USER MOD reduce.3.24.130724 H: found=0, std=0, add=978, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 976 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 5 MET CE :methyl 162:sc= -0.0835 (180deg=-0.943) USER MOD Set 1.2: A 35 CYS SG : rot -91:sc= 0.252 USER MOD Set 1.3: A 69 ASN : amide:sc= 0.171 K(o=0.38,f=-0.36) USER MOD Set 1.4: A 73 TYR OH : rot 30:sc= 0.0416 USER MOD Set 2.1: A 43 HIS : no HD1:sc= 0.938 K(o=0.94,f=-5!) USER MOD Set 2.2: A 45 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 11 ASN : amide:sc= 0.574 K(o=2.8,f=-3.9!) USER MOD Set 3.2: A 15 SER OG : rot -70:sc= 0.665 USER MOD Set 3.3: A 34 SER OG : rot -92:sc= 1.6 USER MOD Set 4.1: A 16 GLN : amide:sc= 2.14 K(o=5.7,f=-6.5) USER MOD Set 4.2: A 23 LYS NZ :NH3+ -174:sc= 1.77 (180deg=0.848) USER MOD Set 4.3: A 60 GLN : amide:sc= 1.81 K(o=5.7,f=-3.8!) USER MOD Single : A 1 MET CE :methyl -163:sc= -0.0216 (180deg=-0.266) USER MOD Single : A 1 MET N :NH3+ 141:sc= 1.27 (180deg=0.634) USER MOD Single : A 2 LYS NZ :NH3+ 145:sc= 2.36 (180deg=1.83) USER MOD Single : A 3 LYS NZ :NH3+ -158:sc= 0.938 (180deg=0.504) USER MOD Single : A 8 CYS SG : rot 171:sc= 0.312 USER MOD Single : A 9 LYS NZ :NH3+ 163:sc= 1.21 (180deg=1) USER MOD Single : A 12 SER OG : rot 180:sc= 0.0476 USER MOD Single : A 13 CYS SG : rot 180:sc= 0.397 USER MOD Single : A 17 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 92:sc= 0.778 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot -70:sc= 0.835 USER MOD Single : A 49 MET CE :methyl 175:sc= -1.07 (180deg=-1.15) USER MOD Single : A 50 MET CE :methyl -136:sc= -0.302 (180deg=-3.62!) USER MOD Single : A 58 SER OG : rot 94:sc= 1.28 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 10:sc= -0.0728 USER MOD Single : A 67 ASN : amide:sc= 0.642 K(o=0.64,f=-0.12) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 THR OG1 : rot -35:sc= 0.206 USER MOD Single : A 93 GLN : amide:sc= 0.988 K(o=0.99,f=-0.17) USER MOD Single : A 100 GLN : amide:sc= 1.18 K(o=1.2,f=-0.72) USER MOD Single : A 107 GLN : amide:sc= 0.306 K(o=0.31,f=-0.79) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 77:sc= 1.17 USER MOD Single : A 118 GLN : amide:sc= 0.886 K(o=0.89,f=0) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 ASN :FLIP amide:sc= -0.049 F(o=-1.9!,f=-0.049) USER MOD Single : A 129 LYS NZ :NH3+ -165:sc= 1.24 (180deg=1.19) USER MOD Single : A 131 SER OG : rot 96:sc= 0.934 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.090 -0.161 1.614 1.00 0.00 N ATOM 2 CA MET A 1 2.503 -0.015 0.190 1.00 0.00 C ATOM 3 C MET A 1 2.549 1.461 -0.218 1.00 0.00 C ATOM 4 O MET A 1 1.543 2.160 -0.106 1.00 0.00 O ATOM 5 CB MET A 1 1.607 -0.837 -0.768 1.00 0.00 C ATOM 6 CG MET A 1 2.109 -0.813 -2.222 1.00 0.00 C ATOM 7 SD MET A 1 1.209 -1.946 -3.319 1.00 0.00 S ATOM 8 CE MET A 1 2.481 -2.245 -4.578 1.00 0.00 C ATOM 0 H1 MET A 1 1.459 -0.982 1.710 1.00 0.00 H new ATOM 0 H2 MET A 1 2.933 -0.301 2.207 1.00 0.00 H new ATOM 0 H3 MET A 1 1.590 0.698 1.920 1.00 0.00 H new ATOM 0 HA MET A 1 3.510 -0.423 0.104 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.563 -1.869 -0.421 1.00 0.00 H new ATOM 0 HB3 MET A 1 0.590 -0.445 -0.733 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.023 0.202 -2.611 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.168 -1.071 -2.237 1.00 0.00 H new ATOM 0 HE1 MET A 1 2.018 -2.665 -5.471 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.971 -1.305 -4.831 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.220 -2.946 -4.189 1.00 0.00 H new ATOM 18 N LYS A 2 3.704 1.928 -0.718 1.00 0.00 N ATOM 19 CA LYS A 2 3.924 3.285 -1.277 1.00 0.00 C ATOM 20 C LYS A 2 4.618 3.239 -2.646 1.00 0.00 C ATOM 21 O LYS A 2 5.154 2.201 -3.036 1.00 0.00 O ATOM 22 CB LYS A 2 4.681 4.144 -0.239 1.00 0.00 C ATOM 23 CG LYS A 2 3.734 4.562 0.899 1.00 0.00 C ATOM 24 CD LYS A 2 4.364 5.521 1.918 1.00 0.00 C ATOM 25 CE LYS A 2 3.265 6.066 2.845 1.00 0.00 C ATOM 26 NZ LYS A 2 2.629 7.283 2.277 1.00 0.00 N ATOM 0 H LYS A 2 4.547 1.354 -0.748 1.00 0.00 H new ATOM 0 HA LYS A 2 2.960 3.757 -1.467 1.00 0.00 H new ATOM 0 HB2 LYS A 2 5.521 3.580 0.166 1.00 0.00 H new ATOM 0 HB3 LYS A 2 5.094 5.030 -0.722 1.00 0.00 H new ATOM 0 HG2 LYS A 2 2.852 5.035 0.468 1.00 0.00 H new ATOM 0 HG3 LYS A 2 3.393 3.668 1.420 1.00 0.00 H new ATOM 0 HD2 LYS A 2 5.125 5.002 2.502 1.00 0.00 H new ATOM 0 HD3 LYS A 2 4.862 6.342 1.403 1.00 0.00 H new ATOM 0 HE2 LYS A 2 2.508 5.298 3.004 1.00 0.00 H new ATOM 0 HE3 LYS A 2 3.692 6.299 3.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 1.619 7.294 2.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 3.090 8.130 2.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 2.733 7.278 1.242 1.00 0.00 H new ATOM 40 N LYS A 3 4.579 4.353 -3.386 1.00 0.00 N ATOM 41 CA LYS A 3 5.141 4.488 -4.744 1.00 0.00 C ATOM 42 C LYS A 3 6.416 5.332 -4.727 1.00 0.00 C ATOM 43 O LYS A 3 6.458 6.380 -4.089 1.00 0.00 O ATOM 44 CB LYS A 3 4.108 5.045 -5.751 1.00 0.00 C ATOM 45 CG LYS A 3 2.839 4.184 -5.934 1.00 0.00 C ATOM 46 CD LYS A 3 1.733 4.311 -4.868 1.00 0.00 C ATOM 47 CE LYS A 3 1.217 5.750 -4.764 1.00 0.00 C ATOM 48 NZ LYS A 3 0.454 5.992 -3.508 1.00 0.00 N ATOM 0 H LYS A 3 4.144 5.213 -3.051 1.00 0.00 H new ATOM 0 HA LYS A 3 5.403 3.487 -5.086 1.00 0.00 H new ATOM 0 HB2 LYS A 3 3.808 6.041 -5.426 1.00 0.00 H new ATOM 0 HB3 LYS A 3 4.594 5.159 -6.720 1.00 0.00 H new ATOM 0 HG2 LYS A 3 2.403 4.430 -6.902 1.00 0.00 H new ATOM 0 HG3 LYS A 3 3.145 3.139 -5.978 1.00 0.00 H new ATOM 0 HD2 LYS A 3 0.907 3.644 -5.117 1.00 0.00 H new ATOM 0 HD3 LYS A 3 2.120 3.991 -3.901 1.00 0.00 H new ATOM 0 HE2 LYS A 3 2.060 6.439 -4.812 1.00 0.00 H new ATOM 0 HE3 LYS A 3 0.579 5.967 -5.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -0.173 6.812 -3.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -0.116 5.152 -3.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 1.117 6.181 -2.730 1.00 0.00 H new ATOM 62 N VAL A 4 7.436 4.896 -5.456 1.00 0.00 N ATOM 63 CA VAL A 4 8.728 5.607 -5.590 1.00 0.00 C ATOM 64 C VAL A 4 9.011 5.902 -7.067 1.00 0.00 C ATOM 65 O VAL A 4 8.765 5.060 -7.928 1.00 0.00 O ATOM 66 CB VAL A 4 9.903 4.869 -4.905 1.00 0.00 C ATOM 67 CG1 VAL A 4 11.167 5.738 -4.865 1.00 0.00 C ATOM 68 CG2 VAL A 4 9.571 4.422 -3.473 1.00 0.00 C ATOM 0 H VAL A 4 7.401 4.025 -5.985 1.00 0.00 H new ATOM 0 HA VAL A 4 8.639 6.554 -5.057 1.00 0.00 H new ATOM 0 HB VAL A 4 10.082 3.982 -5.513 1.00 0.00 H new ATOM 0 HG11 VAL A 4 11.972 5.188 -4.377 1.00 0.00 H new ATOM 0 HG12 VAL A 4 11.466 5.992 -5.882 1.00 0.00 H new ATOM 0 HG13 VAL A 4 10.963 6.652 -4.308 1.00 0.00 H new ATOM 0 HG21 VAL A 4 10.432 3.910 -3.043 1.00 0.00 H new ATOM 0 HG22 VAL A 4 9.327 5.294 -2.867 1.00 0.00 H new ATOM 0 HG23 VAL A 4 8.718 3.744 -3.492 1.00 0.00 H new ATOM 78 N MET A 5 9.543 7.086 -7.365 1.00 0.00 N ATOM 79 CA MET A 5 9.869 7.519 -8.726 1.00 0.00 C ATOM 80 C MET A 5 11.287 8.084 -8.787 1.00 0.00 C ATOM 81 O MET A 5 11.673 8.895 -7.948 1.00 0.00 O ATOM 82 CB MET A 5 8.801 8.503 -9.223 1.00 0.00 C ATOM 83 CG MET A 5 9.175 9.253 -10.507 1.00 0.00 C ATOM 84 SD MET A 5 9.516 8.256 -11.984 1.00 0.00 S ATOM 85 CE MET A 5 8.017 8.581 -12.951 1.00 0.00 C ATOM 0 H MET A 5 9.764 7.785 -6.656 1.00 0.00 H new ATOM 0 HA MET A 5 9.857 6.664 -9.402 1.00 0.00 H new ATOM 0 HB2 MET A 5 7.873 7.957 -9.394 1.00 0.00 H new ATOM 0 HB3 MET A 5 8.602 9.231 -8.437 1.00 0.00 H new ATOM 0 HG2 MET A 5 8.363 9.941 -10.744 1.00 0.00 H new ATOM 0 HG3 MET A 5 10.056 9.860 -10.299 1.00 0.00 H new ATOM 0 HE1 MET A 5 8.193 8.318 -13.994 1.00 0.00 H new ATOM 0 HE2 MET A 5 7.194 7.983 -12.559 1.00 0.00 H new ATOM 0 HE3 MET A 5 7.761 9.638 -12.882 1.00 0.00 H new ATOM 95 N PHE A 6 12.049 7.667 -9.795 1.00 0.00 N ATOM 96 CA PHE A 6 13.476 7.992 -9.958 1.00 0.00 C ATOM 97 C PHE A 6 13.728 8.905 -11.167 1.00 0.00 C ATOM 98 O PHE A 6 13.496 8.484 -12.294 1.00 0.00 O ATOM 99 CB PHE A 6 14.268 6.675 -10.070 1.00 0.00 C ATOM 100 CG PHE A 6 13.981 5.666 -8.976 1.00 0.00 C ATOM 101 CD1 PHE A 6 14.501 5.847 -7.682 1.00 0.00 C ATOM 102 CD2 PHE A 6 13.176 4.546 -9.251 1.00 0.00 C ATOM 103 CE1 PHE A 6 14.176 4.944 -6.656 1.00 0.00 C ATOM 104 CE2 PHE A 6 12.860 3.639 -8.227 1.00 0.00 C ATOM 105 CZ PHE A 6 13.336 3.852 -6.921 1.00 0.00 C ATOM 0 H PHE A 6 11.688 7.077 -10.545 1.00 0.00 H new ATOM 0 HA PHE A 6 13.815 8.552 -9.086 1.00 0.00 H new ATOM 0 HB2 PHE A 6 14.049 6.217 -11.034 1.00 0.00 H new ATOM 0 HB3 PHE A 6 15.333 6.906 -10.062 1.00 0.00 H new ATOM 0 HD1 PHE A 6 15.153 6.683 -7.476 1.00 0.00 H new ATOM 0 HD2 PHE A 6 12.801 4.384 -10.251 1.00 0.00 H new ATOM 0 HE1 PHE A 6 14.573 5.091 -5.662 1.00 0.00 H new ATOM 0 HE2 PHE A 6 12.249 2.775 -8.443 1.00 0.00 H new ATOM 0 HZ PHE A 6 13.056 3.178 -6.125 1.00 0.00 H new ATOM 115 N VAL A 7 14.253 10.115 -10.952 1.00 0.00 N ATOM 116 CA VAL A 7 14.672 11.088 -11.983 1.00 0.00 C ATOM 117 C VAL A 7 16.176 10.992 -12.269 1.00 0.00 C ATOM 118 O VAL A 7 16.984 10.900 -11.353 1.00 0.00 O ATOM 119 CB VAL A 7 14.224 12.531 -11.605 1.00 0.00 C ATOM 120 CG1 VAL A 7 15.202 13.649 -11.999 1.00 0.00 C ATOM 121 CG2 VAL A 7 12.900 12.858 -12.297 1.00 0.00 C ATOM 0 H VAL A 7 14.408 10.467 -10.007 1.00 0.00 H new ATOM 0 HA VAL A 7 14.166 10.834 -12.914 1.00 0.00 H new ATOM 0 HB VAL A 7 14.157 12.514 -10.517 1.00 0.00 H new ATOM 0 HG11 VAL A 7 14.796 14.613 -11.691 1.00 0.00 H new ATOM 0 HG12 VAL A 7 16.160 13.485 -11.506 1.00 0.00 H new ATOM 0 HG13 VAL A 7 15.344 13.644 -13.080 1.00 0.00 H new ATOM 0 HG21 VAL A 7 12.590 13.868 -12.030 1.00 0.00 H new ATOM 0 HG22 VAL A 7 13.028 12.791 -13.377 1.00 0.00 H new ATOM 0 HG23 VAL A 7 12.137 12.148 -11.977 1.00 0.00 H new ATOM 131 N CYS A 8 16.571 11.072 -13.540 1.00 0.00 N ATOM 132 CA CYS A 8 17.964 11.215 -14.005 1.00 0.00 C ATOM 133 C CYS A 8 18.017 12.255 -15.150 1.00 0.00 C ATOM 134 O CYS A 8 16.972 12.754 -15.555 1.00 0.00 O ATOM 135 CB CYS A 8 18.451 9.795 -14.363 1.00 0.00 C ATOM 136 SG CYS A 8 20.191 9.734 -14.900 1.00 0.00 S ATOM 0 H CYS A 8 15.905 11.038 -14.312 1.00 0.00 H new ATOM 0 HA CYS A 8 18.646 11.611 -13.252 1.00 0.00 H new ATOM 0 HB2 CYS A 8 18.324 9.147 -13.496 1.00 0.00 H new ATOM 0 HB3 CYS A 8 17.820 9.393 -15.156 1.00 0.00 H new ATOM 0 HG CYS A 8 20.573 8.495 -14.994 1.00 0.00 H new ATOM 142 N LYS A 9 19.194 12.577 -15.711 1.00 0.00 N ATOM 143 CA LYS A 9 19.333 13.535 -16.842 1.00 0.00 C ATOM 144 C LYS A 9 18.459 13.147 -18.041 1.00 0.00 C ATOM 145 O LYS A 9 17.524 13.862 -18.379 1.00 0.00 O ATOM 146 CB LYS A 9 20.818 13.723 -17.229 1.00 0.00 C ATOM 147 CG LYS A 9 21.594 14.546 -16.184 1.00 0.00 C ATOM 148 CD LYS A 9 23.083 14.716 -16.539 1.00 0.00 C ATOM 149 CE LYS A 9 23.861 13.390 -16.425 1.00 0.00 C ATOM 150 NZ LYS A 9 25.324 13.570 -16.664 1.00 0.00 N ATOM 0 H LYS A 9 20.083 12.185 -15.399 1.00 0.00 H new ATOM 0 HA LYS A 9 18.962 14.502 -16.502 1.00 0.00 H new ATOM 0 HB2 LYS A 9 21.288 12.746 -17.341 1.00 0.00 H new ATOM 0 HB3 LYS A 9 20.879 14.219 -18.197 1.00 0.00 H new ATOM 0 HG2 LYS A 9 21.134 15.530 -16.089 1.00 0.00 H new ATOM 0 HG3 LYS A 9 21.511 14.060 -15.212 1.00 0.00 H new ATOM 0 HD2 LYS A 9 23.171 15.102 -17.555 1.00 0.00 H new ATOM 0 HD3 LYS A 9 23.531 15.457 -15.877 1.00 0.00 H new ATOM 0 HE2 LYS A 9 23.707 12.965 -15.433 1.00 0.00 H new ATOM 0 HE3 LYS A 9 23.463 12.674 -17.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 25.839 12.742 -16.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 25.499 13.670 -17.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 25.654 14.424 -16.171 1.00 0.00 H new ATOM 164 N ARG A 10 18.700 11.958 -18.610 1.00 0.00 N ATOM 165 CA ARG A 10 17.986 11.433 -19.810 1.00 0.00 C ATOM 166 C ARG A 10 17.349 10.045 -19.643 1.00 0.00 C ATOM 167 O ARG A 10 17.047 9.372 -20.621 1.00 0.00 O ATOM 168 CB ARG A 10 18.905 11.568 -21.040 1.00 0.00 C ATOM 169 CG ARG A 10 20.091 10.589 -21.007 1.00 0.00 C ATOM 170 CD ARG A 10 21.341 11.169 -21.666 1.00 0.00 C ATOM 171 NE ARG A 10 21.100 11.516 -23.081 1.00 0.00 N ATOM 172 CZ ARG A 10 21.959 12.022 -23.944 1.00 0.00 C ATOM 173 NH1 ARG A 10 23.193 12.291 -23.627 1.00 0.00 N ATOM 174 NH2 ARG A 10 21.569 12.260 -25.162 1.00 0.00 N ATOM 0 H ARG A 10 19.406 11.314 -18.253 1.00 0.00 H new ATOM 0 HA ARG A 10 17.103 12.053 -19.964 1.00 0.00 H new ATOM 0 HB2 ARG A 10 18.322 11.395 -21.945 1.00 0.00 H new ATOM 0 HB3 ARG A 10 19.283 12.589 -21.095 1.00 0.00 H new ATOM 0 HG2 ARG A 10 20.316 10.329 -19.973 1.00 0.00 H new ATOM 0 HG3 ARG A 10 19.811 9.666 -21.514 1.00 0.00 H new ATOM 0 HD2 ARG A 10 21.660 12.058 -21.122 1.00 0.00 H new ATOM 0 HD3 ARG A 10 22.155 10.447 -21.602 1.00 0.00 H new ATOM 0 HE ARG A 10 20.158 11.344 -23.432 1.00 0.00 H new ATOM 0 HH11 ARG A 10 23.527 12.111 -22.680 1.00 0.00 H new ATOM 0 HH12 ARG A 10 23.825 12.682 -24.325 1.00 0.00 H new ATOM 0 HH21 ARG A 10 20.609 12.055 -25.439 1.00 0.00 H new ATOM 0 HH22 ARG A 10 22.223 12.651 -25.840 1.00 0.00 H new ATOM 188 N ASN A 11 17.199 9.609 -18.387 1.00 0.00 N ATOM 189 CA ASN A 11 16.680 8.295 -17.956 1.00 0.00 C ATOM 190 C ASN A 11 17.389 7.098 -18.623 1.00 0.00 C ATOM 191 O ASN A 11 16.765 6.089 -18.936 1.00 0.00 O ATOM 192 CB ASN A 11 15.146 8.356 -18.054 1.00 0.00 C ATOM 193 CG ASN A 11 14.346 7.190 -17.485 1.00 0.00 C ATOM 194 OD1 ASN A 11 13.343 6.818 -18.065 1.00 0.00 O ATOM 195 ND2 ASN A 11 14.680 6.606 -16.355 1.00 0.00 N ATOM 0 H ASN A 11 17.451 10.196 -17.592 1.00 0.00 H new ATOM 0 HA ASN A 11 16.926 8.092 -16.914 1.00 0.00 H new ATOM 0 HB2 ASN A 11 14.815 9.265 -17.551 1.00 0.00 H new ATOM 0 HB3 ASN A 11 14.882 8.460 -19.107 1.00 0.00 H new ATOM 0 HD21 ASN A 11 14.102 5.855 -15.979 1.00 0.00 H new ATOM 0 HD22 ASN A 11 15.517 6.904 -15.855 1.00 0.00 H new ATOM 202 N SER A 12 18.703 7.239 -18.824 1.00 0.00 N ATOM 203 CA SER A 12 19.590 6.250 -19.455 1.00 0.00 C ATOM 204 C SER A 12 20.219 5.298 -18.437 1.00 0.00 C ATOM 205 O SER A 12 20.168 4.087 -18.617 1.00 0.00 O ATOM 206 CB SER A 12 20.677 6.987 -20.239 1.00 0.00 C ATOM 207 OG SER A 12 21.231 7.969 -19.373 1.00 0.00 O ATOM 0 H SER A 12 19.202 8.082 -18.540 1.00 0.00 H new ATOM 0 HA SER A 12 18.991 5.636 -20.127 1.00 0.00 H new ATOM 0 HB2 SER A 12 21.447 6.292 -20.574 1.00 0.00 H new ATOM 0 HB3 SER A 12 20.258 7.453 -21.131 1.00 0.00 H new ATOM 0 HG SER A 12 21.935 8.461 -19.845 1.00 0.00 H new ATOM 213 N CYS A 13 20.795 5.851 -17.365 1.00 0.00 N ATOM 214 CA CYS A 13 21.487 5.129 -16.288 1.00 0.00 C ATOM 215 C CYS A 13 21.000 5.613 -14.907 1.00 0.00 C ATOM 216 O CYS A 13 20.126 6.474 -14.823 1.00 0.00 O ATOM 217 CB CYS A 13 23.004 5.297 -16.532 1.00 0.00 C ATOM 218 SG CYS A 13 23.971 4.083 -15.573 1.00 0.00 S ATOM 0 H CYS A 13 20.792 6.860 -17.216 1.00 0.00 H new ATOM 0 HA CYS A 13 21.260 4.063 -16.294 1.00 0.00 H new ATOM 0 HB2 CYS A 13 23.219 5.178 -17.594 1.00 0.00 H new ATOM 0 HB3 CYS A 13 23.309 6.307 -16.256 1.00 0.00 H new ATOM 0 HG CYS A 13 25.238 4.255 -15.807 1.00 0.00 H new ATOM 224 N ARG A 14 21.524 5.039 -13.814 1.00 0.00 N ATOM 225 CA ARG A 14 21.102 5.209 -12.393 1.00 0.00 C ATOM 226 C ARG A 14 19.622 4.924 -12.136 1.00 0.00 C ATOM 227 O ARG A 14 19.284 3.875 -11.622 1.00 0.00 O ATOM 228 CB ARG A 14 21.575 6.567 -11.822 1.00 0.00 C ATOM 229 CG ARG A 14 23.058 6.880 -12.071 1.00 0.00 C ATOM 230 CD ARG A 14 23.519 8.057 -11.190 1.00 0.00 C ATOM 231 NE ARG A 14 24.684 8.755 -11.773 1.00 0.00 N ATOM 232 CZ ARG A 14 24.670 9.709 -12.689 1.00 0.00 C ATOM 233 NH1 ARG A 14 23.577 10.212 -13.184 1.00 0.00 N ATOM 234 NH2 ARG A 14 25.792 10.169 -13.134 1.00 0.00 N ATOM 0 H ARG A 14 22.311 4.395 -13.892 1.00 0.00 H new ATOM 0 HA ARG A 14 21.615 4.428 -11.831 1.00 0.00 H new ATOM 0 HB2 ARG A 14 20.970 7.361 -12.260 1.00 0.00 H new ATOM 0 HB3 ARG A 14 21.389 6.580 -10.748 1.00 0.00 H new ATOM 0 HG2 ARG A 14 23.662 5.999 -11.856 1.00 0.00 H new ATOM 0 HG3 ARG A 14 23.212 7.123 -13.122 1.00 0.00 H new ATOM 0 HD2 ARG A 14 22.697 8.762 -11.066 1.00 0.00 H new ATOM 0 HD3 ARG A 14 23.775 7.689 -10.197 1.00 0.00 H new ATOM 0 HE ARG A 14 25.601 8.469 -11.431 1.00 0.00 H new ATOM 0 HH11 ARG A 14 22.669 9.871 -12.867 1.00 0.00 H new ATOM 0 HH12 ARG A 14 23.628 10.947 -13.889 1.00 0.00 H new ATOM 0 HH21 ARG A 14 26.673 9.796 -12.779 1.00 0.00 H new ATOM 0 HH22 ARG A 14 25.797 10.905 -13.840 1.00 0.00 H new ATOM 248 N SER A 15 18.729 5.814 -12.563 1.00 0.00 N ATOM 249 CA SER A 15 17.253 5.721 -12.421 1.00 0.00 C ATOM 250 C SER A 15 16.666 4.393 -12.919 1.00 0.00 C ATOM 251 O SER A 15 15.815 3.806 -12.259 1.00 0.00 O ATOM 252 CB SER A 15 16.616 6.895 -13.179 1.00 0.00 C ATOM 253 OG SER A 15 16.962 6.839 -14.565 1.00 0.00 O ATOM 0 H SER A 15 19.015 6.667 -13.043 1.00 0.00 H new ATOM 0 HA SER A 15 17.024 5.765 -11.356 1.00 0.00 H new ATOM 0 HB2 SER A 15 15.532 6.864 -13.067 1.00 0.00 H new ATOM 0 HB3 SER A 15 16.954 7.839 -12.751 1.00 0.00 H new ATOM 0 HG SER A 15 17.913 7.048 -14.673 1.00 0.00 H new ATOM 259 N GLN A 16 17.196 3.868 -14.028 1.00 0.00 N ATOM 260 CA GLN A 16 16.770 2.573 -14.596 1.00 0.00 C ATOM 261 C GLN A 16 17.239 1.388 -13.727 1.00 0.00 C ATOM 262 O GLN A 16 16.498 0.426 -13.546 1.00 0.00 O ATOM 263 CB GLN A 16 17.314 2.457 -16.034 1.00 0.00 C ATOM 264 CG GLN A 16 16.734 3.507 -17.004 1.00 0.00 C ATOM 265 CD GLN A 16 15.313 3.219 -17.489 1.00 0.00 C ATOM 266 OE1 GLN A 16 14.670 2.249 -17.118 1.00 0.00 O ATOM 267 NE2 GLN A 16 14.807 4.038 -18.379 1.00 0.00 N ATOM 0 H GLN A 16 17.934 4.325 -14.563 1.00 0.00 H new ATOM 0 HA GLN A 16 15.681 2.535 -14.614 1.00 0.00 H new ATOM 0 HB2 GLN A 16 18.399 2.557 -16.011 1.00 0.00 H new ATOM 0 HB3 GLN A 16 17.093 1.461 -16.417 1.00 0.00 H new ATOM 0 HG2 GLN A 16 16.744 4.480 -16.512 1.00 0.00 H new ATOM 0 HG3 GLN A 16 17.390 3.581 -17.871 1.00 0.00 H new ATOM 0 HE21 GLN A 16 15.343 4.848 -18.689 1.00 0.00 H new ATOM 0 HE22 GLN A 16 13.877 3.865 -18.761 1.00 0.00 H new ATOM 276 N MET A 17 18.437 1.484 -13.128 1.00 0.00 N ATOM 277 CA MET A 17 18.934 0.515 -12.132 1.00 0.00 C ATOM 278 C MET A 17 18.129 0.600 -10.831 1.00 0.00 C ATOM 279 O MET A 17 17.781 -0.431 -10.273 1.00 0.00 O ATOM 280 CB MET A 17 20.427 0.744 -11.820 1.00 0.00 C ATOM 281 CG MET A 17 21.410 0.543 -12.975 1.00 0.00 C ATOM 282 SD MET A 17 23.120 0.687 -12.384 1.00 0.00 S ATOM 283 CE MET A 17 24.004 -0.002 -13.801 1.00 0.00 C ATOM 0 H MET A 17 19.094 2.240 -13.321 1.00 0.00 H new ATOM 0 HA MET A 17 18.812 -0.477 -12.566 1.00 0.00 H new ATOM 0 HB2 MET A 17 20.544 1.761 -11.447 1.00 0.00 H new ATOM 0 HB3 MET A 17 20.712 0.073 -11.010 1.00 0.00 H new ATOM 0 HG2 MET A 17 21.256 -0.437 -13.426 1.00 0.00 H new ATOM 0 HG3 MET A 17 21.224 1.284 -13.752 1.00 0.00 H new ATOM 0 HE1 MET A 17 25.076 0.012 -13.603 1.00 0.00 H new ATOM 0 HE2 MET A 17 23.679 -1.029 -13.968 1.00 0.00 H new ATOM 0 HE3 MET A 17 23.791 0.595 -14.688 1.00 0.00 H new ATOM 293 N ALA A 18 17.772 1.808 -10.378 1.00 0.00 N ATOM 294 CA ALA A 18 16.951 2.027 -9.179 1.00 0.00 C ATOM 295 C ALA A 18 15.586 1.330 -9.292 1.00 0.00 C ATOM 296 O ALA A 18 15.183 0.608 -8.383 1.00 0.00 O ATOM 297 CB ALA A 18 16.826 3.536 -8.931 1.00 0.00 C ATOM 0 H ALA A 18 18.049 2.674 -10.840 1.00 0.00 H new ATOM 0 HA ALA A 18 17.439 1.575 -8.315 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.218 3.710 -8.043 1.00 0.00 H new ATOM 0 HB2 ALA A 18 17.817 3.964 -8.781 1.00 0.00 H new ATOM 0 HB3 ALA A 18 16.353 4.008 -9.792 1.00 0.00 H new ATOM 303 N GLU A 19 14.939 1.437 -10.457 1.00 0.00 N ATOM 304 CA GLU A 19 13.741 0.656 -10.794 1.00 0.00 C ATOM 305 C GLU A 19 14.037 -0.851 -10.787 1.00 0.00 C ATOM 306 O GLU A 19 13.263 -1.616 -10.226 1.00 0.00 O ATOM 307 CB GLU A 19 13.214 1.152 -12.152 1.00 0.00 C ATOM 308 CG GLU A 19 11.816 0.622 -12.489 1.00 0.00 C ATOM 309 CD GLU A 19 11.316 1.104 -13.870 1.00 0.00 C ATOM 310 OE1 GLU A 19 11.657 2.236 -14.290 1.00 0.00 O ATOM 311 OE2 GLU A 19 10.541 0.358 -14.515 1.00 0.00 O ATOM 0 H GLU A 19 15.233 2.072 -11.199 1.00 0.00 H new ATOM 0 HA GLU A 19 12.968 0.804 -10.040 1.00 0.00 H new ATOM 0 HB2 GLU A 19 13.191 2.242 -12.149 1.00 0.00 H new ATOM 0 HB3 GLU A 19 13.908 0.850 -12.936 1.00 0.00 H new ATOM 0 HG2 GLU A 19 11.830 -0.468 -12.472 1.00 0.00 H new ATOM 0 HG3 GLU A 19 11.114 0.944 -11.720 1.00 0.00 H new ATOM 318 N GLY A 20 15.197 -1.270 -11.302 1.00 0.00 N ATOM 319 CA GLY A 20 15.705 -2.651 -11.266 1.00 0.00 C ATOM 320 C GLY A 20 15.842 -3.262 -9.869 1.00 0.00 C ATOM 321 O GLY A 20 15.319 -4.349 -9.623 1.00 0.00 O ATOM 0 H GLY A 20 15.837 -0.632 -11.776 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.039 -3.281 -11.856 1.00 0.00 H new ATOM 0 HA3 GLY A 20 16.680 -2.675 -11.752 1.00 0.00 H new ATOM 325 N PHE A 21 16.498 -2.595 -8.915 1.00 0.00 N ATOM 326 CA PHE A 21 16.576 -3.125 -7.541 1.00 0.00 C ATOM 327 C PHE A 21 15.198 -3.102 -6.891 1.00 0.00 C ATOM 328 O PHE A 21 14.764 -4.093 -6.317 1.00 0.00 O ATOM 329 CB PHE A 21 17.584 -2.348 -6.680 1.00 0.00 C ATOM 330 CG PHE A 21 18.886 -2.023 -7.362 1.00 0.00 C ATOM 331 CD1 PHE A 21 19.778 -3.041 -7.741 1.00 0.00 C ATOM 332 CD2 PHE A 21 19.186 -0.681 -7.637 1.00 0.00 C ATOM 333 CE1 PHE A 21 20.964 -2.707 -8.419 1.00 0.00 C ATOM 334 CE2 PHE A 21 20.351 -0.352 -8.334 1.00 0.00 C ATOM 335 CZ PHE A 21 21.236 -1.362 -8.722 1.00 0.00 C ATOM 0 H PHE A 21 16.975 -1.705 -9.058 1.00 0.00 H new ATOM 0 HA PHE A 21 16.928 -4.154 -7.606 1.00 0.00 H new ATOM 0 HB2 PHE A 21 17.119 -1.417 -6.355 1.00 0.00 H new ATOM 0 HB3 PHE A 21 17.796 -2.929 -5.783 1.00 0.00 H new ATOM 0 HD1 PHE A 21 19.554 -4.073 -7.513 1.00 0.00 H new ATOM 0 HD2 PHE A 21 18.515 0.099 -7.309 1.00 0.00 H new ATOM 0 HE1 PHE A 21 21.662 -3.480 -8.705 1.00 0.00 H new ATOM 0 HE2 PHE A 21 20.567 0.679 -8.572 1.00 0.00 H new ATOM 0 HZ PHE A 21 22.137 -1.106 -9.260 1.00 0.00 H new ATOM 345 N ALA A 22 14.476 -1.988 -7.015 1.00 0.00 N ATOM 346 CA ALA A 22 13.203 -1.797 -6.321 1.00 0.00 C ATOM 347 C ALA A 22 12.100 -2.755 -6.803 1.00 0.00 C ATOM 348 O ALA A 22 11.420 -3.347 -5.970 1.00 0.00 O ATOM 349 CB ALA A 22 12.810 -0.326 -6.458 1.00 0.00 C ATOM 0 H ALA A 22 14.755 -1.197 -7.596 1.00 0.00 H new ATOM 0 HA ALA A 22 13.327 -2.048 -5.268 1.00 0.00 H new ATOM 0 HB1 ALA A 22 11.862 -0.154 -5.949 1.00 0.00 H new ATOM 0 HB2 ALA A 22 13.582 0.300 -6.010 1.00 0.00 H new ATOM 0 HB3 ALA A 22 12.706 -0.074 -7.513 1.00 0.00 H new ATOM 355 N LYS A 23 11.972 -3.002 -8.116 1.00 0.00 N ATOM 356 CA LYS A 23 10.967 -3.943 -8.675 1.00 0.00 C ATOM 357 C LYS A 23 11.164 -5.389 -8.192 1.00 0.00 C ATOM 358 O LYS A 23 10.209 -6.155 -8.115 1.00 0.00 O ATOM 359 CB LYS A 23 10.960 -3.856 -10.219 1.00 0.00 C ATOM 360 CG LYS A 23 12.170 -4.536 -10.880 1.00 0.00 C ATOM 361 CD LYS A 23 12.446 -4.162 -12.346 1.00 0.00 C ATOM 362 CE LYS A 23 11.375 -4.663 -13.325 1.00 0.00 C ATOM 363 NZ LYS A 23 11.855 -4.578 -14.739 1.00 0.00 N ATOM 0 H LYS A 23 12.557 -2.560 -8.825 1.00 0.00 H new ATOM 0 HA LYS A 23 9.991 -3.637 -8.299 1.00 0.00 H new ATOM 0 HB2 LYS A 23 10.046 -4.314 -10.596 1.00 0.00 H new ATOM 0 HB3 LYS A 23 10.937 -2.807 -10.515 1.00 0.00 H new ATOM 0 HG2 LYS A 23 13.058 -4.299 -10.294 1.00 0.00 H new ATOM 0 HG3 LYS A 23 12.029 -5.615 -10.823 1.00 0.00 H new ATOM 0 HD2 LYS A 23 12.520 -3.078 -12.427 1.00 0.00 H new ATOM 0 HD3 LYS A 23 13.413 -4.570 -12.640 1.00 0.00 H new ATOM 0 HE2 LYS A 23 11.115 -5.695 -13.088 1.00 0.00 H new ATOM 0 HE3 LYS A 23 10.467 -4.071 -13.210 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 11.078 -4.826 -15.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 12.176 -3.609 -14.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 12.645 -5.240 -14.878 1.00 0.00 H new ATOM 377 N THR A 24 12.411 -5.724 -7.852 1.00 0.00 N ATOM 378 CA THR A 24 12.852 -7.048 -7.369 1.00 0.00 C ATOM 379 C THR A 24 12.781 -7.175 -5.839 1.00 0.00 C ATOM 380 O THR A 24 12.171 -8.105 -5.316 1.00 0.00 O ATOM 381 CB THR A 24 14.289 -7.332 -7.840 1.00 0.00 C ATOM 382 OG1 THR A 24 14.420 -7.072 -9.221 1.00 0.00 O ATOM 383 CG2 THR A 24 14.703 -8.785 -7.622 1.00 0.00 C ATOM 0 H THR A 24 13.179 -5.055 -7.906 1.00 0.00 H new ATOM 0 HA THR A 24 12.165 -7.782 -7.791 1.00 0.00 H new ATOM 0 HB THR A 24 14.928 -6.678 -7.246 1.00 0.00 H new ATOM 0 HG1 THR A 24 14.707 -6.144 -9.353 1.00 0.00 H new ATOM 0 HG21 THR A 24 15.725 -8.929 -7.972 1.00 0.00 H new ATOM 0 HG22 THR A 24 14.646 -9.024 -6.560 1.00 0.00 H new ATOM 0 HG23 THR A 24 14.034 -9.441 -8.178 1.00 0.00 H new ATOM 391 N LEU A 25 13.387 -6.227 -5.109 1.00 0.00 N ATOM 392 CA LEU A 25 13.583 -6.275 -3.645 1.00 0.00 C ATOM 393 C LEU A 25 12.361 -5.751 -2.875 1.00 0.00 C ATOM 394 O LEU A 25 12.072 -6.208 -1.770 1.00 0.00 O ATOM 395 CB LEU A 25 14.867 -5.489 -3.280 1.00 0.00 C ATOM 396 CG LEU A 25 16.142 -5.975 -4.003 1.00 0.00 C ATOM 397 CD1 LEU A 25 17.316 -5.083 -3.624 1.00 0.00 C ATOM 398 CD2 LEU A 25 16.507 -7.418 -3.656 1.00 0.00 C ATOM 0 H LEU A 25 13.767 -5.379 -5.530 1.00 0.00 H new ATOM 0 HA LEU A 25 13.700 -7.316 -3.345 1.00 0.00 H new ATOM 0 HB2 LEU A 25 14.712 -4.436 -3.513 1.00 0.00 H new ATOM 0 HB3 LEU A 25 15.026 -5.557 -2.204 1.00 0.00 H new ATOM 0 HG LEU A 25 15.933 -5.926 -5.072 1.00 0.00 H new ATOM 0 HD11 LEU A 25 18.215 -5.428 -4.135 1.00 0.00 H new ATOM 0 HD12 LEU A 25 17.102 -4.056 -3.919 1.00 0.00 H new ATOM 0 HD13 LEU A 25 17.473 -5.126 -2.546 1.00 0.00 H new ATOM 0 HD21 LEU A 25 17.411 -7.704 -4.194 1.00 0.00 H new ATOM 0 HD22 LEU A 25 16.681 -7.501 -2.583 1.00 0.00 H new ATOM 0 HD23 LEU A 25 15.690 -8.079 -3.943 1.00 0.00 H new ATOM 410 N GLY A 26 11.619 -4.823 -3.486 1.00 0.00 N ATOM 411 CA GLY A 26 10.350 -4.277 -3.004 1.00 0.00 C ATOM 412 C GLY A 26 9.109 -4.903 -3.641 1.00 0.00 C ATOM 413 O GLY A 26 8.020 -4.350 -3.482 1.00 0.00 O ATOM 0 H GLY A 26 11.903 -4.412 -4.375 1.00 0.00 H new ATOM 0 HA2 GLY A 26 10.297 -4.414 -1.924 1.00 0.00 H new ATOM 0 HA3 GLY A 26 10.336 -3.203 -3.191 1.00 0.00 H new ATOM 417 N ALA A 27 9.240 -6.016 -4.369 1.00 0.00 N ATOM 418 CA ALA A 27 8.151 -6.637 -5.132 1.00 0.00 C ATOM 419 C ALA A 27 6.856 -6.828 -4.309 1.00 0.00 C ATOM 420 O ALA A 27 6.804 -7.627 -3.369 1.00 0.00 O ATOM 421 CB ALA A 27 8.653 -7.986 -5.679 1.00 0.00 C ATOM 0 H ALA A 27 10.123 -6.521 -4.447 1.00 0.00 H new ATOM 0 HA ALA A 27 7.882 -5.964 -5.946 1.00 0.00 H new ATOM 0 HB1 ALA A 27 7.858 -8.465 -6.250 1.00 0.00 H new ATOM 0 HB2 ALA A 27 9.514 -7.819 -6.326 1.00 0.00 H new ATOM 0 HB3 ALA A 27 8.942 -8.630 -4.849 1.00 0.00 H new ATOM 427 N GLY A 28 5.801 -6.075 -4.651 1.00 0.00 N ATOM 428 CA GLY A 28 4.467 -6.173 -4.037 1.00 0.00 C ATOM 429 C GLY A 28 4.291 -5.379 -2.738 1.00 0.00 C ATOM 430 O GLY A 28 3.159 -5.063 -2.370 1.00 0.00 O ATOM 0 H GLY A 28 5.852 -5.363 -5.380 1.00 0.00 H new ATOM 0 HA2 GLY A 28 3.726 -5.829 -4.758 1.00 0.00 H new ATOM 0 HA3 GLY A 28 4.253 -7.223 -3.835 1.00 0.00 H new ATOM 434 N LYS A 29 5.392 -4.992 -2.079 1.00 0.00 N ATOM 435 CA LYS A 29 5.394 -4.044 -0.946 1.00 0.00 C ATOM 436 C LYS A 29 5.524 -2.594 -1.393 1.00 0.00 C ATOM 437 O LYS A 29 5.018 -1.714 -0.705 1.00 0.00 O ATOM 438 CB LYS A 29 6.413 -4.423 0.139 1.00 0.00 C ATOM 439 CG LYS A 29 7.831 -4.733 -0.369 1.00 0.00 C ATOM 440 CD LYS A 29 8.736 -5.408 0.676 1.00 0.00 C ATOM 441 CE LYS A 29 9.023 -4.519 1.894 1.00 0.00 C ATOM 442 NZ LYS A 29 9.831 -5.240 2.923 1.00 0.00 N ATOM 0 H LYS A 29 6.323 -5.332 -2.319 1.00 0.00 H new ATOM 0 HA LYS A 29 4.412 -4.128 -0.481 1.00 0.00 H new ATOM 0 HB2 LYS A 29 6.473 -3.606 0.858 1.00 0.00 H new ATOM 0 HB3 LYS A 29 6.039 -5.294 0.677 1.00 0.00 H new ATOM 0 HG2 LYS A 29 7.759 -5.379 -1.244 1.00 0.00 H new ATOM 0 HG3 LYS A 29 8.300 -3.805 -0.696 1.00 0.00 H new ATOM 0 HD2 LYS A 29 8.265 -6.332 1.012 1.00 0.00 H new ATOM 0 HD3 LYS A 29 9.680 -5.684 0.206 1.00 0.00 H new ATOM 0 HE2 LYS A 29 9.556 -3.624 1.574 1.00 0.00 H new ATOM 0 HE3 LYS A 29 8.082 -4.190 2.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 10.006 -4.610 3.731 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 9.311 -6.081 3.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 10.739 -5.532 2.509 1.00 0.00 H new ATOM 456 N ILE A 30 6.127 -2.341 -2.554 1.00 0.00 N ATOM 457 CA ILE A 30 6.128 -1.026 -3.209 1.00 0.00 C ATOM 458 C ILE A 30 5.808 -1.130 -4.710 1.00 0.00 C ATOM 459 O ILE A 30 5.762 -2.226 -5.267 1.00 0.00 O ATOM 460 CB ILE A 30 7.440 -0.242 -2.929 1.00 0.00 C ATOM 461 CG1 ILE A 30 8.764 -0.906 -3.349 1.00 0.00 C ATOM 462 CG2 ILE A 30 7.588 0.039 -1.428 1.00 0.00 C ATOM 463 CD1 ILE A 30 8.882 -1.337 -4.811 1.00 0.00 C ATOM 0 H ILE A 30 6.637 -3.053 -3.077 1.00 0.00 H new ATOM 0 HA ILE A 30 5.321 -0.444 -2.765 1.00 0.00 H new ATOM 0 HB ILE A 30 7.308 0.645 -3.548 1.00 0.00 H new ATOM 0 HG12 ILE A 30 9.576 -0.212 -3.132 1.00 0.00 H new ATOM 0 HG13 ILE A 30 8.918 -1.784 -2.722 1.00 0.00 H new ATOM 0 HG21 ILE A 30 8.512 0.589 -1.250 1.00 0.00 H new ATOM 0 HG22 ILE A 30 6.741 0.632 -1.084 1.00 0.00 H new ATOM 0 HG23 ILE A 30 7.616 -0.904 -0.882 1.00 0.00 H new ATOM 0 HD11 ILE A 30 9.859 -1.790 -4.979 1.00 0.00 H new ATOM 0 HD12 ILE A 30 8.101 -2.062 -5.041 1.00 0.00 H new ATOM 0 HD13 ILE A 30 8.770 -0.466 -5.457 1.00 0.00 H new ATOM 475 N ALA A 31 5.597 0.014 -5.363 1.00 0.00 N ATOM 476 CA ALA A 31 5.511 0.125 -6.827 1.00 0.00 C ATOM 477 C ALA A 31 6.464 1.230 -7.318 1.00 0.00 C ATOM 478 O ALA A 31 6.683 2.216 -6.611 1.00 0.00 O ATOM 479 CB ALA A 31 4.056 0.327 -7.264 1.00 0.00 C ATOM 0 H ALA A 31 5.479 0.907 -4.884 1.00 0.00 H new ATOM 0 HA ALA A 31 5.837 -0.803 -7.296 1.00 0.00 H new ATOM 0 HB1 ALA A 31 4.010 0.407 -8.350 1.00 0.00 H new ATOM 0 HB2 ALA A 31 3.457 -0.523 -6.937 1.00 0.00 H new ATOM 0 HB3 ALA A 31 3.665 1.240 -6.816 1.00 0.00 H new ATOM 485 N VAL A 32 7.074 1.060 -8.494 1.00 0.00 N ATOM 486 CA VAL A 32 8.164 1.917 -8.966 1.00 0.00 C ATOM 487 C VAL A 32 8.122 2.261 -10.450 1.00 0.00 C ATOM 488 O VAL A 32 7.674 1.475 -11.284 1.00 0.00 O ATOM 489 CB VAL A 32 9.521 1.279 -8.637 1.00 0.00 C ATOM 490 CG1 VAL A 32 9.962 1.769 -7.262 1.00 0.00 C ATOM 491 CG2 VAL A 32 9.568 -0.253 -8.708 1.00 0.00 C ATOM 0 H VAL A 32 6.824 0.319 -9.149 1.00 0.00 H new ATOM 0 HA VAL A 32 8.028 2.859 -8.435 1.00 0.00 H new ATOM 0 HB VAL A 32 10.209 1.598 -9.419 1.00 0.00 H new ATOM 0 HG11 VAL A 32 10.926 1.326 -7.010 1.00 0.00 H new ATOM 0 HG12 VAL A 32 10.054 2.855 -7.275 1.00 0.00 H new ATOM 0 HG13 VAL A 32 9.222 1.476 -6.517 1.00 0.00 H new ATOM 0 HG21 VAL A 32 10.571 -0.598 -8.458 1.00 0.00 H new ATOM 0 HG22 VAL A 32 8.853 -0.672 -8.000 1.00 0.00 H new ATOM 0 HG23 VAL A 32 9.313 -0.578 -9.717 1.00 0.00 H new ATOM 501 N THR A 33 8.673 3.438 -10.752 1.00 0.00 N ATOM 502 CA THR A 33 8.801 4.010 -12.102 1.00 0.00 C ATOM 503 C THR A 33 10.107 4.812 -12.187 1.00 0.00 C ATOM 504 O THR A 33 10.568 5.351 -11.179 1.00 0.00 O ATOM 505 CB THR A 33 7.604 4.943 -12.397 1.00 0.00 C ATOM 506 OG1 THR A 33 6.367 4.351 -12.041 1.00 0.00 O ATOM 507 CG2 THR A 33 7.463 5.345 -13.865 1.00 0.00 C ATOM 0 H THR A 33 9.061 4.049 -10.033 1.00 0.00 H new ATOM 0 HA THR A 33 8.812 3.204 -12.836 1.00 0.00 H new ATOM 0 HB THR A 33 7.826 5.824 -11.795 1.00 0.00 H new ATOM 0 HG1 THR A 33 5.637 4.973 -12.242 1.00 0.00 H new ATOM 0 HG21 THR A 33 6.599 5.999 -13.982 1.00 0.00 H new ATOM 0 HG22 THR A 33 8.362 5.871 -14.186 1.00 0.00 H new ATOM 0 HG23 THR A 33 7.327 4.452 -14.475 1.00 0.00 H new ATOM 515 N SER A 34 10.721 4.921 -13.363 1.00 0.00 N ATOM 516 CA SER A 34 11.840 5.838 -13.609 1.00 0.00 C ATOM 517 C SER A 34 11.556 6.783 -14.785 1.00 0.00 C ATOM 518 O SER A 34 10.804 6.458 -15.707 1.00 0.00 O ATOM 519 CB SER A 34 13.160 5.084 -13.782 1.00 0.00 C ATOM 520 OG SER A 34 13.181 4.310 -14.959 1.00 0.00 O ATOM 0 H SER A 34 10.456 4.372 -14.181 1.00 0.00 H new ATOM 0 HA SER A 34 11.946 6.464 -12.723 1.00 0.00 H new ATOM 0 HB2 SER A 34 13.984 5.798 -13.804 1.00 0.00 H new ATOM 0 HB3 SER A 34 13.322 4.436 -12.920 1.00 0.00 H new ATOM 0 HG SER A 34 12.869 3.403 -14.759 1.00 0.00 H new ATOM 526 N CYS A 35 12.142 7.979 -14.721 1.00 0.00 N ATOM 527 CA CYS A 35 12.019 9.034 -15.717 1.00 0.00 C ATOM 528 C CYS A 35 13.250 9.952 -15.689 1.00 0.00 C ATOM 529 O CYS A 35 14.223 9.701 -14.977 1.00 0.00 O ATOM 530 CB CYS A 35 10.707 9.797 -15.484 1.00 0.00 C ATOM 531 SG CYS A 35 10.766 10.874 -14.032 1.00 0.00 S ATOM 0 H CYS A 35 12.740 8.246 -13.939 1.00 0.00 H new ATOM 0 HA CYS A 35 11.982 8.601 -16.717 1.00 0.00 H new ATOM 0 HB2 CYS A 35 10.480 10.397 -16.366 1.00 0.00 H new ATOM 0 HB3 CYS A 35 9.893 9.082 -15.367 1.00 0.00 H new ATOM 0 HG CYS A 35 10.347 10.220 -12.989 1.00 0.00 H new ATOM 537 N GLY A 36 13.259 11.014 -16.487 1.00 0.00 N ATOM 538 CA GLY A 36 14.297 12.040 -16.412 1.00 0.00 C ATOM 539 C GLY A 36 13.820 13.392 -16.897 1.00 0.00 C ATOM 540 O GLY A 36 12.762 13.481 -17.504 1.00 0.00 O ATOM 0 H GLY A 36 12.552 11.189 -17.201 1.00 0.00 H new ATOM 0 HA2 GLY A 36 14.640 12.129 -15.381 1.00 0.00 H new ATOM 0 HA3 GLY A 36 15.155 11.727 -17.007 1.00 0.00 H new ATOM 544 N LEU A 37 14.585 14.459 -16.668 1.00 0.00 N ATOM 545 CA LEU A 37 14.221 15.778 -17.221 1.00 0.00 C ATOM 546 C LEU A 37 14.294 15.825 -18.764 1.00 0.00 C ATOM 547 O LEU A 37 13.750 16.731 -19.397 1.00 0.00 O ATOM 548 CB LEU A 37 14.954 16.938 -16.530 1.00 0.00 C ATOM 549 CG LEU A 37 16.482 16.779 -16.398 1.00 0.00 C ATOM 550 CD1 LEU A 37 17.183 18.132 -16.486 1.00 0.00 C ATOM 551 CD2 LEU A 37 16.837 16.169 -15.037 1.00 0.00 C ATOM 0 H LEU A 37 15.443 14.446 -16.117 1.00 0.00 H new ATOM 0 HA LEU A 37 13.168 15.926 -16.983 1.00 0.00 H new ATOM 0 HB2 LEU A 37 14.749 17.854 -17.084 1.00 0.00 H new ATOM 0 HB3 LEU A 37 14.533 17.067 -15.533 1.00 0.00 H new ATOM 0 HG LEU A 37 16.810 16.132 -17.212 1.00 0.00 H new ATOM 0 HD11 LEU A 37 18.260 17.991 -16.390 1.00 0.00 H new ATOM 0 HD12 LEU A 37 16.962 18.594 -17.448 1.00 0.00 H new ATOM 0 HD13 LEU A 37 16.829 18.778 -15.683 1.00 0.00 H new ATOM 0 HD21 LEU A 37 17.919 16.062 -14.957 1.00 0.00 H new ATOM 0 HD22 LEU A 37 16.477 16.821 -14.241 1.00 0.00 H new ATOM 0 HD23 LEU A 37 16.368 15.190 -14.944 1.00 0.00 H new ATOM 563 N GLU A 38 14.912 14.803 -19.353 1.00 0.00 N ATOM 564 CA GLU A 38 14.944 14.476 -20.781 1.00 0.00 C ATOM 565 C GLU A 38 14.783 12.949 -20.966 1.00 0.00 C ATOM 566 O GLU A 38 14.758 12.185 -19.994 1.00 0.00 O ATOM 567 CB GLU A 38 16.266 14.964 -21.416 1.00 0.00 C ATOM 568 CG GLU A 38 16.488 16.478 -21.313 1.00 0.00 C ATOM 569 CD GLU A 38 17.743 16.901 -22.102 1.00 0.00 C ATOM 570 OE1 GLU A 38 17.629 17.196 -23.317 1.00 0.00 O ATOM 571 OE2 GLU A 38 18.853 16.956 -21.516 1.00 0.00 O ATOM 0 H GLU A 38 15.445 14.129 -18.804 1.00 0.00 H new ATOM 0 HA GLU A 38 14.120 14.983 -21.283 1.00 0.00 H new ATOM 0 HB2 GLU A 38 17.099 14.452 -20.934 1.00 0.00 H new ATOM 0 HB3 GLU A 38 16.280 14.676 -22.467 1.00 0.00 H new ATOM 0 HG2 GLU A 38 15.615 17.005 -21.699 1.00 0.00 H new ATOM 0 HG3 GLU A 38 16.597 16.764 -20.267 1.00 0.00 H new ATOM 578 N SER A 39 14.721 12.483 -22.215 1.00 0.00 N ATOM 579 CA SER A 39 14.756 11.058 -22.592 1.00 0.00 C ATOM 580 C SER A 39 15.678 10.822 -23.799 1.00 0.00 C ATOM 581 O SER A 39 15.763 11.662 -24.699 1.00 0.00 O ATOM 582 CB SER A 39 13.335 10.546 -22.883 1.00 0.00 C ATOM 583 OG SER A 39 12.688 11.336 -23.871 1.00 0.00 O ATOM 0 H SER A 39 14.642 13.102 -23.022 1.00 0.00 H new ATOM 0 HA SER A 39 15.163 10.496 -21.751 1.00 0.00 H new ATOM 0 HB2 SER A 39 13.382 9.510 -23.218 1.00 0.00 H new ATOM 0 HB3 SER A 39 12.748 10.558 -21.965 1.00 0.00 H new ATOM 0 HG SER A 39 11.788 10.984 -24.034 1.00 0.00 H new ATOM 589 N SER A 40 16.374 9.676 -23.829 1.00 0.00 N ATOM 590 CA SER A 40 17.145 9.228 -25.010 1.00 0.00 C ATOM 591 C SER A 40 16.968 7.726 -25.293 1.00 0.00 C ATOM 592 O SER A 40 16.256 7.360 -26.229 1.00 0.00 O ATOM 593 CB SER A 40 18.626 9.623 -24.889 1.00 0.00 C ATOM 594 OG SER A 40 18.791 11.021 -24.715 1.00 0.00 O ATOM 0 H SER A 40 16.422 9.031 -23.040 1.00 0.00 H new ATOM 0 HA SER A 40 16.736 9.749 -25.876 1.00 0.00 H new ATOM 0 HB2 SER A 40 19.074 9.097 -24.045 1.00 0.00 H new ATOM 0 HB3 SER A 40 19.161 9.303 -25.784 1.00 0.00 H new ATOM 0 HG SER A 40 18.560 11.484 -25.548 1.00 0.00 H new ATOM 600 N ARG A 41 17.622 6.864 -24.493 1.00 0.00 N ATOM 601 CA ARG A 41 17.444 5.393 -24.437 1.00 0.00 C ATOM 602 C ARG A 41 18.070 4.842 -23.152 1.00 0.00 C ATOM 603 O ARG A 41 18.914 5.518 -22.567 1.00 0.00 O ATOM 604 CB ARG A 41 18.030 4.695 -25.692 1.00 0.00 C ATOM 605 CG ARG A 41 19.559 4.741 -25.904 1.00 0.00 C ATOM 606 CD ARG A 41 20.177 6.119 -26.186 1.00 0.00 C ATOM 607 NE ARG A 41 19.575 6.763 -27.374 1.00 0.00 N ATOM 608 CZ ARG A 41 20.089 7.738 -28.106 1.00 0.00 C ATOM 609 NH1 ARG A 41 21.231 8.296 -27.820 1.00 0.00 N ATOM 610 NH2 ARG A 41 19.448 8.184 -29.145 1.00 0.00 N ATOM 0 H ARG A 41 18.327 7.188 -23.831 1.00 0.00 H new ATOM 0 HA ARG A 41 16.375 5.178 -24.427 1.00 0.00 H new ATOM 0 HB2 ARG A 41 17.729 3.648 -25.662 1.00 0.00 H new ATOM 0 HB3 ARG A 41 17.558 5.137 -26.570 1.00 0.00 H new ATOM 0 HG2 ARG A 41 20.038 4.329 -25.016 1.00 0.00 H new ATOM 0 HG3 ARG A 41 19.807 4.081 -26.735 1.00 0.00 H new ATOM 0 HD2 ARG A 41 20.041 6.762 -25.317 1.00 0.00 H new ATOM 0 HD3 ARG A 41 21.251 6.011 -26.337 1.00 0.00 H new ATOM 0 HE ARG A 41 18.660 6.416 -27.661 1.00 0.00 H new ATOM 0 HH11 ARG A 41 21.762 7.984 -27.007 1.00 0.00 H new ATOM 0 HH12 ARG A 41 21.594 9.045 -28.409 1.00 0.00 H new ATOM 0 HH21 ARG A 41 18.545 7.782 -29.399 1.00 0.00 H new ATOM 0 HH22 ARG A 41 19.848 8.936 -29.707 1.00 0.00 H new ATOM 624 N VAL A 42 17.718 3.626 -22.716 1.00 0.00 N ATOM 625 CA VAL A 42 18.463 2.955 -21.617 1.00 0.00 C ATOM 626 C VAL A 42 19.907 2.728 -22.076 1.00 0.00 C ATOM 627 O VAL A 42 20.130 2.307 -23.213 1.00 0.00 O ATOM 628 CB VAL A 42 17.857 1.610 -21.155 1.00 0.00 C ATOM 629 CG1 VAL A 42 18.547 1.090 -19.882 1.00 0.00 C ATOM 630 CG2 VAL A 42 16.383 1.748 -20.811 1.00 0.00 C ATOM 0 H VAL A 42 16.939 3.086 -23.092 1.00 0.00 H new ATOM 0 HA VAL A 42 18.405 3.617 -20.753 1.00 0.00 H new ATOM 0 HB VAL A 42 18.000 0.922 -21.989 1.00 0.00 H new ATOM 0 HG11 VAL A 42 18.096 0.143 -19.585 1.00 0.00 H new ATOM 0 HG12 VAL A 42 19.609 0.941 -20.079 1.00 0.00 H new ATOM 0 HG13 VAL A 42 18.425 1.817 -19.079 1.00 0.00 H new ATOM 0 HG21 VAL A 42 15.992 0.782 -20.491 1.00 0.00 H new ATOM 0 HG22 VAL A 42 16.264 2.473 -20.006 1.00 0.00 H new ATOM 0 HG23 VAL A 42 15.835 2.088 -21.690 1.00 0.00 H new ATOM 640 N HIS A 43 20.890 2.975 -21.205 1.00 0.00 N ATOM 641 CA HIS A 43 22.290 2.670 -21.517 1.00 0.00 C ATOM 642 C HIS A 43 22.443 1.150 -21.631 1.00 0.00 C ATOM 643 O HIS A 43 22.083 0.445 -20.687 1.00 0.00 O ATOM 644 CB HIS A 43 23.210 3.271 -20.449 1.00 0.00 C ATOM 645 CG HIS A 43 24.636 3.329 -20.913 1.00 0.00 C ATOM 646 ND1 HIS A 43 25.504 2.244 -21.042 1.00 0.00 N ATOM 647 CD2 HIS A 43 25.248 4.453 -21.372 1.00 0.00 C ATOM 648 CE1 HIS A 43 26.643 2.753 -21.555 1.00 0.00 C ATOM 649 NE2 HIS A 43 26.507 4.074 -21.769 1.00 0.00 N ATOM 0 H HIS A 43 20.743 3.384 -20.282 1.00 0.00 H new ATOM 0 HA HIS A 43 22.580 3.116 -22.468 1.00 0.00 H new ATOM 0 HB2 HIS A 43 22.868 4.275 -20.197 1.00 0.00 H new ATOM 0 HB3 HIS A 43 23.148 2.676 -19.538 1.00 0.00 H new ATOM 0 HD2 HIS A 43 24.827 5.447 -21.416 1.00 0.00 H new ATOM 0 HE1 HIS A 43 27.536 2.182 -21.764 1.00 0.00 H new ATOM 0 HE2 HIS A 43 27.219 4.691 -22.160 1.00 0.00 H new ATOM 657 N PRO A 44 22.953 0.603 -22.744 1.00 0.00 N ATOM 658 CA PRO A 44 22.888 -0.837 -22.956 1.00 0.00 C ATOM 659 C PRO A 44 23.807 -1.610 -21.990 1.00 0.00 C ATOM 660 O PRO A 44 23.511 -2.752 -21.634 1.00 0.00 O ATOM 661 CB PRO A 44 23.272 -1.024 -24.427 1.00 0.00 C ATOM 662 CG PRO A 44 24.208 0.152 -24.707 1.00 0.00 C ATOM 663 CD PRO A 44 23.590 1.271 -23.871 1.00 0.00 C ATOM 0 HA PRO A 44 21.898 -1.242 -22.747 1.00 0.00 H new ATOM 0 HB2 PRO A 44 23.769 -1.980 -24.593 1.00 0.00 H new ATOM 0 HB3 PRO A 44 22.396 -1.003 -25.076 1.00 0.00 H new ATOM 0 HG2 PRO A 44 25.232 -0.063 -24.403 1.00 0.00 H new ATOM 0 HG3 PRO A 44 24.236 0.405 -25.767 1.00 0.00 H new ATOM 0 HD2 PRO A 44 24.350 1.975 -23.532 1.00 0.00 H new ATOM 0 HD3 PRO A 44 22.864 1.841 -24.452 1.00 0.00 H new ATOM 671 N THR A 45 24.870 -0.972 -21.480 1.00 0.00 N ATOM 672 CA THR A 45 25.736 -1.548 -20.439 1.00 0.00 C ATOM 673 C THR A 45 25.041 -1.591 -19.077 1.00 0.00 C ATOM 674 O THR A 45 25.269 -2.525 -18.317 1.00 0.00 O ATOM 675 CB THR A 45 27.074 -0.788 -20.345 1.00 0.00 C ATOM 676 OG1 THR A 45 27.654 -0.637 -21.631 1.00 0.00 O ATOM 677 CG2 THR A 45 28.089 -1.513 -19.463 1.00 0.00 C ATOM 0 H THR A 45 25.155 -0.039 -21.778 1.00 0.00 H new ATOM 0 HA THR A 45 25.946 -2.577 -20.732 1.00 0.00 H new ATOM 0 HB THR A 45 26.843 0.182 -19.906 1.00 0.00 H new ATOM 0 HG1 THR A 45 28.501 -0.151 -21.553 1.00 0.00 H new ATOM 0 HG21 THR A 45 29.015 -0.940 -19.427 1.00 0.00 H new ATOM 0 HG22 THR A 45 27.687 -1.616 -18.455 1.00 0.00 H new ATOM 0 HG23 THR A 45 28.290 -2.501 -19.876 1.00 0.00 H new ATOM 685 N ALA A 46 24.112 -0.675 -18.773 1.00 0.00 N ATOM 686 CA ALA A 46 23.326 -0.728 -17.535 1.00 0.00 C ATOM 687 C ALA A 46 22.518 -2.027 -17.437 1.00 0.00 C ATOM 688 O ALA A 46 22.553 -2.706 -16.415 1.00 0.00 O ATOM 689 CB ALA A 46 22.402 0.495 -17.472 1.00 0.00 C ATOM 0 H ALA A 46 23.886 0.118 -19.374 1.00 0.00 H new ATOM 0 HA ALA A 46 24.009 -0.712 -16.686 1.00 0.00 H new ATOM 0 HB1 ALA A 46 21.815 0.461 -16.554 1.00 0.00 H new ATOM 0 HB2 ALA A 46 23.002 1.405 -17.486 1.00 0.00 H new ATOM 0 HB3 ALA A 46 21.732 0.489 -18.331 1.00 0.00 H new ATOM 695 N ILE A 47 21.868 -2.432 -18.532 1.00 0.00 N ATOM 696 CA ILE A 47 21.143 -3.715 -18.631 1.00 0.00 C ATOM 697 C ILE A 47 22.089 -4.897 -18.377 1.00 0.00 C ATOM 698 O ILE A 47 21.766 -5.780 -17.586 1.00 0.00 O ATOM 699 CB ILE A 47 20.453 -3.796 -20.012 1.00 0.00 C ATOM 700 CG1 ILE A 47 19.320 -2.747 -20.128 1.00 0.00 C ATOM 701 CG2 ILE A 47 19.876 -5.192 -20.292 1.00 0.00 C ATOM 702 CD1 ILE A 47 19.351 -1.988 -21.454 1.00 0.00 C ATOM 0 H ILE A 47 21.826 -1.877 -19.387 1.00 0.00 H new ATOM 0 HA ILE A 47 20.373 -3.769 -17.861 1.00 0.00 H new ATOM 0 HB ILE A 47 21.224 -3.587 -20.754 1.00 0.00 H new ATOM 0 HG12 ILE A 47 18.357 -3.246 -20.022 1.00 0.00 H new ATOM 0 HG13 ILE A 47 19.403 -2.036 -19.306 1.00 0.00 H new ATOM 0 HG21 ILE A 47 19.402 -5.199 -21.273 1.00 0.00 H new ATOM 0 HG22 ILE A 47 20.679 -5.928 -20.272 1.00 0.00 H new ATOM 0 HG23 ILE A 47 19.137 -5.440 -19.530 1.00 0.00 H new ATOM 0 HD11 ILE A 47 18.534 -1.266 -21.479 1.00 0.00 H new ATOM 0 HD12 ILE A 47 20.302 -1.464 -21.551 1.00 0.00 H new ATOM 0 HD13 ILE A 47 19.239 -2.692 -22.279 1.00 0.00 H new ATOM 714 N ALA A 48 23.293 -4.876 -18.955 1.00 0.00 N ATOM 715 CA ALA A 48 24.295 -5.928 -18.741 1.00 0.00 C ATOM 716 C ALA A 48 24.770 -6.005 -17.274 1.00 0.00 C ATOM 717 O ALA A 48 24.967 -7.085 -16.724 1.00 0.00 O ATOM 718 CB ALA A 48 25.467 -5.692 -19.695 1.00 0.00 C ATOM 0 H ALA A 48 23.601 -4.133 -19.582 1.00 0.00 H new ATOM 0 HA ALA A 48 23.835 -6.893 -18.953 1.00 0.00 H new ATOM 0 HB1 ALA A 48 26.219 -6.467 -19.546 1.00 0.00 H new ATOM 0 HB2 ALA A 48 25.110 -5.725 -20.725 1.00 0.00 H new ATOM 0 HB3 ALA A 48 25.908 -4.715 -19.495 1.00 0.00 H new ATOM 724 N MET A 49 24.899 -4.849 -16.622 1.00 0.00 N ATOM 725 CA MET A 49 25.313 -4.715 -15.220 1.00 0.00 C ATOM 726 C MET A 49 24.211 -5.112 -14.237 1.00 0.00 C ATOM 727 O MET A 49 24.523 -5.610 -13.158 1.00 0.00 O ATOM 728 CB MET A 49 25.799 -3.281 -14.978 1.00 0.00 C ATOM 729 CG MET A 49 27.033 -2.931 -15.818 1.00 0.00 C ATOM 730 SD MET A 49 28.633 -3.339 -15.071 1.00 0.00 S ATOM 731 CE MET A 49 28.927 -5.019 -15.671 1.00 0.00 C ATOM 0 H MET A 49 24.713 -3.950 -17.067 1.00 0.00 H new ATOM 0 HA MET A 49 26.131 -5.412 -15.036 1.00 0.00 H new ATOM 0 HB2 MET A 49 24.994 -2.584 -15.212 1.00 0.00 H new ATOM 0 HB3 MET A 49 26.034 -3.154 -13.921 1.00 0.00 H new ATOM 0 HG2 MET A 49 26.957 -3.448 -16.775 1.00 0.00 H new ATOM 0 HG3 MET A 49 27.014 -1.862 -16.031 1.00 0.00 H new ATOM 0 HE1 MET A 49 29.917 -5.350 -15.356 1.00 0.00 H new ATOM 0 HE2 MET A 49 28.173 -5.690 -15.260 1.00 0.00 H new ATOM 0 HE3 MET A 49 28.869 -5.032 -16.759 1.00 0.00 H new ATOM 741 N MET A 50 22.939 -4.953 -14.603 1.00 0.00 N ATOM 742 CA MET A 50 21.807 -5.502 -13.841 1.00 0.00 C ATOM 743 C MET A 50 21.664 -7.019 -14.057 1.00 0.00 C ATOM 744 O MET A 50 21.331 -7.747 -13.122 1.00 0.00 O ATOM 745 CB MET A 50 20.520 -4.759 -14.219 1.00 0.00 C ATOM 746 CG MET A 50 20.534 -3.278 -13.806 1.00 0.00 C ATOM 747 SD MET A 50 20.871 -2.926 -12.058 1.00 0.00 S ATOM 748 CE MET A 50 19.571 -3.922 -11.292 1.00 0.00 C ATOM 0 H MET A 50 22.659 -4.439 -15.438 1.00 0.00 H new ATOM 0 HA MET A 50 21.998 -5.352 -12.778 1.00 0.00 H new ATOM 0 HB2 MET A 50 20.371 -4.828 -15.297 1.00 0.00 H new ATOM 0 HB3 MET A 50 19.671 -5.253 -13.748 1.00 0.00 H new ATOM 0 HG2 MET A 50 21.283 -2.763 -14.408 1.00 0.00 H new ATOM 0 HG3 MET A 50 19.567 -2.844 -14.061 1.00 0.00 H new ATOM 0 HE1 MET A 50 19.095 -3.349 -10.496 1.00 0.00 H new ATOM 0 HE2 MET A 50 18.827 -4.188 -12.042 1.00 0.00 H new ATOM 0 HE3 MET A 50 20.006 -4.830 -10.875 1.00 0.00 H new ATOM 758 N GLU A 51 22.017 -7.526 -15.241 1.00 0.00 N ATOM 759 CA GLU A 51 22.023 -8.968 -15.515 1.00 0.00 C ATOM 760 C GLU A 51 23.118 -9.729 -14.742 1.00 0.00 C ATOM 761 O GLU A 51 22.934 -10.913 -14.456 1.00 0.00 O ATOM 762 CB GLU A 51 22.131 -9.217 -17.029 1.00 0.00 C ATOM 763 CG GLU A 51 20.788 -9.063 -17.758 1.00 0.00 C ATOM 764 CD GLU A 51 19.942 -10.349 -17.638 1.00 0.00 C ATOM 765 OE1 GLU A 51 19.272 -10.559 -16.597 1.00 0.00 O ATOM 766 OE2 GLU A 51 19.953 -11.171 -18.588 1.00 0.00 O ATOM 0 H GLU A 51 22.306 -6.953 -16.034 1.00 0.00 H new ATOM 0 HA GLU A 51 21.075 -9.367 -15.154 1.00 0.00 H new ATOM 0 HB2 GLU A 51 22.852 -8.520 -17.456 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.518 -10.221 -17.200 1.00 0.00 H new ATOM 0 HG2 GLU A 51 20.237 -8.221 -17.339 1.00 0.00 H new ATOM 0 HG3 GLU A 51 20.965 -8.837 -18.809 1.00 0.00 H new ATOM 773 N GLU A 52 24.211 -9.073 -14.308 1.00 0.00 N ATOM 774 CA GLU A 52 25.199 -9.701 -13.407 1.00 0.00 C ATOM 775 C GLU A 52 24.585 -10.136 -12.061 1.00 0.00 C ATOM 776 O GLU A 52 25.007 -11.135 -11.478 1.00 0.00 O ATOM 777 CB GLU A 52 26.351 -8.746 -13.071 1.00 0.00 C ATOM 778 CG GLU A 52 27.246 -8.325 -14.239 1.00 0.00 C ATOM 779 CD GLU A 52 28.610 -7.835 -13.711 1.00 0.00 C ATOM 780 OE1 GLU A 52 28.638 -7.043 -12.734 1.00 0.00 O ATOM 781 OE2 GLU A 52 29.665 -8.257 -14.241 1.00 0.00 O ATOM 0 H GLU A 52 24.433 -8.111 -14.565 1.00 0.00 H new ATOM 0 HA GLU A 52 25.558 -10.572 -13.955 1.00 0.00 H new ATOM 0 HB2 GLU A 52 25.930 -7.847 -12.621 1.00 0.00 H new ATOM 0 HB3 GLU A 52 26.977 -9.218 -12.313 1.00 0.00 H new ATOM 0 HG2 GLU A 52 27.391 -9.165 -14.918 1.00 0.00 H new ATOM 0 HG3 GLU A 52 26.763 -7.533 -14.811 1.00 0.00 H new ATOM 788 N VAL A 53 23.580 -9.393 -11.575 1.00 0.00 N ATOM 789 CA VAL A 53 22.820 -9.695 -10.344 1.00 0.00 C ATOM 790 C VAL A 53 21.480 -10.397 -10.635 1.00 0.00 C ATOM 791 O VAL A 53 20.651 -10.558 -9.741 1.00 0.00 O ATOM 792 CB VAL A 53 22.684 -8.460 -9.425 1.00 0.00 C ATOM 793 CG1 VAL A 53 24.062 -7.970 -8.960 1.00 0.00 C ATOM 794 CG2 VAL A 53 21.962 -7.277 -10.079 1.00 0.00 C ATOM 0 H VAL A 53 23.261 -8.541 -12.037 1.00 0.00 H new ATOM 0 HA VAL A 53 23.407 -10.419 -9.779 1.00 0.00 H new ATOM 0 HB VAL A 53 22.081 -8.802 -8.584 1.00 0.00 H new ATOM 0 HG11 VAL A 53 23.940 -7.100 -8.315 1.00 0.00 H new ATOM 0 HG12 VAL A 53 24.563 -8.765 -8.407 1.00 0.00 H new ATOM 0 HG13 VAL A 53 24.663 -7.697 -9.827 1.00 0.00 H new ATOM 0 HG21 VAL A 53 21.906 -6.449 -9.372 1.00 0.00 H new ATOM 0 HG22 VAL A 53 22.511 -6.960 -10.966 1.00 0.00 H new ATOM 0 HG23 VAL A 53 20.954 -7.579 -10.365 1.00 0.00 H new ATOM 804 N GLY A 54 21.267 -10.838 -11.884 1.00 0.00 N ATOM 805 CA GLY A 54 20.083 -11.593 -12.317 1.00 0.00 C ATOM 806 C GLY A 54 18.788 -10.768 -12.400 1.00 0.00 C ATOM 807 O GLY A 54 17.698 -11.346 -12.371 1.00 0.00 O ATOM 0 H GLY A 54 21.932 -10.675 -12.640 1.00 0.00 H new ATOM 0 HA2 GLY A 54 20.284 -12.027 -13.296 1.00 0.00 H new ATOM 0 HA3 GLY A 54 19.926 -12.422 -11.627 1.00 0.00 H new ATOM 811 N ILE A 55 18.888 -9.434 -12.473 1.00 0.00 N ATOM 812 CA ILE A 55 17.745 -8.510 -12.537 1.00 0.00 C ATOM 813 C ILE A 55 17.536 -8.026 -13.977 1.00 0.00 C ATOM 814 O ILE A 55 18.460 -7.514 -14.612 1.00 0.00 O ATOM 815 CB ILE A 55 17.939 -7.339 -11.549 1.00 0.00 C ATOM 816 CG1 ILE A 55 17.911 -7.863 -10.091 1.00 0.00 C ATOM 817 CG2 ILE A 55 16.865 -6.257 -11.760 1.00 0.00 C ATOM 818 CD1 ILE A 55 18.100 -6.797 -9.001 1.00 0.00 C ATOM 0 H ILE A 55 19.788 -8.954 -12.490 1.00 0.00 H new ATOM 0 HA ILE A 55 16.840 -9.037 -12.235 1.00 0.00 H new ATOM 0 HB ILE A 55 18.911 -6.884 -11.739 1.00 0.00 H new ATOM 0 HG12 ILE A 55 16.958 -8.365 -9.922 1.00 0.00 H new ATOM 0 HG13 ILE A 55 18.692 -8.615 -9.979 1.00 0.00 H new ATOM 0 HG21 ILE A 55 17.024 -5.444 -11.052 1.00 0.00 H new ATOM 0 HG22 ILE A 55 16.932 -5.871 -12.777 1.00 0.00 H new ATOM 0 HG23 ILE A 55 15.877 -6.689 -11.600 1.00 0.00 H new ATOM 0 HD11 ILE A 55 18.064 -7.270 -8.020 1.00 0.00 H new ATOM 0 HD12 ILE A 55 19.065 -6.309 -9.133 1.00 0.00 H new ATOM 0 HD13 ILE A 55 17.305 -6.055 -9.076 1.00 0.00 H new ATOM 830 N ASP A 56 16.300 -8.124 -14.470 1.00 0.00 N ATOM 831 CA ASP A 56 15.955 -7.744 -15.841 1.00 0.00 C ATOM 832 C ASP A 56 15.369 -6.324 -15.946 1.00 0.00 C ATOM 833 O ASP A 56 14.298 -6.023 -15.408 1.00 0.00 O ATOM 834 CB ASP A 56 15.019 -8.791 -16.465 1.00 0.00 C ATOM 835 CG ASP A 56 14.693 -8.467 -17.935 1.00 0.00 C ATOM 836 OD1 ASP A 56 15.551 -7.856 -18.618 1.00 0.00 O ATOM 837 OD2 ASP A 56 13.583 -8.815 -18.405 1.00 0.00 O ATOM 0 H ASP A 56 15.508 -8.470 -13.928 1.00 0.00 H new ATOM 0 HA ASP A 56 16.884 -7.721 -16.411 1.00 0.00 H new ATOM 0 HB2 ASP A 56 15.484 -9.775 -16.405 1.00 0.00 H new ATOM 0 HB3 ASP A 56 14.094 -8.839 -15.890 1.00 0.00 H new ATOM 842 N ILE A 57 16.065 -5.461 -16.695 1.00 0.00 N ATOM 843 CA ILE A 57 15.587 -4.134 -17.122 1.00 0.00 C ATOM 844 C ILE A 57 15.590 -3.988 -18.661 1.00 0.00 C ATOM 845 O ILE A 57 15.478 -2.883 -19.183 1.00 0.00 O ATOM 846 CB ILE A 57 16.327 -2.982 -16.393 1.00 0.00 C ATOM 847 CG1 ILE A 57 17.827 -2.901 -16.741 1.00 0.00 C ATOM 848 CG2 ILE A 57 16.155 -3.076 -14.862 1.00 0.00 C ATOM 849 CD1 ILE A 57 18.391 -1.481 -16.571 1.00 0.00 C ATOM 0 H ILE A 57 17.005 -5.670 -17.033 1.00 0.00 H new ATOM 0 HA ILE A 57 14.544 -4.052 -16.816 1.00 0.00 H new ATOM 0 HB ILE A 57 15.859 -2.066 -16.754 1.00 0.00 H new ATOM 0 HG12 ILE A 57 18.383 -3.589 -16.104 1.00 0.00 H new ATOM 0 HG13 ILE A 57 17.977 -3.228 -17.770 1.00 0.00 H new ATOM 0 HG21 ILE A 57 16.687 -2.253 -14.385 1.00 0.00 H new ATOM 0 HG22 ILE A 57 15.096 -3.018 -14.611 1.00 0.00 H new ATOM 0 HG23 ILE A 57 16.561 -4.024 -14.508 1.00 0.00 H new ATOM 0 HD11 ILE A 57 19.450 -1.477 -16.828 1.00 0.00 H new ATOM 0 HD12 ILE A 57 17.855 -0.796 -17.228 1.00 0.00 H new ATOM 0 HD13 ILE A 57 18.268 -1.162 -15.536 1.00 0.00 H new ATOM 861 N SER A 58 15.719 -5.089 -19.411 1.00 0.00 N ATOM 862 CA SER A 58 15.892 -5.088 -20.881 1.00 0.00 C ATOM 863 C SER A 58 14.668 -4.544 -21.630 1.00 0.00 C ATOM 864 O SER A 58 14.805 -3.931 -22.690 1.00 0.00 O ATOM 865 CB SER A 58 16.185 -6.506 -21.407 1.00 0.00 C ATOM 866 OG SER A 58 17.101 -7.208 -20.589 1.00 0.00 O ATOM 0 H SER A 58 15.707 -6.027 -19.012 1.00 0.00 H new ATOM 0 HA SER A 58 16.737 -4.427 -21.072 1.00 0.00 H new ATOM 0 HB2 SER A 58 15.253 -7.067 -21.468 1.00 0.00 H new ATOM 0 HB3 SER A 58 16.584 -6.440 -22.419 1.00 0.00 H new ATOM 0 HG SER A 58 16.609 -7.745 -19.933 1.00 0.00 H new ATOM 872 N GLY A 59 13.473 -4.740 -21.060 1.00 0.00 N ATOM 873 CA GLY A 59 12.202 -4.228 -21.583 1.00 0.00 C ATOM 874 C GLY A 59 11.882 -2.777 -21.200 1.00 0.00 C ATOM 875 O GLY A 59 10.799 -2.297 -21.540 1.00 0.00 O ATOM 0 H GLY A 59 13.361 -5.274 -20.198 1.00 0.00 H new ATOM 0 HA2 GLY A 59 12.215 -4.307 -22.670 1.00 0.00 H new ATOM 0 HA3 GLY A 59 11.395 -4.869 -21.227 1.00 0.00 H new ATOM 879 N GLN A 60 12.777 -2.071 -20.493 1.00 0.00 N ATOM 880 CA GLN A 60 12.591 -0.660 -20.143 1.00 0.00 C ATOM 881 C GLN A 60 13.101 0.256 -21.268 1.00 0.00 C ATOM 882 O GLN A 60 13.922 -0.123 -22.106 1.00 0.00 O ATOM 883 CB GLN A 60 13.239 -0.348 -18.777 1.00 0.00 C ATOM 884 CG GLN A 60 12.366 -0.853 -17.608 1.00 0.00 C ATOM 885 CD GLN A 60 13.133 -1.087 -16.305 1.00 0.00 C ATOM 886 OE1 GLN A 60 13.037 -2.151 -15.706 1.00 0.00 O ATOM 887 NE2 GLN A 60 13.918 -0.148 -15.820 1.00 0.00 N ATOM 0 H GLN A 60 13.652 -2.466 -20.148 1.00 0.00 H new ATOM 0 HA GLN A 60 11.525 -0.460 -20.039 1.00 0.00 H new ATOM 0 HB2 GLN A 60 14.223 -0.814 -18.725 1.00 0.00 H new ATOM 0 HB3 GLN A 60 13.390 0.727 -18.682 1.00 0.00 H new ATOM 0 HG2 GLN A 60 11.572 -0.129 -17.424 1.00 0.00 H new ATOM 0 HG3 GLN A 60 11.885 -1.785 -17.905 1.00 0.00 H new ATOM 0 HE21 GLN A 60 14.008 0.743 -16.308 1.00 0.00 H new ATOM 0 HE22 GLN A 60 14.436 -0.312 -14.957 1.00 0.00 H new ATOM 896 N THR A 61 12.598 1.487 -21.263 1.00 0.00 N ATOM 897 CA THR A 61 12.869 2.575 -22.208 1.00 0.00 C ATOM 898 C THR A 61 12.947 3.875 -21.409 1.00 0.00 C ATOM 899 O THR A 61 12.526 3.924 -20.247 1.00 0.00 O ATOM 900 CB THR A 61 11.774 2.681 -23.292 1.00 0.00 C ATOM 901 OG1 THR A 61 10.483 2.695 -22.717 1.00 0.00 O ATOM 902 CG2 THR A 61 11.827 1.515 -24.278 1.00 0.00 C ATOM 0 H THR A 61 11.937 1.776 -20.542 1.00 0.00 H new ATOM 0 HA THR A 61 13.807 2.377 -22.726 1.00 0.00 H new ATOM 0 HB THR A 61 11.967 3.615 -23.819 1.00 0.00 H new ATOM 0 HG1 THR A 61 9.810 2.764 -23.426 1.00 0.00 H new ATOM 0 HG21 THR A 61 11.039 1.632 -25.022 1.00 0.00 H new ATOM 0 HG22 THR A 61 12.797 1.503 -24.775 1.00 0.00 H new ATOM 0 HG23 THR A 61 11.683 0.577 -23.741 1.00 0.00 H new ATOM 910 N SER A 62 13.548 4.922 -21.978 1.00 0.00 N ATOM 911 CA SER A 62 13.639 6.216 -21.295 1.00 0.00 C ATOM 912 C SER A 62 12.416 7.108 -21.549 1.00 0.00 C ATOM 913 O SER A 62 11.968 7.234 -22.690 1.00 0.00 O ATOM 914 CB SER A 62 14.942 6.908 -21.650 1.00 0.00 C ATOM 915 OG SER A 62 15.057 7.068 -23.046 1.00 0.00 O ATOM 0 H SER A 62 13.976 4.901 -22.903 1.00 0.00 H new ATOM 0 HA SER A 62 13.639 6.024 -20.222 1.00 0.00 H new ATOM 0 HB2 SER A 62 14.987 7.882 -21.162 1.00 0.00 H new ATOM 0 HB3 SER A 62 15.783 6.325 -21.275 1.00 0.00 H new ATOM 0 HG SER A 62 14.204 6.842 -23.473 1.00 0.00 H new ATOM 921 N ASP A 63 11.920 7.776 -20.502 1.00 0.00 N ATOM 922 CA ASP A 63 10.727 8.647 -20.560 1.00 0.00 C ATOM 923 C ASP A 63 10.880 9.975 -19.777 1.00 0.00 C ATOM 924 O ASP A 63 11.543 9.995 -18.734 1.00 0.00 O ATOM 925 CB ASP A 63 9.488 7.885 -20.069 1.00 0.00 C ATOM 926 CG ASP A 63 8.963 6.888 -21.115 1.00 0.00 C ATOM 927 OD1 ASP A 63 8.455 7.335 -22.174 1.00 0.00 O ATOM 928 OD2 ASP A 63 9.001 5.660 -20.864 1.00 0.00 O ATOM 0 H ASP A 63 12.338 7.730 -19.573 1.00 0.00 H new ATOM 0 HA ASP A 63 10.607 8.924 -21.607 1.00 0.00 H new ATOM 0 HB2 ASP A 63 9.733 7.350 -19.152 1.00 0.00 H new ATOM 0 HB3 ASP A 63 8.701 8.597 -19.822 1.00 0.00 H new ATOM 933 N PRO A 64 10.266 11.087 -20.240 1.00 0.00 N ATOM 934 CA PRO A 64 10.473 12.423 -19.675 1.00 0.00 C ATOM 935 C PRO A 64 9.535 12.756 -18.500 1.00 0.00 C ATOM 936 O PRO A 64 8.355 12.404 -18.499 1.00 0.00 O ATOM 937 CB PRO A 64 10.270 13.379 -20.855 1.00 0.00 C ATOM 938 CG PRO A 64 9.172 12.681 -21.659 1.00 0.00 C ATOM 939 CD PRO A 64 9.496 11.196 -21.477 1.00 0.00 C ATOM 0 HA PRO A 64 11.466 12.504 -19.233 1.00 0.00 H new ATOM 0 HB2 PRO A 64 9.963 14.372 -20.525 1.00 0.00 H new ATOM 0 HB3 PRO A 64 11.183 13.504 -21.438 1.00 0.00 H new ATOM 0 HG2 PRO A 64 8.179 12.926 -21.282 1.00 0.00 H new ATOM 0 HG3 PRO A 64 9.195 12.972 -22.709 1.00 0.00 H new ATOM 0 HD2 PRO A 64 8.583 10.604 -21.419 1.00 0.00 H new ATOM 0 HD3 PRO A 64 10.068 10.817 -22.324 1.00 0.00 H new ATOM 947 N ILE A 65 10.040 13.527 -17.535 1.00 0.00 N ATOM 948 CA ILE A 65 9.354 14.016 -16.326 1.00 0.00 C ATOM 949 C ILE A 65 8.069 14.792 -16.662 1.00 0.00 C ATOM 950 O ILE A 65 7.058 14.652 -15.982 1.00 0.00 O ATOM 951 CB ILE A 65 10.369 14.868 -15.515 1.00 0.00 C ATOM 952 CG1 ILE A 65 9.918 15.010 -14.059 1.00 0.00 C ATOM 953 CG2 ILE A 65 10.653 16.256 -16.126 1.00 0.00 C ATOM 954 CD1 ILE A 65 10.880 15.820 -13.190 1.00 0.00 C ATOM 0 H ILE A 65 11.006 13.852 -17.576 1.00 0.00 H new ATOM 0 HA ILE A 65 9.022 13.172 -15.721 1.00 0.00 H new ATOM 0 HB ILE A 65 11.311 14.321 -15.556 1.00 0.00 H new ATOM 0 HG12 ILE A 65 8.937 15.484 -14.037 1.00 0.00 H new ATOM 0 HG13 ILE A 65 9.801 14.016 -13.626 1.00 0.00 H new ATOM 0 HG21 ILE A 65 11.371 16.788 -15.502 1.00 0.00 H new ATOM 0 HG22 ILE A 65 11.064 16.135 -17.128 1.00 0.00 H new ATOM 0 HG23 ILE A 65 9.726 16.826 -16.180 1.00 0.00 H new ATOM 0 HD11 ILE A 65 10.492 15.876 -12.173 1.00 0.00 H new ATOM 0 HD12 ILE A 65 11.856 15.336 -13.180 1.00 0.00 H new ATOM 0 HD13 ILE A 65 10.978 16.826 -13.597 1.00 0.00 H new ATOM 966 N GLU A 66 8.088 15.533 -17.774 1.00 0.00 N ATOM 967 CA GLU A 66 6.966 16.365 -18.246 1.00 0.00 C ATOM 968 C GLU A 66 5.674 15.569 -18.537 1.00 0.00 C ATOM 969 O GLU A 66 4.585 16.144 -18.476 1.00 0.00 O ATOM 970 CB GLU A 66 7.388 17.134 -19.510 1.00 0.00 C ATOM 971 CG GLU A 66 8.594 18.059 -19.285 1.00 0.00 C ATOM 972 CD GLU A 66 8.824 18.971 -20.507 1.00 0.00 C ATOM 973 OE1 GLU A 66 9.484 18.535 -21.484 1.00 0.00 O ATOM 974 OE2 GLU A 66 8.352 20.135 -20.503 1.00 0.00 O ATOM 0 H GLU A 66 8.901 15.575 -18.389 1.00 0.00 H new ATOM 0 HA GLU A 66 6.731 17.050 -17.431 1.00 0.00 H new ATOM 0 HB2 GLU A 66 7.629 16.420 -20.298 1.00 0.00 H new ATOM 0 HB3 GLU A 66 6.545 17.727 -19.864 1.00 0.00 H new ATOM 0 HG2 GLU A 66 8.429 18.669 -18.397 1.00 0.00 H new ATOM 0 HG3 GLU A 66 9.486 17.461 -19.099 1.00 0.00 H new ATOM 981 N ASN A 67 5.769 14.261 -18.824 1.00 0.00 N ATOM 982 CA ASN A 67 4.605 13.397 -19.084 1.00 0.00 C ATOM 983 C ASN A 67 4.031 12.719 -17.813 1.00 0.00 C ATOM 984 O ASN A 67 2.929 12.169 -17.860 1.00 0.00 O ATOM 985 CB ASN A 67 4.946 12.397 -20.218 1.00 0.00 C ATOM 986 CG ASN A 67 5.123 10.956 -19.746 1.00 0.00 C ATOM 987 OD1 ASN A 67 4.306 10.084 -20.005 1.00 0.00 O ATOM 988 ND2 ASN A 67 6.171 10.666 -19.014 1.00 0.00 N ATOM 0 H ASN A 67 6.661 13.770 -18.883 1.00 0.00 H new ATOM 0 HA ASN A 67 3.786 14.031 -19.422 1.00 0.00 H new ATOM 0 HB2 ASN A 67 4.154 12.428 -20.966 1.00 0.00 H new ATOM 0 HB3 ASN A 67 5.862 12.722 -20.711 1.00 0.00 H new ATOM 0 HD21 ASN A 67 6.302 9.717 -18.664 1.00 0.00 H new ATOM 0 HD22 ASN A 67 6.856 11.389 -18.795 1.00 0.00 H new ATOM 995 N PHE A 68 4.775 12.728 -16.699 1.00 0.00 N ATOM 996 CA PHE A 68 4.472 11.957 -15.487 1.00 0.00 C ATOM 997 C PHE A 68 3.714 12.766 -14.418 1.00 0.00 C ATOM 998 O PHE A 68 3.516 13.978 -14.537 1.00 0.00 O ATOM 999 CB PHE A 68 5.778 11.335 -14.965 1.00 0.00 C ATOM 1000 CG PHE A 68 6.250 10.116 -15.736 1.00 0.00 C ATOM 1001 CD1 PHE A 68 5.430 8.975 -15.844 1.00 0.00 C ATOM 1002 CD2 PHE A 68 7.520 10.112 -16.338 1.00 0.00 C ATOM 1003 CE1 PHE A 68 5.872 7.846 -16.553 1.00 0.00 C ATOM 1004 CE2 PHE A 68 7.959 8.986 -17.057 1.00 0.00 C ATOM 1005 CZ PHE A 68 7.137 7.850 -17.162 1.00 0.00 C ATOM 0 H PHE A 68 5.625 13.285 -16.614 1.00 0.00 H new ATOM 0 HA PHE A 68 3.776 11.159 -15.744 1.00 0.00 H new ATOM 0 HB2 PHE A 68 6.562 12.092 -14.993 1.00 0.00 H new ATOM 0 HB3 PHE A 68 5.640 11.057 -13.920 1.00 0.00 H new ATOM 0 HD1 PHE A 68 4.455 8.969 -15.379 1.00 0.00 H new ATOM 0 HD2 PHE A 68 8.161 10.977 -16.248 1.00 0.00 H new ATOM 0 HE1 PHE A 68 5.239 6.975 -16.630 1.00 0.00 H new ATOM 0 HE2 PHE A 68 8.930 8.994 -17.530 1.00 0.00 H new ATOM 0 HZ PHE A 68 7.478 6.983 -17.709 1.00 0.00 H new ATOM 1015 N ASN A 69 3.264 12.069 -13.367 1.00 0.00 N ATOM 1016 CA ASN A 69 2.340 12.573 -12.343 1.00 0.00 C ATOM 1017 C ASN A 69 2.941 12.510 -10.926 1.00 0.00 C ATOM 1018 O ASN A 69 2.692 11.556 -10.190 1.00 0.00 O ATOM 1019 CB ASN A 69 0.988 11.834 -12.493 1.00 0.00 C ATOM 1020 CG ASN A 69 1.069 10.319 -12.687 1.00 0.00 C ATOM 1021 OD1 ASN A 69 0.737 9.792 -13.740 1.00 0.00 O ATOM 1022 ND2 ASN A 69 1.506 9.573 -11.701 1.00 0.00 N ATOM 0 H ASN A 69 3.544 11.102 -13.200 1.00 0.00 H new ATOM 0 HA ASN A 69 2.160 13.637 -12.498 1.00 0.00 H new ATOM 0 HB2 ASN A 69 0.387 12.035 -11.606 1.00 0.00 H new ATOM 0 HB3 ASN A 69 0.456 12.261 -13.343 1.00 0.00 H new ATOM 0 HD21 ASN A 69 1.567 8.561 -11.815 1.00 0.00 H new ATOM 0 HD22 ASN A 69 1.785 10.004 -10.820 1.00 0.00 H new ATOM 1029 N ALA A 70 3.684 13.549 -10.518 1.00 0.00 N ATOM 1030 CA ALA A 70 4.354 13.610 -9.208 1.00 0.00 C ATOM 1031 C ALA A 70 3.420 13.297 -8.022 1.00 0.00 C ATOM 1032 O ALA A 70 3.835 12.677 -7.046 1.00 0.00 O ATOM 1033 CB ALA A 70 4.950 15.010 -9.015 1.00 0.00 C ATOM 0 H ALA A 70 3.839 14.378 -11.092 1.00 0.00 H new ATOM 0 HA ALA A 70 5.127 12.841 -9.214 1.00 0.00 H new ATOM 0 HB1 ALA A 70 5.448 15.063 -8.047 1.00 0.00 H new ATOM 0 HB2 ALA A 70 5.673 15.210 -9.806 1.00 0.00 H new ATOM 0 HB3 ALA A 70 4.154 15.753 -9.055 1.00 0.00 H new ATOM 1039 N ASP A 71 2.146 13.696 -8.137 1.00 0.00 N ATOM 1040 CA ASP A 71 1.107 13.529 -7.111 1.00 0.00 C ATOM 1041 C ASP A 71 0.849 12.064 -6.706 1.00 0.00 C ATOM 1042 O ASP A 71 0.426 11.796 -5.579 1.00 0.00 O ATOM 1043 CB ASP A 71 -0.187 14.141 -7.666 1.00 0.00 C ATOM 1044 CG ASP A 71 -1.313 14.168 -6.617 1.00 0.00 C ATOM 1045 OD1 ASP A 71 -1.209 14.947 -5.637 1.00 0.00 O ATOM 1046 OD2 ASP A 71 -2.324 13.445 -6.788 1.00 0.00 O ATOM 0 H ASP A 71 1.798 14.160 -8.976 1.00 0.00 H new ATOM 0 HA ASP A 71 1.452 14.027 -6.205 1.00 0.00 H new ATOM 0 HB2 ASP A 71 0.011 15.156 -8.010 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -0.515 13.569 -8.534 1.00 0.00 H new ATOM 1051 N ASP A 72 1.122 11.113 -7.606 1.00 0.00 N ATOM 1052 CA ASP A 72 0.952 9.676 -7.353 1.00 0.00 C ATOM 1053 C ASP A 72 2.234 8.985 -6.846 1.00 0.00 C ATOM 1054 O ASP A 72 2.227 7.776 -6.617 1.00 0.00 O ATOM 1055 CB ASP A 72 0.411 8.989 -8.611 1.00 0.00 C ATOM 1056 CG ASP A 72 -0.250 7.630 -8.315 1.00 0.00 C ATOM 1057 OD1 ASP A 72 -1.110 7.548 -7.401 1.00 0.00 O ATOM 1058 OD2 ASP A 72 0.035 6.646 -9.040 1.00 0.00 O ATOM 0 H ASP A 72 1.471 11.321 -8.542 1.00 0.00 H new ATOM 0 HA ASP A 72 0.229 9.576 -6.544 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -0.316 9.644 -9.092 1.00 0.00 H new ATOM 0 HB3 ASP A 72 1.227 8.844 -9.319 1.00 0.00 H new ATOM 1063 N TYR A 73 3.339 9.718 -6.666 1.00 0.00 N ATOM 1064 CA TYR A 73 4.604 9.178 -6.168 1.00 0.00 C ATOM 1065 C TYR A 73 4.808 9.649 -4.721 1.00 0.00 C ATOM 1066 O TYR A 73 5.172 10.797 -4.481 1.00 0.00 O ATOM 1067 CB TYR A 73 5.762 9.563 -7.112 1.00 0.00 C ATOM 1068 CG TYR A 73 5.499 9.392 -8.602 1.00 0.00 C ATOM 1069 CD1 TYR A 73 4.796 8.271 -9.090 1.00 0.00 C ATOM 1070 CD2 TYR A 73 5.948 10.377 -9.504 1.00 0.00 C ATOM 1071 CE1 TYR A 73 4.491 8.172 -10.460 1.00 0.00 C ATOM 1072 CE2 TYR A 73 5.636 10.286 -10.875 1.00 0.00 C ATOM 1073 CZ TYR A 73 4.886 9.193 -11.349 1.00 0.00 C ATOM 1074 OH TYR A 73 4.555 9.127 -12.667 1.00 0.00 O ATOM 0 H TYR A 73 3.377 10.717 -6.866 1.00 0.00 H new ATOM 0 HA TYR A 73 4.582 8.088 -6.156 1.00 0.00 H new ATOM 0 HB2 TYR A 73 6.023 10.605 -6.927 1.00 0.00 H new ATOM 0 HB3 TYR A 73 6.634 8.965 -6.847 1.00 0.00 H new ATOM 0 HD1 TYR A 73 4.491 7.488 -8.412 1.00 0.00 H new ATOM 0 HD2 TYR A 73 6.536 11.208 -9.142 1.00 0.00 H new ATOM 0 HE1 TYR A 73 3.953 7.312 -10.832 1.00 0.00 H new ATOM 0 HE2 TYR A 73 5.971 11.052 -11.559 1.00 0.00 H new ATOM 0 HH TYR A 73 3.709 8.643 -12.768 1.00 0.00 H new ATOM 1084 N ASP A 74 4.574 8.766 -3.741 1.00 0.00 N ATOM 1085 CA ASP A 74 4.823 9.048 -2.316 1.00 0.00 C ATOM 1086 C ASP A 74 6.250 9.574 -2.095 1.00 0.00 C ATOM 1087 O ASP A 74 6.473 10.495 -1.308 1.00 0.00 O ATOM 1088 CB ASP A 74 4.658 7.768 -1.481 1.00 0.00 C ATOM 1089 CG ASP A 74 3.233 7.225 -1.448 1.00 0.00 C ATOM 1090 OD1 ASP A 74 2.462 7.579 -0.526 1.00 0.00 O ATOM 1091 OD2 ASP A 74 2.926 6.372 -2.312 1.00 0.00 O ATOM 0 H ASP A 74 4.205 7.831 -3.913 1.00 0.00 H new ATOM 0 HA ASP A 74 4.101 9.803 -2.006 1.00 0.00 H new ATOM 0 HB2 ASP A 74 5.319 6.999 -1.880 1.00 0.00 H new ATOM 0 HB3 ASP A 74 4.983 7.969 -0.460 1.00 0.00 H new ATOM 1096 N VAL A 75 7.211 9.011 -2.831 1.00 0.00 N ATOM 1097 CA VAL A 75 8.615 9.411 -2.789 1.00 0.00 C ATOM 1098 C VAL A 75 9.122 9.723 -4.194 1.00 0.00 C ATOM 1099 O VAL A 75 8.898 8.946 -5.124 1.00 0.00 O ATOM 1100 CB VAL A 75 9.470 8.312 -2.143 1.00 0.00 C ATOM 1101 CG1 VAL A 75 10.918 8.776 -1.974 1.00 0.00 C ATOM 1102 CG2 VAL A 75 8.902 7.864 -0.791 1.00 0.00 C ATOM 0 H VAL A 75 7.029 8.250 -3.485 1.00 0.00 H new ATOM 0 HA VAL A 75 8.698 10.313 -2.182 1.00 0.00 H new ATOM 0 HB VAL A 75 9.448 7.455 -2.816 1.00 0.00 H new ATOM 0 HG11 VAL A 75 11.504 7.980 -1.514 1.00 0.00 H new ATOM 0 HG12 VAL A 75 11.339 9.019 -2.950 1.00 0.00 H new ATOM 0 HG13 VAL A 75 10.945 9.660 -1.337 1.00 0.00 H new ATOM 0 HG21 VAL A 75 9.538 7.086 -0.369 1.00 0.00 H new ATOM 0 HG22 VAL A 75 8.870 8.715 -0.110 1.00 0.00 H new ATOM 0 HG23 VAL A 75 7.894 7.473 -0.931 1.00 0.00 H new ATOM 1112 N VAL A 76 9.877 10.811 -4.344 1.00 0.00 N ATOM 1113 CA VAL A 76 10.606 11.137 -5.580 1.00 0.00 C ATOM 1114 C VAL A 76 12.093 11.256 -5.282 1.00 0.00 C ATOM 1115 O VAL A 76 12.490 11.845 -4.284 1.00 0.00 O ATOM 1116 CB VAL A 76 10.054 12.419 -6.224 1.00 0.00 C ATOM 1117 CG1 VAL A 76 10.945 12.966 -7.350 1.00 0.00 C ATOM 1118 CG2 VAL A 76 8.673 12.151 -6.831 1.00 0.00 C ATOM 0 H VAL A 76 10.004 11.502 -3.605 1.00 0.00 H new ATOM 0 HA VAL A 76 10.462 10.331 -6.300 1.00 0.00 H new ATOM 0 HB VAL A 76 10.012 13.156 -5.422 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.498 13.871 -7.761 1.00 0.00 H new ATOM 0 HG12 VAL A 76 11.933 13.198 -6.952 1.00 0.00 H new ATOM 0 HG13 VAL A 76 11.038 12.217 -8.137 1.00 0.00 H new ATOM 0 HG21 VAL A 76 8.291 13.066 -7.285 1.00 0.00 H new ATOM 0 HG22 VAL A 76 8.755 11.375 -7.592 1.00 0.00 H new ATOM 0 HG23 VAL A 76 7.989 11.821 -6.049 1.00 0.00 H new ATOM 1128 N ILE A 77 12.926 10.708 -6.159 1.00 0.00 N ATOM 1129 CA ILE A 77 14.381 10.674 -6.012 1.00 0.00 C ATOM 1130 C ILE A 77 15.038 11.327 -7.227 1.00 0.00 C ATOM 1131 O ILE A 77 14.639 11.034 -8.349 1.00 0.00 O ATOM 1132 CB ILE A 77 14.843 9.209 -5.887 1.00 0.00 C ATOM 1133 CG1 ILE A 77 14.080 8.356 -4.849 1.00 0.00 C ATOM 1134 CG2 ILE A 77 16.353 9.138 -5.627 1.00 0.00 C ATOM 1135 CD1 ILE A 77 14.185 8.823 -3.395 1.00 0.00 C ATOM 0 H ILE A 77 12.601 10.262 -7.017 1.00 0.00 H new ATOM 0 HA ILE A 77 14.672 11.223 -5.117 1.00 0.00 H new ATOM 0 HB ILE A 77 14.601 8.762 -6.851 1.00 0.00 H new ATOM 0 HG12 ILE A 77 13.027 8.334 -5.128 1.00 0.00 H new ATOM 0 HG13 ILE A 77 14.447 7.331 -4.909 1.00 0.00 H new ATOM 0 HG21 ILE A 77 16.659 8.095 -5.542 1.00 0.00 H new ATOM 0 HG22 ILE A 77 16.887 9.607 -6.454 1.00 0.00 H new ATOM 0 HG23 ILE A 77 16.588 9.662 -4.700 1.00 0.00 H new ATOM 0 HD11 ILE A 77 13.612 8.152 -2.755 1.00 0.00 H new ATOM 0 HD12 ILE A 77 15.230 8.816 -3.085 1.00 0.00 H new ATOM 0 HD13 ILE A 77 13.788 9.834 -3.308 1.00 0.00 H new ATOM 1147 N SER A 78 16.070 12.147 -7.033 1.00 0.00 N ATOM 1148 CA SER A 78 16.926 12.648 -8.125 1.00 0.00 C ATOM 1149 C SER A 78 18.281 11.938 -8.121 1.00 0.00 C ATOM 1150 O SER A 78 18.887 11.755 -7.070 1.00 0.00 O ATOM 1151 CB SER A 78 17.109 14.160 -8.043 1.00 0.00 C ATOM 1152 OG SER A 78 17.876 14.567 -9.166 1.00 0.00 O ATOM 0 H SER A 78 16.343 12.488 -6.111 1.00 0.00 H new ATOM 0 HA SER A 78 16.423 12.426 -9.066 1.00 0.00 H new ATOM 0 HB2 SER A 78 16.141 14.662 -8.039 1.00 0.00 H new ATOM 0 HB3 SER A 78 17.614 14.434 -7.116 1.00 0.00 H new ATOM 0 HG SER A 78 18.007 15.538 -9.138 1.00 0.00 H new ATOM 1158 N LEU A 79 18.770 11.529 -9.291 1.00 0.00 N ATOM 1159 CA LEU A 79 20.033 10.797 -9.477 1.00 0.00 C ATOM 1160 C LEU A 79 20.880 11.482 -10.563 1.00 0.00 C ATOM 1161 O LEU A 79 21.432 10.821 -11.442 1.00 0.00 O ATOM 1162 CB LEU A 79 19.748 9.301 -9.774 1.00 0.00 C ATOM 1163 CG LEU A 79 18.863 8.546 -8.757 1.00 0.00 C ATOM 1164 CD1 LEU A 79 17.377 8.627 -9.110 1.00 0.00 C ATOM 1165 CD2 LEU A 79 19.197 7.055 -8.766 1.00 0.00 C ATOM 0 H LEU A 79 18.284 11.702 -10.171 1.00 0.00 H new ATOM 0 HA LEU A 79 20.619 10.823 -8.558 1.00 0.00 H new ATOM 0 HB2 LEU A 79 19.274 9.233 -10.753 1.00 0.00 H new ATOM 0 HB3 LEU A 79 20.703 8.781 -9.846 1.00 0.00 H new ATOM 0 HG LEU A 79 19.057 9.014 -7.792 1.00 0.00 H new ATOM 0 HD11 LEU A 79 16.796 8.082 -8.366 1.00 0.00 H new ATOM 0 HD12 LEU A 79 17.062 9.671 -9.122 1.00 0.00 H new ATOM 0 HD13 LEU A 79 17.212 8.187 -10.093 1.00 0.00 H new ATOM 0 HD21 LEU A 79 18.566 6.536 -8.045 1.00 0.00 H new ATOM 0 HD22 LEU A 79 19.020 6.648 -9.762 1.00 0.00 H new ATOM 0 HD23 LEU A 79 20.244 6.915 -8.498 1.00 0.00 H new ATOM 1213 N VAL A 84 20.567 19.881 -10.845 1.00 0.00 N ATOM 1214 CA VAL A 84 19.118 19.604 -10.888 1.00 0.00 C ATOM 1215 C VAL A 84 18.471 19.781 -9.510 1.00 0.00 C ATOM 1216 O VAL A 84 18.998 19.291 -8.510 1.00 0.00 O ATOM 1217 CB VAL A 84 18.882 18.172 -11.418 1.00 0.00 C ATOM 1218 CG1 VAL A 84 17.393 17.869 -11.631 1.00 0.00 C ATOM 1219 CG2 VAL A 84 19.621 17.949 -12.745 1.00 0.00 C ATOM 0 HA VAL A 84 18.650 20.322 -11.562 1.00 0.00 H new ATOM 0 HB VAL A 84 19.271 17.497 -10.655 1.00 0.00 H new ATOM 0 HG11 VAL A 84 17.279 16.851 -12.004 1.00 0.00 H new ATOM 0 HG12 VAL A 84 16.862 17.970 -10.684 1.00 0.00 H new ATOM 0 HG13 VAL A 84 16.979 18.570 -12.356 1.00 0.00 H new ATOM 0 HG21 VAL A 84 19.439 16.934 -13.097 1.00 0.00 H new ATOM 0 HG22 VAL A 84 19.259 18.661 -13.487 1.00 0.00 H new ATOM 0 HG23 VAL A 84 20.691 18.094 -12.595 1.00 0.00 H new ATOM 1229 N ASN A 85 17.313 20.457 -9.458 1.00 0.00 N ATOM 1230 CA ASN A 85 16.606 20.748 -8.197 1.00 0.00 C ATOM 1231 C ASN A 85 15.076 20.499 -8.211 1.00 0.00 C ATOM 1232 O ASN A 85 14.449 20.599 -7.160 1.00 0.00 O ATOM 1233 CB ASN A 85 16.964 22.195 -7.802 1.00 0.00 C ATOM 1234 CG ASN A 85 16.883 22.425 -6.301 1.00 0.00 C ATOM 1235 OD1 ASN A 85 16.003 23.102 -5.787 1.00 0.00 O ATOM 1236 ND2 ASN A 85 17.820 21.879 -5.553 1.00 0.00 N ATOM 0 H ASN A 85 16.839 20.818 -10.286 1.00 0.00 H new ATOM 0 HA ASN A 85 16.945 20.033 -7.448 1.00 0.00 H new ATOM 0 HB2 ASN A 85 17.972 22.424 -8.148 1.00 0.00 H new ATOM 0 HB3 ASN A 85 16.289 22.884 -8.309 1.00 0.00 H new ATOM 0 HD21 ASN A 85 17.813 22.020 -4.543 1.00 0.00 H new ATOM 0 HD22 ASN A 85 18.552 21.315 -5.984 1.00 0.00 H new ATOM 1243 N LEU A 86 14.478 20.164 -9.371 1.00 0.00 N ATOM 1244 CA LEU A 86 13.035 19.901 -9.570 1.00 0.00 C ATOM 1245 C LEU A 86 12.085 20.918 -8.877 1.00 0.00 C ATOM 1246 O LEU A 86 11.315 20.527 -8.003 1.00 0.00 O ATOM 1247 CB LEU A 86 12.709 18.434 -9.196 1.00 0.00 C ATOM 1248 CG LEU A 86 13.454 17.310 -9.921 1.00 0.00 C ATOM 1249 CD1 LEU A 86 12.846 15.973 -9.486 1.00 0.00 C ATOM 1250 CD2 LEU A 86 13.281 17.445 -11.429 1.00 0.00 C ATOM 0 H LEU A 86 15.010 20.064 -10.236 1.00 0.00 H new ATOM 0 HA LEU A 86 12.837 20.050 -10.631 1.00 0.00 H new ATOM 0 HB2 LEU A 86 12.891 18.316 -8.128 1.00 0.00 H new ATOM 0 HB3 LEU A 86 11.642 18.281 -9.356 1.00 0.00 H new ATOM 0 HG LEU A 86 14.514 17.363 -9.674 1.00 0.00 H new ATOM 0 HD11 LEU A 86 13.363 15.157 -9.991 1.00 0.00 H new ATOM 0 HD12 LEU A 86 12.954 15.858 -8.407 1.00 0.00 H new ATOM 0 HD13 LEU A 86 11.789 15.951 -9.749 1.00 0.00 H new ATOM 0 HD21 LEU A 86 13.816 16.639 -11.930 1.00 0.00 H new ATOM 0 HD22 LEU A 86 12.222 17.388 -11.680 1.00 0.00 H new ATOM 0 HD23 LEU A 86 13.681 18.405 -11.757 1.00 0.00 H new ATOM 1262 N PRO A 87 12.067 22.204 -9.288 1.00 0.00 N ATOM 1263 CA PRO A 87 11.194 23.231 -8.695 1.00 0.00 C ATOM 1264 C PRO A 87 9.672 22.945 -8.557 1.00 0.00 C ATOM 1265 O PRO A 87 9.074 23.534 -7.648 1.00 0.00 O ATOM 1266 CB PRO A 87 11.417 24.485 -9.550 1.00 0.00 C ATOM 1267 CG PRO A 87 12.843 24.315 -10.065 1.00 0.00 C ATOM 1268 CD PRO A 87 12.937 22.809 -10.291 1.00 0.00 C ATOM 0 HA PRO A 87 11.484 23.308 -7.647 1.00 0.00 H new ATOM 0 HB2 PRO A 87 10.699 24.546 -10.368 1.00 0.00 H new ATOM 0 HB3 PRO A 87 11.308 25.396 -8.962 1.00 0.00 H new ATOM 0 HG2 PRO A 87 13.011 24.874 -10.985 1.00 0.00 H new ATOM 0 HG3 PRO A 87 13.580 24.663 -9.341 1.00 0.00 H new ATOM 0 HD2 PRO A 87 12.617 22.544 -11.298 1.00 0.00 H new ATOM 0 HD3 PRO A 87 13.964 22.460 -10.181 1.00 0.00 H new ATOM 1276 N PRO A 88 9.001 22.119 -9.403 1.00 0.00 N ATOM 1277 CA PRO A 88 7.550 21.890 -9.307 1.00 0.00 C ATOM 1278 C PRO A 88 7.119 20.951 -8.153 1.00 0.00 C ATOM 1279 O PRO A 88 7.870 20.675 -7.219 1.00 0.00 O ATOM 1280 CB PRO A 88 7.127 21.354 -10.686 1.00 0.00 C ATOM 1281 CG PRO A 88 8.311 21.578 -11.616 1.00 0.00 C ATOM 1282 CD PRO A 88 9.493 21.561 -10.661 1.00 0.00 C ATOM 0 HA PRO A 88 7.045 22.822 -9.055 1.00 0.00 H new ATOM 0 HB2 PRO A 88 6.872 20.296 -10.630 1.00 0.00 H new ATOM 0 HB3 PRO A 88 6.242 21.876 -11.051 1.00 0.00 H new ATOM 0 HG2 PRO A 88 8.388 20.794 -12.370 1.00 0.00 H new ATOM 0 HG3 PRO A 88 8.234 22.526 -12.149 1.00 0.00 H new ATOM 0 HD2 PRO A 88 9.865 20.547 -10.519 1.00 0.00 H new ATOM 0 HD3 PRO A 88 10.320 22.152 -11.053 1.00 0.00 H new ATOM 1290 N GLU A 89 5.906 20.386 -8.229 1.00 0.00 N ATOM 1291 CA GLU A 89 5.373 19.398 -7.267 1.00 0.00 C ATOM 1292 C GLU A 89 6.221 18.114 -7.111 1.00 0.00 C ATOM 1293 O GLU A 89 6.024 17.332 -6.181 1.00 0.00 O ATOM 1294 CB GLU A 89 3.906 19.052 -7.586 1.00 0.00 C ATOM 1295 CG GLU A 89 3.643 18.585 -9.025 1.00 0.00 C ATOM 1296 CD GLU A 89 3.125 19.735 -9.918 1.00 0.00 C ATOM 1297 OE1 GLU A 89 3.912 20.659 -10.233 1.00 0.00 O ATOM 1298 OE2 GLU A 89 1.927 19.727 -10.295 1.00 0.00 O ATOM 0 H GLU A 89 5.249 20.605 -8.977 1.00 0.00 H new ATOM 0 HA GLU A 89 5.429 19.893 -6.297 1.00 0.00 H new ATOM 0 HB2 GLU A 89 3.577 18.270 -6.901 1.00 0.00 H new ATOM 0 HB3 GLU A 89 3.291 19.930 -7.388 1.00 0.00 H new ATOM 0 HG2 GLU A 89 4.562 18.181 -9.450 1.00 0.00 H new ATOM 0 HG3 GLU A 89 2.914 17.775 -9.016 1.00 0.00 H new ATOM 1305 N TRP A 90 7.232 17.918 -7.958 1.00 0.00 N ATOM 1306 CA TRP A 90 8.244 16.859 -7.857 1.00 0.00 C ATOM 1307 C TRP A 90 9.059 16.870 -6.551 1.00 0.00 C ATOM 1308 O TRP A 90 9.650 15.851 -6.200 1.00 0.00 O ATOM 1309 CB TRP A 90 9.133 16.945 -9.094 1.00 0.00 C ATOM 1310 CG TRP A 90 8.418 16.480 -10.323 1.00 0.00 C ATOM 1311 CD1 TRP A 90 7.680 17.239 -11.164 1.00 0.00 C ATOM 1312 CD2 TRP A 90 8.332 15.124 -10.847 1.00 0.00 C ATOM 1313 NE1 TRP A 90 7.047 16.426 -12.089 1.00 0.00 N ATOM 1314 CE2 TRP A 90 7.415 15.108 -11.935 1.00 0.00 C ATOM 1315 CE3 TRP A 90 8.985 13.918 -10.535 1.00 0.00 C ATOM 1316 CZ2 TRP A 90 7.114 13.937 -12.643 1.00 0.00 C ATOM 1317 CZ3 TRP A 90 8.754 12.756 -11.290 1.00 0.00 C ATOM 1318 CH2 TRP A 90 7.815 12.760 -12.333 1.00 0.00 C ATOM 0 H TRP A 90 7.377 18.518 -8.770 1.00 0.00 H new ATOM 0 HA TRP A 90 7.727 15.900 -7.819 1.00 0.00 H new ATOM 0 HB2 TRP A 90 9.464 17.974 -9.233 1.00 0.00 H new ATOM 0 HB3 TRP A 90 10.027 16.340 -8.942 1.00 0.00 H new ATOM 0 HD1 TRP A 90 7.597 18.315 -11.121 1.00 0.00 H new ATOM 0 HE1 TRP A 90 6.391 16.761 -12.795 1.00 0.00 H new ATOM 0 HE3 TRP A 90 9.673 13.885 -9.704 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 6.357 13.939 -13.413 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 9.303 11.853 -11.066 1.00 0.00 H new ATOM 0 HH2 TRP A 90 7.631 11.858 -12.897 1.00 0.00 H new ATOM 1329 N VAL A 91 9.046 17.977 -5.799 1.00 0.00 N ATOM 1330 CA VAL A 91 9.678 18.085 -4.462 1.00 0.00 C ATOM 1331 C VAL A 91 8.685 18.379 -3.330 1.00 0.00 C ATOM 1332 O VAL A 91 9.094 18.481 -2.175 1.00 0.00 O ATOM 1333 CB VAL A 91 10.853 19.086 -4.453 1.00 0.00 C ATOM 1334 CG1 VAL A 91 11.947 18.659 -5.426 1.00 0.00 C ATOM 1335 CG2 VAL A 91 10.416 20.529 -4.743 1.00 0.00 C ATOM 0 H VAL A 91 8.592 18.840 -6.099 1.00 0.00 H new ATOM 0 HA VAL A 91 10.082 17.093 -4.258 1.00 0.00 H new ATOM 0 HB VAL A 91 11.253 19.072 -3.439 1.00 0.00 H new ATOM 0 HG11 VAL A 91 12.761 19.383 -5.398 1.00 0.00 H new ATOM 0 HG12 VAL A 91 12.324 17.677 -5.141 1.00 0.00 H new ATOM 0 HG13 VAL A 91 11.538 18.612 -6.435 1.00 0.00 H new ATOM 0 HG21 VAL A 91 11.287 21.184 -4.723 1.00 0.00 H new ATOM 0 HG22 VAL A 91 9.949 20.577 -5.727 1.00 0.00 H new ATOM 0 HG23 VAL A 91 9.701 20.852 -3.986 1.00 0.00 H new ATOM 1345 N THR A 92 7.380 18.469 -3.624 1.00 0.00 N ATOM 1346 CA THR A 92 6.314 18.682 -2.618 1.00 0.00 C ATOM 1347 C THR A 92 5.679 17.371 -2.127 1.00 0.00 C ATOM 1348 O THR A 92 4.764 17.392 -1.299 1.00 0.00 O ATOM 1349 CB THR A 92 5.226 19.643 -3.118 1.00 0.00 C ATOM 1350 OG1 THR A 92 4.497 19.041 -4.166 1.00 0.00 O ATOM 1351 CG2 THR A 92 5.800 20.960 -3.648 1.00 0.00 C ATOM 0 H THR A 92 7.024 18.396 -4.577 1.00 0.00 H new ATOM 0 HA THR A 92 6.814 19.143 -1.766 1.00 0.00 H new ATOM 0 HB THR A 92 4.589 19.859 -2.261 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.098 18.488 -4.707 1.00 0.00 H new ATOM 0 HG21 THR A 92 4.986 21.601 -3.988 1.00 0.00 H new ATOM 0 HG22 THR A 92 6.350 21.463 -2.853 1.00 0.00 H new ATOM 0 HG23 THR A 92 6.473 20.755 -4.481 1.00 0.00 H new ATOM 1359 N GLN A 93 6.171 16.221 -2.611 1.00 0.00 N ATOM 1360 CA GLN A 93 5.751 14.891 -2.164 1.00 0.00 C ATOM 1361 C GLN A 93 6.268 14.566 -0.748 1.00 0.00 C ATOM 1362 O GLN A 93 7.015 15.338 -0.142 1.00 0.00 O ATOM 1363 CB GLN A 93 6.165 13.832 -3.204 1.00 0.00 C ATOM 1364 CG GLN A 93 5.647 14.117 -4.627 1.00 0.00 C ATOM 1365 CD GLN A 93 4.183 14.575 -4.656 1.00 0.00 C ATOM 1366 OE1 GLN A 93 3.279 13.941 -4.124 1.00 0.00 O ATOM 1367 NE2 GLN A 93 3.905 15.741 -5.205 1.00 0.00 N ATOM 0 H GLN A 93 6.886 16.192 -3.338 1.00 0.00 H new ATOM 0 HA GLN A 93 4.664 14.879 -2.088 1.00 0.00 H new ATOM 0 HB2 GLN A 93 7.253 13.769 -3.230 1.00 0.00 H new ATOM 0 HB3 GLN A 93 5.797 12.858 -2.882 1.00 0.00 H new ATOM 0 HG2 GLN A 93 6.270 14.884 -5.087 1.00 0.00 H new ATOM 0 HG3 GLN A 93 5.751 13.216 -5.232 1.00 0.00 H new ATOM 0 HE21 GLN A 93 4.644 16.283 -5.652 1.00 0.00 H new ATOM 0 HE22 GLN A 93 2.951 16.101 -5.182 1.00 0.00 H new ATOM 1376 N GLU A 94 5.858 13.417 -0.206 1.00 0.00 N ATOM 1377 CA GLU A 94 6.085 13.064 1.207 1.00 0.00 C ATOM 1378 C GLU A 94 7.578 12.922 1.562 1.00 0.00 C ATOM 1379 O GLU A 94 7.992 13.356 2.642 1.00 0.00 O ATOM 1380 CB GLU A 94 5.270 11.810 1.561 1.00 0.00 C ATOM 1381 CG GLU A 94 5.442 11.381 3.019 1.00 0.00 C ATOM 1382 CD GLU A 94 4.417 10.293 3.385 1.00 0.00 C ATOM 1383 OE1 GLU A 94 4.526 9.161 2.862 1.00 0.00 O ATOM 1384 OE2 GLU A 94 3.488 10.562 4.185 1.00 0.00 O ATOM 0 H GLU A 94 5.358 12.700 -0.731 1.00 0.00 H new ATOM 0 HA GLU A 94 5.733 13.891 1.823 1.00 0.00 H new ATOM 0 HB2 GLU A 94 4.215 12.001 1.366 1.00 0.00 H new ATOM 0 HB3 GLU A 94 5.571 10.991 0.908 1.00 0.00 H new ATOM 0 HG2 GLU A 94 6.453 11.005 3.177 1.00 0.00 H new ATOM 0 HG3 GLU A 94 5.317 12.242 3.675 1.00 0.00 H new ATOM 1391 N ILE A 95 8.397 12.389 0.647 1.00 0.00 N ATOM 1392 CA ILE A 95 9.865 12.380 0.761 1.00 0.00 C ATOM 1393 C ILE A 95 10.512 12.733 -0.588 1.00 0.00 C ATOM 1394 O ILE A 95 10.099 12.232 -1.636 1.00 0.00 O ATOM 1395 CB ILE A 95 10.396 11.015 1.284 1.00 0.00 C ATOM 1396 CG1 ILE A 95 9.727 10.588 2.608 1.00 0.00 C ATOM 1397 CG2 ILE A 95 11.932 11.037 1.431 1.00 0.00 C ATOM 1398 CD1 ILE A 95 10.225 9.250 3.169 1.00 0.00 C ATOM 0 H ILE A 95 8.056 11.945 -0.206 1.00 0.00 H new ATOM 0 HA ILE A 95 10.142 13.139 1.492 1.00 0.00 H new ATOM 0 HB ILE A 95 10.129 10.269 0.536 1.00 0.00 H new ATOM 0 HG12 ILE A 95 9.896 11.365 3.353 1.00 0.00 H new ATOM 0 HG13 ILE A 95 8.650 10.524 2.452 1.00 0.00 H new ATOM 0 HG21 ILE A 95 12.276 10.070 1.798 1.00 0.00 H new ATOM 0 HG22 ILE A 95 12.387 11.240 0.462 1.00 0.00 H new ATOM 0 HG23 ILE A 95 12.219 11.816 2.137 1.00 0.00 H new ATOM 0 HD11 ILE A 95 9.702 9.028 4.099 1.00 0.00 H new ATOM 0 HD12 ILE A 95 10.031 8.458 2.446 1.00 0.00 H new ATOM 0 HD13 ILE A 95 11.296 9.312 3.361 1.00 0.00 H new ATOM 1410 N PHE A 96 11.555 13.566 -0.542 1.00 0.00 N ATOM 1411 CA PHE A 96 12.448 13.834 -1.670 1.00 0.00 C ATOM 1412 C PHE A 96 13.907 13.633 -1.229 1.00 0.00 C ATOM 1413 O PHE A 96 14.312 14.128 -0.172 1.00 0.00 O ATOM 1414 CB PHE A 96 12.202 15.217 -2.289 1.00 0.00 C ATOM 1415 CG PHE A 96 13.190 15.541 -3.403 1.00 0.00 C ATOM 1416 CD1 PHE A 96 12.961 15.106 -4.726 1.00 0.00 C ATOM 1417 CD2 PHE A 96 14.384 16.226 -3.099 1.00 0.00 C ATOM 1418 CE1 PHE A 96 13.933 15.328 -5.718 1.00 0.00 C ATOM 1419 CE2 PHE A 96 15.343 16.468 -4.095 1.00 0.00 C ATOM 1420 CZ PHE A 96 15.119 16.015 -5.405 1.00 0.00 C ATOM 0 H PHE A 96 11.807 14.084 0.300 1.00 0.00 H new ATOM 0 HA PHE A 96 12.231 13.121 -2.465 1.00 0.00 H new ATOM 0 HB2 PHE A 96 11.187 15.259 -2.684 1.00 0.00 H new ATOM 0 HB3 PHE A 96 12.274 15.978 -1.512 1.00 0.00 H new ATOM 0 HD1 PHE A 96 12.039 14.602 -4.977 1.00 0.00 H new ATOM 0 HD2 PHE A 96 14.563 16.568 -2.090 1.00 0.00 H new ATOM 0 HE1 PHE A 96 13.768 14.970 -6.723 1.00 0.00 H new ATOM 0 HE2 PHE A 96 16.251 17.001 -3.854 1.00 0.00 H new ATOM 0 HZ PHE A 96 15.858 16.194 -6.172 1.00 0.00 H new ATOM 1430 N GLU A 97 14.698 12.918 -2.034 1.00 0.00 N ATOM 1431 CA GLU A 97 16.143 12.719 -1.822 1.00 0.00 C ATOM 1432 C GLU A 97 16.926 12.897 -3.132 1.00 0.00 C ATOM 1433 O GLU A 97 16.421 12.586 -4.213 1.00 0.00 O ATOM 1434 CB GLU A 97 16.449 11.327 -1.233 1.00 0.00 C ATOM 1435 CG GLU A 97 15.819 11.030 0.141 1.00 0.00 C ATOM 1436 CD GLU A 97 16.293 9.697 0.765 1.00 0.00 C ATOM 1437 OE1 GLU A 97 17.274 9.089 0.269 1.00 0.00 O ATOM 1438 OE2 GLU A 97 15.700 9.263 1.786 1.00 0.00 O ATOM 0 H GLU A 97 14.349 12.450 -2.870 1.00 0.00 H new ATOM 0 HA GLU A 97 16.460 13.478 -1.107 1.00 0.00 H new ATOM 0 HB2 GLU A 97 16.108 10.571 -1.940 1.00 0.00 H new ATOM 0 HB3 GLU A 97 17.530 11.219 -1.148 1.00 0.00 H new ATOM 0 HG2 GLU A 97 16.056 11.846 0.824 1.00 0.00 H new ATOM 0 HG3 GLU A 97 14.734 11.007 0.037 1.00 0.00 H new ATOM 1445 N ASP A 98 18.184 13.341 -3.045 1.00 0.00 N ATOM 1446 CA ASP A 98 19.101 13.434 -4.187 1.00 0.00 C ATOM 1447 C ASP A 98 20.363 12.576 -3.973 1.00 0.00 C ATOM 1448 O ASP A 98 21.185 12.831 -3.092 1.00 0.00 O ATOM 1449 CB ASP A 98 19.377 14.900 -4.558 1.00 0.00 C ATOM 1450 CG ASP A 98 20.269 15.662 -3.558 1.00 0.00 C ATOM 1451 OD1 ASP A 98 19.851 15.884 -2.395 1.00 0.00 O ATOM 1452 OD2 ASP A 98 21.370 16.106 -3.967 1.00 0.00 O ATOM 0 H ASP A 98 18.600 13.651 -2.167 1.00 0.00 H new ATOM 0 HA ASP A 98 18.617 13.002 -5.063 1.00 0.00 H new ATOM 0 HB2 ASP A 98 19.849 14.929 -5.540 1.00 0.00 H new ATOM 0 HB3 ASP A 98 18.425 15.423 -4.646 1.00 0.00 H new ATOM 1457 N TRP A 99 20.497 11.519 -4.780 1.00 0.00 N ATOM 1458 CA TRP A 99 21.550 10.500 -4.702 1.00 0.00 C ATOM 1459 C TRP A 99 22.630 10.786 -5.748 1.00 0.00 C ATOM 1460 O TRP A 99 22.663 10.191 -6.828 1.00 0.00 O ATOM 1461 CB TRP A 99 20.936 9.099 -4.861 1.00 0.00 C ATOM 1462 CG TRP A 99 19.808 8.704 -3.954 1.00 0.00 C ATOM 1463 CD1 TRP A 99 19.436 9.300 -2.795 1.00 0.00 C ATOM 1464 CD2 TRP A 99 18.887 7.586 -4.133 1.00 0.00 C ATOM 1465 NE1 TRP A 99 18.336 8.647 -2.272 1.00 0.00 N ATOM 1466 CE2 TRP A 99 17.943 7.598 -3.067 1.00 0.00 C ATOM 1467 CE3 TRP A 99 18.770 6.553 -5.085 1.00 0.00 C ATOM 1468 CZ2 TRP A 99 16.937 6.631 -2.948 1.00 0.00 C ATOM 1469 CZ3 TRP A 99 17.747 5.590 -4.993 1.00 0.00 C ATOM 1470 CH2 TRP A 99 16.837 5.620 -3.919 1.00 0.00 C ATOM 0 H TRP A 99 19.843 11.342 -5.542 1.00 0.00 H new ATOM 0 HA TRP A 99 22.029 10.535 -3.723 1.00 0.00 H new ATOM 0 HB2 TRP A 99 20.583 9.006 -5.888 1.00 0.00 H new ATOM 0 HB3 TRP A 99 21.736 8.370 -4.732 1.00 0.00 H new ATOM 0 HD1 TRP A 99 19.924 10.154 -2.349 1.00 0.00 H new ATOM 0 HE1 TRP A 99 17.873 8.911 -1.403 1.00 0.00 H new ATOM 0 HE3 TRP A 99 19.477 6.499 -5.899 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 16.246 6.662 -2.119 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 17.660 4.825 -5.750 1.00 0.00 H new ATOM 0 HH2 TRP A 99 16.065 4.869 -3.842 1.00 0.00 H new ATOM 1481 N GLN A 100 23.498 11.747 -5.445 1.00 0.00 N ATOM 1482 CA GLN A 100 24.566 12.172 -6.351 1.00 0.00 C ATOM 1483 C GLN A 100 25.687 11.111 -6.394 1.00 0.00 C ATOM 1484 O GLN A 100 26.308 10.815 -5.371 1.00 0.00 O ATOM 1485 CB GLN A 100 25.094 13.554 -5.919 1.00 0.00 C ATOM 1486 CG GLN A 100 23.989 14.625 -5.825 1.00 0.00 C ATOM 1487 CD GLN A 100 24.517 16.060 -5.734 1.00 0.00 C ATOM 1488 OE1 GLN A 100 25.607 16.399 -6.176 1.00 0.00 O ATOM 1489 NE2 GLN A 100 23.742 16.975 -5.196 1.00 0.00 N ATOM 0 H GLN A 100 23.482 12.256 -4.561 1.00 0.00 H new ATOM 0 HA GLN A 100 24.172 12.266 -7.363 1.00 0.00 H new ATOM 0 HB2 GLN A 100 25.585 13.462 -4.950 1.00 0.00 H new ATOM 0 HB3 GLN A 100 25.852 13.884 -6.630 1.00 0.00 H new ATOM 0 HG2 GLN A 100 23.342 14.542 -6.698 1.00 0.00 H new ATOM 0 HG3 GLN A 100 23.372 14.420 -4.950 1.00 0.00 H new ATOM 0 HE21 GLN A 100 22.830 16.715 -4.822 1.00 0.00 H new ATOM 0 HE22 GLN A 100 24.053 17.946 -5.153 1.00 0.00 H new ATOM 1498 N LEU A 101 25.941 10.540 -7.579 1.00 0.00 N ATOM 1499 CA LEU A 101 26.991 9.549 -7.866 1.00 0.00 C ATOM 1500 C LEU A 101 27.720 9.913 -9.179 1.00 0.00 C ATOM 1501 O LEU A 101 27.275 10.793 -9.918 1.00 0.00 O ATOM 1502 CB LEU A 101 26.364 8.133 -7.942 1.00 0.00 C ATOM 1503 CG LEU A 101 25.798 7.530 -6.636 1.00 0.00 C ATOM 1504 CD1 LEU A 101 25.220 6.151 -6.939 1.00 0.00 C ATOM 1505 CD2 LEU A 101 26.853 7.354 -5.545 1.00 0.00 C ATOM 0 H LEU A 101 25.392 10.768 -8.408 1.00 0.00 H new ATOM 0 HA LEU A 101 27.728 9.554 -7.063 1.00 0.00 H new ATOM 0 HB2 LEU A 101 25.558 8.161 -8.676 1.00 0.00 H new ATOM 0 HB3 LEU A 101 27.122 7.450 -8.327 1.00 0.00 H new ATOM 0 HG LEU A 101 25.045 8.228 -6.270 1.00 0.00 H new ATOM 0 HD11 LEU A 101 24.818 5.716 -6.024 1.00 0.00 H new ATOM 0 HD12 LEU A 101 24.423 6.245 -7.677 1.00 0.00 H new ATOM 0 HD13 LEU A 101 26.005 5.506 -7.333 1.00 0.00 H new ATOM 0 HD21 LEU A 101 26.389 6.927 -4.656 1.00 0.00 H new ATOM 0 HD22 LEU A 101 27.637 6.686 -5.902 1.00 0.00 H new ATOM 0 HD23 LEU A 101 27.286 8.323 -5.298 1.00 0.00 H new ATOM 1517 N GLU A 102 28.821 9.222 -9.498 1.00 0.00 N ATOM 1518 CA GLU A 102 29.570 9.415 -10.750 1.00 0.00 C ATOM 1519 C GLU A 102 28.786 8.945 -11.982 1.00 0.00 C ATOM 1520 O GLU A 102 27.647 8.484 -11.882 1.00 0.00 O ATOM 1521 CB GLU A 102 30.970 8.789 -10.645 1.00 0.00 C ATOM 1522 CG GLU A 102 30.996 7.263 -10.493 1.00 0.00 C ATOM 1523 CD GLU A 102 32.418 6.764 -10.161 1.00 0.00 C ATOM 1524 OE1 GLU A 102 33.374 7.080 -10.913 1.00 0.00 O ATOM 1525 OE2 GLU A 102 32.586 6.052 -9.141 1.00 0.00 O ATOM 0 H GLU A 102 29.222 8.507 -8.891 1.00 0.00 H new ATOM 0 HA GLU A 102 29.709 10.486 -10.897 1.00 0.00 H new ATOM 0 HB2 GLU A 102 31.538 9.059 -11.535 1.00 0.00 H new ATOM 0 HB3 GLU A 102 31.485 9.231 -9.792 1.00 0.00 H new ATOM 0 HG2 GLU A 102 30.307 6.961 -9.704 1.00 0.00 H new ATOM 0 HG3 GLU A 102 30.649 6.796 -11.415 1.00 0.00 H new ATOM 1532 N ASP A 103 29.358 9.122 -13.171 1.00 0.00 N ATOM 1533 CA ASP A 103 28.678 8.936 -14.461 1.00 0.00 C ATOM 1534 C ASP A 103 29.322 7.814 -15.311 1.00 0.00 C ATOM 1535 O ASP A 103 30.352 8.060 -15.946 1.00 0.00 O ATOM 1536 CB ASP A 103 28.607 10.306 -15.162 1.00 0.00 C ATOM 1537 CG ASP A 103 27.362 10.425 -16.050 1.00 0.00 C ATOM 1538 OD1 ASP A 103 27.284 9.741 -17.095 1.00 0.00 O ATOM 1539 OD2 ASP A 103 26.441 11.187 -15.657 1.00 0.00 O ATOM 0 H ASP A 103 30.332 9.406 -13.272 1.00 0.00 H new ATOM 0 HA ASP A 103 27.659 8.580 -14.306 1.00 0.00 H new ATOM 0 HB2 ASP A 103 28.597 11.098 -14.413 1.00 0.00 H new ATOM 0 HB3 ASP A 103 29.501 10.452 -15.768 1.00 0.00 H new ATOM 1544 N PRO A 104 28.767 6.577 -15.307 1.00 0.00 N ATOM 1545 CA PRO A 104 29.408 5.389 -15.899 1.00 0.00 C ATOM 1546 C PRO A 104 29.502 5.330 -17.432 1.00 0.00 C ATOM 1547 O PRO A 104 30.264 4.518 -17.954 1.00 0.00 O ATOM 1548 CB PRO A 104 28.612 4.194 -15.376 1.00 0.00 C ATOM 1549 CG PRO A 104 28.004 4.692 -14.076 1.00 0.00 C ATOM 1550 CD PRO A 104 27.676 6.130 -14.441 1.00 0.00 C ATOM 0 HA PRO A 104 30.457 5.406 -15.602 1.00 0.00 H new ATOM 0 HB2 PRO A 104 27.842 3.888 -16.084 1.00 0.00 H new ATOM 0 HB3 PRO A 104 29.255 3.329 -15.210 1.00 0.00 H new ATOM 0 HG2 PRO A 104 27.117 4.126 -13.792 1.00 0.00 H new ATOM 0 HG3 PRO A 104 28.703 4.627 -13.242 1.00 0.00 H new ATOM 0 HD2 PRO A 104 26.717 6.195 -14.955 1.00 0.00 H new ATOM 0 HD3 PRO A 104 27.603 6.753 -13.550 1.00 0.00 H new ATOM 1558 N ASP A 105 28.761 6.160 -18.170 1.00 0.00 N ATOM 1559 CA ASP A 105 28.732 6.129 -19.640 1.00 0.00 C ATOM 1560 C ASP A 105 30.134 6.321 -20.256 1.00 0.00 C ATOM 1561 O ASP A 105 30.739 7.394 -20.151 1.00 0.00 O ATOM 1562 CB ASP A 105 27.755 7.192 -20.165 1.00 0.00 C ATOM 1563 CG ASP A 105 27.820 7.350 -21.700 1.00 0.00 C ATOM 1564 OD1 ASP A 105 28.006 6.338 -22.417 1.00 0.00 O ATOM 1565 OD2 ASP A 105 27.673 8.494 -22.195 1.00 0.00 O ATOM 0 H ASP A 105 28.160 6.878 -17.765 1.00 0.00 H new ATOM 0 HA ASP A 105 28.387 5.141 -19.945 1.00 0.00 H new ATOM 0 HB2 ASP A 105 26.740 6.923 -19.874 1.00 0.00 H new ATOM 0 HB3 ASP A 105 27.978 8.150 -19.695 1.00 0.00 H new ATOM 1570 N GLY A 106 30.647 5.272 -20.912 1.00 0.00 N ATOM 1571 CA GLY A 106 31.959 5.280 -21.567 1.00 0.00 C ATOM 1572 C GLY A 106 33.143 5.159 -20.597 1.00 0.00 C ATOM 1573 O GLY A 106 34.279 5.443 -20.985 1.00 0.00 O ATOM 0 H GLY A 106 30.155 4.383 -21.003 1.00 0.00 H new ATOM 0 HA2 GLY A 106 32.002 4.457 -22.281 1.00 0.00 H new ATOM 0 HA3 GLY A 106 32.063 6.203 -22.138 1.00 0.00 H new ATOM 1577 N GLN A 107 32.888 4.757 -19.345 1.00 0.00 N ATOM 1578 CA GLN A 107 33.914 4.549 -18.318 1.00 0.00 C ATOM 1579 C GLN A 107 34.461 3.107 -18.376 1.00 0.00 C ATOM 1580 O GLN A 107 35.207 2.755 -19.295 1.00 0.00 O ATOM 1581 CB GLN A 107 33.395 4.950 -16.918 1.00 0.00 C ATOM 1582 CG GLN A 107 32.784 6.347 -16.780 1.00 0.00 C ATOM 1583 CD GLN A 107 33.722 7.536 -16.945 1.00 0.00 C ATOM 1584 OE1 GLN A 107 34.921 7.430 -17.175 1.00 0.00 O ATOM 1585 NE2 GLN A 107 33.183 8.728 -16.808 1.00 0.00 N ATOM 0 H GLN A 107 31.943 4.564 -19.012 1.00 0.00 H new ATOM 0 HA GLN A 107 34.757 5.209 -18.525 1.00 0.00 H new ATOM 0 HB2 GLN A 107 32.645 4.220 -16.612 1.00 0.00 H new ATOM 0 HB3 GLN A 107 34.223 4.871 -16.214 1.00 0.00 H new ATOM 0 HG2 GLN A 107 31.986 6.441 -17.517 1.00 0.00 H new ATOM 0 HG3 GLN A 107 32.319 6.417 -15.796 1.00 0.00 H new ATOM 0 HE21 GLN A 107 32.185 8.818 -16.617 1.00 0.00 H new ATOM 0 HE22 GLN A 107 33.763 9.563 -16.893 1.00 0.00 H new ATOM 1594 N SER A 108 34.062 2.272 -17.409 1.00 0.00 N ATOM 1595 CA SER A 108 34.499 0.883 -17.205 1.00 0.00 C ATOM 1596 C SER A 108 33.409 0.113 -16.460 1.00 0.00 C ATOM 1597 O SER A 108 32.642 0.709 -15.701 1.00 0.00 O ATOM 1598 CB SER A 108 35.791 0.833 -16.363 1.00 0.00 C ATOM 1599 OG SER A 108 36.885 1.457 -17.022 1.00 0.00 O ATOM 0 H SER A 108 33.384 2.564 -16.705 1.00 0.00 H new ATOM 0 HA SER A 108 34.688 0.437 -18.181 1.00 0.00 H new ATOM 0 HB2 SER A 108 35.618 1.324 -15.405 1.00 0.00 H new ATOM 0 HB3 SER A 108 36.043 -0.206 -16.148 1.00 0.00 H new ATOM 0 HG SER A 108 37.682 1.405 -16.454 1.00 0.00 H new ATOM 1605 N LEU A 109 33.371 -1.216 -16.584 1.00 0.00 N ATOM 1606 CA LEU A 109 32.372 -2.047 -15.885 1.00 0.00 C ATOM 1607 C LEU A 109 32.498 -1.947 -14.362 1.00 0.00 C ATOM 1608 O LEU A 109 31.500 -1.895 -13.658 1.00 0.00 O ATOM 1609 CB LEU A 109 32.496 -3.509 -16.342 1.00 0.00 C ATOM 1610 CG LEU A 109 32.334 -3.739 -17.855 1.00 0.00 C ATOM 1611 CD1 LEU A 109 32.386 -5.241 -18.114 1.00 0.00 C ATOM 1612 CD2 LEU A 109 31.032 -3.163 -18.411 1.00 0.00 C ATOM 0 H LEU A 109 34.021 -1.747 -17.163 1.00 0.00 H new ATOM 0 HA LEU A 109 31.385 -1.667 -16.148 1.00 0.00 H new ATOM 0 HB2 LEU A 109 33.471 -3.887 -16.036 1.00 0.00 H new ATOM 0 HB3 LEU A 109 31.746 -4.101 -15.818 1.00 0.00 H new ATOM 0 HG LEU A 109 33.144 -3.218 -18.366 1.00 0.00 H new ATOM 0 HD11 LEU A 109 32.273 -5.430 -19.181 1.00 0.00 H new ATOM 0 HD12 LEU A 109 33.344 -5.636 -17.775 1.00 0.00 H new ATOM 0 HD13 LEU A 109 31.578 -5.732 -17.571 1.00 0.00 H new ATOM 0 HD21 LEU A 109 30.976 -3.357 -19.482 1.00 0.00 H new ATOM 0 HD22 LEU A 109 30.184 -3.633 -17.913 1.00 0.00 H new ATOM 0 HD23 LEU A 109 31.006 -2.088 -18.235 1.00 0.00 H new ATOM 1624 N GLU A 110 33.721 -1.806 -13.855 1.00 0.00 N ATOM 1625 CA GLU A 110 33.987 -1.533 -12.429 1.00 0.00 C ATOM 1626 C GLU A 110 33.319 -0.248 -11.954 1.00 0.00 C ATOM 1627 O GLU A 110 32.791 -0.190 -10.845 1.00 0.00 O ATOM 1628 CB GLU A 110 35.496 -1.400 -12.170 1.00 0.00 C ATOM 1629 CG GLU A 110 36.238 -2.639 -12.649 1.00 0.00 C ATOM 1630 CD GLU A 110 37.720 -2.617 -12.230 1.00 0.00 C ATOM 1631 OE1 GLU A 110 38.565 -2.074 -12.985 1.00 0.00 O ATOM 1632 OE2 GLU A 110 38.056 -3.152 -11.144 1.00 0.00 O ATOM 0 H GLU A 110 34.567 -1.877 -14.420 1.00 0.00 H new ATOM 0 HA GLU A 110 33.575 -2.378 -11.878 1.00 0.00 H new ATOM 0 HB2 GLU A 110 35.881 -0.519 -12.683 1.00 0.00 H new ATOM 0 HB3 GLU A 110 35.675 -1.252 -11.105 1.00 0.00 H new ATOM 0 HG2 GLU A 110 35.759 -3.529 -12.242 1.00 0.00 H new ATOM 0 HG3 GLU A 110 36.168 -2.707 -13.735 1.00 0.00 H new ATOM 1639 N VAL A 111 33.287 0.777 -12.808 1.00 0.00 N ATOM 1640 CA VAL A 111 32.654 2.053 -12.474 1.00 0.00 C ATOM 1641 C VAL A 111 31.131 1.920 -12.505 1.00 0.00 C ATOM 1642 O VAL A 111 30.459 2.421 -11.603 1.00 0.00 O ATOM 1643 CB VAL A 111 33.162 3.176 -13.393 1.00 0.00 C ATOM 1644 CG1 VAL A 111 32.374 4.480 -13.240 1.00 0.00 C ATOM 1645 CG2 VAL A 111 34.634 3.471 -13.086 1.00 0.00 C ATOM 0 H VAL A 111 33.695 0.747 -13.742 1.00 0.00 H new ATOM 0 HA VAL A 111 32.934 2.328 -11.457 1.00 0.00 H new ATOM 0 HB VAL A 111 33.031 2.819 -14.415 1.00 0.00 H new ATOM 0 HG11 VAL A 111 32.781 5.233 -13.915 1.00 0.00 H new ATOM 0 HG12 VAL A 111 31.326 4.303 -13.484 1.00 0.00 H new ATOM 0 HG13 VAL A 111 32.453 4.834 -12.212 1.00 0.00 H new ATOM 0 HG21 VAL A 111 34.989 4.267 -13.740 1.00 0.00 H new ATOM 0 HG22 VAL A 111 34.733 3.783 -12.046 1.00 0.00 H new ATOM 0 HG23 VAL A 111 35.228 2.572 -13.253 1.00 0.00 H new ATOM 1655 N PHE A 112 30.581 1.161 -13.462 1.00 0.00 N ATOM 1656 CA PHE A 112 29.153 0.812 -13.442 1.00 0.00 C ATOM 1657 C PHE A 112 28.788 0.030 -12.173 1.00 0.00 C ATOM 1658 O PHE A 112 27.841 0.400 -11.491 1.00 0.00 O ATOM 1659 CB PHE A 112 28.776 -0.011 -14.677 1.00 0.00 C ATOM 1660 CG PHE A 112 28.350 0.775 -15.896 1.00 0.00 C ATOM 1661 CD1 PHE A 112 27.005 1.164 -16.033 1.00 0.00 C ATOM 1662 CD2 PHE A 112 29.277 1.087 -16.907 1.00 0.00 C ATOM 1663 CE1 PHE A 112 26.583 1.858 -17.179 1.00 0.00 C ATOM 1664 CE2 PHE A 112 28.858 1.792 -18.048 1.00 0.00 C ATOM 1665 CZ PHE A 112 27.515 2.189 -18.175 1.00 0.00 C ATOM 0 H PHE A 112 31.098 0.779 -14.254 1.00 0.00 H new ATOM 0 HA PHE A 112 28.591 1.746 -13.450 1.00 0.00 H new ATOM 0 HB2 PHE A 112 29.630 -0.631 -14.950 1.00 0.00 H new ATOM 0 HB3 PHE A 112 27.966 -0.687 -14.404 1.00 0.00 H new ATOM 0 HD1 PHE A 112 26.295 0.928 -15.254 1.00 0.00 H new ATOM 0 HD2 PHE A 112 30.309 0.785 -16.806 1.00 0.00 H new ATOM 0 HE1 PHE A 112 25.546 2.136 -17.293 1.00 0.00 H new ATOM 0 HE2 PHE A 112 29.567 2.029 -18.827 1.00 0.00 H new ATOM 0 HZ PHE A 112 27.200 2.751 -19.042 1.00 0.00 H new ATOM 1675 N ARG A 113 29.573 -0.988 -11.800 1.00 0.00 N ATOM 1676 CA ARG A 113 29.392 -1.793 -10.570 1.00 0.00 C ATOM 1677 C ARG A 113 29.480 -0.937 -9.300 1.00 0.00 C ATOM 1678 O ARG A 113 28.659 -1.089 -8.397 1.00 0.00 O ATOM 1679 CB ARG A 113 30.443 -2.921 -10.563 1.00 0.00 C ATOM 1680 CG ARG A 113 30.132 -3.996 -11.621 1.00 0.00 C ATOM 1681 CD ARG A 113 31.315 -4.910 -11.955 1.00 0.00 C ATOM 1682 NE ARG A 113 31.834 -5.622 -10.767 1.00 0.00 N ATOM 1683 CZ ARG A 113 31.582 -6.865 -10.397 1.00 0.00 C ATOM 1684 NH1 ARG A 113 30.712 -7.622 -11.000 1.00 0.00 N ATOM 1685 NH2 ARG A 113 32.209 -7.382 -9.379 1.00 0.00 N ATOM 0 H ARG A 113 30.375 -1.288 -12.355 1.00 0.00 H new ATOM 0 HA ARG A 113 28.390 -2.223 -10.572 1.00 0.00 H new ATOM 0 HB2 ARG A 113 31.430 -2.500 -10.752 1.00 0.00 H new ATOM 0 HB3 ARG A 113 30.476 -3.381 -9.575 1.00 0.00 H new ATOM 0 HG2 ARG A 113 29.303 -4.609 -11.267 1.00 0.00 H new ATOM 0 HG3 ARG A 113 29.798 -3.504 -12.535 1.00 0.00 H new ATOM 0 HD2 ARG A 113 31.007 -5.638 -12.705 1.00 0.00 H new ATOM 0 HD3 ARG A 113 32.115 -4.316 -12.397 1.00 0.00 H new ATOM 0 HE ARG A 113 32.460 -5.091 -10.162 1.00 0.00 H new ATOM 0 HH11 ARG A 113 30.188 -7.261 -11.797 1.00 0.00 H new ATOM 0 HH12 ARG A 113 30.554 -8.576 -10.675 1.00 0.00 H new ATOM 0 HH21 ARG A 113 32.895 -6.827 -8.867 1.00 0.00 H new ATOM 0 HH22 ARG A 113 32.014 -8.342 -9.094 1.00 0.00 H new ATOM 1699 N THR A 114 30.404 0.027 -9.280 1.00 0.00 N ATOM 1700 CA THR A 114 30.587 0.991 -8.174 1.00 0.00 C ATOM 1701 C THR A 114 29.368 1.907 -7.999 1.00 0.00 C ATOM 1702 O THR A 114 28.962 2.184 -6.870 1.00 0.00 O ATOM 1703 CB THR A 114 31.866 1.822 -8.402 1.00 0.00 C ATOM 1704 OG1 THR A 114 33.000 0.980 -8.361 1.00 0.00 O ATOM 1705 CG2 THR A 114 32.077 2.890 -7.332 1.00 0.00 C ATOM 0 H THR A 114 31.064 0.168 -10.045 1.00 0.00 H new ATOM 0 HA THR A 114 30.692 0.420 -7.251 1.00 0.00 H new ATOM 0 HB THR A 114 31.743 2.303 -9.372 1.00 0.00 H new ATOM 0 HG1 THR A 114 33.066 0.478 -9.200 1.00 0.00 H new ATOM 0 HG21 THR A 114 32.992 3.443 -7.545 1.00 0.00 H new ATOM 0 HG22 THR A 114 31.230 3.577 -7.331 1.00 0.00 H new ATOM 0 HG23 THR A 114 32.159 2.415 -6.355 1.00 0.00 H new ATOM 1713 N VAL A 115 28.742 2.343 -9.097 1.00 0.00 N ATOM 1714 CA VAL A 115 27.473 3.100 -9.055 1.00 0.00 C ATOM 1715 C VAL A 115 26.294 2.188 -8.685 1.00 0.00 C ATOM 1716 O VAL A 115 25.576 2.489 -7.734 1.00 0.00 O ATOM 1717 CB VAL A 115 27.275 3.880 -10.373 1.00 0.00 C ATOM 1718 CG1 VAL A 115 25.874 4.482 -10.534 1.00 0.00 C ATOM 1719 CG2 VAL A 115 28.279 5.037 -10.419 1.00 0.00 C ATOM 0 H VAL A 115 29.095 2.185 -10.041 1.00 0.00 H new ATOM 0 HA VAL A 115 27.519 3.845 -8.260 1.00 0.00 H new ATOM 0 HB VAL A 115 27.421 3.160 -11.178 1.00 0.00 H new ATOM 0 HG11 VAL A 115 25.813 5.014 -11.484 1.00 0.00 H new ATOM 0 HG12 VAL A 115 25.131 3.685 -10.517 1.00 0.00 H new ATOM 0 HG13 VAL A 115 25.680 5.176 -9.716 1.00 0.00 H new ATOM 0 HG21 VAL A 115 28.148 5.595 -11.346 1.00 0.00 H new ATOM 0 HG22 VAL A 115 28.110 5.699 -9.570 1.00 0.00 H new ATOM 0 HG23 VAL A 115 29.293 4.641 -10.374 1.00 0.00 H new ATOM 1729 N ARG A 116 26.141 1.040 -9.363 1.00 0.00 N ATOM 1730 CA ARG A 116 25.078 0.028 -9.160 1.00 0.00 C ATOM 1731 C ARG A 116 24.877 -0.307 -7.680 1.00 0.00 C ATOM 1732 O ARG A 116 23.767 -0.182 -7.183 1.00 0.00 O ATOM 1733 CB ARG A 116 25.435 -1.225 -9.999 1.00 0.00 C ATOM 1734 CG ARG A 116 24.338 -2.307 -10.035 1.00 0.00 C ATOM 1735 CD ARG A 116 24.808 -3.632 -10.644 1.00 0.00 C ATOM 1736 NE ARG A 116 25.795 -4.319 -9.777 1.00 0.00 N ATOM 1737 CZ ARG A 116 26.685 -5.213 -10.162 1.00 0.00 C ATOM 1738 NH1 ARG A 116 26.700 -5.665 -11.378 1.00 0.00 N ATOM 1739 NH2 ARG A 116 27.580 -5.669 -9.339 1.00 0.00 N ATOM 0 H ARG A 116 26.786 0.773 -10.107 1.00 0.00 H new ATOM 0 HA ARG A 116 24.123 0.431 -9.497 1.00 0.00 H new ATOM 0 HB2 ARG A 116 25.652 -0.912 -11.020 1.00 0.00 H new ATOM 0 HB3 ARG A 116 26.348 -1.665 -9.599 1.00 0.00 H new ATOM 0 HG2 ARG A 116 23.983 -2.488 -9.020 1.00 0.00 H new ATOM 0 HG3 ARG A 116 23.489 -1.934 -10.608 1.00 0.00 H new ATOM 0 HD2 ARG A 116 23.949 -4.284 -10.803 1.00 0.00 H new ATOM 0 HD3 ARG A 116 25.252 -3.445 -11.622 1.00 0.00 H new ATOM 0 HE ARG A 116 25.785 -4.077 -8.786 1.00 0.00 H new ATOM 0 HH11 ARG A 116 26.015 -5.329 -12.055 1.00 0.00 H new ATOM 0 HH12 ARG A 116 27.396 -6.356 -11.657 1.00 0.00 H new ATOM 0 HH21 ARG A 116 27.603 -5.336 -8.375 1.00 0.00 H new ATOM 0 HH22 ARG A 116 28.260 -6.360 -9.656 1.00 0.00 H new ATOM 1753 N GLY A 117 25.951 -0.651 -6.973 1.00 0.00 N ATOM 1754 CA GLY A 117 25.912 -1.006 -5.544 1.00 0.00 C ATOM 1755 C GLY A 117 25.376 0.112 -4.646 1.00 0.00 C ATOM 1756 O GLY A 117 24.518 -0.135 -3.804 1.00 0.00 O ATOM 0 H GLY A 117 26.887 -0.694 -7.375 1.00 0.00 H new ATOM 0 HA2 GLY A 117 25.290 -1.892 -5.416 1.00 0.00 H new ATOM 0 HA3 GLY A 117 26.917 -1.272 -5.217 1.00 0.00 H new ATOM 1760 N GLN A 118 25.778 1.366 -4.879 1.00 0.00 N ATOM 1761 CA GLN A 118 25.319 2.506 -4.064 1.00 0.00 C ATOM 1762 C GLN A 118 23.855 2.871 -4.356 1.00 0.00 C ATOM 1763 O GLN A 118 23.095 3.167 -3.440 1.00 0.00 O ATOM 1764 CB GLN A 118 26.267 3.700 -4.258 1.00 0.00 C ATOM 1765 CG GLN A 118 27.653 3.418 -3.654 1.00 0.00 C ATOM 1766 CD GLN A 118 28.656 4.524 -3.972 1.00 0.00 C ATOM 1767 OE1 GLN A 118 28.840 5.473 -3.222 1.00 0.00 O ATOM 1768 NE2 GLN A 118 29.339 4.448 -5.097 1.00 0.00 N ATOM 0 H GLN A 118 26.422 1.622 -5.627 1.00 0.00 H new ATOM 0 HA GLN A 118 25.349 2.214 -3.014 1.00 0.00 H new ATOM 0 HB2 GLN A 118 26.369 3.917 -5.321 1.00 0.00 H new ATOM 0 HB3 GLN A 118 25.838 4.587 -3.791 1.00 0.00 H new ATOM 0 HG2 GLN A 118 27.562 3.312 -2.573 1.00 0.00 H new ATOM 0 HG3 GLN A 118 28.028 2.469 -4.037 1.00 0.00 H new ATOM 0 HE21 GLN A 118 29.194 3.661 -5.730 1.00 0.00 H new ATOM 0 HE22 GLN A 118 30.013 5.176 -5.335 1.00 0.00 H new ATOM 1777 N VAL A 119 23.412 2.769 -5.613 1.00 0.00 N ATOM 1778 CA VAL A 119 21.987 2.946 -5.991 1.00 0.00 C ATOM 1779 C VAL A 119 21.121 1.819 -5.400 1.00 0.00 C ATOM 1780 O VAL A 119 20.058 2.096 -4.845 1.00 0.00 O ATOM 1781 CB VAL A 119 21.797 3.061 -7.521 1.00 0.00 C ATOM 1782 CG1 VAL A 119 20.338 3.357 -7.901 1.00 0.00 C ATOM 1783 CG2 VAL A 119 22.613 4.203 -8.129 1.00 0.00 C ATOM 0 H VAL A 119 24.022 2.562 -6.404 1.00 0.00 H new ATOM 0 HA VAL A 119 21.653 3.892 -5.564 1.00 0.00 H new ATOM 0 HB VAL A 119 22.124 2.095 -7.906 1.00 0.00 H new ATOM 0 HG11 VAL A 119 20.252 3.429 -8.985 1.00 0.00 H new ATOM 0 HG12 VAL A 119 19.697 2.553 -7.539 1.00 0.00 H new ATOM 0 HG13 VAL A 119 20.028 4.299 -7.449 1.00 0.00 H new ATOM 0 HG21 VAL A 119 22.443 4.239 -9.205 1.00 0.00 H new ATOM 0 HG22 VAL A 119 22.306 5.148 -7.681 1.00 0.00 H new ATOM 0 HG23 VAL A 119 23.673 4.037 -7.935 1.00 0.00 H new ATOM 1793 N LYS A 120 21.600 0.565 -5.437 1.00 0.00 N ATOM 1794 CA LYS A 120 20.969 -0.589 -4.762 1.00 0.00 C ATOM 1795 C LYS A 120 20.817 -0.329 -3.266 1.00 0.00 C ATOM 1796 O LYS A 120 19.721 -0.497 -2.739 1.00 0.00 O ATOM 1797 CB LYS A 120 21.810 -1.847 -5.034 1.00 0.00 C ATOM 1798 CG LYS A 120 21.147 -3.111 -4.468 1.00 0.00 C ATOM 1799 CD LYS A 120 22.023 -4.347 -4.699 1.00 0.00 C ATOM 1800 CE LYS A 120 21.337 -5.567 -4.071 1.00 0.00 C ATOM 1801 NZ LYS A 120 22.225 -6.766 -4.057 1.00 0.00 N ATOM 0 H LYS A 120 22.450 0.317 -5.944 1.00 0.00 H new ATOM 0 HA LYS A 120 19.966 -0.741 -5.160 1.00 0.00 H new ATOM 0 HB2 LYS A 120 21.954 -1.962 -6.108 1.00 0.00 H new ATOM 0 HB3 LYS A 120 22.799 -1.726 -4.591 1.00 0.00 H new ATOM 0 HG2 LYS A 120 20.967 -2.984 -3.400 1.00 0.00 H new ATOM 0 HG3 LYS A 120 20.175 -3.257 -4.940 1.00 0.00 H new ATOM 0 HD2 LYS A 120 22.174 -4.508 -5.766 1.00 0.00 H new ATOM 0 HD3 LYS A 120 23.008 -4.199 -4.256 1.00 0.00 H new ATOM 0 HE2 LYS A 120 21.036 -5.328 -3.051 1.00 0.00 H new ATOM 0 HE3 LYS A 120 20.428 -5.797 -4.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 21.721 -7.566 -3.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 22.492 -7.011 -5.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 23.082 -6.557 -3.505 1.00 0.00 H new ATOM 1815 N GLU A 121 21.867 0.162 -2.604 1.00 0.00 N ATOM 1816 CA GLU A 121 21.807 0.569 -1.193 1.00 0.00 C ATOM 1817 C GLU A 121 20.737 1.611 -0.953 1.00 0.00 C ATOM 1818 O GLU A 121 19.884 1.413 -0.092 1.00 0.00 O ATOM 1819 CB GLU A 121 23.134 1.163 -0.695 1.00 0.00 C ATOM 1820 CG GLU A 121 24.102 0.044 -0.395 1.00 0.00 C ATOM 1821 CD GLU A 121 25.412 0.581 0.211 1.00 0.00 C ATOM 1822 OE1 GLU A 121 26.356 0.906 -0.547 1.00 0.00 O ATOM 1823 OE2 GLU A 121 25.505 0.674 1.460 1.00 0.00 O ATOM 0 H GLU A 121 22.785 0.290 -3.029 1.00 0.00 H new ATOM 0 HA GLU A 121 21.581 -0.346 -0.646 1.00 0.00 H new ATOM 0 HB2 GLU A 121 23.553 1.829 -1.449 1.00 0.00 H new ATOM 0 HB3 GLU A 121 22.964 1.762 0.200 1.00 0.00 H new ATOM 0 HG2 GLU A 121 23.642 -0.661 0.297 1.00 0.00 H new ATOM 0 HG3 GLU A 121 24.321 -0.505 -1.311 1.00 0.00 H new ATOM 1830 N ARG A 122 20.734 2.714 -1.708 1.00 0.00 N ATOM 1831 CA ARG A 122 19.763 3.780 -1.453 1.00 0.00 C ATOM 1832 C ARG A 122 18.328 3.278 -1.618 1.00 0.00 C ATOM 1833 O ARG A 122 17.501 3.596 -0.773 1.00 0.00 O ATOM 1834 CB ARG A 122 20.053 5.017 -2.305 1.00 0.00 C ATOM 1835 CG ARG A 122 21.383 5.747 -2.045 1.00 0.00 C ATOM 1836 CD ARG A 122 21.653 6.205 -0.610 1.00 0.00 C ATOM 1837 NE ARG A 122 20.616 7.121 -0.076 1.00 0.00 N ATOM 1838 CZ ARG A 122 20.635 7.705 1.113 1.00 0.00 C ATOM 1839 NH1 ARG A 122 21.622 7.533 1.944 1.00 0.00 N ATOM 1840 NH2 ARG A 122 19.655 8.460 1.509 1.00 0.00 N ATOM 0 H ARG A 122 21.376 2.890 -2.481 1.00 0.00 H new ATOM 0 HA ARG A 122 19.869 4.087 -0.413 1.00 0.00 H new ATOM 0 HB2 ARG A 122 20.029 4.720 -3.353 1.00 0.00 H new ATOM 0 HB3 ARG A 122 19.241 5.729 -2.157 1.00 0.00 H new ATOM 0 HG2 ARG A 122 22.196 5.088 -2.350 1.00 0.00 H new ATOM 0 HG3 ARG A 122 21.422 6.622 -2.693 1.00 0.00 H new ATOM 0 HD2 ARG A 122 21.720 5.329 0.036 1.00 0.00 H new ATOM 0 HD3 ARG A 122 22.621 6.704 -0.572 1.00 0.00 H new ATOM 0 HE ARG A 122 19.817 7.319 -0.678 1.00 0.00 H new ATOM 0 HH11 ARG A 122 22.408 6.936 1.686 1.00 0.00 H new ATOM 0 HH12 ARG A 122 21.610 7.995 2.853 1.00 0.00 H new ATOM 0 HH21 ARG A 122 18.851 8.613 0.901 1.00 0.00 H new ATOM 0 HH22 ARG A 122 19.690 8.900 2.428 1.00 0.00 H new ATOM 1854 N VAL A 123 18.062 2.385 -2.575 1.00 0.00 N ATOM 1855 CA VAL A 123 16.772 1.690 -2.665 1.00 0.00 C ATOM 1856 C VAL A 123 16.492 0.750 -1.497 1.00 0.00 C ATOM 1857 O VAL A 123 15.452 0.916 -0.871 1.00 0.00 O ATOM 1858 CB VAL A 123 16.618 0.975 -4.020 1.00 0.00 C ATOM 1859 CG1 VAL A 123 15.420 0.024 -4.053 1.00 0.00 C ATOM 1860 CG2 VAL A 123 16.457 1.994 -5.149 1.00 0.00 C ATOM 0 H VAL A 123 18.727 2.124 -3.303 1.00 0.00 H new ATOM 0 HA VAL A 123 16.011 2.467 -2.597 1.00 0.00 H new ATOM 0 HB VAL A 123 17.526 0.388 -4.158 1.00 0.00 H new ATOM 0 HG11 VAL A 123 15.360 -0.452 -5.032 1.00 0.00 H new ATOM 0 HG12 VAL A 123 15.540 -0.740 -3.285 1.00 0.00 H new ATOM 0 HG13 VAL A 123 14.505 0.585 -3.866 1.00 0.00 H new ATOM 0 HG21 VAL A 123 16.350 1.471 -6.099 1.00 0.00 H new ATOM 0 HG22 VAL A 123 15.570 2.602 -4.967 1.00 0.00 H new ATOM 0 HG23 VAL A 123 17.336 2.637 -5.187 1.00 0.00 H new ATOM 1870 N GLU A 124 17.355 -0.211 -1.165 1.00 0.00 N ATOM 1871 CA GLU A 124 17.084 -1.154 -0.059 1.00 0.00 C ATOM 1872 C GLU A 124 16.877 -0.434 1.270 1.00 0.00 C ATOM 1873 O GLU A 124 16.010 -0.808 2.063 1.00 0.00 O ATOM 1874 CB GLU A 124 18.205 -2.185 0.105 1.00 0.00 C ATOM 1875 CG GLU A 124 18.287 -3.184 -1.039 1.00 0.00 C ATOM 1876 CD GLU A 124 19.303 -4.289 -0.678 1.00 0.00 C ATOM 1877 OE1 GLU A 124 20.526 -4.092 -0.876 1.00 0.00 O ATOM 1878 OE2 GLU A 124 18.888 -5.359 -0.169 1.00 0.00 O ATOM 0 H GLU A 124 18.246 -0.363 -1.638 1.00 0.00 H new ATOM 0 HA GLU A 124 16.163 -1.670 -0.331 1.00 0.00 H new ATOM 0 HB2 GLU A 124 19.158 -1.663 0.189 1.00 0.00 H new ATOM 0 HB3 GLU A 124 18.055 -2.727 1.039 1.00 0.00 H new ATOM 0 HG2 GLU A 124 17.307 -3.622 -1.226 1.00 0.00 H new ATOM 0 HG3 GLU A 124 18.591 -2.680 -1.956 1.00 0.00 H new ATOM 1885 N ASN A 125 17.626 0.647 1.476 1.00 0.00 N ATOM 1886 CA ASN A 125 17.527 1.440 2.688 1.00 0.00 C ATOM 1887 C ASN A 125 16.286 2.364 2.695 1.00 0.00 C ATOM 1888 O ASN A 125 15.740 2.641 3.762 1.00 0.00 O ATOM 1889 CB ASN A 125 18.893 2.095 2.967 1.00 0.00 C ATOM 1890 CG ASN A 125 18.856 3.603 3.062 1.00 0.00 C ATOM 1891 OD1 ASN A 125 19.043 4.238 1.936 1.00 0.00 O flip ATOM 1892 ND2 ASN A 125 18.652 4.202 4.106 1.00 0.00 N flip ATOM 0 H ASN A 125 18.314 0.993 0.807 1.00 0.00 H new ATOM 0 HA ASN A 125 17.324 0.807 3.551 1.00 0.00 H new ATOM 0 HB2 ASN A 125 19.290 1.694 3.899 1.00 0.00 H new ATOM 0 HB3 ASN A 125 19.587 1.810 2.176 1.00 0.00 H new ATOM 0 HD21 ASN A 125 18.509 3.683 4.972 1.00 0.00 H new ATOM 0 HD22 ASN A 125 18.625 5.222 4.112 1.00 0.00 H new ATOM 1899 N LEU A 126 15.789 2.767 1.517 1.00 0.00 N ATOM 1900 CA LEU A 126 14.512 3.470 1.354 1.00 0.00 C ATOM 1901 C LEU A 126 13.302 2.554 1.536 1.00 0.00 C ATOM 1902 O LEU A 126 12.412 2.884 2.316 1.00 0.00 O ATOM 1903 CB LEU A 126 14.499 4.185 -0.013 1.00 0.00 C ATOM 1904 CG LEU A 126 13.160 4.832 -0.410 1.00 0.00 C ATOM 1905 CD1 LEU A 126 12.731 5.923 0.567 1.00 0.00 C ATOM 1906 CD2 LEU A 126 13.291 5.451 -1.795 1.00 0.00 C ATOM 0 H LEU A 126 16.275 2.609 0.634 1.00 0.00 H new ATOM 0 HA LEU A 126 14.427 4.213 2.147 1.00 0.00 H new ATOM 0 HB2 LEU A 126 15.268 4.957 -0.007 1.00 0.00 H new ATOM 0 HB3 LEU A 126 14.777 3.465 -0.783 1.00 0.00 H new ATOM 0 HG LEU A 126 12.404 4.047 -0.397 1.00 0.00 H new ATOM 0 HD11 LEU A 126 11.781 6.348 0.243 1.00 0.00 H new ATOM 0 HD12 LEU A 126 12.616 5.495 1.563 1.00 0.00 H new ATOM 0 HD13 LEU A 126 13.489 6.706 0.594 1.00 0.00 H new ATOM 0 HD21 LEU A 126 12.344 5.910 -2.079 1.00 0.00 H new ATOM 0 HD22 LEU A 126 14.073 6.210 -1.782 1.00 0.00 H new ATOM 0 HD23 LEU A 126 13.550 4.676 -2.517 1.00 0.00 H new ATOM 1918 N ILE A 127 13.232 1.410 0.848 1.00 0.00 N ATOM 1919 CA ILE A 127 12.026 0.561 0.903 1.00 0.00 C ATOM 1920 C ILE A 127 11.755 0.045 2.314 1.00 0.00 C ATOM 1921 O ILE A 127 10.597 -0.083 2.692 1.00 0.00 O ATOM 1922 CB ILE A 127 12.053 -0.585 -0.131 1.00 0.00 C ATOM 1923 CG1 ILE A 127 13.249 -1.547 0.045 1.00 0.00 C ATOM 1924 CG2 ILE A 127 11.993 0.031 -1.544 1.00 0.00 C ATOM 1925 CD1 ILE A 127 13.410 -2.574 -1.077 1.00 0.00 C ATOM 0 H ILE A 127 13.980 1.050 0.255 1.00 0.00 H new ATOM 0 HA ILE A 127 11.190 1.204 0.627 1.00 0.00 H new ATOM 0 HB ILE A 127 11.179 -1.217 0.030 1.00 0.00 H new ATOM 0 HG12 ILE A 127 14.164 -0.959 0.116 1.00 0.00 H new ATOM 0 HG13 ILE A 127 13.136 -2.076 0.991 1.00 0.00 H new ATOM 0 HG21 ILE A 127 12.011 -0.765 -2.289 1.00 0.00 H new ATOM 0 HG22 ILE A 127 11.074 0.607 -1.651 1.00 0.00 H new ATOM 0 HG23 ILE A 127 12.851 0.686 -1.692 1.00 0.00 H new ATOM 0 HD11 ILE A 127 14.274 -3.206 -0.870 1.00 0.00 H new ATOM 0 HD12 ILE A 127 12.514 -3.192 -1.136 1.00 0.00 H new ATOM 0 HD13 ILE A 127 13.557 -2.057 -2.025 1.00 0.00 H new ATOM 1937 N ALA A 128 12.796 -0.141 3.123 1.00 0.00 N ATOM 1938 CA ALA A 128 12.647 -0.550 4.513 1.00 0.00 C ATOM 1939 C ALA A 128 11.953 0.505 5.407 1.00 0.00 C ATOM 1940 O ALA A 128 11.372 0.133 6.431 1.00 0.00 O ATOM 1941 CB ALA A 128 14.040 -0.909 5.043 1.00 0.00 C ATOM 0 H ALA A 128 13.765 -0.012 2.831 1.00 0.00 H new ATOM 0 HA ALA A 128 11.981 -1.412 4.549 1.00 0.00 H new ATOM 0 HB1 ALA A 128 13.964 -1.220 6.085 1.00 0.00 H new ATOM 0 HB2 ALA A 128 14.456 -1.724 4.450 1.00 0.00 H new ATOM 0 HB3 ALA A 128 14.692 -0.038 4.971 1.00 0.00 H new ATOM 1947 N LYS A 129 11.979 1.798 5.025 1.00 0.00 N ATOM 1948 CA LYS A 129 11.278 2.882 5.749 1.00 0.00 C ATOM 1949 C LYS A 129 9.900 3.253 5.184 1.00 0.00 C ATOM 1950 O LYS A 129 9.022 3.605 5.970 1.00 0.00 O ATOM 1951 CB LYS A 129 12.187 4.108 5.967 1.00 0.00 C ATOM 1952 CG LYS A 129 12.812 4.762 4.725 1.00 0.00 C ATOM 1953 CD LYS A 129 13.572 6.052 5.089 1.00 0.00 C ATOM 1954 CE LYS A 129 14.159 6.722 3.832 1.00 0.00 C ATOM 1955 NZ LYS A 129 14.901 7.978 4.144 1.00 0.00 N ATOM 0 H LYS A 129 12.488 2.123 4.203 1.00 0.00 H new ATOM 0 HA LYS A 129 11.051 2.465 6.730 1.00 0.00 H new ATOM 0 HB2 LYS A 129 11.606 4.868 6.490 1.00 0.00 H new ATOM 0 HB3 LYS A 129 12.997 3.811 6.633 1.00 0.00 H new ATOM 0 HG2 LYS A 129 13.494 4.059 4.247 1.00 0.00 H new ATOM 0 HG3 LYS A 129 12.030 4.991 4.001 1.00 0.00 H new ATOM 0 HD2 LYS A 129 12.898 6.745 5.593 1.00 0.00 H new ATOM 0 HD3 LYS A 129 14.374 5.820 5.790 1.00 0.00 H new ATOM 0 HE2 LYS A 129 14.830 6.023 3.332 1.00 0.00 H new ATOM 0 HE3 LYS A 129 13.352 6.945 3.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 15.054 8.517 3.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 14.347 8.552 4.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 15.820 7.742 4.570 1.00 0.00 H new ATOM 1969 N ILE A 130 9.689 3.157 3.862 1.00 0.00 N ATOM 1970 CA ILE A 130 8.405 3.539 3.214 1.00 0.00 C ATOM 1971 C ILE A 130 7.440 2.396 2.836 1.00 0.00 C ATOM 1972 O ILE A 130 6.323 2.694 2.415 1.00 0.00 O ATOM 1973 CB ILE A 130 8.585 4.567 2.070 1.00 0.00 C ATOM 1974 CG1 ILE A 130 9.480 4.139 0.889 1.00 0.00 C ATOM 1975 CG2 ILE A 130 9.123 5.883 2.650 1.00 0.00 C ATOM 1976 CD1 ILE A 130 8.950 2.971 0.055 1.00 0.00 C ATOM 0 H ILE A 130 10.393 2.816 3.208 1.00 0.00 H new ATOM 0 HA ILE A 130 7.879 4.035 4.030 1.00 0.00 H new ATOM 0 HB ILE A 130 7.588 4.670 1.641 1.00 0.00 H new ATOM 0 HG12 ILE A 130 9.622 4.998 0.233 1.00 0.00 H new ATOM 0 HG13 ILE A 130 10.462 3.870 1.278 1.00 0.00 H new ATOM 0 HG21 ILE A 130 9.251 6.609 1.847 1.00 0.00 H new ATOM 0 HG22 ILE A 130 8.417 6.273 3.383 1.00 0.00 H new ATOM 0 HG23 ILE A 130 10.084 5.702 3.132 1.00 0.00 H new ATOM 0 HD11 ILE A 130 9.652 2.749 -0.749 1.00 0.00 H new ATOM 0 HD12 ILE A 130 8.836 2.092 0.690 1.00 0.00 H new ATOM 0 HD13 ILE A 130 7.983 3.238 -0.372 1.00 0.00 H new ATOM 1988 N SER A 131 7.812 1.115 2.980 1.00 0.00 N ATOM 1989 CA SER A 131 6.899 -0.016 2.680 1.00 0.00 C ATOM 1990 C SER A 131 5.630 -0.010 3.547 1.00 0.00 C ATOM 1991 O SER A 131 4.520 -0.076 2.967 1.00 0.00 O ATOM 1992 CB SER A 131 7.605 -1.356 2.824 1.00 0.00 C ATOM 1993 OG SER A 131 8.530 -1.494 1.766 1.00 0.00 O ATOM 1994 OXT SER A 131 5.740 0.029 4.797 1.00 0.00 O ATOM 0 H SER A 131 8.737 0.829 3.302 1.00 0.00 H new ATOM 0 HA SER A 131 6.594 0.122 1.643 1.00 0.00 H new ATOM 0 HB2 SER A 131 8.118 -1.412 3.784 1.00 0.00 H new ATOM 0 HB3 SER A 131 6.880 -2.170 2.801 1.00 0.00 H new ATOM 0 HG SER A 131 9.417 -1.208 2.068 1.00 0.00 H new