395 24.038 8.824 1.00 0.00 O ATOM 0 H GLY A 22 -7.380 25.516 6.129 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -6.348 26.219 8.028 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -7.822 25.992 8.947 1.00 0.00 H new ATOM 376 N GLU A 23 -7.499 23.360 9.246 1.00 0.00 N ATOM 377 CA GLU A 23 -7.089 22.087 9.826 1.00 0.00 C ATOM 378 C GLU A 23 -6.480 21.176 8.764 1.00 0.00 C ATOM 379 O GLU A 23 -6.440 21.522 7.584 1.00 0.00 O ATOM 380 CB GLU A 23 -8.282 21.393 10.485 1.00 0.00 C ATOM 381 CG GLU A 23 -8.506 21.807 11.930 1.00 0.00 C ATOM 382 CD GLU A 23 -9.093 23.200 12.053 1.00 0.00 C ATOM 383 OE1 GLU A 23 -10.045 23.511 11.307 1.00 0.00 O ATOM 384 OE2 GLU A 23 -8.600 23.979 12.896 1.00 0.00 O ATOM 0 H GLU A 23 -8.508 23.509 9.225 1.00 0.00 H new ATOM 0 HA GLU A 23 -6.332 22.290 10.584 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -9.182 21.612 9.910 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -8.132 20.314 10.444 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -9.174 21.092 12.410 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -7.558 21.767 12.467 1.00 0.00 H new ATOM 391 N ALA A 24 -6.006 20.011 9.193 1.00 0.00 N ATOM 392 CA ALA A 24 -5.401 19.049 8.279 1.00 0.00 C ATOM 393 C ALA A 24 -6.262 17.797 8.151 1.00 0.00 C ATOM 394 O ALA A 24 -6.231 16.919 9.013 1.00 0.00 O ATOM 395 CB ALA A 24 -4.001 18.684 8.750 1.00 0.00 C ATOM 0 H ALA A 24 -6.029 19.710 10.167 1.00 0.00 H new ATOM 0 HA ALA A 24 -5.332 19.512 7.295 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -3.561 17.965 8.059 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -3.383 19.581 8.783 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -4.055 18.244 9.746 1.00 0.00 H new ATOM 401 N VAL A 25 -7.031 17.722 7.069 1.00 0.00 N ATOM 402 CA VAL A 25 -7.900 16.576 6.827 1.00 0.00 C ATOM 403 C VAL A 25 -7.104 15.277 6.807 1.00 0.00 C ATOM 404 O VAL A 25 -5.972 15.238 6.325 1.00 0.00 O ATOM 405 CB VAL A 25 -8.661 16.721 5.496 1.00 0.00 C ATOM 406 CG1 VAL A 25 -7.687 16.883 4.339 1.00 0.00 C ATOM 407 CG2 VAL A 25 -9.573 15.524 5.272 1.00 0.00 C ATOM 0 H VAL A 25 -7.070 18.441 6.346 1.00 0.00 H new ATOM 0 HA VAL A 25 -8.619 16.545 7.646 1.00 0.00 H new ATOM 0 HB VAL A 25 -9.280 17.617 5.546 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -8.243 16.984 3.407 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -7.079 17.774 4.497 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -7.040 16.007 4.283 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -10.103 15.642 4.327 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -8.976 14.612 5.241 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -10.294 15.458 6.087 1.00 0.00 H new ATOM 417 N ASN A 26 -7.703 14.213 7.333 1.00 0.00 N ATOM 418 CA ASN A 26 -7.049 12.910 7.375 1.00 0.00 C ATOM 419 C ASN A 26 -7.794 11.900 6.508 1.00 0.00 C ATOM 420 O ASN A 26 -8.633 11.133 6.980 1.00 0.00 O ATOM 421 CB ASN A 26 -6.971 12.402 8.817 1.00 0.00 C ATOM 422 CG ASN A 26 -6.006 11.243 8.969 1.00 0.00 C ATOM 423 OD1 ASN A 26 -4.791 11.415 8.868 1.00 0.00 O ATOM 424 ND2 ASN A 26 -6.543 10.054 9.214 1.00 0.00 N ATOM 0 H ASN A 26 -8.640 14.228 7.736 1.00 0.00 H new ATOM 0 HA ASN A 26 -6.039 13.025 6.982 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -6.661 13.217 9.471 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -7.963 12.091 9.144 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -5.943 9.237 9.327 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -7.556 9.958 9.290 1.00 0.00 H new ATOM 431 N PRO A 27 -7.481 11.896 5.204 1.00 0.00 N ATOM 432 CA PRO A 27 -8.174 10.938 4.337 1.00 0.00 C ATOM 433 C PRO A 27 -7.751 9.499 4.609 1.00 0.00 C ATOM 434 O PRO A 27 -6.747 9.252 5.277 1.00 0.00 O ATOM 435 CB PRO A 27 -7.751 11.363 2.929 1.00 0.00 C ATOM 436 CG PRO A 27 -6.442 12.049 3.118 1.00 0.00 C ATOM 437 CD PRO A 27 -6.517 12.724 4.459 1.00 0.00 C ATOM 0 HA PRO A 27 -9.252 10.952 4.495 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -7.655 10.502 2.268 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -8.486 12.030 2.479 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -5.619 11.335 3.086 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -6.264 12.775 2.325 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -5.545 12.750 4.951 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -6.857 13.756 4.371 1.00 0.00 H new ATOM 445 N TYR A 28 -8.522 8.552 4.086 1.00 0.00 N ATOM 446 CA TYR A 28 -8.228 7.136 4.274 1.00 0.00 C ATOM 447 C TYR A 28 -8.325 6.380 2.953 1.00 0.00 C ATOM 448 O TYR A 28 -9.209 6.642 2.138 1.00 0.00 O ATOM 449 CB TYR A 28 -9.189 6.525 5.296 1.00 0.00 C ATOM 450 CG TYR A 28 -10.638 6.572 4.868 1.00 0.00 C ATOM 451 CD1 TYR A 28 -11.174 5.583 4.053 1.00 0.00 C ATOM 452 CD2 TYR A 28 -11.471 7.606 5.278 1.00 0.00 C ATOM 453 CE1 TYR A 28 -12.498 5.622 3.658 1.00 0.00 C ATOM 454 CE2 TYR A 28 -12.796 7.652 4.889 1.00 0.00 C ATOM 455 CZ TYR A 28 -13.304 6.658 4.080 1.00 0.00 C ATOM 456 OH TYR A 28 -14.623 6.702 3.690 1.00 0.00 O ATOM 0 H TYR A 28 -9.355 8.739 3.528 1.00 0.00 H new ATOM 0 HA TYR A 28 -7.208 7.049 4.648 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -8.905 5.488 5.474 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -9.082 7.052 6.244 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -10.545 4.770 3.722 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -11.076 8.387 5.911 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -12.899 4.846 3.023 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -13.430 8.462 5.217 1.00 0.00 H new ATOM 0 HH TYR A 28 -15.051 7.495 4.074 1.00 0.00 H new ATOM 466 N CYS A 29 -7.409 5.439 2.749 1.00 0.00 N ATOM 467 CA CYS A 29 -7.389 4.643 1.527 1.00 0.00 C ATOM 468 C CYS A 29 -8.335 3.452 1.639 1.00 0.00 C ATOM 469 O CYS A 29 -8.438 2.825 2.692 1.00 0.00 O ATOM 470 CB CYS A 29 -5.969 4.156 1.234 1.00 0.00 C ATOM 471 SG CYS A 29 -4.996 5.289 0.215 1.00 0.00 S ATOM 0 H CYS A 29 -6.671 5.209 3.414 1.00 0.00 H new ATOM 0 HA CYS A 29 -7.725 5.275 0.705 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -5.449 3.996 2.179 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -6.024 3.190 0.733 1.00 0.00 H new ATOM 0 HG CYS A 29 -4.204 5.985 0.975 1.00 0.00 H new ATOM 477 N ALA A 30 -9.027 3.148 0.545 1.00 0.00 N ATOM 478 CA ALA A 30 -9.965 2.033 0.520 1.00 0.00 C ATOM 479 C ALA A 30 -9.359 0.822 -0.182 1.00 0.00 C ATOM 480 O ALA A 30 -8.876 0.923 -1.309 1.00 0.00 O ATOM 481 CB ALA A 30 -11.260 2.447 -0.162 1.00 0.00 C ATOM 0 H ALA A 30 -8.955 3.659 -0.335 1.00 0.00 H new ATOM 0 HA ALA A 30 -10.184 1.752 1.550 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -11.951 1.604 -0.173 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -11.709 3.277 0.383 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -11.049 2.757 -1.186 1.00 0.00 H new ATOM 487 N VAL A 31 -9.388 -0.323 0.493 1.00 0.00 N ATOM 488 CA VAL A 31 -8.842 -1.554 -0.066 1.00 0.00 C ATOM 489 C VAL A 31 -9.919 -2.626 -0.190 1.00 0.00 C ATOM 490 O VAL A 31 -10.193 -3.360 0.761 1.00 0.00 O ATOM 491 CB VAL A 31 -7.688 -2.099 0.795 1.00 0.00 C ATOM 492 CG1 VAL A 31 -7.152 -3.397 0.212 1.00 0.00 C ATOM 493 CG2 VAL A 31 -6.581 -1.063 0.918 1.00 0.00 C ATOM 0 H VAL A 31 -9.784 -0.424 1.428 1.00 0.00 H new ATOM 0 HA VAL A 31 -8.461 -1.309 -1.057 1.00 0.00 H new ATOM 0 HB VAL A 31 -8.071 -2.309 1.794 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -6.337 -3.766 0.835 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -7.950 -4.139 0.181 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -6.784 -3.218 -0.798 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -5.773 -1.465 1.530 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -6.199 -0.819 -0.073 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -6.977 -0.162 1.386 1.00 0.00 H new ATOM 503 N LEU A 32 -10.527 -2.713 -1.368 1.00 0.00 N ATOM 504 CA LEU A 32 -11.575 -3.697 -1.618 1.00 0.00 C ATOM 505 C LEU A 32 -10.986 -4.991 -2.171 1.00 0.00 C ATOM 506 O LEU A 32 -10.589 -5.057 -3.334 1.00 0.00 O ATOM 507 CB LEU A 32 -12.607 -3.134 -2.596 1.00 0.00 C ATOM 508 CG LEU A 32 -13.502 -2.017 -2.059 1.00 0.00 C ATOM 509 CD1 LEU A 32 -12.840 -0.661 -2.257 1.00 0.00 C ATOM 510 CD2 LEU A 32 -14.864 -2.051 -2.737 1.00 0.00 C ATOM 0 H LEU A 32 -10.312 -2.114 -2.165 1.00 0.00 H new ATOM 0 HA LEU A 32 -12.065 -3.919 -0.670 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -12.080 -2.759 -3.473 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -13.244 -3.952 -2.932 1.00 0.00 H new ATOM 0 HG LEU A 32 -13.647 -2.176 -0.990 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -13.491 0.122 -1.869 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -11.889 -0.639 -1.724 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -12.665 -0.493 -3.320 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -15.487 -1.249 -2.342 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -14.739 -1.918 -3.812 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -15.343 -3.011 -2.544 1.00 0.00 H new ATOM 522 N VAL A 33 -10.935 -6.019 -1.329 1.00 0.00 N ATOM 523 CA VAL A 33 -10.398 -7.312 -1.734 1.00 0.00 C ATOM 524 C VAL A 33 -11.483 -8.189 -2.350 1.00 0.00 C ATOM 525 O VAL A 33 -12.633 -8.176 -1.909 1.00 0.00 O ATOM 526 CB VAL A 33 -9.767 -8.056 -0.542 1.00 0.00 C ATOM 527 CG1 VAL A 33 -9.071 -9.324 -1.012 1.00 0.00 C ATOM 528 CG2 VAL A 33 -8.798 -7.148 0.199 1.00 0.00 C ATOM 0 H VAL A 33 -11.259 -5.981 -0.363 1.00 0.00 H new ATOM 0 HA VAL A 33 -9.627 -7.115 -2.479 1.00 0.00 H new ATOM 0 HB VAL A 33 -10.561 -8.342 0.148 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -8.631 -9.836 -0.156 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -9.796 -9.980 -1.494 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -8.286 -9.066 -1.723 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -8.361 -7.690 1.038 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -8.006 -6.830 -0.479 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -9.331 -6.273 0.570 1.00 0.00 H new ATOM 538 N LYS A 34 -11.110 -8.952 -3.372 1.00 0.00 N ATOM 539 CA LYS A 34 -12.050 -9.838 -4.049 1.00 0.00 C ATOM 540 C LYS A 34 -11.379 -11.153 -4.431 1.00 0.00 C ATOM 541 O LYS A 34 -10.248 -11.164 -4.917 1.00 0.00 O ATOM 542 CB LYS A 34 -12.613 -9.158 -5.299 1.00 0.00 C ATOM 543 CG LYS A 34 -13.421 -7.907 -4.999 1.00 0.00 C ATOM 544 CD LYS A 34 -13.573 -7.033 -6.233 1.00 0.00 C ATOM 545 CE LYS A 34 -13.687 -5.562 -5.864 1.00 0.00 C ATOM 546 NZ LYS A 34 -12.351 -4.917 -5.736 1.00 0.00 N ATOM 0 H LYS A 34 -10.163 -8.975 -3.750 1.00 0.00 H new ATOM 0 HA LYS A 34 -12.867 -10.054 -3.361 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -11.789 -8.898 -5.963 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -13.243 -9.867 -5.836 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -14.406 -8.189 -4.628 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -12.933 -7.339 -4.207 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -12.716 -7.179 -6.891 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -14.459 -7.339 -6.790 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -14.270 -5.041 -6.623 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -14.229 -5.465 -4.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -12.403 -3.939 -6.085 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -12.062 -4.913 -4.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -11.654 -5.448 -6.296 1.00 0.00 H new ATOM 560 N GLU A 35 -12.083 -12.258 -4.210 1.00 0.00 N ATOM 561 CA GLU A 35 -11.554 -13.578 -4.532 1.00 0.00 C ATOM 562 C GLU A 35 -12.004 -14.020 -5.922 1.00 0.00 C ATOM 563 O GLU A 35 -13.176 -13.891 -6.277 1.00 0.00 O ATOM 564 CB GLU A 35 -12.006 -14.602 -3.489 1.00 0.00 C ATOM 565 CG GLU A 35 -13.516 -14.708 -3.354 1.00 0.00 C ATOM 566 CD GLU A 35 -13.941 -15.819 -2.413 1.00 0.00 C ATOM 567 OE1 GLU A 35 -13.673 -15.702 -1.199 1.00 0.00 O ATOM 568 OE2 GLU A 35 -14.541 -16.804 -2.890 1.00 0.00 O ATOM 0 H GLU A 35 -13.021 -12.266 -3.809 1.00 0.00 H new ATOM 0 HA GLU A 35 -10.466 -13.517 -4.523 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -11.604 -15.580 -3.754 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -11.581 -14.334 -2.522 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -13.912 -13.759 -2.992 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -13.954 -14.882 -4.337 1.00 0.00 H new ATOM 575 N TYR A 36 -11.064 -14.540 -6.703 1.00 0.00 N ATOM 576 CA TYR A 36 -11.362 -14.998 -8.055 1.00 0.00 C ATOM 577 C TYR A 36 -11.998 -16.384 -8.033 1.00 0.00 C ATOM 578 O TYR A 36 -11.312 -17.393 -7.869 1.00 0.00 O ATOM 579 CB TYR A 36 -10.087 -15.023 -8.900 1.00 0.00 C ATOM 580 CG TYR A 36 -10.331 -14.776 -10.372 1.00 0.00 C ATOM 581 CD1 TYR A 36 -11.292 -15.500 -11.068 1.00 0.00 C ATOM 582 CD2 TYR A 36 -9.600 -13.821 -11.066 1.00 0.00 C ATOM 583 CE1 TYR A 36 -11.517 -15.278 -12.413 1.00 0.00 C ATOM 584 CE2 TYR A 36 -9.820 -13.591 -12.411 1.00 0.00 C ATOM 585 CZ TYR A 36 -10.779 -14.322 -13.079 1.00 0.00 C ATOM 586 OH TYR A 36 -11.000 -14.098 -14.419 1.00 0.00 O ATOM 0 H TYR A 36 -10.090 -14.655 -6.424 1.00 0.00 H new ATOM 0 HA TYR A 36 -12.071 -14.300 -8.500 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -9.397 -14.268 -8.523 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -9.599 -15.990 -8.778 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -11.872 -16.248 -10.549 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -8.847 -13.248 -10.546 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -12.267 -15.850 -12.940 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -9.244 -12.843 -12.936 1.00 0.00 H new ATOM 0 HH TYR A 36 -11.357 -14.912 -14.832 1.00 0.00 H new ATOM 596 N VAL A 37 -13.316 -16.426 -8.200 1.00 0.00 N ATOM 597 CA VAL A 37 -14.047 -17.688 -8.202 1.00 0.00 C ATOM 598 C VAL A 37 -14.184 -18.242 -9.615 1.00 0.00 C ATOM 599 O VAL A 37 -14.744 -17.591 -10.496 1.00 0.00 O ATOM 600 CB VAL A 37 -15.451 -17.524 -7.589 1.00 0.00 C ATOM 601 CG1 VAL A 37 -16.161 -18.867 -7.512 1.00 0.00 C ATOM 602 CG2 VAL A 37 -15.359 -16.881 -6.213 1.00 0.00 C ATOM 0 H VAL A 37 -13.900 -15.601 -8.336 1.00 0.00 H new ATOM 0 HA VAL A 37 -13.472 -18.387 -7.595 1.00 0.00 H new ATOM 0 HB VAL A 37 -16.036 -16.868 -8.234 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -17.151 -18.731 -7.076 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -16.260 -19.284 -8.514 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -15.582 -19.550 -6.890 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -16.360 -16.773 -5.794 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -14.757 -17.510 -5.557 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -14.894 -15.899 -6.301 1.00 0.00 H new ATOM 612 N GLU A 38 -13.668 -19.450 -9.823 1.00 0.00 N ATOM 613 CA GLU A 38 -13.732 -20.092 -11.131 1.00 0.00 C ATOM 614 C GLU A 38 -14.886 -21.088 -11.192 1.00 0.00 C ATOM 615 O GLU A 38 -15.000 -21.975 -10.345 1.00 0.00 O ATOM 616 CB GLU A 38 -12.413 -20.803 -11.440 1.00 0.00 C ATOM 617 CG GLU A 38 -11.337 -19.880 -11.987 1.00 0.00 C ATOM 618 CD GLU A 38 -11.396 -19.745 -13.496 1.00 0.00 C ATOM 619 OE1 GLU A 38 -12.371 -20.242 -14.098 1.00 0.00 O ATOM 620 OE2 GLU A 38 -10.468 -19.142 -14.075 1.00 0.00 O ATOM 0 H GLU A 38 -13.202 -20.003 -9.104 1.00 0.00 H new ATOM 0 HA GLU A 38 -13.903 -19.318 -11.879 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -12.044 -21.278 -10.531 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -12.599 -21.598 -12.162 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -11.444 -18.895 -11.533 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -10.357 -20.259 -11.698 1.00 0.00 H new ATOM 627 N SER A 39 -15.740 -20.935 -12.199 1.00 0.00 N ATOM 628 CA SER A 39 -16.888 -21.818 -12.368 1.00 0.00 C ATOM 629 C SER A 39 -16.945 -22.368 -13.790 1.00 0.00 C ATOM 630 O SER A 39 -16.712 -21.643 -14.757 1.00 0.00 O ATOM 631 CB SER A 39 -18.184 -21.072 -12.045 1.00 0.00 C ATOM 632 OG SER A 39 -19.302 -21.711 -12.637 1.00 0.00 O ATOM 0 H SER A 39 -15.659 -20.208 -12.910 1.00 0.00 H new ATOM 0 HA SER A 39 -16.777 -22.654 -11.678 1.00 0.00 H new ATOM 0 HB2 SER A 39 -18.319 -21.023 -10.965 1.00 0.00 H new ATOM 0 HB3 SER A 39 -18.116 -20.045 -12.405 1.00 0.00 H new ATOM 0 HG SER A 39 -20.118 -21.216 -12.414 1.00 0.00 H new ATOM 638 N GLU A 40 -17.258 -23.655 -13.909 1.00 0.00 N ATOM 639 CA GLU A 40 -17.345 -24.302 -15.212 1.00 0.00 C ATOM 640 C GLU A 40 -18.257 -23.517 -16.150 1.00 0.00 C ATOM 641 O GLU A 40 -17.995 -23.417 -17.348 1.00 0.00 O ATOM 642 CB GLU A 40 -17.861 -25.734 -15.061 1.00 0.00 C ATOM 643 CG GLU A 40 -16.892 -26.659 -14.344 1.00 0.00 C ATOM 644 CD GLU A 40 -15.898 -27.308 -15.287 1.00 0.00 C ATOM 645 OE1 GLU A 40 -15.875 -26.928 -16.477 1.00 0.00 O ATOM 646 OE2 GLU A 40 -15.144 -28.195 -14.837 1.00 0.00 O ATOM 0 H GLU A 40 -17.455 -24.269 -13.119 1.00 0.00 H new ATOM 0 HA GLU A 40 -16.345 -24.327 -15.644 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -18.804 -25.715 -14.514 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -18.074 -26.141 -16.050 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -16.351 -26.094 -13.585 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -17.454 -27.435 -13.824 1.00 0.00 H new ATOM 653 N ASN A 41 -19.330 -22.962 -15.595 1.00 0.00 N ATOM 654 CA ASN A 41 -20.282 -22.186 -16.381 1.00 0.00 C ATOM 655 C ASN A 41 -19.731 -20.798 -16.688 1.00 0.00 C ATOM 656 O ASN A 41 -20.076 -20.192 -17.702 1.00 0.00 O ATOM 657 CB ASN A 41 -21.612 -22.065 -15.634 1.00 0.00 C ATOM 658 CG ASN A 41 -22.525 -23.251 -15.882 1.00 0.00 C ATOM 659 OD1 ASN A 41 -22.061 -24.358 -16.157 1.00 0.00 O ATOM 660 ND2 ASN A 41 -23.830 -23.024 -15.787 1.00 0.00 N ATOM 0 H ASN A 41 -19.562 -23.035 -14.604 1.00 0.00 H new ATOM 0 HA ASN A 41 -20.448 -22.708 -17.323 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -21.418 -21.976 -14.565 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -22.117 -21.150 -15.943 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -24.493 -23.783 -15.944 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -24.170 -22.090 -15.557 1.00 0.00 H new ATOM 667 N GLY A 42 -18.871 -20.299 -15.805 1.00 0.00 N ATOM 668 CA GLY A 42 -18.284 -18.986 -16.000 1.00 0.00 C ATOM 669 C GLY A 42 -17.741 -18.397 -14.713 1.00 0.00 C ATOM 670 O GLY A 42 -18.483 -18.205 -13.750 1.00 0.00 O ATOM 0 H GLY A 42 -18.570 -20.781 -14.958 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -17.479 -19.056 -16.732 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -19.035 -18.314 -16.415 1.00 0.00 H new ATOM 674 N GLN A 43 -16.444 -18.111 -14.697 1.00 0.00 N ATOM 675 CA GLN A 43 -15.802 -17.543 -13.517 1.00 0.00 C ATOM 676 C GLN A 43 -16.318 -16.134 -13.242 1.00 0.00 C ATOM 677 O GLN A 43 -16.742 -15.428 -14.157 1.00 0.00 O ATOM 678 CB GLN A 43 -14.284 -17.515 -13.699 1.00 0.00 C ATOM 679 CG GLN A 43 -13.830 -16.706 -14.903 1.00 0.00 C ATOM 680 CD GLN A 43 -12.510 -17.192 -15.470 1.00 0.00 C ATOM 681 OE1 GLN A 43 -11.453 -16.631 -15.180 1.00 0.00 O ATOM 682 NE2 GLN A 43 -12.565 -18.241 -16.282 1.00 0.00 N ATOM 0 H GLN A 43 -15.817 -18.263 -15.487 1.00 0.00 H new ATOM 0 HA GLN A 43 -16.047 -18.174 -12.663 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -13.826 -17.101 -12.800 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -13.920 -18.537 -13.800 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -14.594 -16.756 -15.678 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -13.734 -15.659 -14.617 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -13.463 -18.675 -16.495 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -11.709 -18.613 -16.693 1.00 0.00 H new ATOM 691 N MET A 44 -16.281 -15.732 -11.976 1.00 0.00 N ATOM 692 CA MET A 44 -16.744 -14.407 -11.581 1.00 0.00 C ATOM 693 C MET A 44 -15.967 -13.897 -10.372 1.00 0.00 C ATOM 694 O MET A 44 -15.328 -14.673 -9.660 1.00 0.00 O ATOM 695 CB MET A 44 -18.240 -14.440 -11.264 1.00 0.00 C ATOM 696 CG MET A 44 -18.570 -15.156 -9.964 1.00 0.00 C ATOM 697 SD MET A 44 -20.317 -15.585 -9.831 1.00 0.00 S ATOM 698 CE MET A 44 -20.241 -16.961 -8.687 1.00 0.00 C ATOM 0 H MET A 44 -15.935 -16.305 -11.206 1.00 0.00 H new ATOM 0 HA MET A 44 -16.571 -13.726 -12.414 1.00 0.00 H new ATOM 0 HB2 MET A 44 -18.615 -13.418 -11.211 1.00 0.00 H new ATOM 0 HB3 MET A 44 -18.766 -14.930 -12.083 1.00 0.00 H new ATOM 0 HG2 MET A 44 -17.971 -16.063 -9.891 1.00 0.00 H new ATOM 0 HG3 MET A 44 -18.291 -14.521 -9.123 1.00 0.00 H new ATOM 0 HE1 MET A 44 -20.394 -17.894 -9.229 1.00 0.00 H new ATOM 0 HE2 MET A 44 -19.265 -16.978 -8.203 1.00 0.00 H new ATOM 0 HE3 MET A 44 -21.019 -16.849 -7.931 1.00 0.00 H new ATOM 708 N TYR A 45 -16.026 -12.589 -10.144 1.00 0.00 N ATOM 709 CA TYR A 45 -15.326 -11.976 -9.022 1.00 0.00 C ATOM 710 C TYR A 45 -16.252 -11.824 -7.819 1.00 0.00 C ATOM 711 O TYR A 45 -17.243 -11.096 -7.873 1.00 0.00 O ATOM 712 CB TYR A 45 -14.769 -10.611 -9.427 1.00 0.00 C ATOM 713 CG TYR A 45 -13.368 -10.671 -9.993 1.00 0.00 C ATOM 714 CD1 TYR A 45 -12.323 -11.218 -9.257 1.00 0.00 C ATOM 715 CD2 TYR A 45 -13.089 -10.182 -11.263 1.00 0.00 C ATOM 716 CE1 TYR A 45 -11.042 -11.275 -9.770 1.00 0.00 C ATOM 717 CE2 TYR A 45 -11.811 -10.237 -11.785 1.00 0.00 C ATOM 718 CZ TYR A 45 -10.791 -10.784 -11.035 1.00 0.00 C ATOM 719 OH TYR A 45 -9.516 -10.839 -11.550 1.00 0.00 O ATOM 0 H TYR A 45 -16.552 -11.933 -10.722 1.00 0.00 H new ATOM 0 HA TYR A 45 -14.500 -12.629 -8.741 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -15.432 -10.163 -10.167 1.00 0.00 H new ATOM 0 HB3 TYR A 45 -14.772 -9.954 -8.557 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -12.516 -11.605 -8.267 1.00 0.00 H new ATOM 0 HD2 TYR A 45 -13.885 -9.751 -11.852 1.00 0.00 H new ATOM 0 HE1 TYR A 45 -10.241 -11.702 -9.184 1.00 0.00 H new ATOM 0 HE2 TYR A 45 -11.612 -9.854 -12.775 1.00 0.00 H new ATOM 0 HH TYR A 45 -9.187 -11.761 -11.510 1.00 0.00 H new ATOM 729 N ILE A 46 -15.921 -12.517 -6.735 1.00 0.00 N ATOM 730 CA ILE A 46 -16.720 -12.459 -5.518 1.00 0.00 C ATOM 731 C ILE A 46 -16.032 -11.619 -4.447 1.00 0.00 C ATOM 732 O ILE A 46 -14.814 -11.680 -4.285 1.00 0.00 O ATOM 733 CB ILE A 46 -16.992 -13.866 -4.954 1.00 0.00 C ATOM 734 CG1 ILE A 46 -17.715 -14.725 -5.994 1.00 0.00 C ATOM 735 CG2 ILE A 46 -17.809 -13.775 -3.674 1.00 0.00 C ATOM 736 CD1 ILE A 46 -19.092 -14.211 -6.350 1.00 0.00 C ATOM 0 H ILE A 46 -15.105 -13.125 -6.675 1.00 0.00 H new ATOM 0 HA ILE A 46 -17.669 -11.995 -5.787 1.00 0.00 H new ATOM 0 HB ILE A 46 -16.038 -14.338 -4.720 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -17.109 -14.773 -6.899 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -17.803 -15.743 -5.615 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -17.993 -14.778 -3.288 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -17.260 -13.195 -2.932 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -18.761 -13.287 -3.884 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -19.545 -14.868 -7.092 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -19.715 -14.189 -5.456 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -19.010 -13.204 -6.759 1.00 0.00 H new ATOM 748 N GLN A 47 -16.821 -10.836 -3.719 1.00 0.00 N ATOM 749 CA GLN A 47 -16.287 -9.984 -2.663 1.00 0.00 C ATOM 750 C GLN A 47 -16.889 -10.351 -1.310 1.00 0.00 C ATOM 751 O GLN A 47 -18.006 -9.947 -0.985 1.00 0.00 O ATOM 752 CB GLN A 47 -16.565 -8.513 -2.975 1.00 0.00 C ATOM 753 CG GLN A 47 -15.763 -7.547 -2.119 1.00 0.00 C ATOM 754 CD GLN A 47 -16.342 -6.146 -2.121 1.00 0.00 C ATOM 755 OE1 GLN A 47 -16.965 -5.720 -3.094 1.00 0.00 O ATOM 756 NE2 GLN A 47 -16.139 -5.420 -1.027 1.00 0.00 N ATOM 0 H GLN A 47 -17.832 -10.774 -3.841 1.00 0.00 H new ATOM 0 HA GLN A 47 -15.209 -10.141 -2.616 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -16.343 -8.325 -4.025 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -17.627 -8.315 -2.833 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -15.726 -7.919 -1.095 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -14.736 -7.512 -2.483 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -15.617 -5.813 -0.244 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -16.505 -4.470 -0.970 1.00 0.00 H new ATOM 765 N LYS A 48 -16.143 -11.121 -0.525 1.00 0.00 N ATOM 766 CA LYS A 48 -16.602 -11.543 0.793 1.00 0.00 C ATOM 767 C LYS A 48 -16.199 -10.530 1.859 1.00 0.00 C ATOM 768 O LYS A 48 -16.848 -10.416 2.899 1.00 0.00 O ATOM 769 CB LYS A 48 -16.028 -12.919 1.139 1.00 0.00 C ATOM 770 CG LYS A 48 -16.329 -13.983 0.098 1.00 0.00 C ATOM 771 CD LYS A 48 -17.823 -14.120 -0.143 1.00 0.00 C ATOM 772 CE LYS A 48 -18.148 -15.382 -0.928 1.00 0.00 C ATOM 773 NZ LYS A 48 -18.393 -16.545 -0.031 1.00 0.00 N ATOM 0 H LYS A 48 -15.217 -11.466 -0.779 1.00 0.00 H new ATOM 0 HA LYS A 48 -17.690 -11.605 0.769 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -14.948 -12.833 1.257 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -16.429 -13.239 2.100 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -15.830 -13.729 -0.837 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -15.923 -14.940 0.426 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -18.346 -14.140 0.813 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -18.186 -13.248 -0.687 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -19.029 -15.208 -1.546 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -17.324 -15.612 -1.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -18.611 -17.385 -0.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -17.544 -16.727 0.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -19.195 -16.336 0.597 1.00 0.00 H new ATOM 787 N LYS A 49 -15.125 -9.793 1.594 1.00 0.00 N ATOM 788 CA LYS A 49 -14.637 -8.787 2.529 1.00 0.00 C ATOM 789 C LYS A 49 -14.929 -7.380 2.016 1.00 0.00 C ATOM 790 O LYS A 49 -14.539 -6.999 0.912 1.00 0.00 O ATOM 791 CB LYS A 49 -13.133 -8.957 2.754 1.00 0.00 C ATOM 792 CG LYS A 49 -12.664 -8.478 4.117 1.00 0.00 C ATOM 793 CD LYS A 49 -11.387 -9.182 4.547 1.00 0.00 C ATOM 794 CE LYS A 49 -10.243 -8.897 3.585 1.00 0.00 C ATOM 795 NZ LYS A 49 -8.937 -9.368 4.123 1.00 0.00 N ATOM 0 H LYS A 49 -14.576 -9.874 0.738 1.00 0.00 H new ATOM 0 HA LYS A 49 -15.158 -8.925 3.476 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -12.874 -10.009 2.639 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -12.594 -8.410 1.981 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -12.495 -7.402 4.087 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -13.446 -8.657 4.855 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -11.110 -8.856 5.550 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -11.562 -10.257 4.598 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -10.440 -9.386 2.631 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -10.191 -7.826 3.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -8.183 -9.156 3.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -8.736 -8.883 5.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -8.978 -10.394 4.285 1.00 0.00 H new ATOM 809 N PRO A 50 -15.632 -6.585 2.835 1.00 0.00 N ATOM 810 CA PRO A 50 -15.930 -5.225 2.377 1.00 0.00 C ATOM 811 C PRO A 50 -14.687 -4.344 2.326 1.00 0.00 C ATOM 812 O PRO A 50 -13.573 -4.808 2.576 1.00 0.00 O ATOM 813 CB PRO A 50 -16.911 -4.703 3.430 1.00 0.00 C ATOM 814 CG PRO A 50 -16.608 -5.494 4.656 1.00 0.00 C ATOM 815 CD PRO A 50 -16.179 -6.854 4.176 1.00 0.00 C ATOM 0 HA PRO A 50 -16.327 -5.216 1.362 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -16.774 -3.636 3.604 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -17.944 -4.844 3.113 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -15.820 -5.020 5.241 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -17.484 -5.566 5.300 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -15.431 -7.295 4.834 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -17.018 -7.549 4.136 1.00 0.00 H new ATOM 823 N THR A 51 -14.882 -3.070 2.000 1.00 0.00 N ATOM 824 CA THR A 51 -13.776 -2.124 1.915 1.00 0.00 C ATOM 825 C THR A 51 -12.932 -2.151 3.184 1.00 0.00 C ATOM 826 O THR A 51 -13.458 -2.289 4.288 1.00 0.00 O ATOM 827 CB THR A 51 -14.282 -0.689 1.678 1.00 0.00 C ATOM 828 OG1 THR A 51 -15.341 -0.695 0.715 1.00 0.00 O ATOM 829 CG2 THR A 51 -13.154 0.209 1.192 1.00 0.00 C ATOM 0 H THR A 51 -15.796 -2.669 1.790 1.00 0.00 H new ATOM 0 HA THR A 51 -13.162 -2.429 1.067 1.00 0.00 H new ATOM 0 HB THR A 51 -14.655 -0.298 2.625 1.00 0.00 H new ATOM 0 HG1 THR A 51 -15.658 0.221 0.572 1.00 0.00 H new ATOM 0 HG21 THR A 51 -13.535 1.217 1.031 1.00 0.00 H new ATOM 0 HG22 THR A 51 -12.362 0.235 1.940 1.00 0.00 H new ATOM 0 HG23 THR A 51 -12.756 -0.182 0.256 1.00 0.00 H new ATOM 837 N MET A 52 -11.620 -2.016 3.019 1.00 0.00 N ATOM 838 CA MET A 52 -10.703 -2.022 4.153 1.00 0.00 C ATOM 839 C MET A 52 -10.023 -0.666 4.310 1.00 0.00 C ATOM 840 O MET A 52 -9.970 0.125 3.367 1.00 0.00 O ATOM 841 CB MET A 52 -9.649 -3.117 3.978 1.00 0.00 C ATOM 842 CG MET A 52 -10.085 -4.471 4.513 1.00 0.00 C ATOM 843 SD MET A 52 -8.695 -5.577 4.822 1.00 0.00 S ATOM 844 CE MET A 52 -7.729 -5.330 3.334 1.00 0.00 C ATOM 0 H MET A 52 -11.168 -1.901 2.112 1.00 0.00 H new ATOM 0 HA MET A 52 -11.281 -2.225 5.054 1.00 0.00 H new ATOM 0 HB2 MET A 52 -9.410 -3.214 2.919 1.00 0.00 H new ATOM 0 HB3 MET A 52 -8.733 -2.813 4.485 1.00 0.00 H new ATOM 0 HG2 MET A 52 -10.644 -4.329 5.438 1.00 0.00 H new ATOM 0 HG3 MET A 52 -10.764 -4.938 3.799 1.00 0.00 H new ATOM 0 HE1 MET A 52 -7.049 -6.171 3.198 1.00 0.00 H new ATOM 0 HE2 MET A 52 -8.396 -5.260 2.475 1.00 0.00 H new ATOM 0 HE3 MET A 52 -7.154 -4.409 3.423 1.00 0.00 H new ATOM 854 N TYR A 53 -9.505 -0.404 5.504 1.00 0.00 N ATOM 855 CA TYR A 53 -8.830 0.858 5.784 1.00 0.00 C ATOM 856 C TYR A 53 -7.436 0.616 6.355 1.00 0.00 C ATOM 857 O TYR A 53 -7.226 0.594 7.568 1.00 0.00 O ATOM 858 CB TYR A 53 -9.656 1.696 6.762 1.00 0.00 C ATOM 859 CG TYR A 53 -11.118 1.794 6.390 1.00 0.00 C ATOM 860 CD1 TYR A 53 -11.510 2.318 5.164 1.00 0.00 C ATOM 861 CD2 TYR A 53 -12.108 1.365 7.265 1.00 0.00 C ATOM 862 CE1 TYR A 53 -12.844 2.410 4.820 1.00 0.00 C ATOM 863 CE2 TYR A 53 -13.445 1.452 6.929 1.00 0.00 C ATOM 864 CZ TYR A 53 -13.808 1.976 5.706 1.00 0.00 C ATOM 865 OH TYR A 53 -15.139 2.066 5.368 1.00 0.00 O ATOM 0 H TYR A 53 -9.539 -1.048 6.294 1.00 0.00 H new ATOM 0 HA TYR A 53 -8.728 1.402 4.845 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -9.572 1.264 7.759 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -9.235 2.700 6.813 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -10.758 2.659 4.468 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -11.827 0.956 8.225 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -13.131 2.819 3.863 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -14.202 1.112 7.620 1.00 0.00 H new ATOM 0 HH TYR A 53 -15.687 1.717 6.101 1.00 0.00 H new ATOM 875 N PRO A 54 -6.456 0.430 5.460 1.00 0.00 N ATOM 876 CA PRO A 54 -5.101 0.195 5.969 1.00 0.00 C ATOM 877 C PRO A 54 -4.499 1.440 6.611 1.00 0.00 C ATOM 878 O PRO A 54 -4.871 2.573 6.304 1.00 0.00 O ATOM 879 CB PRO A 54 -4.313 -0.194 4.715 1.00 0.00 C ATOM 880 CG PRO A 54 -5.057 0.439 3.590 1.00 0.00 C ATOM 881 CD PRO A 54 -6.506 0.421 3.989 1.00 0.00 C ATOM 0 HA PRO A 54 -5.086 -0.564 6.751 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -3.286 0.168 4.764 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -4.264 -1.277 4.598 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -4.712 1.459 3.419 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -4.901 -0.110 2.661 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -7.040 1.288 3.600 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -7.016 -0.465 3.610 1.00 0.00 H new ATOM 889 N PRO A 55 -3.542 1.231 7.527 1.00 0.00 N ATOM 890 CA PRO A 55 -2.938 2.404 8.166 1.00 0.00 C ATOM 891 C PRO A 55 -2.067 3.205 7.204 1.00 0.00 C ATOM 892 O PRO A 55 -1.832 2.786 6.070 1.00 0.00 O ATOM 893 CB PRO A 55 -2.084 1.799 9.283 1.00 0.00 C ATOM 894 CG PRO A 55 -1.771 0.420 8.816 1.00 0.00 C ATOM 895 CD PRO A 55 -2.967 -0.030 8.024 1.00 0.00 C ATOM 0 HA PRO A 55 -3.691 3.108 8.520 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -1.175 2.378 9.444 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -2.624 1.783 10.230 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -0.870 0.411 8.202 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -1.588 -0.246 9.660 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -2.681 -0.691 7.206 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -3.676 -0.578 8.644 1.00 0.00 H new ATOM 903 N TRP A 56 -1.592 4.356 7.663 1.00 0.00 N ATOM 904 CA TRP A 56 -0.746 5.215 6.841 1.00 0.00 C ATOM 905 C TRP A 56 0.728 4.999 7.167 1.00 0.00 C ATOM 906 O TRP A 56 1.119 4.980 8.334 1.00 0.00 O ATOM 907 CB TRP A 56 -1.118 6.684 7.052 1.00 0.00 C ATOM 908 CG TRP A 56 -2.153 7.178 6.087 1.00 0.00 C ATOM 909 CD1 TRP A 56 -3.366 7.724 6.396 1.00 0.00 C ATOM 910 CD2 TRP A 56 -2.066 7.171 4.658 1.00 0.00 C ATOM 911 NE1 TRP A 56 -4.039 8.056 5.245 1.00 0.00 N ATOM 912 CE2 TRP A 56 -3.262 7.727 4.165 1.00 0.00 C ATOM 913 CE3 TRP A 56 -1.093 6.750 3.748 1.00 0.00 C ATOM 914 CZ2 TRP A 56 -3.510 7.871 2.803 1.00 0.00 C ATOM 915 CZ3 TRP A 56 -1.341 6.893 2.396 1.00 0.00 C ATOM 916 CH2 TRP A 56 -2.540 7.450 1.933 1.00 0.00 C ATOM 0 H TRP A 56 -1.777 4.717 8.599 1.00 0.00 H new ATOM 0 HA TRP A 56 -0.910 4.952 5.796 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -1.487 6.816 8.069 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -0.221 7.296 6.957 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -3.741 7.873 7.398 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -4.966 8.479 5.201 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -0.165 6.321 4.095 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -4.435 8.299 2.445 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -0.597 6.569 1.683 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -2.702 7.549 0.870 1.00 0.00 H new ATOM 927 N ASP A 57 1.542 4.839 6.129 1.00 0.00 N ATOM 928 CA ASP A 57 2.973 4.626 6.306 1.00 0.00 C ATOM 929 C ASP A 57 3.238 3.381 7.147 1.00 0.00 C ATOM 930 O ASP A 57 4.251 3.293 7.842 1.00 0.00 O ATOM 931 CB ASP A 57 3.615 5.848 6.964 1.00 0.00 C ATOM 932 CG ASP A 57 3.522 7.088 6.098 1.00 0.00 C ATOM 933 OD1 ASP A 57 2.899 7.013 5.018 1.00 0.00 O ATOM 934 OD2 ASP A 57 4.071 8.135 6.500 1.00 0.00 O ATOM 0 H ASP A 57 1.235 4.853 5.156 1.00 0.00 H new ATOM 0 HA ASP A 57 3.417 4.478 5.322 1.00 0.00 H new ATOM 0 HB2 ASP A 57 3.129 6.039 7.921 1.00 0.00 H new ATOM 0 HB3 ASP A 57 4.663 5.634 7.176 1.00 0.00 H new ATOM 939 N SER A 58 2.320 2.422 7.081 1.00 0.00 N ATOM 940 CA SER A 58 2.452 1.184 7.841 1.00 0.00 C ATOM 941 C SER A 58 2.216 -0.030 6.947 1.00 0.00 C ATOM 942 O SER A 58 1.958 0.106 5.750 1.00 0.00 O ATOM 943 CB SER A 58 1.465 1.171 9.009 1.00 0.00 C ATOM 944 OG SER A 58 2.019 1.799 10.152 1.00 0.00 O ATOM 0 H SER A 58 1.477 2.478 6.509 1.00 0.00 H new ATOM 0 HA SER A 58 3.468 1.133 8.232 1.00 0.00 H new ATOM 0 HB2 SER A 58 0.547 1.682 8.719 1.00 0.00 H new ATOM 0 HB3 SER A 58 1.195 0.143 9.250 1.00 0.00 H new ATOM 0 HG SER A 58 1.368 1.779 10.884 1.00 0.00 H new ATOM 950 N THR A 59 2.307 -1.218 7.537 1.00 0.00 N ATOM 951 CA THR A 59 2.105 -2.456 6.796 1.00 0.00 C ATOM 952 C THR A 59 0.923 -3.243 7.351 1.00 0.00 C ATOM 953 O THR A 59 0.746 -3.342 8.565 1.00 0.00 O ATOM 954 CB THR A 59 3.362 -3.345 6.835 1.00 0.00 C ATOM 955 OG1 THR A 59 4.080 -3.125 8.053 1.00 0.00 O ATOM 956 CG2 THR A 59 4.267 -3.055 5.647 1.00 0.00 C ATOM 0 H THR A 59 2.519 -1.348 8.526 1.00 0.00 H new ATOM 0 HA THR A 59 1.898 -2.176 5.763 1.00 0.00 H new ATOM 0 HB THR A 59 3.045 -4.387 6.784 1.00 0.00 H new ATOM 0 HG1 THR A 59 4.877 -3.695 8.071 1.00 0.00 H new ATOM 0 HG21 THR A 59 5.148 -3.695 5.696 1.00 0.00 H new ATOM 0 HG22 THR A 59 3.727 -3.252 4.721 1.00 0.00 H new ATOM 0 HG23 THR A 59 4.576 -2.010 5.671 1.00 0.00 H new ATOM 964 N PHE A 60 0.116 -3.800 6.454 1.00 0.00 N ATOM 965 CA PHE A 60 -1.051 -4.578 6.855 1.00 0.00 C ATOM 966 C PHE A 60 -0.969 -6.001 6.309 1.00 0.00 C ATOM 967 O PHE A 60 -0.245 -6.269 5.351 1.00 0.00 O ATOM 968 CB PHE A 60 -2.333 -3.904 6.363 1.00 0.00 C ATOM 969 CG PHE A 60 -2.395 -3.750 4.870 1.00 0.00 C ATOM 970 CD1 PHE A 60 -2.806 -4.802 4.068 1.00 0.00 C ATOM 971 CD2 PHE A 60 -2.043 -2.552 4.269 1.00 0.00 C ATOM 972 CE1 PHE A 60 -2.863 -4.663 2.694 1.00 0.00 C ATOM 973 CE2 PHE A 60 -2.098 -2.407 2.896 1.00 0.00 C ATOM 974 CZ PHE A 60 -2.509 -3.463 2.108 1.00 0.00 C ATOM 0 H PHE A 60 0.248 -3.727 5.445 1.00 0.00 H new ATOM 0 HA PHE A 60 -1.069 -4.626 7.944 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -3.191 -4.487 6.696 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -2.417 -2.921 6.825 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -3.085 -5.742 4.522 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -1.722 -1.722 4.881 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -3.184 -5.491 2.079 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -1.820 -1.468 2.440 1.00 0.00 H new ATOM 0 HZ PHE A 60 -2.554 -3.351 1.035 1.00 0.00 H new ATOM 984 N ASP A 61 -1.717 -6.909 6.927 1.00 0.00 N ATOM 985 CA ASP A 61 -1.730 -8.304 6.505 1.00 0.00 C ATOM 986 C ASP A 61 -2.740 -8.522 5.382 1.00 0.00 C ATOM 987 O ASP A 61 -3.783 -7.871 5.338 1.00 0.00 O ATOM 988 CB ASP A 61 -2.060 -9.215 7.688 1.00 0.00 C ATOM 989 CG ASP A 61 -3.435 -8.941 8.265 1.00 0.00 C ATOM 990 OD1 ASP A 61 -3.543 -8.069 9.152 1.00 0.00 O ATOM 991 OD2 ASP A 61 -4.403 -9.598 7.829 1.00 0.00 O ATOM 0 H ASP A 61 -2.322 -6.703 7.722 1.00 0.00 H new ATOM 0 HA ASP A 61 -0.737 -8.554 6.131 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -2.004 -10.255 7.368 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -1.309 -9.081 8.467 1.00 0.00 H new ATOM 996 N ALA A 62 -2.423 -9.443 4.478 1.00 0.00 N ATOM 997 CA ALA A 62 -3.303 -9.747 3.356 1.00 0.00 C ATOM 998 C ALA A 62 -3.303 -11.241 3.048 1.00 0.00 C ATOM 999 O ALA A 62 -2.327 -11.776 2.523 1.00 0.00 O ATOM 1000 CB ALA A 62 -2.886 -8.953 2.128 1.00 0.00 C ATOM 0 H ALA A 62 -1.563 -9.992 4.501 1.00 0.00 H new ATOM 0 HA ALA A 62 -4.317 -9.460 3.633 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -3.552 -9.190 1.298 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -2.944 -7.887 2.347 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -1.862 -9.212 1.857 1.00 0.00 H new ATOM 1006 N HIS A 63 -4.404 -11.909 3.379 1.00 0.00 N ATOM 1007 CA HIS A 63 -4.530 -13.341 3.138 1.00 0.00 C ATOM 1008 C HIS A 63 -4.360 -13.659 1.655 1.00 0.00 C ATOM 1009 O HIS A 63 -4.559 -12.797 0.799 1.00 0.00 O ATOM 1010 CB HIS A 63 -5.889 -13.844 3.627 1.00 0.00 C ATOM 1011 CG HIS A 63 -5.990 -13.943 5.118 1.00 0.00 C ATOM 1012 ND1 HIS A 63 -5.093 -14.653 5.887 1.00 0.00 N ATOM 1013 CD2 HIS A 63 -6.888 -13.414 5.981 1.00 0.00 C ATOM 1014 CE1 HIS A 63 -5.436 -14.559 7.160 1.00 0.00 C ATOM 1015 NE2 HIS A 63 -6.522 -13.811 7.244 1.00 0.00 N ATOM 0 H HIS A 63 -5.221 -11.481 3.815 1.00 0.00 H new ATOM 0 HA HIS A 63 -3.742 -13.849 3.693 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -6.668 -13.174 3.262 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -6.082 -14.825 3.192 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -7.735 -12.795 5.724 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -4.917 -15.016 7.990 1.00 0.00 H new ATOM 0 HE2 HIS A 63 -7.009 -13.568 8.106 1.00 0.00 H new ATOM 1023 N ILE A 64 -3.991 -14.901 1.360 1.00 0.00 N ATOM 1024 CA ILE A 64 -3.794 -15.332 -0.018 1.00 0.00 C ATOM 1025 C ILE A 64 -4.649 -16.554 -0.340 1.00 0.00 C ATOM 1026 O ILE A 64 -4.666 -17.527 0.412 1.00 0.00 O ATOM 1027 CB ILE A 64 -2.317 -15.665 -0.299 1.00 0.00 C ATOM 1028 CG1 ILE A 64 -1.417 -14.514 0.154 1.00 0.00 C ATOM 1029 CG2 ILE A 64 -2.111 -15.954 -1.779 1.00 0.00 C ATOM 1030 CD1 ILE A 64 0.060 -14.826 0.054 1.00 0.00 C ATOM 0 H ILE A 64 -3.822 -15.626 2.057 1.00 0.00 H new ATOM 0 HA ILE A 64 -4.098 -14.501 -0.654 1.00 0.00 H new ATOM 0 HB ILE A 64 -2.047 -16.557 0.267 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -1.636 -13.633 -0.450 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -1.657 -14.260 1.186 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -1.062 -16.188 -1.962 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -2.728 -16.803 -2.073 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -2.395 -15.079 -2.364 1.00 0.00 H new ATOM 0 HD11 ILE A 64 0.637 -13.965 0.391 1.00 0.00 H new ATOM 0 HD12 ILE A 64 0.293 -15.687 0.680 1.00 0.00 H new ATOM 0 HD13 ILE A 64 0.315 -15.051 -0.982 1.00 0.00 H new ATOM 1042 N ASN A 65 -5.356 -16.495 -1.463 1.00 0.00 N ATOM 1043 CA ASN A 65 -6.213 -17.597 -1.886 1.00 0.00 C ATOM 1044 C ASN A 65 -5.863 -18.047 -3.301 1.00 0.00 C ATOM 1045 O ASN A 65 -5.242 -19.092 -3.496 1.00 0.00 O ATOM 1046 CB ASN A 65 -7.684 -17.182 -1.820 1.00 0.00 C ATOM 1047 CG ASN A 65 -8.616 -18.275 -2.304 1.00 0.00 C ATOM 1048 OD1 ASN A 65 -9.475 -18.043 -3.155 1.00 0.00 O ATOM 1049 ND2 ASN A 65 -8.450 -19.477 -1.763 1.00 0.00 N ATOM 0 H ASN A 65 -5.353 -15.696 -2.097 1.00 0.00 H new ATOM 0 HA ASN A 65 -6.048 -18.433 -1.207 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -7.939 -16.920 -0.793 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -7.834 -16.287 -2.424 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -9.047 -20.252 -2.050 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -7.725 -19.624 -1.061 1.00 0.00 H new ATOM 1056 N LYS A 66 -6.264 -17.250 -4.285 1.00 0.00 N ATOM 1057 CA LYS A 66 -5.992 -17.564 -5.683 1.00 0.00 C ATOM 1058 C LYS A 66 -6.488 -16.448 -6.597 1.00 0.00 C ATOM 1059 O LYS A 66 -7.676 -16.127 -6.613 1.00 0.00 O ATOM 1060 CB LYS A 66 -6.657 -18.887 -6.069 1.00 0.00 C ATOM 1061 CG LYS A 66 -6.525 -19.226 -7.544 1.00 0.00 C ATOM 1062 CD LYS A 66 -6.883 -20.678 -7.816 1.00 0.00 C ATOM 1063 CE LYS A 66 -8.387 -20.868 -7.931 1.00 0.00 C ATOM 1064 NZ LYS A 66 -8.734 -22.139 -8.626 1.00 0.00 N ATOM 0 H LYS A 66 -6.779 -16.381 -4.141 1.00 0.00 H new ATOM 0 HA LYS A 66 -4.913 -17.658 -5.805 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -6.217 -19.691 -5.479 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -7.714 -18.842 -5.808 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -7.175 -18.574 -8.128 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -5.504 -19.034 -7.872 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -6.402 -21.006 -8.738 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -6.496 -21.306 -7.013 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -8.831 -20.866 -6.935 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -8.819 -20.027 -8.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -9.768 -22.232 -8.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -8.332 -22.131 -9.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -8.344 -22.943 -8.094 1.00 0.00 H new ATOM 1078 N GLY A 67 -5.570 -15.860 -7.359 1.00 0.00 N ATOM 1079 CA GLY A 67 -5.934 -14.788 -8.266 1.00 0.00 C ATOM 1080 C GLY A 67 -6.710 -13.684 -7.577 1.00 0.00 C ATOM 1081 O GLY A 67 -7.517 -12.998 -8.204 1.00 0.00 O ATOM 0 H GLY A 67 -4.581 -16.108 -7.364 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -5.031 -14.370 -8.711 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -6.532 -15.194 -9.082 1.00 0.00 H new ATOM 1085 N ARG A 68 -6.467 -13.511 -6.281 1.00 0.00 N ATOM 1086 CA ARG A 68 -7.151 -12.484 -5.505 1.00 0.00 C ATOM 1087 C ARG A 68 -6.661 -11.092 -5.894 1.00 0.00 C ATOM 1088 O ARG A 68 -5.461 -10.820 -5.887 1.00 0.00 O ATOM 1089 CB ARG A 68 -6.931 -12.714 -4.009 1.00 0.00 C ATOM 1090 CG ARG A 68 -8.053 -12.173 -3.138 1.00 0.00 C ATOM 1091 CD ARG A 68 -7.914 -12.639 -1.697 1.00 0.00 C ATOM 1092 NE ARG A 68 -7.141 -11.698 -0.890 1.00 0.00 N ATOM 1093 CZ ARG A 68 -7.198 -11.648 0.436 1.00 0.00 C ATOM 1094 NH1 ARG A 68 -7.986 -12.482 1.101 1.00 0.00 N ATOM 1095 NH2 ARG A 68 -6.464 -10.764 1.100 1.00 0.00 N ATOM 0 H ARG A 68 -5.801 -14.069 -5.747 1.00 0.00 H new ATOM 0 HA ARG A 68 -8.217 -12.549 -5.723 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -6.824 -13.783 -3.826 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -5.993 -12.244 -3.712 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -8.048 -11.084 -3.171 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -9.014 -12.500 -3.536 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -8.904 -12.764 -1.259 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -7.431 -13.616 -1.677 1.00 0.00 H new ATOM 0 HE ARG A 68 -6.524 -11.044 -1.371 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -8.550 -13.164 0.594 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -8.028 -12.441 2.119 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -5.855 -10.122 0.592 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -6.508 -10.726 2.118 1.00 0.00 H new ATOM 1109 N VAL A 69 -7.600 -10.214 -6.235 1.00 0.00 N ATOM 1110 CA VAL A 69 -7.264 -8.851 -6.627 1.00 0.00 C ATOM 1111 C VAL A 69 -7.482 -7.878 -5.473 1.00 0.00 C ATOM 1112 O VAL A 69 -8.362 -8.079 -4.637 1.00 0.00 O ATOM 1113 CB VAL A 69 -8.102 -8.392 -7.835 1.00 0.00 C ATOM 1114 CG1 VAL A 69 -7.838 -9.285 -9.038 1.00 0.00 C ATOM 1115 CG2 VAL A 69 -9.582 -8.381 -7.484 1.00 0.00 C ATOM 0 H VAL A 69 -8.598 -10.423 -6.247 1.00 0.00 H new ATOM 0 HA VAL A 69 -6.210 -8.852 -6.904 1.00 0.00 H new ATOM 0 HB VAL A 69 -7.806 -7.376 -8.095 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -8.439 -8.946 -9.882 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -6.782 -9.237 -9.302 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -8.104 -10.313 -8.793 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -10.159 -8.054 -8.349 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -9.895 -9.385 -7.197 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -9.754 -7.696 -6.654 1.00 0.00 H new ATOM 1125 N MET A 70 -6.674 -6.824 -5.435 1.00 0.00 N ATOM 1126 CA MET A 70 -6.780 -5.818 -4.384 1.00 0.00 C ATOM 1127 C MET A 70 -7.022 -4.434 -4.978 1.00 0.00 C ATOM 1128 O MET A 70 -6.088 -3.770 -5.426 1.00 0.00 O ATOM 1129 CB MET A 70 -5.509 -5.805 -3.531 1.00 0.00 C ATOM 1130 CG MET A 70 -5.444 -4.641 -2.556 1.00 0.00 C ATOM 1131 SD MET A 70 -4.173 -4.861 -1.296 1.00 0.00 S ATOM 1132 CE MET A 70 -2.713 -5.046 -2.316 1.00 0.00 C ATOM 0 H MET A 70 -5.939 -6.644 -6.119 1.00 0.00 H new ATOM 0 HA MET A 70 -7.630 -6.076 -3.753 1.00 0.00 H new ATOM 0 HB2 MET A 70 -5.446 -6.739 -2.973 1.00 0.00 H new ATOM 0 HB3 MET A 70 -4.640 -5.767 -4.188 1.00 0.00 H new ATOM 0 HG2 MET A 70 -5.249 -3.721 -3.107 1.00 0.00 H new ATOM 0 HG3 MET A 70 -6.413 -4.523 -2.072 1.00 0.00 H new ATOM 0 HE1 MET A 70 -1.843 -5.209 -1.680 1.00 0.00 H new ATOM 0 HE2 MET A 70 -2.840 -5.899 -2.982 1.00 0.00 H new ATOM 0 HE3 MET A 70 -2.566 -4.143 -2.908 1.00 0.00 H new ATOM 1142 N GLN A 71 -8.281 -4.008 -4.978 1.00 0.00 N ATOM 1143 CA GLN A 71 -8.644 -2.703 -5.518 1.00 0.00 C ATOM 1144 C GLN A 71 -8.274 -1.588 -4.545 1.00 0.00 C ATOM 1145 O GLN A 71 -8.754 -1.557 -3.411 1.00 0.00 O ATOM 1146 CB GLN A 71 -10.142 -2.653 -5.823 1.00 0.00 C ATOM 1147 CG GLN A 71 -10.571 -1.398 -6.565 1.00 0.00 C ATOM 1148 CD GLN A 71 -11.839 -1.600 -7.371 1.00 0.00 C ATOM 1149 OE1 GLN A 71 -12.720 -2.367 -6.982 1.00 0.00 O ATOM 1150 NE2 GLN A 71 -11.939 -0.910 -8.501 1.00 0.00 N ATOM 0 H GLN A 71 -9.066 -4.546 -4.611 1.00 0.00 H new ATOM 0 HA GLN A 71 -8.086 -2.553 -6.442 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -10.413 -3.526 -6.417 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -10.697 -2.719 -4.887 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -10.726 -0.592 -5.848 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -9.768 -1.082 -7.231 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -11.185 -0.285 -8.786 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -12.770 -1.005 -9.084 1.00 0.00 H new ATOM 1159 N ILE A 72 -7.419 -0.677 -4.995 1.00 0.00 N ATOM 1160 CA ILE A 72 -6.985 0.439 -4.163 1.00 0.00 C ATOM 1161 C ILE A 72 -7.600 1.751 -4.640 1.00 0.00 C ATOM 1162 O ILE A 72 -7.284 2.237 -5.727 1.00 0.00 O ATOM 1163 CB ILE A 72 -5.451 0.576 -4.159 1.00 0.00 C ATOM 1164 CG1 ILE A 72 -4.800 -0.753 -3.769 1.00 0.00 C ATOM 1165 CG2 ILE A 72 -5.021 1.683 -3.209 1.00 0.00 C ATOM 1166 CD1 ILE A 72 -3.288 -0.704 -3.758 1.00 0.00 C ATOM 0 H ILE A 72 -7.013 -0.689 -5.931 1.00 0.00 H new ATOM 0 HA ILE A 72 -7.325 0.228 -3.149 1.00 0.00 H new ATOM 0 HB ILE A 72 -5.121 0.839 -5.164 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -5.153 -1.045 -2.780 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -5.126 -1.526 -4.465 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -3.934 1.768 -3.217 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -5.461 2.628 -3.528 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -5.359 1.448 -2.200 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -2.894 -1.680 -3.473 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -2.925 -0.443 -4.752 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -2.953 0.046 -3.041 1.00 0.00 H new ATOM 1178 N ILE A 73 -8.477 2.319 -3.820 1.00 0.00 N ATOM 1179 CA ILE A 73 -9.134 3.576 -4.157 1.00 0.00 C ATOM 1180 C ILE A 73 -8.973 4.598 -3.037 1.00 0.00 C ATOM 1181 O ILE A 73 -9.419 4.376 -1.911 1.00 0.00 O ATOM 1182 CB ILE A 73 -10.634 3.371 -4.437 1.00 0.00 C ATOM 1183 CG1 ILE A 73 -10.830 2.369 -5.577 1.00 0.00 C ATOM 1184 CG2 ILE A 73 -11.298 4.698 -4.772 1.00 0.00 C ATOM 1185 CD1 ILE A 73 -12.237 1.820 -5.665 1.00 0.00 C ATOM 0 H ILE A 73 -8.749 1.929 -2.918 1.00 0.00 H new ATOM 0 HA ILE A 73 -8.652 3.951 -5.060 1.00 0.00 H new ATOM 0 HB ILE A 73 -11.104 2.969 -3.539 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -10.577 2.852 -6.521 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -10.133 1.541 -5.446 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -12.358 4.535 -4.967 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -11.185 5.384 -3.932 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -10.828 5.127 -5.657 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -12.302 1.117 -6.495 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -12.487 1.308 -4.736 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -12.938 2.639 -5.828 1.00 0.00 H new ATOM 1197 N VAL A 74 -8.334 5.720 -3.353 1.00 0.00 N ATOM 1198 CA VAL A 74 -8.117 6.778 -2.374 1.00 0.00 C ATOM 1199 C VAL A 74 -9.360 7.647 -2.219 1.00 0.00 C ATOM 1200 O VAL A 74 -9.737 8.381 -3.134 1.00 0.00 O ATOM 1201 CB VAL A 74 -6.925 7.671 -2.768 1.00 0.00 C ATOM 1202 CG1 VAL A 74 -6.643 8.696 -1.681 1.00 0.00 C ATOM 1203 CG2 VAL A 74 -5.693 6.823 -3.046 1.00 0.00 C ATOM 0 H VAL A 74 -7.958 5.919 -4.280 1.00 0.00 H new ATOM 0 HA VAL A 74 -7.898 6.290 -1.424 1.00 0.00 H new ATOM 0 HB VAL A 74 -7.182 8.208 -3.681 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -5.798 9.317 -1.977 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -7.522 9.324 -1.536 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -6.407 8.182 -0.749 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -4.861 7.470 -3.323 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -5.431 6.258 -2.152 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -5.903 6.133 -3.863 1.00 0.00 H new ATOM 1213 N LYS A 75 -9.994 7.561 -1.055 1.00 0.00 N ATOM 1214 CA LYS A 75 -11.194 8.340 -0.777 1.00 0.00 C ATOM 1215 C LYS A 75 -10.894 9.472 0.201 1.00 0.00 C ATOM 1216 O LYS A 75 -9.782 9.582 0.716 1.00 0.00 O ATOM 1217 CB LYS A 75 -12.293 7.439 -0.209 1.00 0.00 C ATOM 1218 CG LYS A 75 -12.540 6.188 -1.035 1.00 0.00 C ATOM 1219 CD LYS A 75 -13.705 5.380 -0.488 1.00 0.00 C ATOM 1220 CE LYS A 75 -14.220 4.380 -1.512 1.00 0.00 C ATOM 1221 NZ LYS A 75 -15.124 5.021 -2.506 1.00 0.00 N ATOM 0 H LYS A 75 -9.696 6.958 -0.288 1.00 0.00 H new ATOM 0 HA LYS A 75 -11.539 8.775 -1.715 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -12.024 7.147 0.806 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -13.220 8.009 -0.141 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -12.743 6.468 -2.069 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -11.641 5.572 -1.042 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -13.392 4.852 0.412 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -14.512 6.053 -0.198 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -13.377 3.923 -2.030 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -14.753 3.578 -1.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -15.454 4.307 -3.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -15.942 5.435 -2.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -14.609 5.769 -3.012 1.00 0.00 H new ATOM 1235 N GLY A 76 -11.895 10.310 0.455 1.00 0.00 N ATOM 1236 CA GLY A 76 -11.717 11.421 1.372 1.00 0.00 C ATOM 1237 C GLY A 76 -13.028 11.895 1.968 1.00 0.00 C ATOM 1238 O GLY A 76 -13.936 11.098 2.204 1.00 0.00 O ATOM 0 H GLY A 76 -12.825 10.239 0.042 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -11.043 11.121 2.175 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -11.239 12.249 0.847 1.00 0.00 H new ATOM 1242 N LYS A 77 -13.127 13.197 2.215 1.00 0.00 N ATOM 1243 CA LYS A 77 -14.335 13.778 2.788 1.00 0.00 C ATOM 1244 C LYS A 77 -14.960 14.789 1.831 1.00 0.00 C ATOM 1245 O LYS A 77 -16.161 14.747 1.567 1.00 0.00 O ATOM 1246 CB LYS A 77 -14.018 14.453 4.124 1.00 0.00 C ATOM 1247 CG LYS A 77 -13.987 13.491 5.299 1.00 0.00 C ATOM 1248 CD LYS A 77 -14.163 14.219 6.621 1.00 0.00 C ATOM 1249 CE LYS A 77 -12.869 14.881 7.070 1.00 0.00 C ATOM 1250 NZ LYS A 77 -12.979 15.436 8.447 1.00 0.00 N ATOM 0 H LYS A 77 -12.384 13.870 2.027 1.00 0.00 H new ATOM 0 HA LYS A 77 -15.050 12.973 2.956 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -13.052 14.953 4.049 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -14.763 15.225 4.317 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -14.777 12.749 5.183 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -13.040 12.951 5.303 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -14.943 14.974 6.521 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -14.496 13.515 7.384 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -12.058 14.154 7.035 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -12.610 15.680 6.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -12.077 15.878 8.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -13.736 16.149 8.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -13.201 14.669 9.114 1.00 0.00 H new ATOM 1264 N ASN A 78 -14.136 15.695 1.315 1.00 0.00 N ATOM 1265 CA ASN A 78 -14.608 16.716 0.387 1.00 0.00 C ATOM 1266 C ASN A 78 -14.591 16.197 -1.048 1.00 0.00 C ATOM 1267 O ASN A 78 -15.398 16.612 -1.880 1.00 0.00 O ATOM 1268 CB ASN A 78 -13.743 17.973 0.496 1.00 0.00 C ATOM 1269 CG ASN A 78 -13.985 18.731 1.788 1.00 0.00 C ATOM 1270 OD1 ASN A 78 -13.355 18.455 2.809 1.00 0.00 O ATOM 1271 ND2 ASN A 78 -14.901 19.691 1.748 1.00 0.00 N ATOM 0 H ASN A 78 -13.139 15.743 1.524 1.00 0.00 H new ATOM 0 HA ASN A 78 -15.635 16.965 0.653 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -12.691 17.694 0.433 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -13.950 18.628 -0.351 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -15.107 20.235 2.586 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -15.399 19.885 0.879 1.00 0.00 H new ATOM 1278 N VAL A 79 -13.666 15.285 -1.331 1.00 0.00 N ATOM 1279 CA VAL A 79 -13.545 14.707 -2.664 1.00 0.00 C ATOM 1280 C VAL A 79 -14.264 13.365 -2.748 1.00 0.00 C ATOM 1281 O VAL A 79 -14.346 12.630 -1.764 1.00 0.00 O ATOM 1282 CB VAL A 79 -12.069 14.512 -3.058 1.00 0.00 C ATOM 1283 CG1 VAL A 79 -11.405 13.485 -2.154 1.00 0.00 C ATOM 1284 CG2 VAL A 79 -11.959 14.099 -4.518 1.00 0.00 C ATOM 0 H VAL A 79 -12.990 14.931 -0.655 1.00 0.00 H new ATOM 0 HA VAL A 79 -14.009 15.408 -3.357 1.00 0.00 H new ATOM 0 HB VAL A 79 -11.549 15.461 -2.931 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -10.363 13.361 -2.448 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -11.452 13.826 -1.120 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -11.924 12.531 -2.245 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -10.909 13.965 -4.780 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -12.494 13.162 -4.672 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -12.395 14.874 -5.149 1.00 0.00 H new ATOM 1294 N ASP A 80 -14.783 13.052 -3.931 1.00 0.00 N ATOM 1295 CA ASP A 80 -15.494 11.798 -4.145 1.00 0.00 C ATOM 1296 C ASP A 80 -14.536 10.701 -4.599 1.00 0.00 C ATOM 1297 O ASP A 80 -14.645 9.550 -4.172 1.00 0.00 O ATOM 1298 CB ASP A 80 -16.602 11.986 -5.183 1.00 0.00 C ATOM 1299 CG ASP A 80 -17.814 12.698 -4.614 1.00 0.00 C ATOM 1300 OD1 ASP A 80 -17.633 13.747 -3.962 1.00 0.00 O ATOM 1301 OD2 ASP A 80 -18.943 12.204 -4.818 1.00 0.00 O ATOM 0 H ASP A 80 -14.724 13.650 -4.755 1.00 0.00 H new ATOM 0 HA ASP A 80 -15.941 11.496 -3.198 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -16.213 12.556 -6.027 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -16.904 11.012 -5.568 1.00 0.00 H new ATOM 1306 N LEU A 81 -13.599 11.063 -5.468 1.00 0.00 N ATOM 1307 CA LEU A 81 -12.622 10.109 -5.982 1.00 0.00 C ATOM 1308 C LEU A 81 -11.387 10.829 -6.515 1.00 0.00 C ATOM 1309 O LEU A 81 -11.498 11.826 -7.229 1.00 0.00 O ATOM 1310 CB LEU A 81 -13.246 9.255 -7.087 1.00 0.00 C ATOM 1311 CG LEU A 81 -12.555 7.921 -7.374 1.00 0.00 C ATOM 1312 CD1 LEU A 81 -13.146 6.817 -6.511 1.00 0.00 C ATOM 1313 CD2 LEU A 81 -12.672 7.568 -8.850 1.00 0.00 C ATOM 0 H LEU A 81 -13.495 12.010 -5.832 1.00 0.00 H new ATOM 0 HA LEU A 81 -12.316 9.461 -5.161 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -14.284 9.054 -6.821 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -13.260 9.840 -8.007 1.00 0.00 H new ATOM 0 HG LEU A 81 -11.498 8.020 -7.127 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -12.642 5.875 -6.729 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -13.010 7.066 -5.459 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -14.210 6.717 -6.726 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -12.175 6.616 -9.037 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -13.724 7.488 -9.123 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -12.201 8.347 -9.449 1.00 0.00 H new ATOM 1325 N ILE A 82 -10.213 10.316 -6.166 1.00 0.00 N ATOM 1326 CA ILE A 82 -8.958 10.908 -6.612 1.00 0.00 C ATOM 1327 C ILE A 82 -8.309 10.063 -7.703 1.00 0.00 C ATOM 1328 O ILE A 82 -7.939 10.573 -8.760 1.00 0.00 O ATOM 1329 CB ILE A 82 -7.965 11.070 -5.446 1.00 0.00 C ATOM 1330 CG1 ILE A 82 -8.601 11.884 -4.317 1.00 0.00 C ATOM 1331 CG2 ILE A 82 -6.685 11.734 -5.929 1.00 0.00 C ATOM 1332 CD1 ILE A 82 -7.806 11.855 -3.030 1.00 0.00 C ATOM 0 H ILE A 82 -10.104 9.491 -5.576 1.00 0.00 H new ATOM 0 HA ILE A 82 -9.199 11.893 -7.012 1.00 0.00 H new ATOM 0 HB ILE A 82 -7.715 10.082 -5.060 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -8.712 12.918 -4.643 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -9.603 11.502 -4.124 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -5.993 11.842 -5.094 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -6.226 11.119 -6.703 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -6.917 12.718 -6.337 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -8.315 12.453 -2.274 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -7.717 10.826 -2.680 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -6.812 12.265 -3.207 1.00 0.00 H new ATOM 1344 N SER A 83 -8.176 8.767 -7.440 1.00 0.00 N ATOM 1345 CA SER A 83 -7.570 7.850 -8.398 1.00 0.00 C ATOM 1346 C SER A 83 -7.658 6.410 -7.902 1.00 0.00 C ATOM 1347 O SER A 83 -8.038 6.158 -6.760 1.00 0.00 O ATOM 1348 CB SER A 83 -6.108 8.228 -8.644 1.00 0.00 C ATOM 1349 OG SER A 83 -5.354 8.157 -7.446 1.00 0.00 O ATOM 0 H SER A 83 -8.480 8.328 -6.571 1.00 0.00 H new ATOM 0 HA SER A 83 -8.120 7.928 -9.336 1.00 0.00 H new ATOM 0 HB2 SER A 83 -5.677 7.559 -9.389 1.00 0.00 H new ATOM 0 HB3 SER A 83 -6.054 9.237 -9.052 1.00 0.00 H new ATOM 0 HG SER A 83 -4.423 8.402 -7.630 1.00 0.00 H new ATOM 1355 N GLU A 84 -7.302 5.468 -8.771 1.00 0.00 N ATOM 1356 CA GLU A 84 -7.341 4.053 -8.422 1.00 0.00 C ATOM 1357 C GLU A 84 -6.432 3.241 -9.340 1.00 0.00 C ATOM 1358 O GLU A 84 -6.004 3.719 -10.392 1.00 0.00 O ATOM 1359 CB GLU A 84 -8.774 3.524 -8.507 1.00 0.00 C ATOM 1360 CG GLU A 84 -9.269 3.333 -9.931 1.00 0.00 C ATOM 1361 CD GLU A 84 -8.978 1.946 -10.470 1.00 0.00 C ATOM 1362 OE1 GLU A 84 -9.553 0.971 -9.942 1.00 0.00 O ATOM 1363 OE2 GLU A 84 -8.174 1.836 -11.420 1.00 0.00 O ATOM 0 H GLU A 84 -6.984 5.660 -9.721 1.00 0.00 H new ATOM 0 HA GLU A 84 -6.982 3.947 -7.398 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -8.833 2.572 -7.980 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -9.439 4.216 -7.990 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -10.343 3.514 -9.965 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -8.800 4.075 -10.577 1.00 0.00 H new ATOM 1370 N THR A 85 -6.139 2.009 -8.934 1.00 0.00 N ATOM 1371 CA THR A 85 -5.280 1.131 -9.718 1.00 0.00 C ATOM 1372 C THR A 85 -5.540 -0.334 -9.384 1.00 0.00 C ATOM 1373 O THR A 85 -6.022 -0.658 -8.298 1.00 0.00 O ATOM 1374 CB THR A 85 -3.790 1.443 -9.479 1.00 0.00 C ATOM 1375 OG1 THR A 85 -2.980 0.689 -10.387 1.00 0.00 O ATOM 1376 CG2 THR A 85 -3.392 1.117 -8.047 1.00 0.00 C ATOM 0 H THR A 85 -6.484 1.597 -8.067 1.00 0.00 H new ATOM 0 HA THR A 85 -5.518 1.310 -10.767 1.00 0.00 H new ATOM 0 HB THR A 85 -3.633 2.508 -9.650 1.00 0.00 H new ATOM 0 HG1 THR A 85 -2.035 0.894 -10.230 1.00 0.00 H new ATOM 0 HG21 THR A 85 -2.336 1.345 -7.902 1.00 0.00 H new ATOM 0 HG22 THR A 85 -3.990 1.714 -7.358 1.00 0.00 H new ATOM 0 HG23 THR A 85 -3.564 0.058 -7.854 1.00 0.00 H new ATOM 1384 N THR A 86 -5.219 -1.217 -10.325 1.00 0.00 N ATOM 1385 CA THR A 86 -5.419 -2.647 -10.130 1.00 0.00 C ATOM 1386 C THR A 86 -4.110 -3.342 -9.773 1.00 0.00 C ATOM 1387 O THR A 86 -3.052 -3.009 -10.308 1.00 0.00 O ATOM 1388 CB THR A 86 -6.010 -3.308 -11.390 1.00 0.00 C ATOM 1389 OG1 THR A 86 -6.946 -2.422 -12.014 1.00 0.00 O ATOM 1390 CG2 THR A 86 -6.700 -4.618 -11.041 1.00 0.00 C ATOM 0 H THR A 86 -4.820 -0.966 -11.229 1.00 0.00 H new ATOM 0 HA THR A 86 -6.123 -2.758 -9.305 1.00 0.00 H new ATOM 0 HB THR A 86 -5.193 -3.519 -12.080 1.00 0.00 H new ATOM 0 HG1 THR A 86 -7.316 -2.848 -12.815 1.00 0.00 H new ATOM 0 HG21 THR A 86 -7.109 -5.066 -11.946 1.00 0.00 H new ATOM 0 HG22 THR A 86 -5.979 -5.301 -10.592 1.00 0.00 H new ATOM 0 HG23 THR A 86 -7.507 -4.427 -10.334 1.00 0.00 H new ATOM 1398 N VAL A 87 -4.187 -4.310 -8.866 1.00 0.00 N ATOM 1399 CA VAL A 87 -3.008 -5.053 -8.438 1.00 0.00 C ATOM 1400 C VAL A 87 -3.382 -6.455 -7.971 1.00 0.00 C ATOM 1401 O VAL A 87 -4.285 -6.627 -7.152 1.00 0.00 O ATOM 1402 CB VAL A 87 -2.268 -4.325 -7.300 1.00 0.00 C ATOM 1403 CG1 VAL A 87 -3.209 -4.057 -6.136 1.00 0.00 C ATOM 1404 CG2 VAL A 87 -1.062 -5.134 -6.847 1.00 0.00 C ATOM 0 H VAL A 87 -5.054 -4.598 -8.413 1.00 0.00 H new ATOM 0 HA VAL A 87 -2.348 -5.125 -9.303 1.00 0.00 H new ATOM 0 HB VAL A 87 -1.913 -3.365 -7.676 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -2.668 -3.542 -5.342 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -4.037 -3.434 -6.474 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -3.597 -5.002 -5.757 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.551 -4.605 -6.043 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.392 -6.109 -6.488 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -0.378 -5.268 -7.685 1.00 0.00 H new ATOM 1414 N GLU A 88 -2.681 -7.455 -8.496 1.00 0.00 N ATOM 1415 CA GLU A 88 -2.940 -8.843 -8.132 1.00 0.00 C ATOM 1416 C GLU A 88 -2.186 -9.222 -6.861 1.00 0.00 C ATOM 1417 O GLU A 88 -1.031 -8.838 -6.672 1.00 0.00 O ATOM 1418 CB GLU A 88 -2.537 -9.777 -9.275 1.00 0.00 C ATOM 1419 CG GLU A 88 -3.482 -9.727 -10.464 1.00 0.00 C ATOM 1420 CD GLU A 88 -2.782 -10.014 -11.778 1.00 0.00 C ATOM 1421 OE1 GLU A 88 -1.835 -9.275 -12.120 1.00 0.00 O ATOM 1422 OE2 GLU A 88 -3.181 -10.978 -12.465 1.00 0.00 O ATOM 0 H GLU A 88 -1.930 -7.330 -9.174 1.00 0.00 H new ATOM 0 HA GLU A 88 -4.009 -8.949 -7.945 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -1.533 -9.517 -9.609 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -2.493 -10.799 -8.899 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -4.283 -10.452 -10.317 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -3.948 -8.743 -10.512 1.00 0.00 H new ATOM 1429 N LEU A 89 -2.848 -9.978 -5.991 1.00 0.00 N ATOM 1430 CA LEU A 89 -2.242 -10.409 -4.736 1.00 0.00 C ATOM 1431 C LEU A 89 -1.574 -11.772 -4.894 1.00 0.00 C ATOM 1432 O LEU A 89 -0.576 -12.066 -4.236 1.00 0.00 O ATOM 1433 CB LEU A 89 -3.298 -10.471 -3.631 1.00 0.00 C ATOM 1434 CG LEU A 89 -3.893 -9.131 -3.196 1.00 0.00 C ATOM 1435 CD1 LEU A 89 -5.333 -9.310 -2.742 1.00 0.00 C ATOM 1436 CD2 LEU A 89 -3.055 -8.510 -2.088 1.00 0.00 C ATOM 0 H LEU A 89 -3.804 -10.305 -6.132 1.00 0.00 H new ATOM 0 HA LEU A 89 -1.479 -9.681 -4.460 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -4.111 -11.114 -3.968 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -2.854 -10.949 -2.758 1.00 0.00 H new ATOM 0 HG LEU A 89 -3.885 -8.456 -4.052 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -5.740 -8.346 -2.436 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -5.926 -9.711 -3.564 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -5.366 -10.002 -1.900 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -3.493 -7.557 -1.791 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -3.031 -9.182 -1.230 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -2.040 -8.346 -2.448 1.00 0.00 H new ATOM 1448 N TYR A 90 -2.131 -12.599 -5.772 1.00 0.00 N ATOM 1449 CA TYR A 90 -1.590 -13.930 -6.017 1.00 0.00 C ATOM 1450 C TYR A 90 -0.162 -13.849 -6.549 1.00 0.00 C ATOM 1451 O TYR A 90 0.793 -14.192 -5.851 1.00 0.00 O ATOM 1452 CB TYR A 90 -2.473 -14.688 -7.009 1.00 0.00 C ATOM 1453 CG TYR A 90 -1.993 -16.092 -7.298 1.00 0.00 C ATOM 1454 CD1 TYR A 90 -2.245 -17.131 -6.410 1.00 0.00 C ATOM 1455 CD2 TYR A 90 -1.287 -16.381 -8.460 1.00 0.00 C ATOM 1456 CE1 TYR A 90 -1.807 -18.415 -6.670 1.00 0.00 C ATOM 1457 CE2 TYR A 90 -0.847 -17.663 -8.729 1.00 0.00 C ATOM 1458 CZ TYR A 90 -1.108 -18.676 -7.830 1.00 0.00 C ATOM 1459 OH TYR A 90 -0.672 -19.954 -8.093 1.00 0.00 O ATOM 0 H TYR A 90 -2.957 -12.371 -6.326 1.00 0.00 H new ATOM 0 HA TYR A 90 -1.575 -14.468 -5.069 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -3.489 -14.734 -6.616 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -2.517 -14.129 -7.944 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -2.793 -16.931 -5.501 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -1.079 -15.590 -9.165 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -2.011 -19.210 -5.969 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -0.302 -17.871 -9.638 1.00 0.00 H new ATOM 0 HH TYR A 90 -0.198 -19.968 -8.950 1.00 0.00 H new ATOM 1469 N SER A 91 -0.025 -13.393 -7.789 1.00 0.00 N ATOM 1470 CA SER A 91 1.286 -13.269 -8.418 1.00 0.00 C ATOM 1471 C SER A 91 2.231 -12.448 -7.545 1.00 0.00 C ATOM 1472 O SER A 91 3.439 -12.687 -7.523 1.00 0.00 O ATOM 1473 CB SER A 91 1.154 -12.620 -9.797 1.00 0.00 C ATOM 1474 OG SER A 91 2.289 -11.828 -10.098 1.00 0.00 O ATOM 0 H SER A 91 -0.805 -13.103 -8.379 1.00 0.00 H new ATOM 0 HA SER A 91 1.703 -14.269 -8.534 1.00 0.00 H new ATOM 0 HB2 SER A 91 1.034 -13.393 -10.556 1.00 0.00 H new ATOM 0 HB3 SER A 91 0.257 -12.002 -9.827 1.00 0.00 H new ATOM 0 HG SER A 91 2.181 -11.425 -10.985 1.00 0.00 H new ATOM 1480 N LEU A 92 1.672 -11.479 -6.828 1.00 0.00 N ATOM 1481 CA LEU A 92 2.464 -10.621 -5.953 1.00 0.00 C ATOM 1482 C LEU A 92 3.285 -11.453 -4.974 1.00 0.00 C ATOM 1483 O LEU A 92 4.424 -11.111 -4.656 1.00 0.00 O ATOM 1484 CB LEU A 92 1.552 -9.662 -5.186 1.00 0.00 C ATOM 1485 CG LEU A 92 2.218 -8.845 -4.078 1.00 0.00 C ATOM 1486 CD1 LEU A 92 3.278 -7.922 -4.659 1.00 0.00 C ATOM 1487 CD2 LEU A 92 1.178 -8.047 -3.305 1.00 0.00 C ATOM 0 H LEU A 92 0.674 -11.268 -6.835 1.00 0.00 H new ATOM 0 HA LEU A 92 3.149 -10.043 -6.573 1.00 0.00 H new ATOM 0 HB2 LEU A 92 1.102 -8.971 -5.899 1.00 0.00 H new ATOM 0 HB3 LEU A 92 0.739 -10.239 -4.746 1.00 0.00 H new ATOM 0 HG LEU A 92 2.705 -9.534 -3.387 1.00 0.00 H new ATOM 0 HD11 LEU A 92 3.741 -7.349 -3.856 1.00 0.00 H new ATOM 0 HD12 LEU A 92 4.039 -8.515 -5.166 1.00 0.00 H new ATOM 0 HD13 LEU A 92 2.815 -7.239 -5.372 1.00 0.00 H new ATOM 0 HD21 LEU A 92 1.670 -7.472 -2.521 1.00 0.00 H new ATOM 0 HD22 LEU A 92 0.662 -7.368 -3.984 1.00 0.00 H new ATOM 0 HD23 LEU A 92 0.456 -8.729 -2.856 1.00 0.00 H new ATOM 1499 N ALA A 93 2.701 -12.548 -4.499 1.00 0.00 N ATOM 1500 CA ALA A 93 3.380 -13.431 -3.559 1.00 0.00 C ATOM 1501 C ALA A 93 4.529 -14.172 -4.234 1.00 0.00 C ATOM 1502 O ALA A 93 5.473 -14.604 -3.574 1.00 0.00 O ATOM 1503 CB ALA A 93 2.393 -14.420 -2.957 1.00 0.00 C ATOM 0 H ALA A 93 1.758 -12.845 -4.750 1.00 0.00 H new ATOM 0 HA ALA A 93 3.797 -12.818 -2.760 1.00 0.00 H new ATOM 0 HB1 ALA A 93 2.914 -15.073 -2.257 1.00 0.00 H new ATOM 0 HB2 ALA A 93 1.608 -13.876 -2.431 1.00 0.00 H new ATOM 0 HB3 ALA A 93 1.949 -15.020 -3.751 1.00 0.00 H new ATOM 1509 N GLU A 94 4.441 -14.316 -5.553 1.00 0.00 N ATOM 1510 CA GLU A 94 5.474 -15.006 -6.316 1.00 0.00 C ATOM 1511 C GLU A 94 6.608 -14.053 -6.684 1.00 0.00 C ATOM 1512 O GLU A 94 7.740 -14.479 -6.915 1.00 0.00 O ATOM 1513 CB GLU A 94 4.878 -15.620 -7.584 1.00 0.00 C ATOM 1514 CG GLU A 94 3.958 -16.800 -7.316 1.00 0.00 C ATOM 1515 CD GLU A 94 3.955 -17.807 -8.449 1.00 0.00 C ATOM 1516 OE1 GLU A 94 3.452 -17.470 -9.541 1.00 0.00 O ATOM 1517 OE2 GLU A 94 4.456 -18.933 -8.243 1.00 0.00 O ATOM 0 H GLU A 94 3.666 -13.964 -6.115 1.00 0.00 H new ATOM 0 HA GLU A 94 5.880 -15.802 -5.691 1.00 0.00 H new ATOM 0 HB2 GLU A 94 4.322 -14.852 -8.123 1.00 0.00 H new ATOM 0 HB3 GLU A 94 5.689 -15.944 -8.237 1.00 0.00 H new ATOM 0 HG2 GLU A 94 4.267 -17.295 -6.396 1.00 0.00 H new ATOM 0 HG3 GLU A 94 2.943 -16.436 -7.156 1.00 0.00 H new ATOM 1524 N ARG A 95 6.295 -12.763 -6.736 1.00 0.00 N ATOM 1525 CA ARG A 95 7.286 -11.749 -7.077 1.00 0.00 C ATOM 1526 C ARG A 95 8.209 -11.472 -5.894 1.00 0.00 C ATOM 1527 O ARG A 95 9.426 -11.372 -6.054 1.00 0.00 O ATOM 1528 CB ARG A 95 6.594 -10.456 -7.512 1.00 0.00 C ATOM 1529 CG ARG A 95 6.332 -10.379 -9.007 1.00 0.00 C ATOM 1530 CD ARG A 95 5.977 -8.965 -9.439 1.00 0.00 C ATOM 1531 NE ARG A 95 6.185 -8.761 -10.870 1.00 0.00 N ATOM 1532 CZ ARG A 95 6.194 -7.565 -11.449 1.00 0.00 C ATOM 1533 NH1 ARG A 95 6.009 -6.472 -10.721 1.00 0.00 N ATOM 1534 NH2 ARG A 95 6.389 -7.461 -12.757 1.00 0.00 N ATOM 0 H ARG A 95 5.363 -12.395 -6.546 1.00 0.00 H new ATOM 0 HA ARG A 95 7.887 -12.127 -7.904 1.00 0.00 H new ATOM 0 HB2 ARG A 95 5.647 -10.364 -6.980 1.00 0.00 H new ATOM 0 HB3 ARG A 95 7.210 -9.607 -7.215 1.00 0.00 H new ATOM 0 HG2 ARG A 95 7.215 -10.715 -9.550 1.00 0.00 H new ATOM 0 HG3 ARG A 95 5.519 -11.056 -9.270 1.00 0.00 H new ATOM 0 HD2 ARG A 95 4.935 -8.761 -9.192 1.00 0.00 H new ATOM 0 HD3 ARG A 95 6.583 -8.252 -8.879 1.00 0.00 H new ATOM 0 HE ARG A 95 6.331 -9.582 -11.457 1.00 0.00 H new ATOM 0 HH11 ARG A 95 5.860 -6.549 -9.715 1.00 0.00 H new ATOM 0 HH12 ARG A 95 6.016 -5.555 -11.167 1.00 0.00 H new ATOM 0 HH21 ARG A 95 6.532 -8.300 -13.320 1.00 0.00 H new ATOM 0 HH22 ARG A 95 6.396 -6.542 -13.200 1.00 0.00 H new ATOM 1548 N CYS A 96 7.622 -11.349 -4.709 1.00 0.00 N ATOM 1549 CA CYS A 96 8.392 -11.081 -3.499 1.00 0.00 C ATOM 1550 C CYS A 96 9.534 -12.081 -3.349 1.00 0.00 C ATOM 1551 O CYS A 96 10.668 -11.703 -3.057 1.00 0.00 O ATOM 1552 CB CYS A 96 7.484 -11.137 -2.269 1.00 0.00 C ATOM 1553 SG CYS A 96 6.103 -9.971 -2.317 1.00 0.00 S ATOM 0 H CYS A 96 6.616 -11.430 -4.560 1.00 0.00 H new ATOM 0 HA CYS A 96 8.817 -10.081 -3.582 1.00 0.00 H new ATOM 0 HB2 CYS A 96 7.089 -12.148 -2.168 1.00 0.00 H new ATOM 0 HB3 CYS A 96 8.082 -10.939 -1.380 1.00 0.00 H new ATOM 0 HG CYS A 96 5.283 -10.309 -3.267 1.00 0.00 H new ATOM 1559 N ARG A 97 9.225 -13.358 -3.549 1.00 0.00 N ATOM 1560 CA ARG A 97 10.225 -14.413 -3.434 1.00 0.00 C ATOM 1561 C ARG A 97 11.400 -14.154 -4.373 1.00 0.00 C ATOM 1562 O ARG A 97 12.554 -14.401 -4.024 1.00 0.00 O ATOM 1563 CB ARG A 97 9.600 -15.774 -3.745 1.00 0.00 C ATOM 1564 CG ARG A 97 8.415 -16.117 -2.856 1.00 0.00 C ATOM 1565 CD ARG A 97 7.947 -17.547 -3.080 1.00 0.00 C ATOM 1566 NE ARG A 97 7.705 -17.829 -4.492 1.00 0.00 N ATOM 1567 CZ ARG A 97 7.666 -19.055 -5.000 1.00 0.00 C ATOM 1568 NH1 ARG A 97 7.853 -20.108 -4.216 1.00 0.00 N ATOM 1569 NH2 ARG A 97 7.440 -19.231 -6.296 1.00 0.00 N ATOM 0 H ARG A 97 8.290 -13.687 -3.791 1.00 0.00 H new ATOM 0 HA ARG A 97 10.596 -14.417 -2.409 1.00 0.00 H new ATOM 0 HB2 ARG A 97 9.278 -15.787 -4.786 1.00 0.00 H new ATOM 0 HB3 ARG A 97 10.361 -16.547 -3.637 1.00 0.00 H new ATOM 0 HG2 ARG A 97 8.692 -15.983 -1.810 1.00 0.00 H new ATOM 0 HG3 ARG A 97 7.595 -15.428 -3.059 1.00 0.00 H new ATOM 0 HD2 ARG A 97 8.697 -18.238 -2.696 1.00 0.00 H new ATOM 0 HD3 ARG A 97 7.032 -17.722 -2.514 1.00 0.00 H new ATOM 0 HE ARG A 97 7.558 -17.041 -5.123 1.00 0.00 H new ATOM 0 HH11 ARG A 97 8.027 -19.977 -3.220 1.00 0.00 H new ATOM 0 HH12 ARG A 97 7.822 -21.049 -4.609 1.00 0.00 H new ATOM 0 HH21 ARG A 97 7.296 -18.424 -6.903 1.00 0.00 H new ATOM 0 HH22 ARG A 97 7.410 -20.173 -6.685 1.00 0.00 H new ATOM 1583 N LYS A 98 11.097 -13.656 -5.567 1.00 0.00 N ATOM 1584 CA LYS A 98 12.126 -13.363 -6.557 1.00 0.00 C ATOM 1585 C LYS A 98 13.155 -12.385 -5.999 1.00 0.00 C ATOM 1586 O LYS A 98 14.295 -12.341 -6.459 1.00 0.00 O ATOM 1587 CB LYS A 98 11.493 -12.785 -7.825 1.00 0.00 C ATOM 1588 CG LYS A 98 10.392 -13.655 -8.406 1.00 0.00 C ATOM 1589 CD LYS A 98 10.308 -13.514 -9.917 1.00 0.00 C ATOM 1590 CE LYS A 98 11.227 -14.501 -10.621 1.00 0.00 C ATOM 1591 NZ LYS A 98 10.749 -14.820 -11.995 1.00 0.00 N ATOM 0 H LYS A 98 10.147 -13.447 -5.872 1.00 0.00 H new ATOM 0 HA LYS A 98 12.633 -14.296 -6.804 1.00 0.00 H new ATOM 0 HB2 LYS A 98 11.085 -11.799 -7.601 1.00 0.00 H new ATOM 0 HB3 LYS A 98 12.269 -12.645 -8.577 1.00 0.00 H new ATOM 0 HG2 LYS A 98 10.576 -14.698 -8.147 1.00 0.00 H new ATOM 0 HG3 LYS A 98 9.436 -13.380 -7.960 1.00 0.00 H new ATOM 0 HD2 LYS A 98 9.280 -13.677 -10.242 1.00 0.00 H new ATOM 0 HD3 LYS A 98 10.576 -12.497 -10.204 1.00 0.00 H new ATOM 0 HE2 LYS A 98 12.234 -14.086 -10.674 1.00 0.00 H new ATOM 0 HE3 LYS A 98 11.291 -15.419 -10.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 11.402 -15.495 -12.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 9.799 -15.239 -11.943 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 10.712 -13.948 -12.561 1.00 0.00 H new ATOM 1605 N ASN A 99 12.745 -11.604 -5.005 1.00 0.00 N ATOM 1606 CA ASN A 99 13.632 -10.628 -4.384 1.00 0.00 C ATOM 1607 C ASN A 99 14.282 -11.204 -3.130 1.00 0.00 C ATOM 1608 O ASN A 99 14.698 -10.465 -2.239 1.00 0.00 O ATOM 1609 CB ASN A 99 12.858 -9.355 -4.033 1.00 0.00 C ATOM 1610 CG ASN A 99 12.767 -8.393 -5.201 1.00 0.00 C ATOM 1611 OD1 ASN A 99 13.332 -7.299 -5.164 1.00 0.00 O ATOM 1612 ND2 ASN A 99 12.053 -8.796 -6.245 1.00 0.00 N ATOM 0 H ASN A 99 11.804 -11.628 -4.612 1.00 0.00 H new ATOM 0 HA ASN A 99 14.418 -10.382 -5.098 1.00 0.00 H new ATOM 0 HB2 ASN A 99 11.853 -9.623 -3.707 1.00 0.00 H new ATOM 0 HB3 ASN A 99 13.344 -8.858 -3.193 1.00 0.00 H new ATOM 0 HD21 ASN A 99 11.955 -8.191 -7.060 1.00 0.00 H new ATOM 0 HD22 ASN A 99 11.602 -9.711 -6.232 1.00 0.00 H new ATOM 1619 N ASN A 100 14.366 -12.529 -3.069 1.00 0.00 N ATOM 1620 CA ASN A 100 14.966 -13.205 -1.924 1.00 0.00 C ATOM 1621 C ASN A 100 14.224 -12.856 -0.637 1.00 0.00 C ATOM 1622 O ASN A 100 14.788 -12.923 0.454 1.00 0.00 O ATOM 1623 CB ASN A 100 16.441 -12.823 -1.795 1.00 0.00 C ATOM 1624 CG ASN A 100 17.293 -13.969 -1.283 1.00 0.00 C ATOM 1625 OD1 ASN A 100 17.069 -15.128 -1.634 1.00 0.00 O ATOM 1626 ND2 ASN A 100 18.275 -13.650 -0.449 1.00 0.00 N ATOM 0 H ASN A 100 14.026 -13.156 -3.799 1.00 0.00 H new ATOM 0 HA ASN A 100 14.889 -14.280 -2.087 1.00 0.00 H new ATOM 0 HB2 ASN A 100 16.816 -12.501 -2.766 1.00 0.00 H new ATOM 0 HB3 ASN A 100 16.536 -11.973 -1.119 1.00 0.00 H new ATOM 0 HD21 ASN A 100 18.881 -14.379 -0.072 1.00 0.00 H new ATOM 0 HD22 ASN A 100 18.424 -12.676 -0.185 1.00 0.00 H new ATOM 1633 N GLY A 101 12.955 -12.483 -0.773 1.00 0.00 N ATOM 1634 CA GLY A 101 12.157 -12.130 0.386 1.00 0.00 C ATOM 1635 C GLY A 101 11.011 -11.201 0.039 1.00 0.00 C ATOM 1636 O GLY A 101 9.885 -11.647 -0.185 1.00 0.00 O ATOM 0 H GLY A 101 12.466 -12.419 -1.666 1.00 0.00 H new ATOM 0 HA2 GLY A 101 11.760 -13.038 0.840 1.00 0.00 H new ATOM 0 HA3 GLY A 101 12.794 -11.653 1.131 1.00 0.00 H new ATOM 1640 N LYS A 102 11.295 -9.903 -0.004 1.00 0.00 N ATOM 1641 CA LYS A 102 10.280 -8.907 -0.326 1.00 0.00 C ATOM 1642 C LYS A 102 10.704 -8.066 -1.525 1.00 0.00 C ATOM 1643 O LYS A 102 11.894 -7.846 -1.753 1.00 0.00 O ATOM 1644 CB LYS A 102 10.025 -8.002 0.881 1.00 0.00 C ATOM 1645 CG LYS A 102 11.268 -7.282 1.375 1.00 0.00 C ATOM 1646 CD LYS A 102 11.324 -5.852 0.865 1.00 0.00 C ATOM 1647 CE LYS A 102 12.737 -5.459 0.461 1.00 0.00 C ATOM 1648 NZ LYS A 102 13.418 -4.669 1.524 1.00 0.00 N ATOM 0 H LYS A 102 12.221 -9.516 0.180 1.00 0.00 H new ATOM 0 HA LYS A 102 9.359 -9.432 -0.581 1.00 0.00 H new ATOM 0 HB2 LYS A 102 9.268 -7.263 0.617 1.00 0.00 H new ATOM 0 HB3 LYS A 102 9.615 -8.602 1.694 1.00 0.00 H new ATOM 0 HG2 LYS A 102 11.280 -7.281 2.465 1.00 0.00 H new ATOM 0 HG3 LYS A 102 12.157 -7.821 1.047 1.00 0.00 H new ATOM 0 HD2 LYS A 102 10.656 -5.743 0.010 1.00 0.00 H new ATOM 0 HD3 LYS A 102 10.964 -5.174 1.639 1.00 0.00 H new ATOM 0 HE2 LYS A 102 13.317 -6.357 0.248 1.00 0.00 H new ATOM 0 HE3 LYS A 102 12.703 -4.876 -0.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 14.447 -4.804 1.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 13.192 -3.661 1.406 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 13.092 -4.990 2.458 1.00 0.00 H new ATOM 1662 N THR A 103 9.723 -7.596 -2.289 1.00 0.00 N ATOM 1663 CA THR A 103 9.994 -6.779 -3.465 1.00 0.00 C ATOM 1664 C THR A 103 9.228 -5.462 -3.408 1.00 0.00 C ATOM 1665 O THR A 103 8.079 -5.421 -2.970 1.00 0.00 O ATOM 1666 CB THR A 103 9.621 -7.520 -4.763 1.00 0.00 C ATOM 1667 OG1 THR A 103 10.046 -6.761 -5.900 1.00 0.00 O ATOM 1668 CG2 THR A 103 8.121 -7.759 -4.838 1.00 0.00 C ATOM 0 H THR A 103 8.733 -7.767 -2.114 1.00 0.00 H new ATOM 0 HA THR A 103 11.065 -6.574 -3.467 1.00 0.00 H new ATOM 0 HB THR A 103 10.127 -8.486 -4.762 1.00 0.00 H new ATOM 0 HG1 THR A 103 9.807 -7.240 -6.721 1.00 0.00 H new ATOM 0 HG21 THR A 103 7.882 -8.284 -5.763 1.00 0.00 H new ATOM 0 HG22 THR A 103 7.806 -8.362 -3.987 1.00 0.00 H new ATOM 0 HG23 THR A 103 7.599 -6.802 -4.818 1.00 0.00 H new ATOM 1676 N GLU A 104 9.873 -4.388 -3.854 1.00 0.00 N ATOM 1677 CA GLU A 104 9.251 -3.069 -3.852 1.00 0.00 C ATOM 1678 C GLU A 104 8.659 -2.745 -5.221 1.00 0.00 C ATOM 1679 O GLU A 104 9.350 -2.808 -6.238 1.00 0.00 O ATOM 1680 CB GLU A 104 10.272 -2.000 -3.460 1.00 0.00 C ATOM 1681 CG GLU A 104 10.469 -1.868 -1.959 1.00 0.00 C ATOM 1682 CD GLU A 104 11.557 -2.784 -1.431 1.00 0.00 C ATOM 1683 OE1 GLU A 104 12.144 -3.534 -2.238 1.00 0.00 O ATOM 1684 OE2 GLU A 104 11.820 -2.749 -0.211 1.00 0.00 O ATOM 0 H GLU A 104 10.825 -4.406 -4.221 1.00 0.00 H new ATOM 0 HA GLU A 104 8.444 -3.077 -3.119 1.00 0.00 H new ATOM 0 HB2 GLU A 104 11.229 -2.236 -3.924 1.00 0.00 H new ATOM 0 HB3 GLU A 104 9.952 -1.039 -3.862 1.00 0.00 H new ATOM 0 HG2 GLU A 104 10.721 -0.835 -1.719 1.00 0.00 H new ATOM 0 HG3 GLU A 104 9.531 -2.094 -1.452 1.00 0.00 H new ATOM 1691 N ILE A 105 7.376 -2.400 -5.238 1.00 0.00 N ATOM 1692 CA ILE A 105 6.692 -2.066 -6.480 1.00 0.00 C ATOM 1693 C ILE A 105 5.957 -0.734 -6.363 1.00 0.00 C ATOM 1694 O ILE A 105 5.304 -0.461 -5.356 1.00 0.00 O ATOM 1695 CB ILE A 105 5.685 -3.161 -6.881 1.00 0.00 C ATOM 1696 CG1 ILE A 105 6.398 -4.505 -7.042 1.00 0.00 C ATOM 1697 CG2 ILE A 105 4.969 -2.777 -8.167 1.00 0.00 C ATOM 1698 CD1 ILE A 105 5.461 -5.692 -7.026 1.00 0.00 C ATOM 0 H ILE A 105 6.790 -2.345 -4.405 1.00 0.00 H new ATOM 0 HA ILE A 105 7.459 -1.989 -7.251 1.00 0.00 H new ATOM 0 HB ILE A 105 4.941 -3.258 -6.090 1.00 0.00 H new ATOM 0 HG12 ILE A 105 6.952 -4.503 -7.980 1.00 0.00 H new ATOM 0 HG13 ILE A 105 7.128 -4.618 -6.241 1.00 0.00 H new ATOM 0 HG21 ILE A 105 4.261 -3.561 -8.437 1.00 0.00 H new ATOM 0 HG22 ILE A 105 4.433 -1.839 -8.019 1.00 0.00 H new ATOM 0 HG23 ILE A 105 5.699 -2.656 -8.967 1.00 0.00 H new ATOM 0 HD11 ILE A 105 6.035 -6.611 -7.145 1.00 0.00 H new ATOM 0 HD12 ILE A 105 4.925 -5.720 -6.077 1.00 0.00 H new ATOM 0 HD13 ILE A 105 4.746 -5.603 -7.844 1.00 0.00 H new ATOM 1710 N TRP A 106 6.068 0.089 -7.399 1.00 0.00 N ATOM 1711 CA TRP A 106 5.413 1.392 -7.412 1.00 0.00 C ATOM 1712 C TRP A 106 4.098 1.332 -8.182 1.00 0.00 C ATOM 1713 O TRP A 106 4.081 1.045 -9.380 1.00 0.00 O ATOM 1714 CB TRP A 106 6.334 2.443 -8.033 1.00 0.00 C ATOM 1715 CG TRP A 106 7.412 2.912 -7.103 1.00 0.00 C ATOM 1716 CD1 TRP A 106 8.606 2.296 -6.855 1.00 0.00 C ATOM 1717 CD2 TRP A 106 7.393 4.095 -6.297 1.00 0.00 C ATOM 1718 NE1 TRP A 106 9.330 3.025 -5.943 1.00 0.00 N ATOM 1719 CE2 TRP A 106 8.609 4.133 -5.585 1.00 0.00 C ATOM 1720 CE3 TRP A 106 6.469 5.126 -6.107 1.00 0.00 C ATOM 1721 CZ2 TRP A 106 8.920 5.162 -4.700 1.00 0.00 C ATOM 1722 CZ3 TRP A 106 6.780 6.145 -5.228 1.00 0.00 C ATOM 1723 CH2 TRP A 106 7.997 6.158 -4.534 1.00 0.00 C ATOM 0 H TRP A 106 6.605 -0.122 -8.240 1.00 0.00 H new ATOM 0 HA TRP A 106 5.197 1.673 -6.381 1.00 0.00 H new ATOM 0 HB2 TRP A 106 6.793 2.029 -8.930 1.00 0.00 H new ATOM 0 HB3 TRP A 106 5.737 3.299 -8.347 1.00 0.00 H new ATOM 0 HD1 TRP A 106 8.933 1.372 -7.309 1.00 0.00 H new ATOM 0 HE1 TRP A 106 10.255 2.781 -5.590 1.00 0.00 H new ATOM 0 HE3 TRP A 106 5.529 5.126 -6.638 1.00 0.00 H new ATOM 0 HZ2 TRP A 106 9.857 5.173 -4.163 1.00 0.00 H new ATOM 0 HZ3 TRP A 106 6.072 6.946 -5.073 1.00 0.00 H new ATOM 0 HH2 TRP A 106 8.211 6.970 -3.855 1.00 0.00 H new ATOM 1734 N LEU A 107 2.999 1.605 -7.489 1.00 0.00 N ATOM 1735 CA LEU A 107 1.678 1.583 -8.108 1.00 0.00 C ATOM 1736 C LEU A 107 1.402 2.887 -8.850 1.00 0.00 C ATOM 1737 O LEU A 107 1.773 3.965 -8.388 1.00 0.00 O ATOM 1738 CB LEU A 107 0.600 1.348 -7.049 1.00 0.00 C ATOM 1739 CG LEU A 107 0.724 0.056 -6.240 1.00 0.00 C ATOM 1740 CD1 LEU A 107 -0.056 0.164 -4.939 1.00 0.00 C ATOM 1741 CD2 LEU A 107 0.241 -1.133 -7.057 1.00 0.00 C ATOM 0 H LEU A 107 2.996 1.844 -6.497 1.00 0.00 H new ATOM 0 HA LEU A 107 1.656 0.765 -8.828 1.00 0.00 H new ATOM 0 HB2 LEU A 107 0.610 2.189 -6.356 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -0.372 1.353 -7.542 1.00 0.00 H new ATOM 0 HG LEU A 107 1.775 -0.099 -5.997 1.00 0.00 H new ATOM 0 HD11 LEU A 107 0.044 -0.764 -4.377 1.00 0.00 H new ATOM 0 HD12 LEU A 107 0.337 0.991 -4.347 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -1.108 0.343 -5.159 1.00 0.00 H new ATOM 0 HD21 LEU A 107 0.337 -2.044 -6.466 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -0.804 -0.986 -7.331 1.00 0.00 H new ATOM 0 HD23 LEU A 107 0.844 -1.222 -7.961 1.00 0.00 H new ATOM 1753 N GLU A 108 0.748 2.779 -10.002 1.00 0.00 N ATOM 1754 CA GLU A 108 0.421 3.951 -10.807 1.00 0.00 C ATOM 1755 C GLU A 108 -1.086 4.193 -10.829 1.00 0.00 C ATOM 1756 O GLU A 108 -1.811 3.594 -11.623 1.00 0.00 O ATOM 1757 CB GLU A 108 0.941 3.777 -12.235 1.00 0.00 C ATOM 1758 CG GLU A 108 0.646 2.410 -12.829 1.00 0.00 C ATOM 1759 CD GLU A 108 0.558 2.437 -14.342 1.00 0.00 C ATOM 1760 OE1 GLU A 108 -0.431 2.987 -14.870 1.00 0.00 O ATOM 1761 OE2 GLU A 108 1.480 1.909 -14.999 1.00 0.00 O ATOM 0 H GLU A 108 0.434 1.893 -10.399 1.00 0.00 H new ATOM 0 HA GLU A 108 0.904 4.817 -10.355 1.00 0.00 H new ATOM 0 HB2 GLU A 108 0.496 4.543 -12.870 1.00 0.00 H new ATOM 0 HB3 GLU A 108 2.018 3.942 -12.243 1.00 0.00 H new ATOM 0 HG2 GLU A 108 1.426 1.711 -12.527 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -0.293 2.036 -12.421 1.00 0.00 H new ATOM 1768 N LEU A 109 -1.549 5.075 -9.950 1.00 0.00 N ATOM 1769 CA LEU A 109 -2.970 5.398 -9.867 1.00 0.00 C ATOM 1770 C LEU A 109 -3.390 6.307 -11.017 1.00 0.00 C ATOM 1771 O LEU A 109 -2.711 7.285 -11.330 1.00 0.00 O ATOM 1772 CB LEU A 109 -3.282 6.071 -8.530 1.00 0.00 C ATOM 1773 CG LEU A 109 -2.639 5.440 -7.294 1.00 0.00 C ATOM 1774 CD1 LEU A 109 -2.698 6.398 -6.114 1.00 0.00 C ATOM 1775 CD2 LEU A 109 -3.321 4.124 -6.950 1.00 0.00 C ATOM 0 H LEU A 109 -0.962 5.579 -9.285 1.00 0.00 H new ATOM 0 HA LEU A 109 -3.534 4.468 -9.939 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -2.965 7.112 -8.588 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -4.363 6.074 -8.391 1.00 0.00 H new ATOM 0 HG LEU A 109 -1.592 5.235 -7.518 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -2.236 5.932 -5.244 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -2.163 7.314 -6.362 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -3.738 6.635 -5.889 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -2.850 3.690 -6.068 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -4.377 4.304 -6.746 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -3.226 3.435 -7.789 1.00 0.00 H new ATOM 1787 N LYS A 110 -4.515 5.979 -11.643 1.00 0.00 N ATOM 1788 CA LYS A 110 -5.030 6.767 -12.757 1.00 0.00 C ATOM 1789 C LYS A 110 -6.279 7.538 -12.346 1.00 0.00 C ATOM 1790 O LYS A 110 -6.972 7.189 -11.390 1.00 0.00 O ATOM 1791 CB LYS A 110 -5.346 5.859 -13.948 1.00 0.00 C ATOM 1792 CG LYS A 110 -4.114 5.403 -14.709 1.00 0.00 C ATOM 1793 CD LYS A 110 -3.761 6.368 -15.829 1.00 0.00 C ATOM 1794 CE LYS A 110 -2.452 5.986 -16.502 1.00 0.00 C ATOM 1795 NZ LYS A 110 -2.662 5.016 -17.613 1.00 0.00 N ATOM 0 H LYS A 110 -5.088 5.172 -11.398 1.00 0.00 H new ATOM 0 HA LYS A 110 -4.262 7.484 -13.048 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -5.888 4.983 -13.592 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -6.010 6.388 -14.632 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -3.272 5.318 -14.022 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -4.288 4.410 -15.124 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -4.562 6.378 -16.568 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -3.684 7.379 -15.429 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -1.968 6.882 -16.889 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -1.777 5.552 -15.764 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -1.746 4.781 -18.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -3.101 4.150 -17.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -3.285 5.439 -18.330 1.00 0.00 H new ATOM 1809 N PRO A 111 -6.580 8.616 -13.086 1.00 0.00 N ATOM 1810 CA PRO A 111 -5.851 9.144 -14.242 1.00 0.00 C ATOM 1811 C PRO A 111 -4.506 9.749 -13.853 1.00 0.00 C ATOM 1812 O PRO A 111 -3.665 10.016 -14.710 1.00 0.00 O ATOM 1813 CB PRO A 111 -6.786 10.226 -14.788 1.00 0.00 C ATOM 1814 CG PRO A 111 -7.601 10.649 -13.614 1.00 0.00 C ATOM 1815 CD PRO A 111 -7.770 9.421 -12.763 1.00 0.00 C ATOM 0 HA PRO A 111 -5.613 8.363 -14.964 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -6.224 11.063 -15.202 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -7.416 9.838 -15.588 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -7.102 11.443 -13.058 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -8.568 11.040 -13.931 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -7.811 9.670 -11.703 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -8.691 8.890 -13.002 1.00 0.00 H new ATOM 1823 N GLN A 112 -4.312 9.963 -12.555 1.00 0.00 N ATOM 1824 CA GLN A 112 -3.069 10.537 -12.054 1.00 0.00 C ATOM 1825 C GLN A 112 -2.827 10.127 -10.605 1.00 0.00 C ATOM 1826 O GLN A 112 -3.761 9.790 -9.880 1.00 0.00 O ATOM 1827 CB GLN A 112 -3.106 12.062 -12.166 1.00 0.00 C ATOM 1828 CG GLN A 112 -4.412 12.676 -11.690 1.00 0.00 C ATOM 1829 CD GLN A 112 -4.469 14.174 -11.915 1.00 0.00 C ATOM 1830 OE1 GLN A 112 -3.909 14.952 -11.141 1.00 0.00 O ATOM 1831 NE2 GLN A 112 -5.146 14.589 -12.979 1.00 0.00 N ATOM 0 H GLN A 112 -4.999 9.748 -11.833 1.00 0.00 H new ATOM 0 HA GLN A 112 -2.249 10.155 -12.663 1.00 0.00 H new ATOM 0 HB2 GLN A 112 -2.284 12.481 -11.585 1.00 0.00 H new ATOM 0 HB3 GLN A 112 -2.938 12.346 -13.205 1.00 0.00 H new ATOM 0 HG2 GLN A 112 -5.243 12.202 -12.212 1.00 0.00 H new ATOM 0 HG3 GLN A 112 -4.542 12.467 -10.628 1.00 0.00 H new ATOM 0 HE21 GLN A 112 -5.595 13.911 -13.594 1.00 0.00 H new ATOM 0 HE22 GLN A 112 -5.217 15.586 -13.181 1.00 0.00 H new ATOM 1840 N GLY A 113 -1.564 10.160 -10.189 1.00 0.00 N ATOM 1841 CA GLY A 113 -1.221 9.789 -8.829 1.00 0.00 C ATOM 1842 C GLY A 113 -0.475 8.472 -8.757 1.00 0.00 C ATOM 1843 O GLY A 113 -0.519 7.674 -9.694 1.00 0.00 O ATOM 0 H GLY A 113 -0.773 10.437 -10.770 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -0.609 10.574 -8.385 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -2.132 9.720 -8.234 1.00 0.00 H new ATOM 1847 N ARG A 114 0.214 8.243 -7.644 1.00 0.00 N ATOM 1848 CA ARG A 114 0.976 7.014 -7.455 1.00 0.00 C ATOM 1849 C ARG A 114 1.215 6.745 -5.973 1.00 0.00 C ATOM 1850 O ARG A 114 1.108 7.648 -5.143 1.00 0.00 O ATOM 1851 CB ARG A 114 2.314 7.100 -8.192 1.00 0.00 C ATOM 1852 CG ARG A 114 3.038 8.421 -7.987 1.00 0.00 C ATOM 1853 CD ARG A 114 4.458 8.367 -8.528 1.00 0.00 C ATOM 1854 NE ARG A 114 4.489 8.390 -9.988 1.00 0.00 N ATOM 1855 CZ ARG A 114 5.570 8.700 -10.695 1.00 0.00 C ATOM 1856 NH1 ARG A 114 6.702 9.012 -10.080 1.00 0.00 N ATOM 1857 NH2 ARG A 114 5.519 8.698 -12.021 1.00 0.00 N ATOM 0 H ARG A 114 0.260 8.893 -6.859 1.00 0.00 H new ATOM 0 HA ARG A 114 0.395 6.189 -7.867 1.00 0.00 H new ATOM 0 HB2 ARG A 114 2.957 6.287 -7.856 1.00 0.00 H new ATOM 0 HB3 ARG A 114 2.142 6.951 -9.258 1.00 0.00 H new ATOM 0 HG2 ARG A 114 2.488 9.220 -8.485 1.00 0.00 H new ATOM 0 HG3 ARG A 114 3.061 8.664 -6.925 1.00 0.00 H new ATOM 0 HD2 ARG A 114 5.026 9.213 -8.140 1.00 0.00 H new ATOM 0 HD3 ARG A 114 4.948 7.462 -8.169 1.00 0.00 H new ATOM 0 HE ARG A 114 3.634 8.155 -10.492 1.00 0.00 H new ATOM 0 HH11 ARG A 114 6.745 9.015 -9.061 1.00 0.00 H new ATOM 0 HH12 ARG A 114 7.530 9.250 -10.626 1.00 0.00 H new ATOM 0 HH21 ARG A 114 4.650 8.458 -12.498 1.00 0.00 H new ATOM 0 HH22 ARG A 114 6.349 8.936 -12.564 1.00 0.00 H new ATOM 1871 N MET A 115 1.540 5.498 -5.648 1.00 0.00 N ATOM 1872 CA MET A 115 1.795 5.111 -4.265 1.00 0.00 C ATOM 1873 C MET A 115 2.773 3.942 -4.200 1.00 0.00 C ATOM 1874 O MET A 115 2.769 3.067 -5.066 1.00 0.00 O ATOM 1875 CB MET A 115 0.486 4.735 -3.568 1.00 0.00 C ATOM 1876 CG MET A 115 -0.234 3.564 -4.218 1.00 0.00 C ATOM 1877 SD MET A 115 -1.589 2.935 -3.209 1.00 0.00 S ATOM 1878 CE MET A 115 -2.377 4.464 -2.709 1.00 0.00 C ATOM 0 H MET A 115 1.633 4.739 -6.323 1.00 0.00 H new ATOM 0 HA MET A 115 2.239 5.963 -3.751 1.00 0.00 H new ATOM 0 HB2 MET A 115 0.696 4.489 -2.527 1.00 0.00 H new ATOM 0 HB3 MET A 115 -0.176 5.601 -3.564 1.00 0.00 H new ATOM 0 HG2 MET A 115 -0.622 3.874 -5.188 1.00 0.00 H new ATOM 0 HG3 MET A 115 0.480 2.761 -4.403 1.00 0.00 H new ATOM 0 HE1 MET A 115 -3.338 4.243 -2.245 1.00 0.00 H new ATOM 0 HE2 MET A 115 -1.740 4.984 -1.994 1.00 0.00 H new ATOM 0 HE3 MET A 115 -2.532 5.096 -3.583 1.00 0.00 H new ATOM 1888 N LEU A 116 3.611 3.935 -3.168 1.00 0.00 N ATOM 1889 CA LEU A 116 4.595 2.873 -2.990 1.00 0.00 C ATOM 1890 C LEU A 116 3.954 1.633 -2.376 1.00 0.00 C ATOM 1891 O LEU A 116 3.248 1.720 -1.371 1.00 0.00 O ATOM 1892 CB LEU A 116 5.744 3.360 -2.104 1.00 0.00 C ATOM 1893 CG LEU A 116 7.141 2.871 -2.488 1.00 0.00 C ATOM 1894 CD1 LEU A 116 8.158 3.282 -1.435 1.00 0.00 C ATOM 1895 CD2 LEU A 116 7.145 1.361 -2.676 1.00 0.00 C ATOM 0 H LEU A 116 3.628 4.652 -2.443 1.00 0.00 H new ATOM 0 HA LEU A 116 4.988 2.607 -3.971 1.00 0.00 H new ATOM 0 HB2 LEU A 116 5.747 4.450 -2.114 1.00 0.00 H new ATOM 0 HB3 LEU A 116 5.542 3.051 -1.079 1.00 0.00 H new ATOM 0 HG LEU A 116 7.420 3.335 -3.434 1.00 0.00 H new ATOM 0 HD11 LEU A 116 9.146 2.925 -1.725 1.00 0.00 H new ATOM 0 HD12 LEU A 116 8.175 4.369 -1.350 1.00 0.00 H new ATOM 0 HD13 LEU A 116 7.883 2.847 -0.474 1.00 0.00 H new ATOM 0 HD21 LEU A 116 8.147 1.031 -2.949 1.00 0.00 H new ATOM 0 HD22 LEU A 116 6.844 0.878 -1.746 1.00 0.00 H new ATOM 0 HD23 LEU A 116 6.446 1.091 -3.468 1.00 0.00 H new ATOM 1907 N MET A 117 4.207 0.479 -2.985 1.00 0.00 N ATOM 1908 CA MET A 117 3.657 -0.779 -2.495 1.00 0.00 C ATOM 1909 C MET A 117 4.769 -1.715 -2.032 1.00 0.00 C ATOM 1910 O MET A 117 5.578 -2.177 -2.835 1.00 0.00 O ATOM 1911 CB MET A 117 2.826 -1.456 -3.587 1.00 0.00 C ATOM 1912 CG MET A 117 1.833 -2.475 -3.051 1.00 0.00 C ATOM 1913 SD MET A 117 0.918 -3.310 -4.362 1.00 0.00 S ATOM 1914 CE MET A 117 2.207 -4.327 -5.079 1.00 0.00 C ATOM 0 H MET A 117 4.789 0.389 -3.818 1.00 0.00 H new ATOM 0 HA MET A 117 3.014 -0.559 -1.643 1.00 0.00 H new ATOM 0 HB2 MET A 117 2.285 -0.693 -4.146 1.00 0.00 H new ATOM 0 HB3 MET A 117 3.497 -1.950 -4.290 1.00 0.00 H new ATOM 0 HG2 MET A 117 2.365 -3.217 -2.456 1.00 0.00 H new ATOM 0 HG3 MET A 117 1.130 -1.976 -2.384 1.00 0.00 H new ATOM 0 HE1 MET A 117 1.763 -5.219 -5.521 1.00 0.00 H new ATOM 0 HE2 MET A 117 2.730 -3.761 -5.850 1.00 0.00 H new ATOM 0 HE3 MET A 117 2.913 -4.620 -4.302 1.00 0.00 H new ATOM 1924 N ASN A 118 4.802 -1.990 -0.733 1.00 0.00 N ATOM 1925 CA ASN A 118 5.816 -2.870 -0.163 1.00 0.00 C ATOM 1926 C ASN A 118 5.207 -4.208 0.248 1.00 0.00 C ATOM 1927 O ASN A 118 4.547 -4.309 1.282 1.00 0.00 O ATOM 1928 CB ASN A 118 6.477 -2.206 1.046 1.00 0.00 C ATOM 1929 CG ASN A 118 7.710 -1.409 0.665 1.00 0.00 C ATOM 1930 OD1 ASN A 118 8.745 -1.491 1.327 1.00 0.00 O ATOM 1931 ND2 ASN A 118 7.605 -0.632 -0.407 1.00 0.00 N ATOM 0 H ASN A 118 4.138 -1.616 -0.055 1.00 0.00 H new ATOM 0 HA ASN A 118 6.572 -3.054 -0.927 1.00 0.00 H new ATOM 0 HB2 ASN A 118 5.758 -1.547 1.534 1.00 0.00 H new ATOM 0 HB3 ASN A 118 6.752 -2.971 1.772 1.00 0.00 H new ATOM 0 HD21 ASN A 118 8.402 -0.073 -0.711 1.00 0.00 H new ATOM 0 HD22 ASN A 118 6.728 -0.595 -0.926 1.00 0.00 H new ATOM 1938 N ALA A 119 5.433 -5.231 -0.570 1.00 0.00 N ATOM 1939 CA ALA A 119 4.909 -6.562 -0.290 1.00 0.00 C ATOM 1940 C ALA A 119 5.991 -7.467 0.289 1.00 0.00 C ATOM 1941 O ALA A 119 7.000 -7.740 -0.362 1.00 0.00 O ATOM 1942 CB ALA A 119 4.326 -7.176 -1.555 1.00 0.00 C ATOM 0 H ALA A 119 5.975 -5.163 -1.431 1.00 0.00 H new ATOM 0 HA ALA A 119 4.117 -6.465 0.453 1.00 0.00 H new ATOM 0 HB1 ALA A 119 3.938 -8.170 -1.332 1.00 0.00 H new ATOM 0 HB2 ALA A 119 3.518 -6.546 -1.926 1.00 0.00 H new ATOM 0 HB3 ALA A 119 5.104 -7.252 -2.314 1.00 0.00 H new ATOM 1948 N ARG A 120 5.775 -7.929 1.516 1.00 0.00 N ATOM 1949 CA ARG A 120 6.733 -8.802 2.184 1.00 0.00 C ATOM 1950 C ARG A 120 6.211 -10.234 2.248 1.00 0.00 C ATOM 1951 O ARG A 120 5.016 -10.478 2.078 1.00 0.00 O ATOM 1952 CB ARG A 120 7.025 -8.290 3.596 1.00 0.00 C ATOM 1953 CG ARG A 120 8.243 -8.934 4.238 1.00 0.00 C ATOM 1954 CD ARG A 120 8.930 -7.984 5.206 1.00 0.00 C ATOM 1955 NE ARG A 120 10.057 -8.615 5.885 1.00 0.00 N ATOM 1956 CZ ARG A 120 10.970 -7.942 6.576 1.00 0.00 C ATOM 1957 NH1 ARG A 120 10.888 -6.622 6.679 1.00 0.00 N ATOM 1958 NH2 ARG A 120 11.967 -8.588 7.167 1.00 0.00 N ATOM 0 H ARG A 120 4.945 -7.713 2.068 1.00 0.00 H new ATOM 0 HA ARG A 120 7.657 -8.796 1.605 1.00 0.00 H new ATOM 0 HB2 ARG A 120 7.173 -7.211 3.559 1.00 0.00 H new ATOM 0 HB3 ARG A 120 6.154 -8.471 4.226 1.00 0.00 H new ATOM 0 HG2 ARG A 120 7.942 -9.839 4.766 1.00 0.00 H new ATOM 0 HG3 ARG A 120 8.947 -9.237 3.463 1.00 0.00 H new ATOM 0 HD2 ARG A 120 9.279 -7.105 4.665 1.00 0.00 H new ATOM 0 HD3 ARG A 120 8.209 -7.637 5.946 1.00 0.00 H new ATOM 0 HE ARG A 120 10.149 -9.629 5.826 1.00 0.00 H new ATOM 0 HH11 ARG A 120 10.123 -6.122 6.227 1.00 0.00 H new ATOM 0 HH12 ARG A 120 11.590 -6.107 7.210 1.00 0.00 H new ATOM 0 HH21 ARG A 120 12.033 -9.603 7.091 1.00 0.00 H new ATOM 0 HH22 ARG A 120 12.667 -8.070 7.697 1.00 0.00 H new ATOM 1972 N TYR A 121 7.113 -11.177 2.495 1.00 0.00 N ATOM 1973 CA TYR A 121 6.744 -12.585 2.579 1.00 0.00 C ATOM 1974 C TYR A 121 6.681 -13.046 4.032 1.00 0.00 C ATOM 1975 O TYR A 121 7.688 -13.042 4.741 1.00 0.00 O ATOM 1976 CB TYR A 121 7.744 -13.443 1.802 1.00 0.00 C ATOM 1977 CG TYR A 121 7.238 -14.834 1.494 1.00 0.00 C ATOM 1978 CD1 TYR A 121 5.969 -15.030 0.961 1.00 0.00 C ATOM 1979 CD2 TYR A 121 8.026 -15.952 1.736 1.00 0.00 C ATOM 1980 CE1 TYR A 121 5.501 -16.299 0.678 1.00 0.00 C ATOM 1981 CE2 TYR A 121 7.567 -17.224 1.454 1.00 0.00 C ATOM 1982 CZ TYR A 121 6.304 -17.393 0.926 1.00 0.00 C ATOM 1983 OH TYR A 121 5.843 -18.658 0.646 1.00 0.00 O ATOM 0 H TYR A 121 8.105 -10.992 2.641 1.00 0.00 H new ATOM 0 HA TYR A 121 5.755 -12.702 2.137 1.00 0.00 H new ATOM 0 HB2 TYR A 121 7.992 -12.940 0.867 1.00 0.00 H new ATOM 0 HB3 TYR A 121 8.667 -13.520 2.377 1.00 0.00 H new ATOM 0 HD1 TYR A 121 5.338 -14.176 0.765 1.00 0.00 H new ATOM 0 HD2 TYR A 121 9.015 -15.825 2.152 1.00 0.00 H new ATOM 0 HE1 TYR A 121 4.512 -16.434 0.265 1.00 0.00 H new ATOM 0 HE2 TYR A 121 8.194 -18.082 1.646 1.00 0.00 H new ATOM 0 HH TYR A 121 6.531 -19.316 0.878 1.00 0.00 H new ATOM 1993 N PHE A 122 5.491 -13.445 4.468 1.00 0.00 N ATOM 1994 CA PHE A 122 5.295 -13.909 5.836 1.00 0.00 C ATOM 1995 C PHE A 122 4.298 -15.063 5.881 1.00 0.00 C ATOM 1996 O PHE A 122 3.418 -15.173 5.026 1.00 0.00 O ATOM 1997 CB PHE A 122 4.804 -12.761 6.721 1.00 0.00 C ATOM 1998 CG PHE A 122 5.862 -11.739 7.019 1.00 0.00 C ATOM 1999 CD1 PHE A 122 7.066 -12.115 7.594 1.00 0.00 C ATOM 2000 CD2 PHE A 122 5.654 -10.401 6.725 1.00 0.00 C ATOM 2001 CE1 PHE A 122 8.042 -11.176 7.869 1.00 0.00 C ATOM 2002 CE2 PHE A 122 6.627 -9.458 6.997 1.00 0.00 C ATOM 2003 CZ PHE A 122 7.822 -9.846 7.571 1.00 0.00 C ATOM 0 H PHE A 122 4.648 -13.456 3.894 1.00 0.00 H new ATOM 0 HA PHE A 122 6.254 -14.265 6.213 1.00 0.00 H new ATOM 0 HB2 PHE A 122 3.963 -12.270 6.231 1.00 0.00 H new ATOM 0 HB3 PHE A 122 4.431 -13.171 7.660 1.00 0.00 H new ATOM 0 HD1 PHE A 122 7.243 -13.154 7.830 1.00 0.00 H new ATOM 0 HD2 PHE A 122 4.721 -10.091 6.278 1.00 0.00 H new ATOM 0 HE1 PHE A 122 8.976 -11.482 8.317 1.00 0.00 H new ATOM 0 HE2 PHE A 122 6.453 -8.419 6.761 1.00 0.00 H new ATOM 0 HZ PHE A 122 8.583 -9.110 7.786 1.00 0.00 H new ATOM 2013 N LEU A 123 4.442 -15.923 6.884 1.00 0.00 N ATOM 2014 CA LEU A 123 3.555 -17.070 7.042 1.00 0.00 C ATOM 2015 C LEU A 123 2.782 -16.985 8.354 1.00 0.00 C ATOM 2016 O LEU A 123 3.171 -16.258 9.267 1.00 0.00 O ATOM 2017 CB LEU A 123 4.358 -18.371 6.993 1.00 0.00 C ATOM 2018 CG LEU A 123 4.402 -19.083 5.640 1.00 0.00 C ATOM 2019 CD1 LEU A 123 5.447 -18.448 4.736 1.00 0.00 C ATOM 2020 CD2 LEU A 123 4.686 -20.566 5.827 1.00 0.00 C ATOM 0 H LEU A 123 5.165 -15.847 7.600 1.00 0.00 H new ATOM 0 HA LEU A 123 2.840 -17.060 6.220 1.00 0.00 H new ATOM 0 HB2 LEU A 123 5.381 -18.155 7.300 1.00 0.00 H new ATOM 0 HB3 LEU A 123 3.943 -19.059 7.729 1.00 0.00 H new ATOM 0 HG LEU A 123 3.427 -18.977 5.164 1.00 0.00 H new ATOM 0 HD11 LEU A 123 5.464 -18.968 3.778 1.00 0.00 H new ATOM 0 HD12 LEU A 123 5.200 -17.399 4.575 1.00 0.00 H new ATOM 0 HD13 LEU A 123 6.428 -18.522 5.206 1.00 0.00 H new ATOM 0 HD21 LEU A 123 4.714 -21.057 4.854 1.00 0.00 H new ATOM 0 HD22 LEU A 123 5.647 -20.692 6.325 1.00 0.00 H new ATOM 0 HD23 LEU A 123 3.901 -21.013 6.436 1.00 0.00 H new ATOM 2032 N GLU A 124 1.688 -17.735 8.440 1.00 0.00 N ATOM 2033 CA GLU A 124 0.862 -17.744 9.642 1.00 0.00 C ATOM 2034 C GLU A 124 -0.005 -18.999 9.696 1.00 0.00 C ATOM 2035 O GLU A 124 -0.427 -19.519 8.664 1.00 0.00 O ATOM 2036 CB GLU A 124 -0.022 -16.497 9.690 1.00 0.00 C ATOM 2037 CG GLU A 124 -1.084 -16.545 10.775 1.00 0.00 C ATOM 2038 CD GLU A 124 -0.491 -16.621 12.169 1.00 0.00 C ATOM 2039 OE1 GLU A 124 0.742 -16.470 12.297 1.00 0.00 O ATOM 2040 OE2 GLU A 124 -1.259 -16.833 13.130 1.00 0.00 O ATOM 0 H GLU A 124 1.353 -18.343 7.693 1.00 0.00 H new ATOM 0 HA GLU A 124 1.525 -17.743 10.508 1.00 0.00 H new ATOM 0 HB2 GLU A 124 0.608 -15.621 9.848 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -0.508 -16.369 8.723 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -1.715 -15.659 10.700 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -1.728 -17.409 10.610 1.00 0.00 H new ATOM 2047 N MET A 125 -0.266 -19.478 10.908 1.00 0.00 N ATOM 2048 CA MET A 125 -1.084 -20.671 11.097 1.00 0.00 C ATOM 2049 C MET A 125 -2.568 -20.322 11.077 1.00 0.00 C ATOM 2050 O MET A 125 -3.007 -19.395 11.758 1.00 0.00 O ATOM 2051 CB MET A 125 -0.727 -21.356 12.418 1.00 0.00 C ATOM 2052 CG MET A 125 -0.798 -20.429 13.621 1.00 0.00 C ATOM 2053 SD MET A 125 -0.625 -21.308 15.186 1.00 0.00 S ATOM 2054 CE MET A 125 0.824 -22.307 14.855 1.00 0.00 C ATOM 0 H MET A 125 0.076 -19.059 11.773 1.00 0.00 H new ATOM 0 HA MET A 125 -0.879 -21.355 10.274 1.00 0.00 H new ATOM 0 HB2 MET A 125 -1.403 -22.196 12.577 1.00 0.00 H new ATOM 0 HB3 MET A 125 0.280 -21.766 12.345 1.00 0.00 H new ATOM 0 HG2 MET A 125 -0.013 -19.677 13.542 1.00 0.00 H new ATOM 0 HG3 MET A 125 -1.750 -19.898 13.610 1.00 0.00 H new ATOM 0 HE1 MET A 125 1.195 -22.730 15.788 1.00 0.00 H new ATOM 0 HE2 MET A 125 0.561 -23.113 14.170 1.00 0.00 H new ATOM 0 HE3 MET A 125 1.599 -21.686 14.404 1.00 0.00 H new ATOM 2064 N SER A 126 -3.337 -21.069 10.291 1.00 0.00 N ATOM 2065 CA SER A 126 -4.772 -20.835 10.179 1.00 0.00 C ATOM 2066 C SER A 126 -5.433 -21.911 9.323 1.00 0.00 C ATOM 2067 O SER A 126 -4.760 -22.779 8.769 1.00 0.00 O ATOM 2068 CB SER A 126 -5.039 -19.454 9.578 1.00 0.00 C ATOM 2069 OG SER A 126 -6.404 -19.095 9.712 1.00 0.00 O ATOM 0 H SER A 126 -2.990 -21.841 9.722 1.00 0.00 H new ATOM 0 HA SER A 126 -5.201 -20.877 11.180 1.00 0.00 H new ATOM 0 HB2 SER A 126 -4.414 -18.711 10.074 1.00 0.00 H new ATOM 0 HB3 SER A 126 -4.761 -19.453 8.524 1.00 0.00 H new ATOM 0 HG SER A 126 -6.549 -18.208 9.322 1.00 0.00 H new ATOM 2075 N GLY A 127 -6.757 -21.847 9.220 1.00 0.00 N ATOM 2076 CA GLY A 127 -7.488 -22.820 8.431 1.00 0.00 C ATOM 2077 C GLY A 127 -7.550 -22.448 6.963 1.00 0.00 C ATOM 2078 O GLY A 127 -7.146 -21.359 6.555 1.00 0.00 O ATOM 0 H GLY A 127 -7.336 -21.138 9.669 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -7.015 -23.797 8.535 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -8.501 -22.913 8.822 1.00 0.00 H new ATOM 2082 N PRO A 128 -8.067 -23.369 6.136 1.00 0.00 N ATOM 2083 CA PRO A 128 -8.141 -23.042 4.709 1.00 0.00 C ATOM 2084 C PRO A 128 -9.176 -21.962 4.414 1.00 0.00 C ATOM 2085 O PRO A 128 -10.024 -21.656 5.253 1.00 0.00 O ATOM 2086 CB PRO A 128 -8.551 -24.367 4.062 1.00 0.00 C ATOM 2087 CG PRO A 128 -9.263 -25.110 5.140 1.00 0.00 C ATOM 2088 CD PRO A 128 -8.596 -24.711 6.427 1.00 0.00 C ATOM 0 HA PRO A 128 -7.199 -22.642 4.334 1.00 0.00 H new ATOM 0 HB2 PRO A 128 -9.198 -24.203 3.200 1.00 0.00 H new ATOM 0 HB3 PRO A 128 -7.681 -24.920 3.707 1.00 0.00 H new ATOM 0 HG2 PRO A 128 -10.323 -24.856 5.155 1.00 0.00 H new ATOM 0 HG3 PRO A 128 -9.195 -26.186 4.983 1.00 0.00 H new ATOM 0 HD2 PRO A 128 -9.303 -24.693 7.257 1.00 0.00 H new ATOM 0 HD3 PRO A 128 -7.801 -25.406 6.700 1.00 0.00 H new ATOM 2096 N SER A 129 -9.103 -21.388 3.218 1.00 0.00 N ATOM 2097 CA SER A 129 -10.032 -20.340 2.814 1.00 0.00 C ATOM 2098 C SER A 129 -11.168 -20.915 1.974 1.00 0.00 C ATOM 2099 O SER A 129 -12.343 -20.742 2.297 1.00 0.00 O ATOM 2100 CB SER A 129 -9.298 -19.254 2.025 1.00 0.00 C ATOM 2101 OG SER A 129 -10.065 -18.064 1.960 1.00 0.00 O ATOM 0 H SER A 129 -8.409 -21.631 2.511 1.00 0.00 H new ATOM 0 HA SER A 129 -10.457 -19.899 3.715 1.00 0.00 H new ATOM 0 HB2 SER A 129 -8.337 -19.046 2.495 1.00 0.00 H new ATOM 0 HB3 SER A 129 -9.089 -19.611 1.017 1.00 0.00 H new ATOM 0 HG SER A 129 -9.573 -17.385 1.452 1.00 0.00 H new ATOM 2107 N SER A 130 -10.808 -21.601 0.894 1.00 0.00 N ATOM 2108 CA SER A 130 -11.796 -22.200 0.004 1.00 0.00 C ATOM 2109 C SER A 130 -12.784 -23.059 0.788 1.00 0.00 C ATOM 2110 O SER A 130 -12.476 -23.542 1.876 1.00 0.00 O ATOM 2111 CB SER A 130 -11.104 -23.046 -1.066 1.00 0.00 C ATOM 2112 OG SER A 130 -9.882 -22.454 -1.473 1.00 0.00 O ATOM 0 H SER A 130 -9.839 -21.756 0.614 1.00 0.00 H new ATOM 0 HA SER A 130 -12.347 -21.394 -0.481 1.00 0.00 H new ATOM 0 HB2 SER A 130 -10.915 -24.047 -0.677 1.00 0.00 H new ATOM 0 HB3 SER A 130 -11.762 -23.158 -1.928 1.00 0.00 H new ATOM 0 HG SER A 130 -9.147 -22.821 -0.939 1.00 0.00 H new ATOM 2118 N GLY A 131 -13.974 -23.244 0.225 1.00 0.00 N ATOM 2119 CA GLY A 131 -14.990 -24.045 0.884 1.00 0.00 C ATOM 2120 C GLY A 131 -14.505 -25.444 1.209 1.00 0.00 C ATOM 2121 O GLY A 131 -13.915 -25.673 2.264 1.00 0.00 O ATOM 0 H GLY A 131 -14.253 -22.854 -0.675 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -15.300 -23.548 1.804 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -15.870 -24.108 0.244 1.00 0.00 H new TER 2125 GLY A 131