USER MOD reduce.3.24.130724 H: found=0, std=0, add=1059, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1057 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 12 THR OG1 : rot 32:sc= -2.81! USER MOD Set 1.2: A 14 ASN : amide:sc= -0.0331 X(o=-2.8,f=-3.3) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 175:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 SER OG : rot -170:sc= -1.15 USER MOD Single : A 20 MET CE :methyl -142:sc= -1.6 (180deg=-2.83!) USER MOD Single : A 22 GLN : amide:sc= -0.0832 K(o=-0.083,f=-1.8!) USER MOD Single : A 25 ASN : amide:sc= -1.9! C(o=-1.9!,f=-2.6!) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 33 TYR OH : rot 140:sc= -0.78 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 ASN : amide:sc= -10.6! C(o=-11!,f=-7.8!) USER MOD Single : A 44 ASN : amide:sc= -4.9! C(o=-4.9!,f=-5.6!) USER MOD Single : A 46 TYR OH : rot -138:sc= 0.993 USER MOD Single : A 47 SER OG : rot -170:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 52 ASN : amide:sc= -0.67 K(o=-0.67,f=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 GLN : amide:sc= -0.748 X(o=-0.75,f=-0.54) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 ASN : amide:sc= -0.813 K(o=-0.81,f=-3.4!) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 66 GLN : amide:sc= -0.531 X(o=-0.53,f=-0.57) USER MOD Single : A 68 TYR OH : rot 180:sc=-0.00693 USER MOD Single : A 73 GLN : amide:sc=-0.000111 K(o=-0.00011,f=-0.88) USER MOD Single : A 76 ASN : amide:sc= -1.18 K(o=-1.2,f=-0.51!) USER MOD Single : A 81 ASN : amide:sc= -0.0145 X(o=-0.015,f=0) USER MOD Single : A 82 GLN : amide:sc= -0.289 K(o=-0.29,f=-4.1!) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 TYR OH : rot 130:sc= -0.551 USER MOD Single : A 89 ASN : amide:sc= -1.5! C(o=-1.5!,f=-2.7!) USER MOD Single : A 93 SER OG : rot 150:sc= -0.08 USER MOD Single : A 94 ASN : amide:sc= -0.877 K(o=-0.88,f=-1.8!) USER MOD Single : A 97 THR OG1 : rot -68:sc= 0.791 USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 TYR OH : rot 157:sc= 1.13 USER MOD Single : A 107 SER OG : rot 171:sc= 0.937 USER MOD Single : A 110 LYS NZ :NH3+ -138:sc= -0.0421 (180deg=-1.96!) USER MOD Single : A 111 SER OG : rot 180:sc= 0.00196 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot 79:sc= -2.83! USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 159:sc= -1.17 USER MOD Single : A 128 GLN : amide:sc= -0.153 K(o=-0.15,f=-1) USER MOD Single : A 129 LYS NZ :NH3+ -131:sc= 0.791 (180deg=0.0248) USER MOD Single : A 130 HIS : no HD1:sc= -0.691 K(o=-0.69,f=-0.17) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 134 SER OG : rot 69:sc= 0.449 USER MOD Single : A 136 HIS : no HD1:sc= -0.437 X(o=-0.44,f=-0.041) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 ASN : amide:sc= 0 X(o=0,f=-0.0034) USER MOD Single : A 140 THR OG1 : rot 37:sc= 0.2 USER MOD Single : A 145 SER OG : rot 180:sc= 0 USER MOD Single : A 148 SER OG : rot 180:sc= -0.0804 USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -21.880 22.854 -16.774 1.00 0.00 N ATOM 2 CA GLY A 1 -22.572 21.620 -16.451 1.00 0.00 C ATOM 3 C GLY A 1 -21.624 20.521 -16.014 1.00 0.00 C ATOM 4 O GLY A 1 -21.706 19.392 -16.497 1.00 0.00 O ATOM 0 H1 GLY A 1 -22.572 23.573 -17.067 1.00 0.00 H new ATOM 0 H2 GLY A 1 -21.363 23.191 -15.937 1.00 0.00 H new ATOM 0 H3 GLY A 1 -21.209 22.683 -17.550 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -23.294 21.809 -15.657 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -23.136 21.285 -17.322 1.00 0.00 H new ATOM 8 N SER A 2 -20.721 20.852 -15.096 1.00 0.00 N ATOM 9 CA SER A 2 -19.749 19.886 -14.598 1.00 0.00 C ATOM 10 C SER A 2 -20.231 19.253 -13.296 1.00 0.00 C ATOM 11 O SER A 2 -20.375 19.931 -12.279 1.00 0.00 O ATOM 12 CB SER A 2 -18.394 20.561 -14.378 1.00 0.00 C ATOM 13 OG SER A 2 -17.350 19.603 -14.323 1.00 0.00 O ATOM 0 H SER A 2 -20.643 21.781 -14.682 1.00 0.00 H new ATOM 0 HA SER A 2 -19.639 19.100 -15.346 1.00 0.00 H new ATOM 0 HB2 SER A 2 -18.201 21.268 -15.185 1.00 0.00 H new ATOM 0 HB3 SER A 2 -18.416 21.134 -13.451 1.00 0.00 H new ATOM 0 HG SER A 2 -16.494 20.060 -14.183 1.00 0.00 H new ATOM 19 N SER A 3 -20.479 17.947 -13.336 1.00 0.00 N ATOM 20 CA SER A 3 -20.949 17.222 -12.162 1.00 0.00 C ATOM 21 C SER A 3 -20.096 15.982 -11.912 1.00 0.00 C ATOM 22 O SER A 3 -19.821 15.209 -12.828 1.00 0.00 O ATOM 23 CB SER A 3 -22.415 16.819 -12.338 1.00 0.00 C ATOM 24 OG SER A 3 -23.037 16.597 -11.084 1.00 0.00 O ATOM 0 H SER A 3 -20.362 17.370 -14.169 1.00 0.00 H new ATOM 0 HA SER A 3 -20.862 17.882 -11.299 1.00 0.00 H new ATOM 0 HB2 SER A 3 -22.948 17.601 -12.878 1.00 0.00 H new ATOM 0 HB3 SER A 3 -22.477 15.915 -12.943 1.00 0.00 H new ATOM 0 HG SER A 3 -23.992 16.424 -11.219 1.00 0.00 H new ATOM 30 N GLY A 4 -19.679 15.801 -10.662 1.00 0.00 N ATOM 31 CA GLY A 4 -18.862 14.654 -10.312 1.00 0.00 C ATOM 32 C GLY A 4 -17.871 14.964 -9.207 1.00 0.00 C ATOM 33 O GLY A 4 -17.180 15.982 -9.251 1.00 0.00 O ATOM 0 H GLY A 4 -19.892 16.428 -9.886 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -19.508 13.834 -9.997 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -18.322 14.313 -11.195 1.00 0.00 H new ATOM 37 N SER A 5 -17.803 14.085 -8.212 1.00 0.00 N ATOM 38 CA SER A 5 -16.894 14.273 -7.088 1.00 0.00 C ATOM 39 C SER A 5 -15.442 14.120 -7.532 1.00 0.00 C ATOM 40 O SER A 5 -14.859 13.041 -7.424 1.00 0.00 O ATOM 41 CB SER A 5 -17.208 13.268 -5.977 1.00 0.00 C ATOM 42 OG SER A 5 -18.459 13.549 -5.375 1.00 0.00 O ATOM 0 H SER A 5 -18.366 13.236 -8.162 1.00 0.00 H new ATOM 0 HA SER A 5 -17.034 15.284 -6.704 1.00 0.00 H new ATOM 0 HB2 SER A 5 -17.217 12.258 -6.387 1.00 0.00 H new ATOM 0 HB3 SER A 5 -16.422 13.298 -5.222 1.00 0.00 H new ATOM 0 HG SER A 5 -18.638 12.892 -4.670 1.00 0.00 H new ATOM 48 N SER A 6 -14.865 15.208 -8.031 1.00 0.00 N ATOM 49 CA SER A 6 -13.482 15.195 -8.495 1.00 0.00 C ATOM 50 C SER A 6 -12.546 15.752 -7.427 1.00 0.00 C ATOM 51 O SER A 6 -12.323 16.960 -7.349 1.00 0.00 O ATOM 52 CB SER A 6 -13.347 16.010 -9.783 1.00 0.00 C ATOM 53 OG SER A 6 -12.083 15.800 -10.389 1.00 0.00 O ATOM 0 H SER A 6 -15.333 16.109 -8.125 1.00 0.00 H new ATOM 0 HA SER A 6 -13.201 14.161 -8.696 1.00 0.00 H new ATOM 0 HB2 SER A 6 -14.138 15.731 -10.479 1.00 0.00 H new ATOM 0 HB3 SER A 6 -13.476 17.069 -9.562 1.00 0.00 H new ATOM 0 HG SER A 6 -12.022 16.330 -11.211 1.00 0.00 H new ATOM 59 N GLY A 7 -11.999 14.861 -6.606 1.00 0.00 N ATOM 60 CA GLY A 7 -11.092 15.281 -5.553 1.00 0.00 C ATOM 61 C GLY A 7 -9.787 14.511 -5.570 1.00 0.00 C ATOM 62 O GLY A 7 -8.721 15.086 -5.788 1.00 0.00 O ATOM 0 H GLY A 7 -12.167 13.856 -6.651 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -10.884 16.345 -5.661 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -11.576 15.147 -4.586 1.00 0.00 H new ATOM 66 N VAL A 8 -9.870 13.205 -5.337 1.00 0.00 N ATOM 67 CA VAL A 8 -8.686 12.354 -5.326 1.00 0.00 C ATOM 68 C VAL A 8 -8.588 11.531 -6.605 1.00 0.00 C ATOM 69 O VAL A 8 -9.537 10.847 -6.991 1.00 0.00 O ATOM 70 CB VAL A 8 -8.690 11.402 -4.115 1.00 0.00 C ATOM 71 CG1 VAL A 8 -7.489 10.470 -4.163 1.00 0.00 C ATOM 72 CG2 VAL A 8 -8.710 12.193 -2.816 1.00 0.00 C ATOM 0 H VAL A 8 -10.745 12.713 -5.153 1.00 0.00 H new ATOM 0 HA VAL A 8 -7.822 13.015 -5.256 1.00 0.00 H new ATOM 0 HB VAL A 8 -9.593 10.793 -4.157 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -7.509 9.805 -3.299 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -7.524 9.878 -5.077 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -6.571 11.058 -4.147 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -8.713 11.505 -1.971 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -7.826 12.829 -2.763 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -9.606 12.813 -2.781 1.00 0.00 H new ATOM 82 N LYS A 9 -7.435 11.600 -7.261 1.00 0.00 N ATOM 83 CA LYS A 9 -7.210 10.860 -8.497 1.00 0.00 C ATOM 84 C LYS A 9 -6.828 9.413 -8.203 1.00 0.00 C ATOM 85 O LYS A 9 -6.160 9.127 -7.209 1.00 0.00 O ATOM 86 CB LYS A 9 -6.112 11.532 -9.325 1.00 0.00 C ATOM 87 CG LYS A 9 -6.496 12.907 -9.843 1.00 0.00 C ATOM 88 CD LYS A 9 -5.344 13.565 -10.585 1.00 0.00 C ATOM 89 CE LYS A 9 -4.456 14.361 -9.641 1.00 0.00 C ATOM 90 NZ LYS A 9 -4.908 15.774 -9.514 1.00 0.00 N ATOM 0 H LYS A 9 -6.640 12.162 -6.957 1.00 0.00 H new ATOM 0 HA LYS A 9 -8.139 10.862 -9.067 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -5.212 11.621 -8.716 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -5.863 10.891 -10.171 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -7.355 12.819 -10.508 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -6.801 13.539 -9.009 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -4.750 12.802 -11.088 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -5.737 14.224 -11.359 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -4.456 13.890 -8.658 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -3.429 14.340 -10.004 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -4.277 16.283 -8.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -4.884 16.232 -10.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -5.879 15.796 -9.143 1.00 0.00 H new ATOM 104 N PHE A 10 -7.253 8.505 -9.075 1.00 0.00 N ATOM 105 CA PHE A 10 -6.955 7.087 -8.909 1.00 0.00 C ATOM 106 C PHE A 10 -5.735 6.688 -9.735 1.00 0.00 C ATOM 107 O PHE A 10 -5.384 7.357 -10.707 1.00 0.00 O ATOM 108 CB PHE A 10 -8.161 6.239 -9.317 1.00 0.00 C ATOM 109 CG PHE A 10 -9.346 6.407 -8.410 1.00 0.00 C ATOM 110 CD1 PHE A 10 -9.340 5.872 -7.132 1.00 0.00 C ATOM 111 CD2 PHE A 10 -10.467 7.102 -8.835 1.00 0.00 C ATOM 112 CE1 PHE A 10 -10.430 6.024 -6.297 1.00 0.00 C ATOM 113 CE2 PHE A 10 -11.560 7.259 -8.004 1.00 0.00 C ATOM 114 CZ PHE A 10 -11.541 6.720 -6.732 1.00 0.00 C ATOM 0 H PHE A 10 -7.805 8.726 -9.904 1.00 0.00 H new ATOM 0 HA PHE A 10 -6.734 6.908 -7.857 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -8.452 6.501 -10.334 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -7.869 5.189 -9.330 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -8.473 5.330 -6.784 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -10.487 7.526 -9.828 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -10.413 5.599 -5.304 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -12.428 7.802 -8.348 1.00 0.00 H new ATOM 0 HZ PHE A 10 -12.393 6.843 -6.079 1.00 0.00 H new ATOM 124 N LEU A 11 -5.094 5.594 -9.340 1.00 0.00 N ATOM 125 CA LEU A 11 -3.913 5.104 -10.043 1.00 0.00 C ATOM 126 C LEU A 11 -2.951 6.247 -10.353 1.00 0.00 C ATOM 127 O LEU A 11 -2.216 6.204 -11.340 1.00 0.00 O ATOM 128 CB LEU A 11 -4.321 4.400 -11.338 1.00 0.00 C ATOM 129 CG LEU A 11 -5.189 3.152 -11.178 1.00 0.00 C ATOM 130 CD1 LEU A 11 -5.840 2.781 -12.502 1.00 0.00 C ATOM 131 CD2 LEU A 11 -4.362 1.991 -10.645 1.00 0.00 C ATOM 0 H LEU A 11 -5.372 5.029 -8.537 1.00 0.00 H new ATOM 0 HA LEU A 11 -3.404 4.391 -9.394 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -4.858 5.114 -11.963 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -3.416 4.122 -11.878 1.00 0.00 H new ATOM 0 HG LEU A 11 -5.977 3.371 -10.458 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -6.454 1.890 -12.369 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -6.466 3.605 -12.843 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -5.067 2.581 -13.244 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -4.997 1.111 -10.538 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -3.552 1.771 -11.341 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -3.944 2.258 -9.674 1.00 0.00 H new ATOM 143 N THR A 12 -2.960 7.269 -9.502 1.00 0.00 N ATOM 144 CA THR A 12 -2.088 8.422 -9.684 1.00 0.00 C ATOM 145 C THR A 12 -1.368 8.777 -8.389 1.00 0.00 C ATOM 146 O THR A 12 -2.000 8.989 -7.353 1.00 0.00 O ATOM 147 CB THR A 12 -2.877 9.651 -10.173 1.00 0.00 C ATOM 148 OG1 THR A 12 -4.047 9.834 -9.368 1.00 0.00 O ATOM 149 CG2 THR A 12 -3.280 9.491 -11.631 1.00 0.00 C ATOM 0 H THR A 12 -3.562 7.321 -8.680 1.00 0.00 H new ATOM 0 HA THR A 12 -1.353 8.146 -10.441 1.00 0.00 H new ATOM 0 HB THR A 12 -2.234 10.526 -10.084 1.00 0.00 H new ATOM 0 HG1 THR A 12 -3.867 9.528 -8.455 1.00 0.00 H new ATOM 0 HG21 THR A 12 -3.836 10.371 -11.954 1.00 0.00 H new ATOM 0 HG22 THR A 12 -2.386 9.381 -12.245 1.00 0.00 H new ATOM 0 HG23 THR A 12 -3.907 8.606 -11.740 1.00 0.00 H new ATOM 157 N VAL A 13 -0.042 8.842 -8.452 1.00 0.00 N ATOM 158 CA VAL A 13 0.765 9.174 -7.284 1.00 0.00 C ATOM 159 C VAL A 13 0.452 10.579 -6.782 1.00 0.00 C ATOM 160 O VAL A 13 0.777 11.569 -7.436 1.00 0.00 O ATOM 161 CB VAL A 13 2.270 9.074 -7.594 1.00 0.00 C ATOM 162 CG1 VAL A 13 3.092 9.572 -6.416 1.00 0.00 C ATOM 163 CG2 VAL A 13 2.646 7.644 -7.951 1.00 0.00 C ATOM 0 H VAL A 13 0.497 8.669 -9.301 1.00 0.00 H new ATOM 0 HA VAL A 13 0.513 8.450 -6.509 1.00 0.00 H new ATOM 0 HB VAL A 13 2.490 9.708 -8.453 1.00 0.00 H new ATOM 0 HG11 VAL A 13 4.153 9.494 -6.654 1.00 0.00 H new ATOM 0 HG12 VAL A 13 2.842 10.613 -6.212 1.00 0.00 H new ATOM 0 HG13 VAL A 13 2.871 8.967 -5.537 1.00 0.00 H new ATOM 0 HG21 VAL A 13 3.713 7.592 -8.167 1.00 0.00 H new ATOM 0 HG22 VAL A 13 2.413 6.987 -7.114 1.00 0.00 H new ATOM 0 HG23 VAL A 13 2.082 7.328 -8.829 1.00 0.00 H new ATOM 173 N ASN A 14 -0.179 10.658 -5.615 1.00 0.00 N ATOM 174 CA ASN A 14 -0.536 11.942 -5.024 1.00 0.00 C ATOM 175 C ASN A 14 0.581 12.454 -4.119 1.00 0.00 C ATOM 176 O ASN A 14 0.929 11.817 -3.124 1.00 0.00 O ATOM 177 CB ASN A 14 -1.836 11.818 -4.227 1.00 0.00 C ATOM 178 CG ASN A 14 -2.871 10.969 -4.940 1.00 0.00 C ATOM 179 OD1 ASN A 14 -3.140 11.163 -6.126 1.00 0.00 O ATOM 180 ND2 ASN A 14 -3.459 10.022 -4.218 1.00 0.00 N ATOM 0 H ASN A 14 -0.454 9.848 -5.060 1.00 0.00 H new ATOM 0 HA ASN A 14 -0.681 12.657 -5.833 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -1.621 11.382 -3.252 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -2.246 12.812 -4.048 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -4.164 9.420 -4.643 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -3.205 9.896 -3.238 1.00 0.00 H new ATOM 187 N ASP A 15 1.138 13.607 -4.470 1.00 0.00 N ATOM 188 CA ASP A 15 2.215 14.206 -3.690 1.00 0.00 C ATOM 189 C ASP A 15 1.949 14.057 -2.195 1.00 0.00 C ATOM 190 O ASP A 15 2.814 13.609 -1.442 1.00 0.00 O ATOM 191 CB ASP A 15 2.372 15.684 -4.048 1.00 0.00 C ATOM 192 CG ASP A 15 3.804 16.164 -3.909 1.00 0.00 C ATOM 193 OD1 ASP A 15 4.726 15.353 -4.138 1.00 0.00 O ATOM 194 OD2 ASP A 15 4.002 17.350 -3.571 1.00 0.00 O ATOM 0 H ASP A 15 0.862 14.146 -5.290 1.00 0.00 H new ATOM 0 HA ASP A 15 3.140 13.682 -3.931 1.00 0.00 H new ATOM 0 HB2 ASP A 15 2.036 15.845 -5.072 1.00 0.00 H new ATOM 0 HB3 ASP A 15 1.727 16.282 -3.404 1.00 0.00 H new ATOM 199 N ASP A 16 0.748 14.437 -1.772 1.00 0.00 N ATOM 200 CA ASP A 16 0.368 14.346 -0.367 1.00 0.00 C ATOM 201 C ASP A 16 1.034 13.146 0.300 1.00 0.00 C ATOM 202 O ASP A 16 0.574 12.013 0.161 1.00 0.00 O ATOM 203 CB ASP A 16 -1.152 14.241 -0.234 1.00 0.00 C ATOM 204 CG ASP A 16 -1.859 15.513 -0.656 1.00 0.00 C ATOM 205 OD1 ASP A 16 -1.788 16.509 0.094 1.00 0.00 O ATOM 206 OD2 ASP A 16 -2.486 15.513 -1.737 1.00 0.00 O ATOM 0 H ASP A 16 0.021 14.811 -2.382 1.00 0.00 H new ATOM 0 HA ASP A 16 0.707 15.252 0.135 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -1.511 13.411 -0.842 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -1.408 14.012 0.800 1.00 0.00 H new ATOM 211 N ILE A 17 2.120 13.404 1.021 1.00 0.00 N ATOM 212 CA ILE A 17 2.848 12.345 1.709 1.00 0.00 C ATOM 213 C ILE A 17 2.226 12.043 3.068 1.00 0.00 C ATOM 214 O ILE A 17 1.905 12.954 3.832 1.00 0.00 O ATOM 215 CB ILE A 17 4.330 12.718 1.906 1.00 0.00 C ATOM 216 CG1 ILE A 17 4.458 13.880 2.893 1.00 0.00 C ATOM 217 CG2 ILE A 17 4.968 13.076 0.573 1.00 0.00 C ATOM 218 CD1 ILE A 17 5.890 14.284 3.168 1.00 0.00 C ATOM 0 H ILE A 17 2.515 14.336 1.144 1.00 0.00 H new ATOM 0 HA ILE A 17 2.785 11.458 1.079 1.00 0.00 H new ATOM 0 HB ILE A 17 4.855 11.856 2.318 1.00 0.00 H new ATOM 0 HG12 ILE A 17 3.915 14.740 2.501 1.00 0.00 H new ATOM 0 HG13 ILE A 17 3.980 13.602 3.833 1.00 0.00 H new ATOM 0 HG21 ILE A 17 6.015 13.337 0.729 1.00 0.00 H new ATOM 0 HG22 ILE A 17 4.904 12.223 -0.102 1.00 0.00 H new ATOM 0 HG23 ILE A 17 4.444 13.925 0.135 1.00 0.00 H new ATOM 0 HD11 ILE A 17 5.905 15.113 3.876 1.00 0.00 H new ATOM 0 HD12 ILE A 17 6.432 13.438 3.589 1.00 0.00 H new ATOM 0 HD13 ILE A 17 6.366 14.593 2.237 1.00 0.00 H new ATOM 230 N LEU A 18 2.060 10.759 3.364 1.00 0.00 N ATOM 231 CA LEU A 18 1.478 10.335 4.632 1.00 0.00 C ATOM 232 C LEU A 18 1.955 8.936 5.010 1.00 0.00 C ATOM 233 O LEU A 18 2.304 8.133 4.144 1.00 0.00 O ATOM 234 CB LEU A 18 -0.049 10.360 4.549 1.00 0.00 C ATOM 235 CG LEU A 18 -0.698 11.745 4.559 1.00 0.00 C ATOM 236 CD1 LEU A 18 -2.195 11.634 4.309 1.00 0.00 C ATOM 237 CD2 LEU A 18 -0.427 12.452 5.879 1.00 0.00 C ATOM 0 H LEU A 18 2.320 9.993 2.743 1.00 0.00 H new ATOM 0 HA LEU A 18 1.805 11.031 5.404 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -0.352 9.845 3.637 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -0.448 9.787 5.386 1.00 0.00 H new ATOM 0 HG LEU A 18 -0.259 12.337 3.756 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -2.640 12.629 4.320 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -2.368 11.169 3.338 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -2.650 11.024 5.090 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -0.896 13.436 5.868 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -0.839 11.863 6.699 1.00 0.00 H new ATOM 0 HD23 LEU A 18 0.648 12.565 6.017 1.00 0.00 H new ATOM 249 N SER A 19 1.966 8.650 6.308 1.00 0.00 N ATOM 250 CA SER A 19 2.401 7.348 6.800 1.00 0.00 C ATOM 251 C SER A 19 1.458 6.245 6.327 1.00 0.00 C ATOM 252 O SER A 19 0.333 6.514 5.906 1.00 0.00 O ATOM 253 CB SER A 19 2.470 7.354 8.329 1.00 0.00 C ATOM 254 OG SER A 19 1.177 7.472 8.897 1.00 0.00 O ATOM 0 H SER A 19 1.679 9.302 7.038 1.00 0.00 H new ATOM 0 HA SER A 19 3.395 7.149 6.399 1.00 0.00 H new ATOM 0 HB2 SER A 19 2.942 6.436 8.679 1.00 0.00 H new ATOM 0 HB3 SER A 19 3.095 8.181 8.665 1.00 0.00 H new ATOM 0 HG SER A 19 1.256 7.632 9.861 1.00 0.00 H new ATOM 260 N MET A 20 1.927 5.004 6.399 1.00 0.00 N ATOM 261 CA MET A 20 1.126 3.860 5.980 1.00 0.00 C ATOM 262 C MET A 20 -0.249 3.887 6.640 1.00 0.00 C ATOM 263 O MET A 20 -1.283 3.788 5.979 1.00 0.00 O ATOM 264 CB MET A 20 1.845 2.554 6.324 1.00 0.00 C ATOM 265 CG MET A 20 1.633 1.454 5.296 1.00 0.00 C ATOM 266 SD MET A 20 0.208 0.415 5.674 1.00 0.00 S ATOM 267 CE MET A 20 -0.296 -0.079 4.028 1.00 0.00 C ATOM 0 H MET A 20 2.857 4.765 6.743 1.00 0.00 H new ATOM 0 HA MET A 20 0.991 3.919 4.900 1.00 0.00 H new ATOM 0 HB2 MET A 20 2.913 2.751 6.418 1.00 0.00 H new ATOM 0 HB3 MET A 20 1.498 2.203 7.296 1.00 0.00 H new ATOM 0 HG2 MET A 20 1.500 1.903 4.312 1.00 0.00 H new ATOM 0 HG3 MET A 20 2.527 0.833 5.245 1.00 0.00 H new ATOM 0 HE1 MET A 20 -1.384 -0.106 3.973 1.00 0.00 H new ATOM 0 HE2 MET A 20 0.087 0.637 3.300 1.00 0.00 H new ATOM 0 HE3 MET A 20 0.103 -1.069 3.807 1.00 0.00 H new ATOM 277 N PRO A 21 -0.263 4.023 7.974 1.00 0.00 N ATOM 278 CA PRO A 21 -1.505 4.066 8.752 1.00 0.00 C ATOM 279 C PRO A 21 -2.293 5.350 8.514 1.00 0.00 C ATOM 280 O PRO A 21 -3.394 5.518 9.038 1.00 0.00 O ATOM 281 CB PRO A 21 -1.018 3.998 10.201 1.00 0.00 C ATOM 282 CG PRO A 21 0.368 4.544 10.162 1.00 0.00 C ATOM 283 CD PRO A 21 0.932 4.145 8.826 1.00 0.00 C ATOM 0 HA PRO A 21 -2.186 3.260 8.479 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -1.656 4.585 10.861 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -1.030 2.974 10.575 1.00 0.00 H new ATOM 0 HG2 PRO A 21 0.364 5.628 10.276 1.00 0.00 H new ATOM 0 HG3 PRO A 21 0.970 4.140 10.976 1.00 0.00 H new ATOM 0 HD2 PRO A 21 1.624 4.894 8.442 1.00 0.00 H new ATOM 0 HD3 PRO A 21 1.481 3.205 8.886 1.00 0.00 H new ATOM 291 N GLN A 22 -1.723 6.251 7.722 1.00 0.00 N ATOM 292 CA GLN A 22 -2.373 7.519 7.416 1.00 0.00 C ATOM 293 C GLN A 22 -2.863 7.546 5.972 1.00 0.00 C ATOM 294 O GLN A 22 -3.856 8.199 5.655 1.00 0.00 O ATOM 295 CB GLN A 22 -1.411 8.683 7.661 1.00 0.00 C ATOM 296 CG GLN A 22 -1.183 8.983 9.134 1.00 0.00 C ATOM 297 CD GLN A 22 -2.306 9.799 9.744 1.00 0.00 C ATOM 298 OE1 GLN A 22 -3.440 9.333 9.852 1.00 0.00 O ATOM 299 NE2 GLN A 22 -1.995 11.026 10.147 1.00 0.00 N ATOM 0 H GLN A 22 -0.812 6.127 7.280 1.00 0.00 H new ATOM 0 HA GLN A 22 -3.235 7.624 8.075 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -0.453 8.457 7.192 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -1.802 9.576 7.173 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -1.082 8.045 9.680 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -0.243 9.522 9.250 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -1.042 11.372 10.038 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -2.709 11.622 10.565 1.00 0.00 H new ATOM 308 N ALA A 23 -2.159 6.830 5.100 1.00 0.00 N ATOM 309 CA ALA A 23 -2.524 6.770 3.690 1.00 0.00 C ATOM 310 C ALA A 23 -3.747 5.886 3.476 1.00 0.00 C ATOM 311 O ALA A 23 -4.808 6.363 3.073 1.00 0.00 O ATOM 312 CB ALA A 23 -1.352 6.263 2.863 1.00 0.00 C ATOM 0 H ALA A 23 -1.333 6.284 5.346 1.00 0.00 H new ATOM 0 HA ALA A 23 -2.776 7.778 3.362 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -1.638 6.223 1.812 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -0.504 6.937 2.983 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -1.073 5.265 3.201 1.00 0.00 H new ATOM 318 N ARG A 24 -3.592 4.594 3.748 1.00 0.00 N ATOM 319 CA ARG A 24 -4.684 3.642 3.583 1.00 0.00 C ATOM 320 C ARG A 24 -5.970 4.176 4.207 1.00 0.00 C ATOM 321 O ARG A 24 -7.061 3.964 3.681 1.00 0.00 O ATOM 322 CB ARG A 24 -4.317 2.298 4.216 1.00 0.00 C ATOM 323 CG ARG A 24 -4.156 2.360 5.726 1.00 0.00 C ATOM 324 CD ARG A 24 -3.806 0.998 6.305 1.00 0.00 C ATOM 325 NE ARG A 24 -4.997 0.202 6.588 1.00 0.00 N ATOM 326 CZ ARG A 24 -4.985 -0.901 7.329 1.00 0.00 C ATOM 327 NH1 ARG A 24 -3.850 -1.335 7.858 1.00 0.00 N ATOM 328 NH2 ARG A 24 -6.111 -1.571 7.542 1.00 0.00 N ATOM 0 H ARG A 24 -2.721 4.183 4.084 1.00 0.00 H new ATOM 0 HA ARG A 24 -4.851 3.500 2.515 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -5.088 1.568 3.971 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -3.387 1.940 3.774 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -3.375 3.076 5.981 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -5.080 2.722 6.177 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -3.168 0.459 5.605 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -3.232 1.130 7.222 1.00 0.00 H new ATOM 0 HE ARG A 24 -5.887 0.509 6.195 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -2.983 -0.822 7.697 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -3.843 -2.182 8.426 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -6.986 -1.239 7.137 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -6.101 -2.418 8.111 1.00 0.00 H new ATOM 342 N ASN A 25 -5.831 4.871 5.332 1.00 0.00 N ATOM 343 CA ASN A 25 -6.982 5.434 6.029 1.00 0.00 C ATOM 344 C ASN A 25 -7.602 6.571 5.222 1.00 0.00 C ATOM 345 O ASN A 25 -8.824 6.722 5.179 1.00 0.00 O ATOM 346 CB ASN A 25 -6.569 5.942 7.412 1.00 0.00 C ATOM 347 CG ASN A 25 -7.422 7.105 7.880 1.00 0.00 C ATOM 348 OD1 ASN A 25 -8.607 7.188 7.558 1.00 0.00 O ATOM 349 ND2 ASN A 25 -6.821 8.010 8.643 1.00 0.00 N ATOM 0 H ASN A 25 -4.934 5.058 5.780 1.00 0.00 H new ATOM 0 HA ASN A 25 -7.726 4.646 6.146 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -6.644 5.127 8.132 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -5.524 6.249 7.386 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -7.344 8.815 8.987 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -5.836 7.900 8.885 1.00 0.00 H new ATOM 356 N PHE A 26 -6.753 7.369 4.584 1.00 0.00 N ATOM 357 CA PHE A 26 -7.217 8.493 3.779 1.00 0.00 C ATOM 358 C PHE A 26 -8.004 8.004 2.566 1.00 0.00 C ATOM 359 O PHE A 26 -9.198 8.273 2.437 1.00 0.00 O ATOM 360 CB PHE A 26 -6.031 9.345 3.322 1.00 0.00 C ATOM 361 CG PHE A 26 -6.409 10.427 2.352 1.00 0.00 C ATOM 362 CD1 PHE A 26 -6.583 10.141 1.008 1.00 0.00 C ATOM 363 CD2 PHE A 26 -6.590 11.731 2.784 1.00 0.00 C ATOM 364 CE1 PHE A 26 -6.930 11.136 0.113 1.00 0.00 C ATOM 365 CE2 PHE A 26 -6.938 12.730 1.894 1.00 0.00 C ATOM 366 CZ PHE A 26 -7.109 12.431 0.557 1.00 0.00 C ATOM 0 H PHE A 26 -5.739 7.258 4.609 1.00 0.00 H new ATOM 0 HA PHE A 26 -7.876 9.103 4.397 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -5.562 9.798 4.195 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -5.286 8.698 2.860 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -6.446 9.129 0.655 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -6.458 11.970 3.829 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -7.061 10.900 -0.933 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -7.076 13.742 2.244 1.00 0.00 H new ATOM 0 HZ PHE A 26 -7.382 13.209 -0.140 1.00 0.00 H new ATOM 376 N CYS A 27 -7.324 7.286 1.678 1.00 0.00 N ATOM 377 CA CYS A 27 -7.957 6.760 0.474 1.00 0.00 C ATOM 378 C CYS A 27 -9.373 6.275 0.772 1.00 0.00 C ATOM 379 O CYS A 27 -10.289 6.477 -0.024 1.00 0.00 O ATOM 380 CB CYS A 27 -7.125 5.615 -0.106 1.00 0.00 C ATOM 381 SG CYS A 27 -5.510 6.132 -0.770 1.00 0.00 S ATOM 0 H CYS A 27 -6.335 7.055 1.770 1.00 0.00 H new ATOM 0 HA CYS A 27 -8.014 7.565 -0.258 1.00 0.00 H new ATOM 0 HB2 CYS A 27 -6.964 4.867 0.671 1.00 0.00 H new ATOM 0 HB3 CYS A 27 -7.695 5.132 -0.900 1.00 0.00 H new ATOM 386 N ALA A 28 -9.543 5.634 1.924 1.00 0.00 N ATOM 387 CA ALA A 28 -10.847 5.122 2.328 1.00 0.00 C ATOM 388 C ALA A 28 -11.875 6.245 2.415 1.00 0.00 C ATOM 389 O ALA A 28 -12.995 6.115 1.922 1.00 0.00 O ATOM 390 CB ALA A 28 -10.739 4.398 3.661 1.00 0.00 C ATOM 0 H ALA A 28 -8.794 5.457 2.594 1.00 0.00 H new ATOM 0 HA ALA A 28 -11.184 4.415 1.569 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -11.720 4.021 3.951 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -10.043 3.564 3.567 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -10.377 5.089 4.422 1.00 0.00 H new ATOM 396 N SER A 29 -11.487 7.349 3.047 1.00 0.00 N ATOM 397 CA SER A 29 -12.376 8.494 3.202 1.00 0.00 C ATOM 398 C SER A 29 -12.777 9.059 1.843 1.00 0.00 C ATOM 399 O SER A 29 -13.935 9.413 1.623 1.00 0.00 O ATOM 400 CB SER A 29 -11.701 9.581 4.041 1.00 0.00 C ATOM 401 OG SER A 29 -11.652 9.213 5.409 1.00 0.00 O ATOM 0 H SER A 29 -10.563 7.474 3.460 1.00 0.00 H new ATOM 0 HA SER A 29 -13.277 8.156 3.715 1.00 0.00 H new ATOM 0 HB2 SER A 29 -10.690 9.755 3.672 1.00 0.00 H new ATOM 0 HB3 SER A 29 -12.246 10.519 3.933 1.00 0.00 H new ATOM 0 HG SER A 29 -11.215 9.923 5.923 1.00 0.00 H new ATOM 407 N ALA A 30 -11.811 9.141 0.935 1.00 0.00 N ATOM 408 CA ALA A 30 -12.062 9.661 -0.403 1.00 0.00 C ATOM 409 C ALA A 30 -12.997 8.742 -1.183 1.00 0.00 C ATOM 410 O ALA A 30 -13.913 9.204 -1.861 1.00 0.00 O ATOM 411 CB ALA A 30 -10.751 9.842 -1.154 1.00 0.00 C ATOM 0 H ALA A 30 -10.847 8.854 1.102 1.00 0.00 H new ATOM 0 HA ALA A 30 -12.548 10.631 -0.303 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -10.954 10.231 -2.152 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -10.116 10.544 -0.613 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -10.243 8.881 -1.236 1.00 0.00 H new ATOM 417 N GLY A 31 -12.758 7.438 -1.081 1.00 0.00 N ATOM 418 CA GLY A 31 -13.587 6.476 -1.783 1.00 0.00 C ATOM 419 C GLY A 31 -12.769 5.429 -2.514 1.00 0.00 C ATOM 420 O GLY A 31 -13.116 5.023 -3.622 1.00 0.00 O ATOM 0 H GLY A 31 -12.006 7.031 -0.525 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -14.249 5.983 -1.071 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -14.221 7.001 -2.497 1.00 0.00 H new ATOM 424 N GLY A 32 -11.678 4.993 -1.892 1.00 0.00 N ATOM 425 CA GLY A 32 -10.824 3.993 -2.506 1.00 0.00 C ATOM 426 C GLY A 32 -9.908 3.319 -1.504 1.00 0.00 C ATOM 427 O GLY A 32 -10.070 3.484 -0.294 1.00 0.00 O ATOM 0 H GLY A 32 -11.370 5.314 -0.974 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -11.444 3.239 -2.992 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -10.223 4.462 -3.285 1.00 0.00 H new ATOM 431 N TYR A 33 -8.944 2.556 -2.006 1.00 0.00 N ATOM 432 CA TYR A 33 -8.000 1.851 -1.147 1.00 0.00 C ATOM 433 C TYR A 33 -6.664 1.648 -1.855 1.00 0.00 C ATOM 434 O TYR A 33 -6.597 1.622 -3.084 1.00 0.00 O ATOM 435 CB TYR A 33 -8.576 0.498 -0.724 1.00 0.00 C ATOM 436 CG TYR A 33 -9.038 -0.353 -1.885 1.00 0.00 C ATOM 437 CD1 TYR A 33 -8.138 -0.801 -2.845 1.00 0.00 C ATOM 438 CD2 TYR A 33 -10.374 -0.710 -2.022 1.00 0.00 C ATOM 439 CE1 TYR A 33 -8.556 -1.578 -3.907 1.00 0.00 C ATOM 440 CE2 TYR A 33 -10.800 -1.489 -3.081 1.00 0.00 C ATOM 441 CZ TYR A 33 -9.887 -1.920 -4.021 1.00 0.00 C ATOM 442 OH TYR A 33 -10.307 -2.695 -5.078 1.00 0.00 O ATOM 0 H TYR A 33 -8.795 2.410 -3.004 1.00 0.00 H new ATOM 0 HA TYR A 33 -7.831 2.461 -0.260 1.00 0.00 H new ATOM 0 HB2 TYR A 33 -7.820 -0.049 -0.161 1.00 0.00 H new ATOM 0 HB3 TYR A 33 -9.416 0.665 -0.050 1.00 0.00 H new ATOM 0 HD1 TYR A 33 -7.094 -0.537 -2.759 1.00 0.00 H new ATOM 0 HD2 TYR A 33 -11.091 -0.373 -1.288 1.00 0.00 H new ATOM 0 HE1 TYR A 33 -7.844 -1.916 -4.645 1.00 0.00 H new ATOM 0 HE2 TYR A 33 -11.842 -1.759 -3.172 1.00 0.00 H new ATOM 0 HH TYR A 33 -10.971 -3.344 -4.764 1.00 0.00 H new ATOM 452 N LEU A 34 -5.602 1.505 -1.070 1.00 0.00 N ATOM 453 CA LEU A 34 -4.266 1.303 -1.620 1.00 0.00 C ATOM 454 C LEU A 34 -4.303 0.340 -2.802 1.00 0.00 C ATOM 455 O LEU A 34 -4.902 -0.732 -2.723 1.00 0.00 O ATOM 456 CB LEU A 34 -3.324 0.768 -0.540 1.00 0.00 C ATOM 457 CG LEU A 34 -2.799 1.796 0.463 1.00 0.00 C ATOM 458 CD1 LEU A 34 -2.024 1.108 1.576 1.00 0.00 C ATOM 459 CD2 LEU A 34 -1.926 2.827 -0.238 1.00 0.00 C ATOM 0 H LEU A 34 -5.640 1.525 -0.051 1.00 0.00 H new ATOM 0 HA LEU A 34 -3.896 2.266 -1.972 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -3.844 -0.015 0.012 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -2.470 0.300 -1.030 1.00 0.00 H new ATOM 0 HG LEU A 34 -3.651 2.311 0.906 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -1.658 1.855 2.280 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -2.678 0.409 2.096 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -1.179 0.566 1.150 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -1.561 3.551 0.491 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -1.079 2.327 -0.708 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -2.512 3.342 -0.999 1.00 0.00 H new ATOM 471 N ALA A 35 -3.656 0.729 -3.896 1.00 0.00 N ATOM 472 CA ALA A 35 -3.612 -0.101 -5.093 1.00 0.00 C ATOM 473 C ALA A 35 -2.524 -1.165 -4.983 1.00 0.00 C ATOM 474 O ALA A 35 -1.335 -0.849 -4.948 1.00 0.00 O ATOM 475 CB ALA A 35 -3.386 0.762 -6.326 1.00 0.00 C ATOM 0 H ALA A 35 -3.155 1.614 -3.978 1.00 0.00 H new ATOM 0 HA ALA A 35 -4.572 -0.608 -5.189 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -3.355 0.129 -7.213 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -4.200 1.481 -6.421 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -2.441 1.296 -6.228 1.00 0.00 H new ATOM 481 N ASP A 36 -2.940 -2.425 -4.928 1.00 0.00 N ATOM 482 CA ASP A 36 -2.001 -3.536 -4.822 1.00 0.00 C ATOM 483 C ASP A 36 -1.108 -3.612 -6.056 1.00 0.00 C ATOM 484 O ASP A 36 -1.343 -2.922 -7.048 1.00 0.00 O ATOM 485 CB ASP A 36 -2.756 -4.854 -4.641 1.00 0.00 C ATOM 486 CG ASP A 36 -3.861 -4.752 -3.608 1.00 0.00 C ATOM 487 OD1 ASP A 36 -3.755 -3.892 -2.710 1.00 0.00 O ATOM 488 OD2 ASP A 36 -4.831 -5.533 -3.698 1.00 0.00 O ATOM 0 H ASP A 36 -3.921 -2.703 -4.955 1.00 0.00 H new ATOM 0 HA ASP A 36 -1.370 -3.365 -3.950 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -3.183 -5.159 -5.596 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -2.054 -5.633 -4.342 1.00 0.00 H new ATOM 493 N ASP A 37 -0.082 -4.453 -5.986 1.00 0.00 N ATOM 494 CA ASP A 37 0.848 -4.619 -7.098 1.00 0.00 C ATOM 495 C ASP A 37 1.122 -6.096 -7.361 1.00 0.00 C ATOM 496 O ASP A 37 2.201 -6.603 -7.053 1.00 0.00 O ATOM 497 CB ASP A 37 2.159 -3.888 -6.807 1.00 0.00 C ATOM 498 CG ASP A 37 1.959 -2.399 -6.601 1.00 0.00 C ATOM 499 OD1 ASP A 37 0.884 -2.009 -6.099 1.00 0.00 O ATOM 500 OD2 ASP A 37 2.878 -1.625 -6.941 1.00 0.00 O ATOM 0 H ASP A 37 0.127 -5.030 -5.172 1.00 0.00 H new ATOM 0 HA ASP A 37 0.391 -4.189 -7.989 1.00 0.00 H new ATOM 0 HB2 ASP A 37 2.620 -4.316 -5.917 1.00 0.00 H new ATOM 0 HB3 ASP A 37 2.852 -4.048 -7.633 1.00 0.00 H new ATOM 505 N LEU A 38 0.137 -6.783 -7.930 1.00 0.00 N ATOM 506 CA LEU A 38 0.271 -8.204 -8.234 1.00 0.00 C ATOM 507 C LEU A 38 0.020 -8.470 -9.715 1.00 0.00 C ATOM 508 O LEU A 38 -1.125 -8.587 -10.149 1.00 0.00 O ATOM 509 CB LEU A 38 -0.703 -9.021 -7.385 1.00 0.00 C ATOM 510 CG LEU A 38 -2.159 -8.554 -7.396 1.00 0.00 C ATOM 511 CD1 LEU A 38 -3.098 -9.728 -7.169 1.00 0.00 C ATOM 512 CD2 LEU A 38 -2.382 -7.479 -6.342 1.00 0.00 C ATOM 0 H LEU A 38 -0.763 -6.379 -8.190 1.00 0.00 H new ATOM 0 HA LEU A 38 1.291 -8.506 -7.997 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -0.672 -10.056 -7.727 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -0.348 -9.015 -6.354 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.376 -8.126 -8.375 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -4.130 -9.376 -7.180 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -2.957 -10.465 -7.960 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -2.881 -10.186 -6.204 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.424 -7.158 -6.364 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -2.147 -7.881 -5.357 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -1.735 -6.626 -6.549 1.00 0.00 H new ATOM 524 N GLY A 39 1.099 -8.567 -10.485 1.00 0.00 N ATOM 525 CA GLY A 39 0.974 -8.821 -11.909 1.00 0.00 C ATOM 526 C GLY A 39 1.928 -7.980 -12.734 1.00 0.00 C ATOM 527 O GLY A 39 1.905 -6.751 -12.661 1.00 0.00 O ATOM 0 H GLY A 39 2.058 -8.474 -10.149 1.00 0.00 H new ATOM 0 HA2 GLY A 39 1.163 -9.877 -12.105 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -0.050 -8.617 -12.223 1.00 0.00 H new ATOM 531 N ASP A 40 2.770 -8.642 -13.519 1.00 0.00 N ATOM 532 CA ASP A 40 3.737 -7.947 -14.362 1.00 0.00 C ATOM 533 C ASP A 40 3.110 -6.714 -15.005 1.00 0.00 C ATOM 534 O ASP A 40 3.753 -5.671 -15.128 1.00 0.00 O ATOM 535 CB ASP A 40 4.271 -8.887 -15.444 1.00 0.00 C ATOM 536 CG ASP A 40 4.366 -10.323 -14.968 1.00 0.00 C ATOM 537 OD1 ASP A 40 5.062 -10.569 -13.961 1.00 0.00 O ATOM 538 OD2 ASP A 40 3.745 -11.201 -15.603 1.00 0.00 O ATOM 0 H ASP A 40 2.803 -9.659 -13.590 1.00 0.00 H new ATOM 0 HA ASP A 40 4.566 -7.624 -13.732 1.00 0.00 H new ATOM 0 HB2 ASP A 40 3.620 -8.839 -16.317 1.00 0.00 H new ATOM 0 HB3 ASP A 40 5.256 -8.547 -15.763 1.00 0.00 H new ATOM 543 N ASP A 41 1.853 -6.841 -15.415 1.00 0.00 N ATOM 544 CA ASP A 41 1.139 -5.737 -16.046 1.00 0.00 C ATOM 545 C ASP A 41 0.947 -4.584 -15.066 1.00 0.00 C ATOM 546 O ASP A 41 1.037 -3.415 -15.441 1.00 0.00 O ATOM 547 CB ASP A 41 -0.218 -6.211 -16.568 1.00 0.00 C ATOM 548 CG ASP A 41 -0.815 -5.255 -17.581 1.00 0.00 C ATOM 549 OD1 ASP A 41 -1.008 -4.070 -17.236 1.00 0.00 O ATOM 550 OD2 ASP A 41 -1.090 -5.691 -18.719 1.00 0.00 O ATOM 0 H ASP A 41 1.307 -7.698 -15.322 1.00 0.00 H new ATOM 0 HA ASP A 41 1.738 -5.381 -16.885 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -0.105 -7.195 -17.024 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -0.906 -6.325 -15.731 1.00 0.00 H new ATOM 555 N LYS A 42 0.680 -4.921 -13.809 1.00 0.00 N ATOM 556 CA LYS A 42 0.474 -3.915 -12.774 1.00 0.00 C ATOM 557 C LYS A 42 1.805 -3.339 -12.302 1.00 0.00 C ATOM 558 O LYS A 42 1.911 -2.147 -12.018 1.00 0.00 O ATOM 559 CB LYS A 42 -0.281 -4.520 -11.588 1.00 0.00 C ATOM 560 CG LYS A 42 -1.149 -3.520 -10.845 1.00 0.00 C ATOM 561 CD LYS A 42 -2.425 -3.212 -11.611 1.00 0.00 C ATOM 562 CE LYS A 42 -2.930 -1.808 -11.312 1.00 0.00 C ATOM 563 NZ LYS A 42 -4.020 -1.401 -12.241 1.00 0.00 N ATOM 0 H LYS A 42 0.601 -5.884 -13.482 1.00 0.00 H new ATOM 0 HA LYS A 42 -0.120 -3.107 -13.201 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -0.908 -5.337 -11.946 1.00 0.00 H new ATOM 0 HB3 LYS A 42 0.438 -4.951 -10.892 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -1.401 -3.916 -9.861 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -0.589 -2.599 -10.684 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -2.242 -3.314 -12.681 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -3.193 -3.940 -11.348 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -3.293 -1.764 -10.285 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -2.104 -1.101 -11.389 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -4.337 -0.439 -12.004 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -3.667 -1.419 -13.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -4.819 -2.061 -12.149 1.00 0.00 H new ATOM 577 N ASN A 43 2.820 -4.194 -12.223 1.00 0.00 N ATOM 578 CA ASN A 43 4.145 -3.770 -11.786 1.00 0.00 C ATOM 579 C ASN A 43 4.821 -2.914 -12.853 1.00 0.00 C ATOM 580 O ASN A 43 5.232 -1.785 -12.590 1.00 0.00 O ATOM 581 CB ASN A 43 5.014 -4.988 -11.467 1.00 0.00 C ATOM 582 CG ASN A 43 6.494 -4.658 -11.467 1.00 0.00 C ATOM 583 OD1 ASN A 43 7.138 -4.643 -10.418 1.00 0.00 O ATOM 584 ND2 ASN A 43 7.041 -4.390 -12.647 1.00 0.00 N ATOM 0 H ASN A 43 2.750 -5.185 -12.456 1.00 0.00 H new ATOM 0 HA ASN A 43 4.028 -3.170 -10.884 1.00 0.00 H new ATOM 0 HB2 ASN A 43 4.733 -5.386 -10.492 1.00 0.00 H new ATOM 0 HB3 ASN A 43 4.819 -5.772 -12.199 1.00 0.00 H new ATOM 0 HD21 ASN A 43 8.033 -4.160 -12.709 1.00 0.00 H new ATOM 0 HD22 ASN A 43 6.469 -4.414 -13.491 1.00 0.00 H new ATOM 591 N ASN A 44 4.931 -3.461 -14.060 1.00 0.00 N ATOM 592 CA ASN A 44 5.557 -2.748 -15.168 1.00 0.00 C ATOM 593 C ASN A 44 4.798 -1.463 -15.486 1.00 0.00 C ATOM 594 O ASN A 44 5.355 -0.525 -16.057 1.00 0.00 O ATOM 595 CB ASN A 44 5.614 -3.640 -16.409 1.00 0.00 C ATOM 596 CG ASN A 44 4.389 -3.484 -17.290 1.00 0.00 C ATOM 597 OD1 ASN A 44 4.060 -2.380 -17.723 1.00 0.00 O ATOM 598 ND2 ASN A 44 3.709 -4.592 -17.559 1.00 0.00 N ATOM 0 H ASN A 44 4.595 -4.395 -14.295 1.00 0.00 H new ATOM 0 HA ASN A 44 6.572 -2.486 -14.871 1.00 0.00 H new ATOM 0 HB2 ASN A 44 6.506 -3.398 -16.986 1.00 0.00 H new ATOM 0 HB3 ASN A 44 5.706 -4.681 -16.101 1.00 0.00 H new ATOM 0 HD21 ASN A 44 2.876 -4.549 -18.147 1.00 0.00 H new ATOM 0 HD22 ASN A 44 4.019 -5.486 -17.178 1.00 0.00 H new ATOM 605 N PHE A 45 3.524 -1.427 -15.111 1.00 0.00 N ATOM 606 CA PHE A 45 2.688 -0.258 -15.357 1.00 0.00 C ATOM 607 C PHE A 45 3.041 0.875 -14.397 1.00 0.00 C ATOM 608 O PHE A 45 3.206 2.023 -14.809 1.00 0.00 O ATOM 609 CB PHE A 45 1.209 -0.622 -15.210 1.00 0.00 C ATOM 610 CG PHE A 45 0.328 0.556 -14.904 1.00 0.00 C ATOM 611 CD1 PHE A 45 -0.165 1.352 -15.925 1.00 0.00 C ATOM 612 CD2 PHE A 45 -0.005 0.867 -13.596 1.00 0.00 C ATOM 613 CE1 PHE A 45 -0.976 2.437 -15.647 1.00 0.00 C ATOM 614 CE2 PHE A 45 -0.815 1.950 -13.312 1.00 0.00 C ATOM 615 CZ PHE A 45 -1.300 2.737 -14.339 1.00 0.00 C ATOM 0 H PHE A 45 3.048 -2.194 -14.636 1.00 0.00 H new ATOM 0 HA PHE A 45 2.873 0.081 -16.376 1.00 0.00 H new ATOM 0 HB2 PHE A 45 0.866 -1.092 -16.131 1.00 0.00 H new ATOM 0 HB3 PHE A 45 1.102 -1.361 -14.416 1.00 0.00 H new ATOM 0 HD1 PHE A 45 0.087 1.123 -16.950 1.00 0.00 H new ATOM 0 HD2 PHE A 45 0.373 0.256 -12.789 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -1.355 3.049 -16.452 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -1.069 2.181 -12.288 1.00 0.00 H new ATOM 0 HZ PHE A 45 -1.931 3.585 -14.119 1.00 0.00 H new ATOM 625 N TYR A 46 3.157 0.543 -13.116 1.00 0.00 N ATOM 626 CA TYR A 46 3.488 1.531 -12.097 1.00 0.00 C ATOM 627 C TYR A 46 4.812 2.220 -12.416 1.00 0.00 C ATOM 628 O TYR A 46 4.892 3.448 -12.456 1.00 0.00 O ATOM 629 CB TYR A 46 3.563 0.870 -10.720 1.00 0.00 C ATOM 630 CG TYR A 46 2.231 0.355 -10.222 1.00 0.00 C ATOM 631 CD1 TYR A 46 1.109 1.174 -10.209 1.00 0.00 C ATOM 632 CD2 TYR A 46 2.096 -0.950 -9.765 1.00 0.00 C ATOM 633 CE1 TYR A 46 -0.110 0.708 -9.754 1.00 0.00 C ATOM 634 CE2 TYR A 46 0.881 -1.425 -9.310 1.00 0.00 C ATOM 635 CZ TYR A 46 -0.219 -0.592 -9.306 1.00 0.00 C ATOM 636 OH TYR A 46 -1.431 -1.060 -8.853 1.00 0.00 O ATOM 0 H TYR A 46 3.027 -0.403 -12.759 1.00 0.00 H new ATOM 0 HA TYR A 46 2.700 2.284 -12.088 1.00 0.00 H new ATOM 0 HB2 TYR A 46 4.271 0.042 -10.762 1.00 0.00 H new ATOM 0 HB3 TYR A 46 3.956 1.589 -10.002 1.00 0.00 H new ATOM 0 HD1 TYR A 46 1.191 2.192 -10.560 1.00 0.00 H new ATOM 0 HD2 TYR A 46 2.955 -1.604 -9.765 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -0.972 1.358 -9.749 1.00 0.00 H new ATOM 0 HE2 TYR A 46 0.793 -2.443 -8.959 1.00 0.00 H new ATOM 0 HH TYR A 46 -1.293 -1.597 -8.045 1.00 0.00 H new ATOM 646 N SER A 47 5.848 1.419 -12.642 1.00 0.00 N ATOM 647 CA SER A 47 7.170 1.950 -12.955 1.00 0.00 C ATOM 648 C SER A 47 7.062 3.207 -13.812 1.00 0.00 C ATOM 649 O SER A 47 7.843 4.146 -13.658 1.00 0.00 O ATOM 650 CB SER A 47 8.008 0.895 -13.680 1.00 0.00 C ATOM 651 OG SER A 47 9.356 1.312 -13.805 1.00 0.00 O ATOM 0 H SER A 47 5.798 0.401 -12.614 1.00 0.00 H new ATOM 0 HA SER A 47 7.660 2.212 -12.017 1.00 0.00 H new ATOM 0 HB2 SER A 47 7.965 -0.047 -13.133 1.00 0.00 H new ATOM 0 HB3 SER A 47 7.588 0.709 -14.669 1.00 0.00 H new ATOM 0 HG SER A 47 9.833 0.701 -14.404 1.00 0.00 H new ATOM 657 N SER A 48 6.088 3.217 -14.716 1.00 0.00 N ATOM 658 CA SER A 48 5.879 4.357 -15.602 1.00 0.00 C ATOM 659 C SER A 48 5.568 5.617 -14.801 1.00 0.00 C ATOM 660 O SER A 48 6.329 6.585 -14.827 1.00 0.00 O ATOM 661 CB SER A 48 4.739 4.067 -16.580 1.00 0.00 C ATOM 662 OG SER A 48 4.665 5.062 -17.587 1.00 0.00 O ATOM 0 H SER A 48 5.431 2.449 -14.855 1.00 0.00 H new ATOM 0 HA SER A 48 6.798 4.522 -16.164 1.00 0.00 H new ATOM 0 HB2 SER A 48 4.890 3.090 -17.040 1.00 0.00 H new ATOM 0 HB3 SER A 48 3.794 4.022 -16.039 1.00 0.00 H new ATOM 0 HG SER A 48 3.930 4.853 -18.200 1.00 0.00 H new ATOM 668 N ILE A 49 4.446 5.597 -14.090 1.00 0.00 N ATOM 669 CA ILE A 49 4.035 6.737 -13.280 1.00 0.00 C ATOM 670 C ILE A 49 4.916 6.880 -12.044 1.00 0.00 C ATOM 671 O ILE A 49 4.882 7.902 -11.360 1.00 0.00 O ATOM 672 CB ILE A 49 2.565 6.612 -12.837 1.00 0.00 C ATOM 673 CG1 ILE A 49 2.397 5.433 -11.877 1.00 0.00 C ATOM 674 CG2 ILE A 49 1.659 6.449 -14.048 1.00 0.00 C ATOM 675 CD1 ILE A 49 1.128 5.497 -11.057 1.00 0.00 C ATOM 0 H ILE A 49 3.805 4.804 -14.058 1.00 0.00 H new ATOM 0 HA ILE A 49 4.144 7.623 -13.905 1.00 0.00 H new ATOM 0 HB ILE A 49 2.280 7.525 -12.314 1.00 0.00 H new ATOM 0 HG12 ILE A 49 2.404 4.505 -12.449 1.00 0.00 H new ATOM 0 HG13 ILE A 49 3.254 5.398 -11.204 1.00 0.00 H new ATOM 0 HG21 ILE A 49 0.624 6.362 -13.719 1.00 0.00 H new ATOM 0 HG22 ILE A 49 1.761 7.318 -14.698 1.00 0.00 H new ATOM 0 HG23 ILE A 49 1.942 5.550 -14.596 1.00 0.00 H new ATOM 0 HD11 ILE A 49 1.076 4.629 -10.399 1.00 0.00 H new ATOM 0 HD12 ILE A 49 1.128 6.407 -10.458 1.00 0.00 H new ATOM 0 HD13 ILE A 49 0.265 5.500 -11.722 1.00 0.00 H new ATOM 687 N ALA A 50 5.706 5.848 -11.765 1.00 0.00 N ATOM 688 CA ALA A 50 6.600 5.860 -10.613 1.00 0.00 C ATOM 689 C ALA A 50 8.004 6.300 -11.013 1.00 0.00 C ATOM 690 O ALA A 50 8.981 5.977 -10.338 1.00 0.00 O ATOM 691 CB ALA A 50 6.640 4.486 -9.962 1.00 0.00 C ATOM 0 H ALA A 50 5.745 4.994 -12.321 1.00 0.00 H new ATOM 0 HA ALA A 50 6.214 6.580 -9.891 1.00 0.00 H new ATOM 0 HB1 ALA A 50 7.311 4.510 -9.103 1.00 0.00 H new ATOM 0 HB2 ALA A 50 5.638 4.210 -9.632 1.00 0.00 H new ATOM 0 HB3 ALA A 50 6.999 3.752 -10.683 1.00 0.00 H new ATOM 697 N ALA A 51 8.097 7.038 -12.114 1.00 0.00 N ATOM 698 CA ALA A 51 9.382 7.523 -12.602 1.00 0.00 C ATOM 699 C ALA A 51 10.181 8.182 -11.483 1.00 0.00 C ATOM 700 O ALA A 51 10.050 9.380 -11.236 1.00 0.00 O ATOM 701 CB ALA A 51 9.176 8.499 -13.751 1.00 0.00 C ATOM 0 H ALA A 51 7.298 7.313 -12.685 1.00 0.00 H new ATOM 0 HA ALA A 51 9.951 6.667 -12.964 1.00 0.00 H new ATOM 0 HB1 ALA A 51 10.144 8.853 -14.106 1.00 0.00 H new ATOM 0 HB2 ALA A 51 8.653 7.997 -14.565 1.00 0.00 H new ATOM 0 HB3 ALA A 51 8.583 9.347 -13.407 1.00 0.00 H new ATOM 707 N ASN A 52 11.010 7.391 -10.809 1.00 0.00 N ATOM 708 CA ASN A 52 11.830 7.898 -9.715 1.00 0.00 C ATOM 709 C ASN A 52 10.957 8.406 -8.571 1.00 0.00 C ATOM 710 O ASN A 52 11.254 9.430 -7.955 1.00 0.00 O ATOM 711 CB ASN A 52 12.743 9.021 -10.212 1.00 0.00 C ATOM 712 CG ASN A 52 13.691 8.556 -11.300 1.00 0.00 C ATOM 713 OD1 ASN A 52 14.856 8.258 -11.037 1.00 0.00 O ATOM 714 ND2 ASN A 52 13.195 8.493 -12.530 1.00 0.00 N ATOM 0 H ASN A 52 11.131 6.397 -11.001 1.00 0.00 H new ATOM 0 HA ASN A 52 12.444 7.077 -9.344 1.00 0.00 H new ATOM 0 HB2 ASN A 52 12.133 9.841 -10.591 1.00 0.00 H new ATOM 0 HB3 ASN A 52 13.320 9.414 -9.375 1.00 0.00 H new ATOM 0 HD21 ASN A 52 13.786 8.188 -13.303 1.00 0.00 H new ATOM 0 HD22 ASN A 52 12.223 8.750 -12.702 1.00 0.00 H new ATOM 721 N THR A 53 9.878 7.682 -8.291 1.00 0.00 N ATOM 722 CA THR A 53 8.961 8.058 -7.223 1.00 0.00 C ATOM 723 C THR A 53 8.699 6.885 -6.284 1.00 0.00 C ATOM 724 O THR A 53 8.467 5.762 -6.730 1.00 0.00 O ATOM 725 CB THR A 53 7.618 8.560 -7.785 1.00 0.00 C ATOM 726 OG1 THR A 53 7.841 9.649 -8.688 1.00 0.00 O ATOM 727 CG2 THR A 53 6.694 9.007 -6.662 1.00 0.00 C ATOM 0 H THR A 53 9.618 6.831 -8.790 1.00 0.00 H new ATOM 0 HA THR A 53 9.438 8.865 -6.668 1.00 0.00 H new ATOM 0 HB THR A 53 7.143 7.737 -8.319 1.00 0.00 H new ATOM 0 HG1 THR A 53 6.982 9.961 -9.042 1.00 0.00 H new ATOM 0 HG21 THR A 53 5.752 9.357 -7.084 1.00 0.00 H new ATOM 0 HG22 THR A 53 6.502 8.168 -5.993 1.00 0.00 H new ATOM 0 HG23 THR A 53 7.165 9.816 -6.104 1.00 0.00 H new ATOM 735 N GLN A 54 8.739 7.154 -4.983 1.00 0.00 N ATOM 736 CA GLN A 54 8.506 6.120 -3.982 1.00 0.00 C ATOM 737 C GLN A 54 7.172 6.337 -3.276 1.00 0.00 C ATOM 738 O GLN A 54 6.983 7.331 -2.575 1.00 0.00 O ATOM 739 CB GLN A 54 9.643 6.106 -2.959 1.00 0.00 C ATOM 740 CG GLN A 54 11.021 5.962 -3.582 1.00 0.00 C ATOM 741 CD GLN A 54 12.139 6.145 -2.575 1.00 0.00 C ATOM 742 OE1 GLN A 54 11.929 6.021 -1.368 1.00 0.00 O ATOM 743 NE2 GLN A 54 13.337 6.440 -3.066 1.00 0.00 N ATOM 0 H GLN A 54 8.930 8.079 -4.598 1.00 0.00 H new ATOM 0 HA GLN A 54 8.474 5.157 -4.491 1.00 0.00 H new ATOM 0 HB2 GLN A 54 9.610 7.029 -2.379 1.00 0.00 H new ATOM 0 HB3 GLN A 54 9.482 5.285 -2.261 1.00 0.00 H new ATOM 0 HG2 GLN A 54 11.107 4.977 -4.040 1.00 0.00 H new ATOM 0 HG3 GLN A 54 11.133 6.695 -4.381 1.00 0.00 H new ATOM 0 HE21 GLN A 54 13.466 6.533 -4.073 1.00 0.00 H new ATOM 0 HE22 GLN A 54 14.128 6.573 -2.436 1.00 0.00 H new ATOM 752 N PHE A 55 6.249 5.399 -3.464 1.00 0.00 N ATOM 753 CA PHE A 55 4.931 5.489 -2.846 1.00 0.00 C ATOM 754 C PHE A 55 4.565 4.179 -2.154 1.00 0.00 C ATOM 755 O PHE A 55 5.217 3.154 -2.357 1.00 0.00 O ATOM 756 CB PHE A 55 3.874 5.837 -3.896 1.00 0.00 C ATOM 757 CG PHE A 55 3.725 4.792 -4.965 1.00 0.00 C ATOM 758 CD1 PHE A 55 4.707 4.620 -5.927 1.00 0.00 C ATOM 759 CD2 PHE A 55 2.602 3.982 -5.008 1.00 0.00 C ATOM 760 CE1 PHE A 55 4.571 3.660 -6.912 1.00 0.00 C ATOM 761 CE2 PHE A 55 2.460 3.020 -5.990 1.00 0.00 C ATOM 762 CZ PHE A 55 3.447 2.858 -6.943 1.00 0.00 C ATOM 0 H PHE A 55 6.389 4.568 -4.039 1.00 0.00 H new ATOM 0 HA PHE A 55 4.962 6.280 -2.096 1.00 0.00 H new ATOM 0 HB2 PHE A 55 2.913 5.978 -3.400 1.00 0.00 H new ATOM 0 HB3 PHE A 55 4.135 6.787 -4.362 1.00 0.00 H new ATOM 0 HD1 PHE A 55 5.589 5.243 -5.907 1.00 0.00 H new ATOM 0 HD2 PHE A 55 1.828 4.104 -4.265 1.00 0.00 H new ATOM 0 HE1 PHE A 55 5.343 3.537 -7.657 1.00 0.00 H new ATOM 0 HE2 PHE A 55 1.579 2.396 -6.012 1.00 0.00 H new ATOM 0 HZ PHE A 55 3.340 2.106 -7.711 1.00 0.00 H new ATOM 772 N TRP A 56 3.520 4.221 -1.337 1.00 0.00 N ATOM 773 CA TRP A 56 3.067 3.038 -0.614 1.00 0.00 C ATOM 774 C TRP A 56 2.215 2.145 -1.510 1.00 0.00 C ATOM 775 O TRP A 56 1.767 2.567 -2.577 1.00 0.00 O ATOM 776 CB TRP A 56 2.269 3.446 0.625 1.00 0.00 C ATOM 777 CG TRP A 56 3.105 4.106 1.679 1.00 0.00 C ATOM 778 CD1 TRP A 56 3.021 5.402 2.100 1.00 0.00 C ATOM 779 CD2 TRP A 56 4.153 3.501 2.444 1.00 0.00 C ATOM 780 NE1 TRP A 56 3.954 5.640 3.081 1.00 0.00 N ATOM 781 CE2 TRP A 56 4.661 4.489 3.311 1.00 0.00 C ATOM 782 CE3 TRP A 56 4.711 2.220 2.484 1.00 0.00 C ATOM 783 CZ2 TRP A 56 5.699 4.235 4.203 1.00 0.00 C ATOM 784 CZ3 TRP A 56 5.742 1.970 3.369 1.00 0.00 C ATOM 785 CH2 TRP A 56 6.227 2.972 4.220 1.00 0.00 C ATOM 0 H TRP A 56 2.970 5.061 -1.158 1.00 0.00 H new ATOM 0 HA TRP A 56 3.947 2.475 -0.302 1.00 0.00 H new ATOM 0 HB2 TRP A 56 1.470 4.125 0.327 1.00 0.00 H new ATOM 0 HB3 TRP A 56 1.793 2.562 1.049 1.00 0.00 H new ATOM 0 HD1 TRP A 56 2.324 6.133 1.718 1.00 0.00 H new ATOM 0 HE1 TRP A 56 4.097 6.529 3.560 1.00 0.00 H new ATOM 0 HE3 TRP A 56 4.343 1.440 1.835 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 6.075 5.007 4.858 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 6.182 0.984 3.406 1.00 0.00 H new ATOM 0 HH2 TRP A 56 7.033 2.744 4.902 1.00 0.00 H new ATOM 796 N ILE A 57 1.996 0.910 -1.071 1.00 0.00 N ATOM 797 CA ILE A 57 1.197 -0.041 -1.834 1.00 0.00 C ATOM 798 C ILE A 57 0.337 -0.900 -0.914 1.00 0.00 C ATOM 799 O ILE A 57 0.434 -0.807 0.309 1.00 0.00 O ATOM 800 CB ILE A 57 2.085 -0.960 -2.694 1.00 0.00 C ATOM 801 CG1 ILE A 57 3.131 -1.657 -1.821 1.00 0.00 C ATOM 802 CG2 ILE A 57 2.758 -0.162 -3.801 1.00 0.00 C ATOM 803 CD1 ILE A 57 4.079 -2.540 -2.603 1.00 0.00 C ATOM 0 H ILE A 57 2.361 0.545 -0.191 1.00 0.00 H new ATOM 0 HA ILE A 57 0.551 0.544 -2.489 1.00 0.00 H new ATOM 0 HB ILE A 57 1.456 -1.722 -3.154 1.00 0.00 H new ATOM 0 HG12 ILE A 57 3.708 -0.902 -1.286 1.00 0.00 H new ATOM 0 HG13 ILE A 57 2.622 -2.260 -1.070 1.00 0.00 H new ATOM 0 HG21 ILE A 57 3.382 -0.825 -4.400 1.00 0.00 H new ATOM 0 HG22 ILE A 57 1.997 0.292 -4.436 1.00 0.00 H new ATOM 0 HG23 ILE A 57 3.377 0.620 -3.361 1.00 0.00 H new ATOM 0 HD11 ILE A 57 4.793 -3.002 -1.921 1.00 0.00 H new ATOM 0 HD12 ILE A 57 3.513 -3.317 -3.116 1.00 0.00 H new ATOM 0 HD13 ILE A 57 4.616 -1.938 -3.336 1.00 0.00 H new ATOM 815 N GLY A 58 -0.504 -1.738 -1.511 1.00 0.00 N ATOM 816 CA GLY A 58 -1.368 -2.604 -0.729 1.00 0.00 C ATOM 817 C GLY A 58 -0.595 -3.663 0.031 1.00 0.00 C ATOM 818 O GLY A 58 -1.116 -4.272 0.966 1.00 0.00 O ATOM 0 H GLY A 58 -0.603 -1.833 -2.522 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -1.940 -2.000 -0.024 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -2.087 -3.088 -1.390 1.00 0.00 H new ATOM 822 N LEU A 59 0.652 -3.884 -0.370 1.00 0.00 N ATOM 823 CA LEU A 59 1.500 -4.878 0.278 1.00 0.00 C ATOM 824 C LEU A 59 1.999 -4.371 1.628 1.00 0.00 C ATOM 825 O LEU A 59 2.686 -3.353 1.704 1.00 0.00 O ATOM 826 CB LEU A 59 2.688 -5.228 -0.619 1.00 0.00 C ATOM 827 CG LEU A 59 3.422 -6.528 -0.285 1.00 0.00 C ATOM 828 CD1 LEU A 59 2.502 -7.724 -0.476 1.00 0.00 C ATOM 829 CD2 LEU A 59 4.670 -6.671 -1.143 1.00 0.00 C ATOM 0 H LEU A 59 1.098 -3.388 -1.141 1.00 0.00 H new ATOM 0 HA LEU A 59 0.903 -5.775 0.445 1.00 0.00 H new ATOM 0 HB2 LEU A 59 2.335 -5.288 -1.648 1.00 0.00 H new ATOM 0 HB3 LEU A 59 3.405 -4.408 -0.575 1.00 0.00 H new ATOM 0 HG LEU A 59 3.726 -6.493 0.761 1.00 0.00 H new ATOM 0 HD11 LEU A 59 3.041 -8.640 -0.234 1.00 0.00 H new ATOM 0 HD12 LEU A 59 1.638 -7.627 0.181 1.00 0.00 H new ATOM 0 HD13 LEU A 59 2.167 -7.763 -1.512 1.00 0.00 H new ATOM 0 HD21 LEU A 59 5.180 -7.601 -0.892 1.00 0.00 H new ATOM 0 HD22 LEU A 59 4.388 -6.684 -2.196 1.00 0.00 H new ATOM 0 HD23 LEU A 59 5.338 -5.830 -0.957 1.00 0.00 H new ATOM 841 N PHE A 60 1.651 -5.090 2.690 1.00 0.00 N ATOM 842 CA PHE A 60 2.064 -4.713 4.037 1.00 0.00 C ATOM 843 C PHE A 60 2.177 -5.942 4.934 1.00 0.00 C ATOM 844 O PHE A 60 1.409 -6.896 4.801 1.00 0.00 O ATOM 845 CB PHE A 60 1.071 -3.717 4.639 1.00 0.00 C ATOM 846 CG PHE A 60 -0.310 -4.281 4.817 1.00 0.00 C ATOM 847 CD1 PHE A 60 -0.588 -5.148 5.861 1.00 0.00 C ATOM 848 CD2 PHE A 60 -1.329 -3.944 3.941 1.00 0.00 C ATOM 849 CE1 PHE A 60 -1.858 -5.669 6.027 1.00 0.00 C ATOM 850 CE2 PHE A 60 -2.600 -4.461 4.102 1.00 0.00 C ATOM 851 CZ PHE A 60 -2.865 -5.324 5.147 1.00 0.00 C ATOM 0 H PHE A 60 1.084 -5.937 2.644 1.00 0.00 H new ATOM 0 HA PHE A 60 3.044 -4.241 3.971 1.00 0.00 H new ATOM 0 HB2 PHE A 60 1.446 -3.382 5.606 1.00 0.00 H new ATOM 0 HB3 PHE A 60 1.016 -2.838 3.997 1.00 0.00 H new ATOM 0 HD1 PHE A 60 0.196 -5.420 6.553 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -1.127 -3.269 3.122 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -2.062 -6.345 6.844 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -3.385 -4.191 3.412 1.00 0.00 H new ATOM 0 HZ PHE A 60 -3.858 -5.728 5.276 1.00 0.00 H new ATOM 861 N LYS A 61 3.140 -5.913 5.849 1.00 0.00 N ATOM 862 CA LYS A 61 3.355 -7.022 6.771 1.00 0.00 C ATOM 863 C LYS A 61 2.314 -7.012 7.886 1.00 0.00 C ATOM 864 O LYS A 61 1.858 -5.953 8.312 1.00 0.00 O ATOM 865 CB LYS A 61 4.761 -6.949 7.370 1.00 0.00 C ATOM 866 CG LYS A 61 5.062 -8.068 8.352 1.00 0.00 C ATOM 867 CD LYS A 61 6.558 -8.250 8.548 1.00 0.00 C ATOM 868 CE LYS A 61 7.155 -9.152 7.479 1.00 0.00 C ATOM 869 NZ LYS A 61 8.637 -9.244 7.595 1.00 0.00 N ATOM 0 H LYS A 61 3.785 -5.132 5.972 1.00 0.00 H new ATOM 0 HA LYS A 61 3.253 -7.952 6.212 1.00 0.00 H new ATOM 0 HB2 LYS A 61 5.493 -6.979 6.563 1.00 0.00 H new ATOM 0 HB3 LYS A 61 4.882 -5.991 7.875 1.00 0.00 H new ATOM 0 HG2 LYS A 61 4.593 -7.848 9.311 1.00 0.00 H new ATOM 0 HG3 LYS A 61 4.626 -8.999 7.989 1.00 0.00 H new ATOM 0 HD2 LYS A 61 7.050 -7.278 8.522 1.00 0.00 H new ATOM 0 HD3 LYS A 61 6.748 -8.677 9.533 1.00 0.00 H new ATOM 0 HE2 LYS A 61 6.722 -10.149 7.561 1.00 0.00 H new ATOM 0 HE3 LYS A 61 6.891 -8.770 6.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 9.006 -9.868 6.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 9.053 -8.296 7.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 8.889 -9.632 8.526 1.00 0.00 H new ATOM 883 N ASN A 62 1.944 -8.200 8.355 1.00 0.00 N ATOM 884 CA ASN A 62 0.958 -8.327 9.421 1.00 0.00 C ATOM 885 C ASN A 62 1.619 -8.774 10.722 1.00 0.00 C ATOM 886 O ASN A 62 2.832 -8.973 10.778 1.00 0.00 O ATOM 887 CB ASN A 62 -0.131 -9.325 9.021 1.00 0.00 C ATOM 888 CG ASN A 62 -1.468 -9.008 9.662 1.00 0.00 C ATOM 889 OD1 ASN A 62 -1.662 -7.928 10.220 1.00 0.00 O ATOM 890 ND2 ASN A 62 -2.399 -9.952 9.584 1.00 0.00 N ATOM 0 H ASN A 62 2.312 -9.088 8.013 1.00 0.00 H new ATOM 0 HA ASN A 62 0.504 -7.349 9.581 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -0.241 -9.323 7.937 1.00 0.00 H new ATOM 0 HB3 ASN A 62 0.178 -10.330 9.308 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -3.319 -9.796 9.996 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -2.194 -10.833 9.112 1.00 0.00 H new ATOM 897 N SER A 63 0.811 -8.929 11.767 1.00 0.00 N ATOM 898 CA SER A 63 1.317 -9.348 13.068 1.00 0.00 C ATOM 899 C SER A 63 2.065 -10.674 12.959 1.00 0.00 C ATOM 900 O SER A 63 3.248 -10.761 13.287 1.00 0.00 O ATOM 901 CB SER A 63 0.167 -9.479 14.068 1.00 0.00 C ATOM 902 OG SER A 63 -0.161 -8.223 14.637 1.00 0.00 O ATOM 0 H SER A 63 -0.196 -8.771 11.737 1.00 0.00 H new ATOM 0 HA SER A 63 2.012 -8.587 13.422 1.00 0.00 H new ATOM 0 HB2 SER A 63 -0.708 -9.895 13.568 1.00 0.00 H new ATOM 0 HB3 SER A 63 0.445 -10.178 14.857 1.00 0.00 H new ATOM 0 HG SER A 63 -0.900 -8.334 15.271 1.00 0.00 H new ATOM 908 N ASP A 64 1.365 -11.704 12.497 1.00 0.00 N ATOM 909 CA ASP A 64 1.961 -13.026 12.343 1.00 0.00 C ATOM 910 C ASP A 64 3.340 -12.928 11.697 1.00 0.00 C ATOM 911 O ASP A 64 4.290 -13.574 12.138 1.00 0.00 O ATOM 912 CB ASP A 64 1.052 -13.924 11.501 1.00 0.00 C ATOM 913 CG ASP A 64 0.047 -14.682 12.344 1.00 0.00 C ATOM 914 OD1 ASP A 64 0.387 -15.047 13.489 1.00 0.00 O ATOM 915 OD2 ASP A 64 -1.081 -14.913 11.859 1.00 0.00 O ATOM 0 H ASP A 64 0.384 -11.649 12.223 1.00 0.00 H new ATOM 0 HA ASP A 64 2.074 -13.465 13.334 1.00 0.00 H new ATOM 0 HB2 ASP A 64 0.522 -13.315 10.769 1.00 0.00 H new ATOM 0 HB3 ASP A 64 1.663 -14.634 10.943 1.00 0.00 H new ATOM 920 N GLY A 65 3.441 -12.117 10.649 1.00 0.00 N ATOM 921 CA GLY A 65 4.707 -11.951 9.959 1.00 0.00 C ATOM 922 C GLY A 65 4.582 -12.154 8.462 1.00 0.00 C ATOM 923 O GLY A 65 5.586 -12.218 7.753 1.00 0.00 O ATOM 0 H GLY A 65 2.669 -11.572 10.265 1.00 0.00 H new ATOM 0 HA2 GLY A 65 5.096 -10.952 10.156 1.00 0.00 H new ATOM 0 HA3 GLY A 65 5.431 -12.660 10.360 1.00 0.00 H new ATOM 927 N GLN A 66 3.347 -12.258 7.981 1.00 0.00 N ATOM 928 CA GLN A 66 3.096 -12.458 6.559 1.00 0.00 C ATOM 929 C GLN A 66 2.693 -11.150 5.888 1.00 0.00 C ATOM 930 O GLN A 66 2.276 -10.201 6.553 1.00 0.00 O ATOM 931 CB GLN A 66 2.002 -13.508 6.355 1.00 0.00 C ATOM 932 CG GLN A 66 2.190 -14.755 7.204 1.00 0.00 C ATOM 933 CD GLN A 66 1.488 -15.967 6.624 1.00 0.00 C ATOM 934 OE1 GLN A 66 1.786 -16.397 5.510 1.00 0.00 O ATOM 935 NE2 GLN A 66 0.549 -16.525 7.379 1.00 0.00 N ATOM 0 H GLN A 66 2.505 -12.207 8.555 1.00 0.00 H new ATOM 0 HA GLN A 66 4.019 -12.811 6.099 1.00 0.00 H new ATOM 0 HB2 GLN A 66 1.035 -13.063 6.587 1.00 0.00 H new ATOM 0 HB3 GLN A 66 1.977 -13.795 5.304 1.00 0.00 H new ATOM 0 HG2 GLN A 66 3.255 -14.968 7.300 1.00 0.00 H new ATOM 0 HG3 GLN A 66 1.811 -14.567 8.209 1.00 0.00 H new ATOM 0 HE21 GLN A 66 0.334 -16.135 8.297 1.00 0.00 H new ATOM 0 HE22 GLN A 66 0.042 -17.343 7.041 1.00 0.00 H new ATOM 944 N PHE A 67 2.820 -11.105 4.566 1.00 0.00 N ATOM 945 CA PHE A 67 2.469 -9.911 3.804 1.00 0.00 C ATOM 946 C PHE A 67 1.078 -10.045 3.193 1.00 0.00 C ATOM 947 O PHE A 67 0.798 -10.994 2.460 1.00 0.00 O ATOM 948 CB PHE A 67 3.501 -9.663 2.702 1.00 0.00 C ATOM 949 CG PHE A 67 4.775 -9.044 3.202 1.00 0.00 C ATOM 950 CD1 PHE A 67 4.810 -7.714 3.589 1.00 0.00 C ATOM 951 CD2 PHE A 67 5.938 -9.792 3.285 1.00 0.00 C ATOM 952 CE1 PHE A 67 5.981 -7.142 4.049 1.00 0.00 C ATOM 953 CE2 PHE A 67 7.113 -9.226 3.744 1.00 0.00 C ATOM 954 CZ PHE A 67 7.133 -7.899 4.128 1.00 0.00 C ATOM 0 H PHE A 67 3.163 -11.881 4.000 1.00 0.00 H new ATOM 0 HA PHE A 67 2.466 -9.062 4.487 1.00 0.00 H new ATOM 0 HB2 PHE A 67 3.734 -10.609 2.213 1.00 0.00 H new ATOM 0 HB3 PHE A 67 3.063 -9.013 1.945 1.00 0.00 H new ATOM 0 HD1 PHE A 67 3.912 -7.117 3.530 1.00 0.00 H new ATOM 0 HD2 PHE A 67 5.927 -10.830 2.987 1.00 0.00 H new ATOM 0 HE1 PHE A 67 5.995 -6.104 4.346 1.00 0.00 H new ATOM 0 HE2 PHE A 67 8.013 -9.820 3.802 1.00 0.00 H new ATOM 0 HZ PHE A 67 8.048 -7.454 4.489 1.00 0.00 H new ATOM 964 N TYR A 68 0.209 -9.088 3.500 1.00 0.00 N ATOM 965 CA TYR A 68 -1.155 -9.100 2.984 1.00 0.00 C ATOM 966 C TYR A 68 -1.384 -7.935 2.026 1.00 0.00 C ATOM 967 O TYR A 68 -0.485 -7.131 1.782 1.00 0.00 O ATOM 968 CB TYR A 68 -2.159 -9.032 4.136 1.00 0.00 C ATOM 969 CG TYR A 68 -2.075 -10.209 5.082 1.00 0.00 C ATOM 970 CD1 TYR A 68 -1.001 -10.350 5.953 1.00 0.00 C ATOM 971 CD2 TYR A 68 -3.070 -11.179 5.106 1.00 0.00 C ATOM 972 CE1 TYR A 68 -0.920 -11.424 6.818 1.00 0.00 C ATOM 973 CE2 TYR A 68 -2.997 -12.255 5.969 1.00 0.00 C ATOM 974 CZ TYR A 68 -1.921 -12.373 6.823 1.00 0.00 C ATOM 975 OH TYR A 68 -1.844 -13.444 7.685 1.00 0.00 O ATOM 0 H TYR A 68 0.425 -8.294 4.103 1.00 0.00 H new ATOM 0 HA TYR A 68 -1.302 -10.032 2.437 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -1.993 -8.113 4.698 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -3.167 -8.978 3.726 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -0.217 -9.607 5.954 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -3.914 -11.090 4.439 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -0.077 -11.520 7.487 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -3.779 -13.000 5.975 1.00 0.00 H new ATOM 0 HH TYR A 68 -2.628 -14.019 7.563 1.00 0.00 H new ATOM 985 N TRP A 69 -2.595 -7.853 1.485 1.00 0.00 N ATOM 986 CA TRP A 69 -2.944 -6.787 0.554 1.00 0.00 C ATOM 987 C TRP A 69 -4.059 -5.914 1.119 1.00 0.00 C ATOM 988 O TRP A 69 -5.006 -6.415 1.724 1.00 0.00 O ATOM 989 CB TRP A 69 -3.374 -7.377 -0.791 1.00 0.00 C ATOM 990 CG TRP A 69 -2.240 -7.978 -1.565 1.00 0.00 C ATOM 991 CD1 TRP A 69 -2.039 -9.303 -1.828 1.00 0.00 C ATOM 992 CD2 TRP A 69 -1.150 -7.276 -2.173 1.00 0.00 C ATOM 993 NE1 TRP A 69 -0.890 -9.467 -2.564 1.00 0.00 N ATOM 994 CE2 TRP A 69 -0.327 -8.238 -2.790 1.00 0.00 C ATOM 995 CE3 TRP A 69 -0.791 -5.928 -2.259 1.00 0.00 C ATOM 996 CZ2 TRP A 69 0.832 -7.894 -3.480 1.00 0.00 C ATOM 997 CZ3 TRP A 69 0.360 -5.588 -2.945 1.00 0.00 C ATOM 998 CH2 TRP A 69 1.160 -6.567 -3.548 1.00 0.00 C ATOM 0 H TRP A 69 -3.350 -8.512 1.675 1.00 0.00 H new ATOM 0 HA TRP A 69 -2.061 -6.165 0.405 1.00 0.00 H new ATOM 0 HB2 TRP A 69 -4.132 -8.141 -0.619 1.00 0.00 H new ATOM 0 HB3 TRP A 69 -3.840 -6.595 -1.391 1.00 0.00 H new ATOM 0 HD1 TRP A 69 -2.688 -10.104 -1.505 1.00 0.00 H new ATOM 0 HE1 TRP A 69 -0.517 -10.359 -2.889 1.00 0.00 H new ATOM 0 HE3 TRP A 69 -1.402 -5.166 -1.798 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 1.450 -8.647 -3.945 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 0.647 -4.549 -3.017 1.00 0.00 H new ATOM 0 HH2 TRP A 69 2.053 -6.269 -4.077 1.00 0.00 H new ATOM 1009 N ASP A 70 -3.941 -4.606 0.917 1.00 0.00 N ATOM 1010 CA ASP A 70 -4.940 -3.663 1.406 1.00 0.00 C ATOM 1011 C ASP A 70 -6.233 -3.778 0.605 1.00 0.00 C ATOM 1012 O ASP A 70 -6.296 -3.363 -0.553 1.00 0.00 O ATOM 1013 CB ASP A 70 -4.403 -2.233 1.330 1.00 0.00 C ATOM 1014 CG ASP A 70 -5.352 -1.225 1.949 1.00 0.00 C ATOM 1015 OD1 ASP A 70 -6.568 -1.309 1.676 1.00 0.00 O ATOM 1016 OD2 ASP A 70 -4.878 -0.353 2.706 1.00 0.00 O ATOM 0 H ASP A 70 -3.163 -4.175 0.418 1.00 0.00 H new ATOM 0 HA ASP A 70 -5.156 -3.906 2.446 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -3.440 -2.182 1.839 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -4.227 -1.969 0.287 1.00 0.00 H new ATOM 1021 N ARG A 71 -7.261 -4.344 1.228 1.00 0.00 N ATOM 1022 CA ARG A 71 -8.552 -4.515 0.572 1.00 0.00 C ATOM 1023 C ARG A 71 -9.557 -3.481 1.071 1.00 0.00 C ATOM 1024 O ARG A 71 -10.766 -3.651 0.919 1.00 0.00 O ATOM 1025 CB ARG A 71 -9.091 -5.925 0.820 1.00 0.00 C ATOM 1026 CG ARG A 71 -8.371 -7.001 0.022 1.00 0.00 C ATOM 1027 CD ARG A 71 -8.777 -6.973 -1.443 1.00 0.00 C ATOM 1028 NE ARG A 71 -8.475 -8.232 -2.118 1.00 0.00 N ATOM 1029 CZ ARG A 71 -7.285 -8.525 -2.631 1.00 0.00 C ATOM 1030 NH1 ARG A 71 -6.290 -7.652 -2.546 1.00 0.00 N ATOM 1031 NH2 ARG A 71 -7.088 -9.692 -3.231 1.00 0.00 N ATOM 0 H ARG A 71 -7.225 -4.692 2.186 1.00 0.00 H new ATOM 0 HA ARG A 71 -8.409 -4.370 -0.499 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -9.008 -6.155 1.882 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -10.152 -5.948 0.571 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -7.294 -6.858 0.105 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -8.596 -7.980 0.444 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -9.845 -6.768 -1.520 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -8.259 -6.158 -1.947 1.00 0.00 H new ATOM 0 HE ARG A 71 -9.219 -8.925 -2.200 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -6.438 -6.754 -2.086 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -5.377 -7.879 -2.941 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -7.851 -10.366 -3.299 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -6.174 -9.915 -3.624 1.00 0.00 H new ATOM 1045 N GLY A 72 -9.047 -2.407 1.668 1.00 0.00 N ATOM 1046 CA GLY A 72 -9.913 -1.362 2.181 1.00 0.00 C ATOM 1047 C GLY A 72 -9.794 -1.195 3.683 1.00 0.00 C ATOM 1048 O GLY A 72 -8.882 -1.741 4.303 1.00 0.00 O ATOM 0 H GLY A 72 -8.050 -2.243 1.805 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -9.667 -0.419 1.693 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -10.947 -1.593 1.925 1.00 0.00 H new ATOM 1052 N GLN A 73 -10.716 -0.437 4.267 1.00 0.00 N ATOM 1053 CA GLN A 73 -10.708 -0.197 5.706 1.00 0.00 C ATOM 1054 C GLN A 73 -11.561 -1.231 6.434 1.00 0.00 C ATOM 1055 O GLN A 73 -12.778 -1.278 6.262 1.00 0.00 O ATOM 1056 CB GLN A 73 -11.219 1.211 6.012 1.00 0.00 C ATOM 1057 CG GLN A 73 -10.752 1.749 7.355 1.00 0.00 C ATOM 1058 CD GLN A 73 -11.416 3.062 7.721 1.00 0.00 C ATOM 1059 OE1 GLN A 73 -12.572 3.304 7.373 1.00 0.00 O ATOM 1060 NE2 GLN A 73 -10.686 3.918 8.427 1.00 0.00 N ATOM 0 H GLN A 73 -11.478 0.021 3.767 1.00 0.00 H new ATOM 0 HA GLN A 73 -9.681 -0.287 6.059 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -10.888 1.888 5.224 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -12.309 1.206 5.991 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -10.962 1.012 8.130 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -9.671 1.887 7.331 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -9.732 3.676 8.694 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -11.080 4.818 8.702 1.00 0.00 H new ATOM 1069 N GLY A 74 -10.912 -2.058 7.249 1.00 0.00 N ATOM 1070 CA GLY A 74 -11.627 -3.080 7.991 1.00 0.00 C ATOM 1071 C GLY A 74 -11.823 -4.350 7.187 1.00 0.00 C ATOM 1072 O GLY A 74 -11.708 -5.454 7.721 1.00 0.00 O ATOM 0 H GLY A 74 -9.905 -2.038 7.408 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -11.079 -3.313 8.904 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -12.599 -2.692 8.294 1.00 0.00 H new ATOM 1076 N ILE A 75 -12.120 -4.195 5.902 1.00 0.00 N ATOM 1077 CA ILE A 75 -12.332 -5.339 5.024 1.00 0.00 C ATOM 1078 C ILE A 75 -11.227 -6.376 5.195 1.00 0.00 C ATOM 1079 O ILE A 75 -10.060 -6.030 5.373 1.00 0.00 O ATOM 1080 CB ILE A 75 -12.394 -4.911 3.546 1.00 0.00 C ATOM 1081 CG1 ILE A 75 -13.497 -3.870 3.340 1.00 0.00 C ATOM 1082 CG2 ILE A 75 -12.627 -6.121 2.653 1.00 0.00 C ATOM 1083 CD1 ILE A 75 -14.893 -4.426 3.515 1.00 0.00 C ATOM 0 H ILE A 75 -12.219 -3.288 5.445 1.00 0.00 H new ATOM 0 HA ILE A 75 -13.288 -5.780 5.307 1.00 0.00 H new ATOM 0 HB ILE A 75 -11.439 -4.461 3.273 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -13.349 -3.052 4.045 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -13.405 -3.449 2.339 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -12.668 -5.802 1.612 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -11.811 -6.832 2.783 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -13.569 -6.597 2.924 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -15.623 -3.633 3.354 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -15.060 -5.225 2.792 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -15.003 -4.822 4.525 1.00 0.00 H new ATOM 1095 N ASN A 76 -11.604 -7.649 5.138 1.00 0.00 N ATOM 1096 CA ASN A 76 -10.645 -8.738 5.285 1.00 0.00 C ATOM 1097 C ASN A 76 -9.593 -8.689 4.181 1.00 0.00 C ATOM 1098 O ASN A 76 -9.900 -8.780 2.992 1.00 0.00 O ATOM 1099 CB ASN A 76 -11.365 -10.087 5.259 1.00 0.00 C ATOM 1100 CG ASN A 76 -12.405 -10.167 4.159 1.00 0.00 C ATOM 1101 OD1 ASN A 76 -12.255 -9.553 3.102 1.00 0.00 O ATOM 1102 ND2 ASN A 76 -13.467 -10.926 4.402 1.00 0.00 N ATOM 0 H ASN A 76 -12.567 -7.952 4.991 1.00 0.00 H new ATOM 0 HA ASN A 76 -10.144 -8.620 6.246 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -10.633 -10.883 5.122 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -11.845 -10.258 6.222 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -14.200 -11.018 3.698 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -13.550 -11.417 5.292 1.00 0.00 H new ATOM 1109 N PRO A 77 -8.321 -8.543 4.581 1.00 0.00 N ATOM 1110 CA PRO A 77 -7.198 -8.480 3.642 1.00 0.00 C ATOM 1111 C PRO A 77 -6.933 -9.820 2.964 1.00 0.00 C ATOM 1112 O PRO A 77 -7.583 -10.820 3.270 1.00 0.00 O ATOM 1113 CB PRO A 77 -6.014 -8.087 4.530 1.00 0.00 C ATOM 1114 CG PRO A 77 -6.387 -8.564 5.891 1.00 0.00 C ATOM 1115 CD PRO A 77 -7.882 -8.428 5.982 1.00 0.00 C ATOM 0 HA PRO A 77 -7.388 -7.782 2.827 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -5.090 -8.552 4.187 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -5.851 -7.009 4.519 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -6.080 -9.599 6.040 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -5.894 -7.971 6.661 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -8.319 -9.208 6.605 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -8.173 -7.472 6.417 1.00 0.00 H new ATOM 1123 N ASP A 78 -5.976 -9.833 2.043 1.00 0.00 N ATOM 1124 CA ASP A 78 -5.625 -11.051 1.322 1.00 0.00 C ATOM 1125 C ASP A 78 -4.184 -11.458 1.613 1.00 0.00 C ATOM 1126 O ASP A 78 -3.301 -10.608 1.742 1.00 0.00 O ATOM 1127 CB ASP A 78 -5.818 -10.853 -0.182 1.00 0.00 C ATOM 1128 CG ASP A 78 -6.127 -12.152 -0.902 1.00 0.00 C ATOM 1129 OD1 ASP A 78 -5.173 -12.847 -1.305 1.00 0.00 O ATOM 1130 OD2 ASP A 78 -7.324 -12.471 -1.061 1.00 0.00 O ATOM 0 H ASP A 78 -5.429 -9.014 1.778 1.00 0.00 H new ATOM 0 HA ASP A 78 -6.285 -11.848 1.663 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -6.629 -10.145 -0.351 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -4.916 -10.411 -0.606 1.00 0.00 H new ATOM 1135 N LEU A 79 -3.952 -12.762 1.717 1.00 0.00 N ATOM 1136 CA LEU A 79 -2.617 -13.282 1.994 1.00 0.00 C ATOM 1137 C LEU A 79 -1.816 -13.440 0.706 1.00 0.00 C ATOM 1138 O LEU A 79 -2.208 -14.182 -0.195 1.00 0.00 O ATOM 1139 CB LEU A 79 -2.713 -14.627 2.717 1.00 0.00 C ATOM 1140 CG LEU A 79 -1.440 -15.104 3.417 1.00 0.00 C ATOM 1141 CD1 LEU A 79 -0.243 -14.985 2.488 1.00 0.00 C ATOM 1142 CD2 LEU A 79 -1.206 -14.313 4.696 1.00 0.00 C ATOM 0 H LEU A 79 -4.671 -13.479 1.614 1.00 0.00 H new ATOM 0 HA LEU A 79 -2.101 -12.567 2.635 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -3.509 -14.562 3.459 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -3.012 -15.385 1.993 1.00 0.00 H new ATOM 0 HG LEU A 79 -1.566 -16.154 3.681 1.00 0.00 H new ATOM 0 HD11 LEU A 79 0.653 -15.329 3.004 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -0.409 -15.597 1.601 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -0.114 -13.944 2.192 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.296 -14.666 5.181 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -1.102 -13.255 4.456 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -2.052 -14.451 5.369 1.00 0.00 H new ATOM 1154 N LEU A 80 -0.691 -12.739 0.626 1.00 0.00 N ATOM 1155 CA LEU A 80 0.169 -12.802 -0.551 1.00 0.00 C ATOM 1156 C LEU A 80 0.485 -14.249 -0.917 1.00 0.00 C ATOM 1157 O LEU A 80 1.411 -14.848 -0.372 1.00 0.00 O ATOM 1158 CB LEU A 80 1.466 -12.031 -0.302 1.00 0.00 C ATOM 1159 CG LEU A 80 2.536 -12.150 -1.388 1.00 0.00 C ATOM 1160 CD1 LEU A 80 2.278 -11.149 -2.503 1.00 0.00 C ATOM 1161 CD2 LEU A 80 3.923 -11.944 -0.795 1.00 0.00 C ATOM 0 H LEU A 80 -0.352 -12.120 1.362 1.00 0.00 H new ATOM 0 HA LEU A 80 -0.363 -12.344 -1.385 1.00 0.00 H new ATOM 0 HB2 LEU A 80 1.220 -10.977 -0.176 1.00 0.00 H new ATOM 0 HB3 LEU A 80 1.894 -12.373 0.640 1.00 0.00 H new ATOM 0 HG LEU A 80 2.488 -13.154 -1.810 1.00 0.00 H new ATOM 0 HD11 LEU A 80 3.049 -11.248 -3.267 1.00 0.00 H new ATOM 0 HD12 LEU A 80 1.301 -11.342 -2.947 1.00 0.00 H new ATOM 0 HD13 LEU A 80 2.298 -10.138 -2.096 1.00 0.00 H new ATOM 0 HD21 LEU A 80 4.672 -12.032 -1.582 1.00 0.00 H new ATOM 0 HD22 LEU A 80 3.983 -10.953 -0.346 1.00 0.00 H new ATOM 0 HD23 LEU A 80 4.108 -12.700 -0.032 1.00 0.00 H new ATOM 1173 N ASN A 81 -0.289 -14.802 -1.844 1.00 0.00 N ATOM 1174 CA ASN A 81 -0.090 -16.178 -2.284 1.00 0.00 C ATOM 1175 C ASN A 81 0.234 -16.232 -3.774 1.00 0.00 C ATOM 1176 O ASN A 81 -0.152 -17.171 -4.469 1.00 0.00 O ATOM 1177 CB ASN A 81 -1.337 -17.015 -1.992 1.00 0.00 C ATOM 1178 CG ASN A 81 -1.009 -18.474 -1.739 1.00 0.00 C ATOM 1179 OD1 ASN A 81 -1.337 -19.344 -2.546 1.00 0.00 O ATOM 1180 ND2 ASN A 81 -0.359 -18.748 -0.614 1.00 0.00 N ATOM 0 H ASN A 81 -1.060 -14.319 -2.305 1.00 0.00 H new ATOM 0 HA ASN A 81 0.754 -16.590 -1.731 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -1.851 -16.605 -1.122 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -2.026 -16.941 -2.833 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -0.112 -19.712 -0.390 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -0.107 -17.995 0.026 1.00 0.00 H new ATOM 1187 N GLN A 82 0.945 -15.217 -4.256 1.00 0.00 N ATOM 1188 CA GLN A 82 1.321 -15.149 -5.663 1.00 0.00 C ATOM 1189 C GLN A 82 2.700 -15.760 -5.889 1.00 0.00 C ATOM 1190 O GLN A 82 3.623 -15.580 -5.094 1.00 0.00 O ATOM 1191 CB GLN A 82 1.307 -13.698 -6.146 1.00 0.00 C ATOM 1192 CG GLN A 82 2.262 -12.794 -5.383 1.00 0.00 C ATOM 1193 CD GLN A 82 2.022 -11.323 -5.663 1.00 0.00 C ATOM 1194 OE1 GLN A 82 0.943 -10.795 -5.390 1.00 0.00 O ATOM 1195 NE2 GLN A 82 3.029 -10.653 -6.211 1.00 0.00 N ATOM 0 H GLN A 82 1.272 -14.432 -3.693 1.00 0.00 H new ATOM 0 HA GLN A 82 0.592 -15.723 -6.236 1.00 0.00 H new ATOM 0 HB2 GLN A 82 1.565 -13.674 -7.205 1.00 0.00 H new ATOM 0 HB3 GLN A 82 0.295 -13.303 -6.055 1.00 0.00 H new ATOM 0 HG2 GLN A 82 2.155 -12.979 -4.314 1.00 0.00 H new ATOM 0 HG3 GLN A 82 3.288 -13.048 -5.649 1.00 0.00 H new ATOM 0 HE21 GLN A 82 3.905 -11.131 -6.420 1.00 0.00 H new ATOM 0 HE22 GLN A 82 2.926 -9.660 -6.423 1.00 0.00 H new ATOM 1204 N PRO A 83 2.845 -16.501 -6.997 1.00 0.00 N ATOM 1205 CA PRO A 83 4.109 -17.154 -7.353 1.00 0.00 C ATOM 1206 C PRO A 83 5.183 -16.152 -7.764 1.00 0.00 C ATOM 1207 O PRO A 83 6.373 -16.383 -7.552 1.00 0.00 O ATOM 1208 CB PRO A 83 3.726 -18.044 -8.539 1.00 0.00 C ATOM 1209 CG PRO A 83 2.530 -17.387 -9.136 1.00 0.00 C ATOM 1210 CD PRO A 83 1.787 -16.758 -7.989 1.00 0.00 C ATOM 0 HA PRO A 83 4.537 -17.701 -6.513 1.00 0.00 H new ATOM 0 HB2 PRO A 83 4.540 -18.114 -9.260 1.00 0.00 H new ATOM 0 HB3 PRO A 83 3.499 -19.060 -8.215 1.00 0.00 H new ATOM 0 HG2 PRO A 83 2.823 -16.636 -9.870 1.00 0.00 H new ATOM 0 HG3 PRO A 83 1.904 -18.113 -9.655 1.00 0.00 H new ATOM 0 HD2 PRO A 83 1.287 -15.838 -8.291 1.00 0.00 H new ATOM 0 HD3 PRO A 83 1.019 -17.423 -7.594 1.00 0.00 H new ATOM 1218 N ILE A 84 4.755 -15.040 -8.351 1.00 0.00 N ATOM 1219 CA ILE A 84 5.680 -14.003 -8.789 1.00 0.00 C ATOM 1220 C ILE A 84 5.788 -12.889 -7.754 1.00 0.00 C ATOM 1221 O ILE A 84 4.792 -12.483 -7.155 1.00 0.00 O ATOM 1222 CB ILE A 84 5.249 -13.395 -10.137 1.00 0.00 C ATOM 1223 CG1 ILE A 84 5.298 -14.456 -11.238 1.00 0.00 C ATOM 1224 CG2 ILE A 84 6.136 -12.213 -10.494 1.00 0.00 C ATOM 1225 CD1 ILE A 84 4.500 -14.087 -12.469 1.00 0.00 C ATOM 0 H ILE A 84 3.773 -14.834 -8.534 1.00 0.00 H new ATOM 0 HA ILE A 84 6.653 -14.480 -8.909 1.00 0.00 H new ATOM 0 HB ILE A 84 4.223 -13.039 -10.046 1.00 0.00 H new ATOM 0 HG12 ILE A 84 6.336 -14.623 -11.525 1.00 0.00 H new ATOM 0 HG13 ILE A 84 4.922 -15.398 -10.840 1.00 0.00 H new ATOM 0 HG21 ILE A 84 5.818 -11.795 -11.449 1.00 0.00 H new ATOM 0 HG22 ILE A 84 6.055 -11.450 -9.719 1.00 0.00 H new ATOM 0 HG23 ILE A 84 7.171 -12.545 -10.570 1.00 0.00 H new ATOM 0 HD11 ILE A 84 4.580 -14.885 -13.207 1.00 0.00 H new ATOM 0 HD12 ILE A 84 3.454 -13.949 -12.196 1.00 0.00 H new ATOM 0 HD13 ILE A 84 4.890 -13.161 -12.892 1.00 0.00 H new ATOM 1237 N THR A 85 7.006 -12.396 -7.547 1.00 0.00 N ATOM 1238 CA THR A 85 7.245 -11.328 -6.585 1.00 0.00 C ATOM 1239 C THR A 85 8.232 -10.304 -7.133 1.00 0.00 C ATOM 1240 O THR A 85 8.904 -10.550 -8.135 1.00 0.00 O ATOM 1241 CB THR A 85 7.785 -11.883 -5.253 1.00 0.00 C ATOM 1242 OG1 THR A 85 8.890 -12.760 -5.499 1.00 0.00 O ATOM 1243 CG2 THR A 85 6.696 -12.630 -4.497 1.00 0.00 C ATOM 0 H THR A 85 7.842 -12.720 -8.033 1.00 0.00 H new ATOM 0 HA THR A 85 6.285 -10.843 -6.406 1.00 0.00 H new ATOM 0 HB THR A 85 8.118 -11.043 -4.643 1.00 0.00 H new ATOM 0 HG1 THR A 85 9.228 -13.107 -4.647 1.00 0.00 H new ATOM 0 HG21 THR A 85 7.101 -13.013 -3.560 1.00 0.00 H new ATOM 0 HG22 THR A 85 5.869 -11.952 -4.285 1.00 0.00 H new ATOM 0 HG23 THR A 85 6.337 -13.461 -5.104 1.00 0.00 H new ATOM 1251 N TYR A 86 8.317 -9.157 -6.470 1.00 0.00 N ATOM 1252 CA TYR A 86 9.222 -8.095 -6.892 1.00 0.00 C ATOM 1253 C TYR A 86 10.194 -7.730 -5.774 1.00 0.00 C ATOM 1254 O TYR A 86 10.940 -6.756 -5.878 1.00 0.00 O ATOM 1255 CB TYR A 86 8.428 -6.858 -7.317 1.00 0.00 C ATOM 1256 CG TYR A 86 7.373 -7.145 -8.361 1.00 0.00 C ATOM 1257 CD1 TYR A 86 7.703 -7.209 -9.710 1.00 0.00 C ATOM 1258 CD2 TYR A 86 6.048 -7.351 -8.000 1.00 0.00 C ATOM 1259 CE1 TYR A 86 6.742 -7.470 -10.668 1.00 0.00 C ATOM 1260 CE2 TYR A 86 5.081 -7.614 -8.952 1.00 0.00 C ATOM 1261 CZ TYR A 86 5.433 -7.673 -10.284 1.00 0.00 C ATOM 1262 OH TYR A 86 4.473 -7.933 -11.235 1.00 0.00 O ATOM 0 H TYR A 86 7.770 -8.938 -5.637 1.00 0.00 H new ATOM 0 HA TYR A 86 9.797 -8.460 -7.743 1.00 0.00 H new ATOM 0 HB2 TYR A 86 7.950 -6.424 -6.439 1.00 0.00 H new ATOM 0 HB3 TYR A 86 9.118 -6.110 -7.706 1.00 0.00 H new ATOM 0 HD1 TYR A 86 8.727 -7.052 -10.014 1.00 0.00 H new ATOM 0 HD2 TYR A 86 5.768 -7.305 -6.958 1.00 0.00 H new ATOM 0 HE1 TYR A 86 7.015 -7.515 -11.712 1.00 0.00 H new ATOM 0 HE2 TYR A 86 4.055 -7.772 -8.654 1.00 0.00 H new ATOM 0 HH TYR A 86 3.959 -8.725 -10.973 1.00 0.00 H new ATOM 1272 N TRP A 87 10.179 -8.519 -4.706 1.00 0.00 N ATOM 1273 CA TRP A 87 11.058 -8.280 -3.567 1.00 0.00 C ATOM 1274 C TRP A 87 12.433 -7.809 -4.031 1.00 0.00 C ATOM 1275 O TRP A 87 13.109 -8.497 -4.795 1.00 0.00 O ATOM 1276 CB TRP A 87 11.197 -9.552 -2.729 1.00 0.00 C ATOM 1277 CG TRP A 87 9.955 -9.899 -1.966 1.00 0.00 C ATOM 1278 CD1 TRP A 87 9.287 -11.090 -1.986 1.00 0.00 C ATOM 1279 CD2 TRP A 87 9.231 -9.046 -1.073 1.00 0.00 C ATOM 1280 NE1 TRP A 87 8.191 -11.029 -1.159 1.00 0.00 N ATOM 1281 CE2 TRP A 87 8.135 -9.786 -0.587 1.00 0.00 C ATOM 1282 CE3 TRP A 87 9.403 -7.730 -0.635 1.00 0.00 C ATOM 1283 CZ2 TRP A 87 7.218 -9.251 0.314 1.00 0.00 C ATOM 1284 CZ3 TRP A 87 8.491 -7.201 0.259 1.00 0.00 C ATOM 1285 CH2 TRP A 87 7.410 -7.961 0.726 1.00 0.00 C ATOM 0 H TRP A 87 9.568 -9.330 -4.605 1.00 0.00 H new ATOM 0 HA TRP A 87 10.614 -7.496 -2.954 1.00 0.00 H new ATOM 0 HB2 TRP A 87 11.457 -10.384 -3.384 1.00 0.00 H new ATOM 0 HB3 TRP A 87 12.023 -9.428 -2.028 1.00 0.00 H new ATOM 0 HD1 TRP A 87 9.577 -11.953 -2.567 1.00 0.00 H new ATOM 0 HE1 TRP A 87 7.527 -11.786 -0.998 1.00 0.00 H new ATOM 0 HE3 TRP A 87 10.234 -7.137 -0.989 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 6.384 -9.834 0.675 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 8.614 -6.185 0.603 1.00 0.00 H new ATOM 0 HH2 TRP A 87 6.715 -7.519 1.425 1.00 0.00 H new ATOM 1296 N ALA A 88 12.839 -6.634 -3.563 1.00 0.00 N ATOM 1297 CA ALA A 88 14.134 -6.073 -3.928 1.00 0.00 C ATOM 1298 C ALA A 88 15.273 -6.988 -3.489 1.00 0.00 C ATOM 1299 O ALA A 88 15.039 -8.068 -2.947 1.00 0.00 O ATOM 1300 CB ALA A 88 14.302 -4.690 -3.317 1.00 0.00 C ATOM 0 H ALA A 88 12.290 -6.052 -2.930 1.00 0.00 H new ATOM 0 HA ALA A 88 14.170 -5.986 -5.014 1.00 0.00 H new ATOM 0 HB1 ALA A 88 15.274 -4.284 -3.598 1.00 0.00 H new ATOM 0 HB2 ALA A 88 13.514 -4.032 -3.683 1.00 0.00 H new ATOM 0 HB3 ALA A 88 14.239 -4.762 -2.231 1.00 0.00 H new ATOM 1306 N ASN A 89 16.504 -6.550 -3.729 1.00 0.00 N ATOM 1307 CA ASN A 89 17.679 -7.331 -3.359 1.00 0.00 C ATOM 1308 C ASN A 89 17.739 -7.542 -1.849 1.00 0.00 C ATOM 1309 O ASN A 89 17.961 -6.600 -1.089 1.00 0.00 O ATOM 1310 CB ASN A 89 18.953 -6.633 -3.839 1.00 0.00 C ATOM 1311 CG ASN A 89 19.350 -5.475 -2.944 1.00 0.00 C ATOM 1312 OD1 ASN A 89 20.021 -5.662 -1.929 1.00 0.00 O ATOM 1313 ND2 ASN A 89 18.935 -4.270 -3.318 1.00 0.00 N ATOM 0 H ASN A 89 16.714 -5.659 -4.178 1.00 0.00 H new ATOM 0 HA ASN A 89 17.603 -8.306 -3.841 1.00 0.00 H new ATOM 0 HB2 ASN A 89 19.768 -7.356 -3.876 1.00 0.00 H new ATOM 0 HB3 ASN A 89 18.803 -6.269 -4.855 1.00 0.00 H new ATOM 0 HD21 ASN A 89 19.171 -3.452 -2.756 1.00 0.00 H new ATOM 0 HD22 ASN A 89 18.381 -4.162 -4.167 1.00 0.00 H new ATOM 1320 N GLY A 90 17.540 -8.785 -1.422 1.00 0.00 N ATOM 1321 CA GLY A 90 17.576 -9.097 -0.005 1.00 0.00 C ATOM 1322 C GLY A 90 16.251 -8.832 0.681 1.00 0.00 C ATOM 1323 O GLY A 90 16.175 -8.805 1.909 1.00 0.00 O ATOM 0 H GLY A 90 17.355 -9.581 -2.032 1.00 0.00 H new ATOM 0 HA2 GLY A 90 17.846 -10.145 0.126 1.00 0.00 H new ATOM 0 HA3 GLY A 90 18.355 -8.504 0.475 1.00 0.00 H new ATOM 1327 N GLU A 91 15.204 -8.636 -0.114 1.00 0.00 N ATOM 1328 CA GLU A 91 13.875 -8.369 0.425 1.00 0.00 C ATOM 1329 C GLU A 91 13.009 -9.624 0.382 1.00 0.00 C ATOM 1330 O GLU A 91 13.236 -10.539 -0.410 1.00 0.00 O ATOM 1331 CB GLU A 91 13.199 -7.242 -0.358 1.00 0.00 C ATOM 1332 CG GLU A 91 13.680 -5.855 0.034 1.00 0.00 C ATOM 1333 CD GLU A 91 13.043 -5.358 1.317 1.00 0.00 C ATOM 1334 OE1 GLU A 91 11.798 -5.271 1.367 1.00 0.00 O ATOM 1335 OE2 GLU A 91 13.789 -5.056 2.272 1.00 0.00 O ATOM 0 H GLU A 91 15.250 -8.657 -1.133 1.00 0.00 H new ATOM 0 HA GLU A 91 13.988 -8.061 1.465 1.00 0.00 H new ATOM 0 HB2 GLU A 91 13.378 -7.392 -1.423 1.00 0.00 H new ATOM 0 HB3 GLU A 91 12.121 -7.300 -0.205 1.00 0.00 H new ATOM 0 HG2 GLU A 91 14.763 -5.870 0.153 1.00 0.00 H new ATOM 0 HG3 GLU A 91 13.458 -5.156 -0.772 1.00 0.00 H new ATOM 1342 N PRO A 92 11.991 -9.670 1.255 1.00 0.00 N ATOM 1343 CA PRO A 92 11.711 -8.587 2.203 1.00 0.00 C ATOM 1344 C PRO A 92 12.771 -8.484 3.294 1.00 0.00 C ATOM 1345 O PRO A 92 13.397 -9.479 3.660 1.00 0.00 O ATOM 1346 CB PRO A 92 10.360 -8.983 2.804 1.00 0.00 C ATOM 1347 CG PRO A 92 10.298 -10.464 2.655 1.00 0.00 C ATOM 1348 CD PRO A 92 11.035 -10.783 1.384 1.00 0.00 C ATOM 0 HA PRO A 92 11.707 -7.611 1.718 1.00 0.00 H new ATOM 0 HB2 PRO A 92 10.291 -8.687 3.851 1.00 0.00 H new ATOM 0 HB3 PRO A 92 9.536 -8.498 2.280 1.00 0.00 H new ATOM 0 HG2 PRO A 92 10.758 -10.962 3.509 1.00 0.00 H new ATOM 0 HG3 PRO A 92 9.265 -10.808 2.604 1.00 0.00 H new ATOM 0 HD2 PRO A 92 11.544 -11.745 1.445 1.00 0.00 H new ATOM 0 HD3 PRO A 92 10.360 -10.834 0.530 1.00 0.00 H new ATOM 1356 N SER A 93 12.966 -7.275 3.811 1.00 0.00 N ATOM 1357 CA SER A 93 13.953 -7.042 4.859 1.00 0.00 C ATOM 1358 C SER A 93 13.724 -7.981 6.039 1.00 0.00 C ATOM 1359 O SER A 93 12.787 -8.778 6.040 1.00 0.00 O ATOM 1360 CB SER A 93 13.893 -5.588 5.331 1.00 0.00 C ATOM 1361 OG SER A 93 14.973 -5.288 6.197 1.00 0.00 O ATOM 0 H SER A 93 12.454 -6.442 3.521 1.00 0.00 H new ATOM 0 HA SER A 93 14.941 -7.242 4.444 1.00 0.00 H new ATOM 0 HB2 SER A 93 13.918 -4.921 4.469 1.00 0.00 H new ATOM 0 HB3 SER A 93 12.949 -5.408 5.846 1.00 0.00 H new ATOM 0 HG SER A 93 15.210 -4.341 6.109 1.00 0.00 H new ATOM 1367 N ASN A 94 14.589 -7.881 7.043 1.00 0.00 N ATOM 1368 CA ASN A 94 14.483 -8.721 8.230 1.00 0.00 C ATOM 1369 C ASN A 94 14.346 -7.870 9.489 1.00 0.00 C ATOM 1370 O ASN A 94 14.006 -8.376 10.559 1.00 0.00 O ATOM 1371 CB ASN A 94 15.707 -9.632 8.347 1.00 0.00 C ATOM 1372 CG ASN A 94 16.841 -8.980 9.114 1.00 0.00 C ATOM 1373 OD1 ASN A 94 16.749 -8.770 10.323 1.00 0.00 O ATOM 1374 ND2 ASN A 94 17.920 -8.655 8.410 1.00 0.00 N ATOM 0 H ASN A 94 15.371 -7.226 7.058 1.00 0.00 H new ATOM 0 HA ASN A 94 13.589 -9.336 8.130 1.00 0.00 H new ATOM 0 HB2 ASN A 94 15.421 -10.559 8.845 1.00 0.00 H new ATOM 0 HB3 ASN A 94 16.054 -9.900 7.349 1.00 0.00 H new ATOM 0 HD21 ASN A 94 18.715 -8.213 8.871 1.00 0.00 H new ATOM 0 HD22 ASN A 94 17.953 -8.848 7.409 1.00 0.00 H new ATOM 1381 N ASP A 95 14.612 -6.576 9.353 1.00 0.00 N ATOM 1382 CA ASP A 95 14.517 -5.653 10.479 1.00 0.00 C ATOM 1383 C ASP A 95 13.088 -5.584 11.006 1.00 0.00 C ATOM 1384 O ASP A 95 12.123 -5.504 10.245 1.00 0.00 O ATOM 1385 CB ASP A 95 14.989 -4.259 10.063 1.00 0.00 C ATOM 1386 CG ASP A 95 15.578 -3.478 11.222 1.00 0.00 C ATOM 1387 OD1 ASP A 95 14.797 -2.967 12.051 1.00 0.00 O ATOM 1388 OD2 ASP A 95 16.821 -3.377 11.299 1.00 0.00 O ATOM 0 H ASP A 95 14.895 -6.142 8.475 1.00 0.00 H new ATOM 0 HA ASP A 95 15.161 -6.023 11.277 1.00 0.00 H new ATOM 0 HB2 ASP A 95 15.736 -4.352 9.274 1.00 0.00 H new ATOM 0 HB3 ASP A 95 14.150 -3.704 9.644 1.00 0.00 H new ATOM 1393 N PRO A 96 12.946 -5.618 12.339 1.00 0.00 N ATOM 1394 CA PRO A 96 11.638 -5.561 12.998 1.00 0.00 C ATOM 1395 C PRO A 96 10.980 -4.191 12.864 1.00 0.00 C ATOM 1396 O PRO A 96 9.770 -4.051 13.045 1.00 0.00 O ATOM 1397 CB PRO A 96 11.966 -5.856 14.464 1.00 0.00 C ATOM 1398 CG PRO A 96 13.386 -5.437 14.626 1.00 0.00 C ATOM 1399 CD PRO A 96 14.052 -5.713 13.306 1.00 0.00 C ATOM 0 HA PRO A 96 10.929 -6.261 12.557 1.00 0.00 H new ATOM 0 HB2 PRO A 96 11.311 -5.302 15.136 1.00 0.00 H new ATOM 0 HB3 PRO A 96 11.837 -6.914 14.694 1.00 0.00 H new ATOM 0 HG2 PRO A 96 13.454 -4.380 14.884 1.00 0.00 H new ATOM 0 HG3 PRO A 96 13.868 -5.993 15.430 1.00 0.00 H new ATOM 0 HD2 PRO A 96 14.836 -4.987 13.092 1.00 0.00 H new ATOM 0 HD3 PRO A 96 14.517 -6.699 13.289 1.00 0.00 H new ATOM 1407 N THR A 97 11.785 -3.182 12.545 1.00 0.00 N ATOM 1408 CA THR A 97 11.282 -1.824 12.388 1.00 0.00 C ATOM 1409 C THR A 97 10.475 -1.682 11.103 1.00 0.00 C ATOM 1410 O THR A 97 9.404 -1.075 11.095 1.00 0.00 O ATOM 1411 CB THR A 97 12.430 -0.797 12.376 1.00 0.00 C ATOM 1412 OG1 THR A 97 13.240 -0.982 11.210 1.00 0.00 O ATOM 1413 CG2 THR A 97 13.290 -0.932 13.623 1.00 0.00 C ATOM 0 H THR A 97 12.788 -3.281 12.390 1.00 0.00 H new ATOM 0 HA THR A 97 10.636 -1.626 13.243 1.00 0.00 H new ATOM 0 HB THR A 97 11.994 0.202 12.361 1.00 0.00 H new ATOM 0 HG1 THR A 97 13.724 -1.831 11.279 1.00 0.00 H new ATOM 0 HG21 THR A 97 14.094 -0.197 13.592 1.00 0.00 H new ATOM 0 HG22 THR A 97 12.677 -0.762 14.508 1.00 0.00 H new ATOM 0 HG23 THR A 97 13.717 -1.934 13.664 1.00 0.00 H new ATOM 1421 N ARG A 98 10.995 -2.246 10.017 1.00 0.00 N ATOM 1422 CA ARG A 98 10.322 -2.182 8.726 1.00 0.00 C ATOM 1423 C ARG A 98 9.341 -3.340 8.565 1.00 0.00 C ATOM 1424 O ARG A 98 9.739 -4.504 8.550 1.00 0.00 O ATOM 1425 CB ARG A 98 11.347 -2.207 7.591 1.00 0.00 C ATOM 1426 CG ARG A 98 12.593 -1.385 7.878 1.00 0.00 C ATOM 1427 CD ARG A 98 13.747 -1.788 6.973 1.00 0.00 C ATOM 1428 NE ARG A 98 13.636 -1.190 5.645 1.00 0.00 N ATOM 1429 CZ ARG A 98 14.669 -1.021 4.827 1.00 0.00 C ATOM 1430 NH1 ARG A 98 15.883 -1.403 5.198 1.00 0.00 N ATOM 1431 NH2 ARG A 98 14.488 -0.468 3.634 1.00 0.00 N ATOM 0 H ARG A 98 11.880 -2.752 10.006 1.00 0.00 H new ATOM 0 HA ARG A 98 9.764 -1.247 8.682 1.00 0.00 H new ATOM 0 HB2 ARG A 98 11.639 -3.239 7.399 1.00 0.00 H new ATOM 0 HB3 ARG A 98 10.878 -1.834 6.681 1.00 0.00 H new ATOM 0 HG2 ARG A 98 12.372 -0.327 7.738 1.00 0.00 H new ATOM 0 HG3 ARG A 98 12.884 -1.515 8.920 1.00 0.00 H new ATOM 0 HD2 ARG A 98 14.689 -1.484 7.430 1.00 0.00 H new ATOM 0 HD3 ARG A 98 13.773 -2.874 6.881 1.00 0.00 H new ATOM 0 HE ARG A 98 12.715 -0.886 5.329 1.00 0.00 H new ATOM 0 HH11 ARG A 98 16.026 -1.828 6.114 1.00 0.00 H new ATOM 0 HH12 ARG A 98 16.674 -1.272 4.567 1.00 0.00 H new ATOM 0 HH21 ARG A 98 13.555 -0.173 3.345 1.00 0.00 H new ATOM 0 HH22 ARG A 98 15.281 -0.338 3.006 1.00 0.00 H new ATOM 1445 N GLN A 99 8.059 -3.011 8.446 1.00 0.00 N ATOM 1446 CA GLN A 99 7.022 -4.024 8.288 1.00 0.00 C ATOM 1447 C GLN A 99 6.223 -3.790 7.010 1.00 0.00 C ATOM 1448 O GLN A 99 5.877 -4.734 6.300 1.00 0.00 O ATOM 1449 CB GLN A 99 6.086 -4.018 9.497 1.00 0.00 C ATOM 1450 CG GLN A 99 6.813 -3.931 10.829 1.00 0.00 C ATOM 1451 CD GLN A 99 6.052 -4.603 11.955 1.00 0.00 C ATOM 1452 OE1 GLN A 99 6.004 -5.830 12.041 1.00 0.00 O ATOM 1453 NE2 GLN A 99 5.453 -3.801 12.827 1.00 0.00 N ATOM 0 H GLN A 99 7.713 -2.051 8.456 1.00 0.00 H new ATOM 0 HA GLN A 99 7.507 -4.997 8.218 1.00 0.00 H new ATOM 0 HB2 GLN A 99 5.400 -3.175 9.411 1.00 0.00 H new ATOM 0 HB3 GLN A 99 5.480 -4.924 9.482 1.00 0.00 H new ATOM 0 HG2 GLN A 99 7.795 -4.393 10.733 1.00 0.00 H new ATOM 0 HG3 GLN A 99 6.977 -2.883 11.081 1.00 0.00 H new ATOM 0 HE21 GLN A 99 5.519 -2.789 12.718 1.00 0.00 H new ATOM 0 HE22 GLN A 99 4.927 -4.197 13.606 1.00 0.00 H new ATOM 1462 N CYS A 100 5.932 -2.525 6.723 1.00 0.00 N ATOM 1463 CA CYS A 100 5.173 -2.166 5.532 1.00 0.00 C ATOM 1464 C CYS A 100 6.080 -2.106 4.306 1.00 0.00 C ATOM 1465 O CYS A 100 7.299 -1.986 4.428 1.00 0.00 O ATOM 1466 CB CYS A 100 4.477 -0.818 5.732 1.00 0.00 C ATOM 1467 SG CYS A 100 3.320 -0.781 7.138 1.00 0.00 S ATOM 0 H CYS A 100 6.211 -1.731 7.300 1.00 0.00 H new ATOM 0 HA CYS A 100 4.419 -2.936 5.367 1.00 0.00 H new ATOM 0 HB2 CYS A 100 5.235 -0.048 5.878 1.00 0.00 H new ATOM 0 HB3 CYS A 100 3.934 -0.563 4.822 1.00 0.00 H new ATOM 1472 N VAL A 101 5.476 -2.188 3.125 1.00 0.00 N ATOM 1473 CA VAL A 101 6.228 -2.141 1.877 1.00 0.00 C ATOM 1474 C VAL A 101 5.802 -0.953 1.022 1.00 0.00 C ATOM 1475 O VAL A 101 4.628 -0.582 0.998 1.00 0.00 O ATOM 1476 CB VAL A 101 6.046 -3.436 1.063 1.00 0.00 C ATOM 1477 CG1 VAL A 101 6.922 -3.413 -0.180 1.00 0.00 C ATOM 1478 CG2 VAL A 101 6.357 -4.653 1.922 1.00 0.00 C ATOM 0 H VAL A 101 4.468 -2.287 3.006 1.00 0.00 H new ATOM 0 HA VAL A 101 7.279 -2.033 2.145 1.00 0.00 H new ATOM 0 HB VAL A 101 5.006 -3.501 0.744 1.00 0.00 H new ATOM 0 HG11 VAL A 101 6.780 -4.336 -0.742 1.00 0.00 H new ATOM 0 HG12 VAL A 101 6.647 -2.562 -0.803 1.00 0.00 H new ATOM 0 HG13 VAL A 101 7.968 -3.324 0.114 1.00 0.00 H new ATOM 0 HG21 VAL A 101 6.223 -5.559 1.331 1.00 0.00 H new ATOM 0 HG22 VAL A 101 7.388 -4.597 2.273 1.00 0.00 H new ATOM 0 HG23 VAL A 101 5.683 -4.676 2.778 1.00 0.00 H new ATOM 1488 N TYR A 102 6.762 -0.360 0.322 1.00 0.00 N ATOM 1489 CA TYR A 102 6.487 0.789 -0.533 1.00 0.00 C ATOM 1490 C TYR A 102 7.154 0.626 -1.895 1.00 0.00 C ATOM 1491 O TYR A 102 8.307 0.203 -1.988 1.00 0.00 O ATOM 1492 CB TYR A 102 6.972 2.076 0.135 1.00 0.00 C ATOM 1493 CG TYR A 102 8.469 2.273 0.056 1.00 0.00 C ATOM 1494 CD1 TYR A 102 9.309 1.766 1.039 1.00 0.00 C ATOM 1495 CD2 TYR A 102 9.043 2.964 -1.004 1.00 0.00 C ATOM 1496 CE1 TYR A 102 10.678 1.944 0.971 1.00 0.00 C ATOM 1497 CE2 TYR A 102 10.411 3.145 -1.082 1.00 0.00 C ATOM 1498 CZ TYR A 102 11.223 2.634 -0.092 1.00 0.00 C ATOM 1499 OH TYR A 102 12.586 2.812 -0.164 1.00 0.00 O ATOM 0 H TYR A 102 7.738 -0.656 0.330 1.00 0.00 H new ATOM 0 HA TYR A 102 5.409 0.850 -0.682 1.00 0.00 H new ATOM 0 HB2 TYR A 102 6.477 2.927 -0.333 1.00 0.00 H new ATOM 0 HB3 TYR A 102 6.670 2.068 1.182 1.00 0.00 H new ATOM 0 HD1 TYR A 102 8.885 1.223 1.871 1.00 0.00 H new ATOM 0 HD2 TYR A 102 8.409 3.367 -1.780 1.00 0.00 H new ATOM 0 HE1 TYR A 102 11.317 1.545 1.745 1.00 0.00 H new ATOM 0 HE2 TYR A 102 10.841 3.683 -1.913 1.00 0.00 H new ATOM 0 HH TYR A 102 12.847 2.965 -1.096 1.00 0.00 H new ATOM 1509 N PHE A 103 6.421 0.966 -2.950 1.00 0.00 N ATOM 1510 CA PHE A 103 6.940 0.858 -4.309 1.00 0.00 C ATOM 1511 C PHE A 103 8.154 1.763 -4.500 1.00 0.00 C ATOM 1512 O PHE A 103 8.017 2.973 -4.680 1.00 0.00 O ATOM 1513 CB PHE A 103 5.854 1.222 -5.323 1.00 0.00 C ATOM 1514 CG PHE A 103 6.181 0.802 -6.727 1.00 0.00 C ATOM 1515 CD1 PHE A 103 7.036 1.561 -7.510 1.00 0.00 C ATOM 1516 CD2 PHE A 103 5.632 -0.351 -7.266 1.00 0.00 C ATOM 1517 CE1 PHE A 103 7.339 1.178 -8.803 1.00 0.00 C ATOM 1518 CE2 PHE A 103 5.932 -0.739 -8.558 1.00 0.00 C ATOM 1519 CZ PHE A 103 6.785 0.027 -9.328 1.00 0.00 C ATOM 0 H PHE A 103 5.466 1.319 -2.890 1.00 0.00 H new ATOM 0 HA PHE A 103 7.248 -0.175 -4.473 1.00 0.00 H new ATOM 0 HB2 PHE A 103 4.916 0.756 -5.022 1.00 0.00 H new ATOM 0 HB3 PHE A 103 5.695 2.300 -5.302 1.00 0.00 H new ATOM 0 HD1 PHE A 103 7.471 2.463 -7.105 1.00 0.00 H new ATOM 0 HD2 PHE A 103 4.962 -0.953 -6.670 1.00 0.00 H new ATOM 0 HE1 PHE A 103 8.008 1.778 -9.402 1.00 0.00 H new ATOM 0 HE2 PHE A 103 5.500 -1.641 -8.965 1.00 0.00 H new ATOM 0 HZ PHE A 103 7.018 -0.273 -10.339 1.00 0.00 H new ATOM 1529 N ASP A 104 9.340 1.167 -4.460 1.00 0.00 N ATOM 1530 CA ASP A 104 10.579 1.917 -4.629 1.00 0.00 C ATOM 1531 C ASP A 104 10.909 2.095 -6.108 1.00 0.00 C ATOM 1532 O ASP A 104 11.575 1.255 -6.712 1.00 0.00 O ATOM 1533 CB ASP A 104 11.732 1.206 -3.919 1.00 0.00 C ATOM 1534 CG ASP A 104 12.858 2.153 -3.552 1.00 0.00 C ATOM 1535 OD1 ASP A 104 13.247 2.974 -4.410 1.00 0.00 O ATOM 1536 OD2 ASP A 104 13.350 2.075 -2.407 1.00 0.00 O ATOM 0 H ASP A 104 9.470 0.166 -4.312 1.00 0.00 H new ATOM 0 HA ASP A 104 10.441 2.903 -4.184 1.00 0.00 H new ATOM 0 HB2 ASP A 104 11.357 0.725 -3.016 1.00 0.00 H new ATOM 0 HB3 ASP A 104 12.120 0.417 -4.563 1.00 0.00 H new ATOM 1541 N GLY A 105 10.436 3.195 -6.687 1.00 0.00 N ATOM 1542 CA GLY A 105 10.689 3.462 -8.090 1.00 0.00 C ATOM 1543 C GLY A 105 12.138 3.816 -8.361 1.00 0.00 C ATOM 1544 O GLY A 105 12.681 3.477 -9.412 1.00 0.00 O ATOM 0 H GLY A 105 9.882 3.906 -6.209 1.00 0.00 H new ATOM 0 HA2 GLY A 105 10.416 2.586 -8.678 1.00 0.00 H new ATOM 0 HA3 GLY A 105 10.050 4.280 -8.422 1.00 0.00 H new ATOM 1548 N ARG A 106 12.766 4.501 -7.410 1.00 0.00 N ATOM 1549 CA ARG A 106 14.159 4.904 -7.553 1.00 0.00 C ATOM 1550 C ARG A 106 15.096 3.791 -7.091 1.00 0.00 C ATOM 1551 O ARG A 106 16.231 4.049 -6.687 1.00 0.00 O ATOM 1552 CB ARG A 106 14.429 6.178 -6.751 1.00 0.00 C ATOM 1553 CG ARG A 106 13.625 7.377 -7.224 1.00 0.00 C ATOM 1554 CD ARG A 106 13.754 8.549 -6.264 1.00 0.00 C ATOM 1555 NE ARG A 106 15.120 9.063 -6.207 1.00 0.00 N ATOM 1556 CZ ARG A 106 15.425 10.301 -5.837 1.00 0.00 C ATOM 1557 NH1 ARG A 106 14.465 11.149 -5.493 1.00 0.00 N ATOM 1558 NH2 ARG A 106 16.692 10.694 -5.811 1.00 0.00 N ATOM 0 H ARG A 106 12.332 4.788 -6.533 1.00 0.00 H new ATOM 0 HA ARG A 106 14.348 5.101 -8.608 1.00 0.00 H new ATOM 0 HB2 ARG A 106 14.203 5.991 -5.701 1.00 0.00 H new ATOM 0 HB3 ARG A 106 15.491 6.417 -6.811 1.00 0.00 H new ATOM 0 HG2 ARG A 106 13.967 7.678 -8.214 1.00 0.00 H new ATOM 0 HG3 ARG A 106 12.576 7.098 -7.320 1.00 0.00 H new ATOM 0 HD2 ARG A 106 13.079 9.347 -6.574 1.00 0.00 H new ATOM 0 HD3 ARG A 106 13.442 8.237 -5.267 1.00 0.00 H new ATOM 0 HE ARG A 106 15.882 8.436 -6.466 1.00 0.00 H new ATOM 0 HH11 ARG A 106 13.490 10.851 -5.512 1.00 0.00 H new ATOM 0 HH12 ARG A 106 14.702 12.100 -5.209 1.00 0.00 H new ATOM 0 HH21 ARG A 106 17.433 10.045 -6.075 1.00 0.00 H new ATOM 0 HH22 ARG A 106 16.925 11.645 -5.527 1.00 0.00 H new ATOM 1572 N SER A 107 14.614 2.554 -7.152 1.00 0.00 N ATOM 1573 CA SER A 107 15.406 1.403 -6.736 1.00 0.00 C ATOM 1574 C SER A 107 16.335 0.949 -7.858 1.00 0.00 C ATOM 1575 O SER A 107 16.876 -0.155 -7.822 1.00 0.00 O ATOM 1576 CB SER A 107 14.490 0.251 -6.319 1.00 0.00 C ATOM 1577 OG SER A 107 15.240 -0.913 -6.015 1.00 0.00 O ATOM 0 H SER A 107 13.678 2.323 -7.486 1.00 0.00 H new ATOM 0 HA SER A 107 16.015 1.701 -5.882 1.00 0.00 H new ATOM 0 HB2 SER A 107 13.902 0.546 -5.450 1.00 0.00 H new ATOM 0 HB3 SER A 107 13.785 0.034 -7.122 1.00 0.00 H new ATOM 0 HG SER A 107 14.650 -1.589 -5.621 1.00 0.00 H new ATOM 1583 N GLY A 108 16.515 1.811 -8.854 1.00 0.00 N ATOM 1584 CA GLY A 108 17.379 1.482 -9.973 1.00 0.00 C ATOM 1585 C GLY A 108 16.684 0.618 -11.007 1.00 0.00 C ATOM 1586 O GLY A 108 16.985 0.700 -12.198 1.00 0.00 O ATOM 0 H GLY A 108 16.078 2.731 -8.906 1.00 0.00 H new ATOM 0 HA2 GLY A 108 17.723 2.402 -10.445 1.00 0.00 H new ATOM 0 HA3 GLY A 108 18.263 0.962 -9.605 1.00 0.00 H new ATOM 1590 N ASP A 109 15.753 -0.213 -10.552 1.00 0.00 N ATOM 1591 CA ASP A 109 15.013 -1.097 -11.446 1.00 0.00 C ATOM 1592 C ASP A 109 13.554 -1.207 -11.016 1.00 0.00 C ATOM 1593 O ASP A 109 13.159 -0.675 -9.979 1.00 0.00 O ATOM 1594 CB ASP A 109 15.656 -2.484 -11.473 1.00 0.00 C ATOM 1595 CG ASP A 109 16.756 -2.593 -12.510 1.00 0.00 C ATOM 1596 OD1 ASP A 109 16.437 -2.582 -13.717 1.00 0.00 O ATOM 1597 OD2 ASP A 109 17.938 -2.688 -12.115 1.00 0.00 O ATOM 0 H ASP A 109 15.492 -0.293 -9.569 1.00 0.00 H new ATOM 0 HA ASP A 109 15.046 -0.670 -12.448 1.00 0.00 H new ATOM 0 HB2 ASP A 109 16.065 -2.711 -10.488 1.00 0.00 H new ATOM 0 HB3 ASP A 109 14.891 -3.232 -11.680 1.00 0.00 H new ATOM 1602 N LYS A 110 12.756 -1.900 -11.822 1.00 0.00 N ATOM 1603 CA LYS A 110 11.340 -2.081 -11.526 1.00 0.00 C ATOM 1604 C LYS A 110 11.080 -3.461 -10.930 1.00 0.00 C ATOM 1605 O LYS A 110 10.042 -3.695 -10.312 1.00 0.00 O ATOM 1606 CB LYS A 110 10.505 -1.897 -12.796 1.00 0.00 C ATOM 1607 CG LYS A 110 10.770 -2.952 -13.856 1.00 0.00 C ATOM 1608 CD LYS A 110 9.729 -2.905 -14.962 1.00 0.00 C ATOM 1609 CE LYS A 110 9.542 -4.269 -15.610 1.00 0.00 C ATOM 1610 NZ LYS A 110 9.053 -4.154 -17.011 1.00 0.00 N ATOM 0 H LYS A 110 13.066 -2.345 -12.685 1.00 0.00 H new ATOM 0 HA LYS A 110 11.049 -1.328 -10.794 1.00 0.00 H new ATOM 0 HB2 LYS A 110 9.448 -1.917 -12.532 1.00 0.00 H new ATOM 0 HB3 LYS A 110 10.710 -0.912 -13.216 1.00 0.00 H new ATOM 0 HG2 LYS A 110 11.762 -2.800 -14.282 1.00 0.00 H new ATOM 0 HG3 LYS A 110 10.769 -3.940 -13.396 1.00 0.00 H new ATOM 0 HD2 LYS A 110 8.778 -2.561 -14.554 1.00 0.00 H new ATOM 0 HD3 LYS A 110 10.032 -2.180 -15.718 1.00 0.00 H new ATOM 0 HE2 LYS A 110 10.489 -4.809 -15.599 1.00 0.00 H new ATOM 0 HE3 LYS A 110 8.833 -4.855 -15.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 8.319 -4.870 -17.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 8.654 -3.206 -17.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 9.844 -4.305 -17.668 1.00 0.00 H new ATOM 1624 N SER A 111 12.031 -4.370 -11.118 1.00 0.00 N ATOM 1625 CA SER A 111 11.904 -5.727 -10.601 1.00 0.00 C ATOM 1626 C SER A 111 12.254 -5.778 -9.116 1.00 0.00 C ATOM 1627 O SER A 111 11.899 -6.725 -8.415 1.00 0.00 O ATOM 1628 CB SER A 111 12.810 -6.681 -11.382 1.00 0.00 C ATOM 1629 OG SER A 111 14.141 -6.197 -11.429 1.00 0.00 O ATOM 0 H SER A 111 12.898 -4.191 -11.625 1.00 0.00 H new ATOM 0 HA SER A 111 10.867 -6.040 -10.724 1.00 0.00 H new ATOM 0 HB2 SER A 111 12.794 -7.666 -10.915 1.00 0.00 H new ATOM 0 HB3 SER A 111 12.428 -6.802 -12.396 1.00 0.00 H new ATOM 0 HG SER A 111 14.700 -6.825 -11.932 1.00 0.00 H new ATOM 1635 N LYS A 112 12.953 -4.751 -8.645 1.00 0.00 N ATOM 1636 CA LYS A 112 13.351 -4.675 -7.244 1.00 0.00 C ATOM 1637 C LYS A 112 12.761 -3.437 -6.577 1.00 0.00 C ATOM 1638 O LYS A 112 13.433 -2.759 -5.799 1.00 0.00 O ATOM 1639 CB LYS A 112 14.877 -4.653 -7.127 1.00 0.00 C ATOM 1640 CG LYS A 112 15.548 -5.894 -7.689 1.00 0.00 C ATOM 1641 CD LYS A 112 16.968 -6.045 -7.167 1.00 0.00 C ATOM 1642 CE LYS A 112 17.569 -7.384 -7.566 1.00 0.00 C ATOM 1643 NZ LYS A 112 17.829 -7.462 -9.030 1.00 0.00 N ATOM 0 H LYS A 112 13.256 -3.960 -9.213 1.00 0.00 H new ATOM 0 HA LYS A 112 12.966 -5.558 -6.734 1.00 0.00 H new ATOM 0 HB2 LYS A 112 15.260 -3.776 -7.648 1.00 0.00 H new ATOM 0 HB3 LYS A 112 15.151 -4.546 -6.077 1.00 0.00 H new ATOM 0 HG2 LYS A 112 14.966 -6.776 -7.422 1.00 0.00 H new ATOM 0 HG3 LYS A 112 15.563 -5.839 -8.778 1.00 0.00 H new ATOM 0 HD2 LYS A 112 17.587 -5.237 -7.556 1.00 0.00 H new ATOM 0 HD3 LYS A 112 16.969 -5.954 -6.081 1.00 0.00 H new ATOM 0 HE2 LYS A 112 18.501 -7.540 -7.023 1.00 0.00 H new ATOM 0 HE3 LYS A 112 16.892 -8.187 -7.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 18.238 -8.390 -9.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 16.936 -7.339 -9.548 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 18.495 -6.712 -9.305 1.00 0.00 H new ATOM 1657 N VAL A 113 11.501 -3.147 -6.886 1.00 0.00 N ATOM 1658 CA VAL A 113 10.820 -1.992 -6.315 1.00 0.00 C ATOM 1659 C VAL A 113 10.248 -2.316 -4.939 1.00 0.00 C ATOM 1660 O VAL A 113 10.107 -1.435 -4.091 1.00 0.00 O ATOM 1661 CB VAL A 113 9.682 -1.502 -7.229 1.00 0.00 C ATOM 1662 CG1 VAL A 113 10.243 -0.950 -8.531 1.00 0.00 C ATOM 1663 CG2 VAL A 113 8.694 -2.626 -7.499 1.00 0.00 C ATOM 0 H VAL A 113 10.931 -3.697 -7.529 1.00 0.00 H new ATOM 0 HA VAL A 113 11.565 -1.202 -6.219 1.00 0.00 H new ATOM 0 HB VAL A 113 9.151 -0.698 -6.720 1.00 0.00 H new ATOM 0 HG11 VAL A 113 9.424 -0.609 -9.164 1.00 0.00 H new ATOM 0 HG12 VAL A 113 10.908 -0.114 -8.315 1.00 0.00 H new ATOM 0 HG13 VAL A 113 10.800 -1.732 -9.048 1.00 0.00 H new ATOM 0 HG21 VAL A 113 7.896 -2.262 -8.147 1.00 0.00 H new ATOM 0 HG22 VAL A 113 9.209 -3.453 -7.988 1.00 0.00 H new ATOM 0 HG23 VAL A 113 8.268 -2.970 -6.557 1.00 0.00 H new ATOM 1673 N TRP A 114 9.920 -3.585 -4.725 1.00 0.00 N ATOM 1674 CA TRP A 114 9.363 -4.026 -3.452 1.00 0.00 C ATOM 1675 C TRP A 114 10.388 -3.888 -2.332 1.00 0.00 C ATOM 1676 O TRP A 114 11.318 -4.689 -2.224 1.00 0.00 O ATOM 1677 CB TRP A 114 8.893 -5.478 -3.553 1.00 0.00 C ATOM 1678 CG TRP A 114 7.513 -5.617 -4.121 1.00 0.00 C ATOM 1679 CD1 TRP A 114 6.818 -4.676 -4.826 1.00 0.00 C ATOM 1680 CD2 TRP A 114 6.660 -6.764 -4.029 1.00 0.00 C ATOM 1681 NE1 TRP A 114 5.584 -5.169 -5.178 1.00 0.00 N ATOM 1682 CE2 TRP A 114 5.463 -6.448 -4.702 1.00 0.00 C ATOM 1683 CE3 TRP A 114 6.791 -8.027 -3.446 1.00 0.00 C ATOM 1684 CZ2 TRP A 114 4.407 -7.349 -4.805 1.00 0.00 C ATOM 1685 CZ3 TRP A 114 5.742 -8.921 -3.550 1.00 0.00 C ATOM 1686 CH2 TRP A 114 4.563 -8.579 -4.225 1.00 0.00 C ATOM 0 H TRP A 114 10.030 -4.327 -5.417 1.00 0.00 H new ATOM 0 HA TRP A 114 8.509 -3.390 -3.218 1.00 0.00 H new ATOM 0 HB2 TRP A 114 9.592 -6.036 -4.175 1.00 0.00 H new ATOM 0 HB3 TRP A 114 8.917 -5.930 -2.562 1.00 0.00 H new ATOM 0 HD1 TRP A 114 7.184 -3.690 -5.071 1.00 0.00 H new ATOM 0 HE1 TRP A 114 4.873 -4.664 -5.708 1.00 0.00 H new ATOM 0 HE3 TRP A 114 7.696 -8.300 -2.923 1.00 0.00 H new ATOM 0 HZ2 TRP A 114 3.497 -7.087 -5.324 1.00 0.00 H new ATOM 0 HZ3 TRP A 114 5.833 -9.900 -3.103 1.00 0.00 H new ATOM 0 HH2 TRP A 114 3.761 -9.300 -4.289 1.00 0.00 H new ATOM 1697 N THR A 115 10.215 -2.866 -1.499 1.00 0.00 N ATOM 1698 CA THR A 115 11.126 -2.623 -0.388 1.00 0.00 C ATOM 1699 C THR A 115 10.360 -2.348 0.901 1.00 0.00 C ATOM 1700 O THR A 115 9.394 -1.583 0.911 1.00 0.00 O ATOM 1701 CB THR A 115 12.062 -1.435 -0.679 1.00 0.00 C ATOM 1702 OG1 THR A 115 12.926 -1.750 -1.777 1.00 0.00 O ATOM 1703 CG2 THR A 115 12.896 -1.091 0.546 1.00 0.00 C ATOM 0 H THR A 115 9.452 -2.193 -1.573 1.00 0.00 H new ATOM 0 HA THR A 115 11.724 -3.526 -0.266 1.00 0.00 H new ATOM 0 HB THR A 115 11.448 -0.571 -0.936 1.00 0.00 H new ATOM 0 HG1 THR A 115 13.517 -0.989 -1.957 1.00 0.00 H new ATOM 0 HG21 THR A 115 13.549 -0.249 0.317 1.00 0.00 H new ATOM 0 HG22 THR A 115 12.237 -0.824 1.372 1.00 0.00 H new ATOM 0 HG23 THR A 115 13.500 -1.953 0.828 1.00 0.00 H new ATOM 1711 N THR A 116 10.797 -2.974 1.990 1.00 0.00 N ATOM 1712 CA THR A 116 10.152 -2.796 3.284 1.00 0.00 C ATOM 1713 C THR A 116 10.667 -1.547 3.989 1.00 0.00 C ATOM 1714 O THR A 116 11.824 -1.161 3.821 1.00 0.00 O ATOM 1715 CB THR A 116 10.378 -4.017 4.197 1.00 0.00 C ATOM 1716 OG1 THR A 116 11.779 -4.289 4.313 1.00 0.00 O ATOM 1717 CG2 THR A 116 9.662 -5.242 3.649 1.00 0.00 C ATOM 0 H THR A 116 11.595 -3.609 2.001 1.00 0.00 H new ATOM 0 HA THR A 116 9.085 -2.687 3.092 1.00 0.00 H new ATOM 0 HB THR A 116 9.970 -3.788 5.181 1.00 0.00 H new ATOM 0 HG1 THR A 116 12.181 -3.666 4.954 1.00 0.00 H new ATOM 0 HG21 THR A 116 9.836 -6.091 4.310 1.00 0.00 H new ATOM 0 HG22 THR A 116 8.592 -5.042 3.589 1.00 0.00 H new ATOM 0 HG23 THR A 116 10.044 -5.472 2.654 1.00 0.00 H new ATOM 1725 N ASP A 117 9.803 -0.919 4.778 1.00 0.00 N ATOM 1726 CA ASP A 117 10.172 0.287 5.510 1.00 0.00 C ATOM 1727 C ASP A 117 9.168 0.577 6.622 1.00 0.00 C ATOM 1728 O ASP A 117 8.053 0.055 6.618 1.00 0.00 O ATOM 1729 CB ASP A 117 10.257 1.481 4.558 1.00 0.00 C ATOM 1730 CG ASP A 117 11.239 2.533 5.035 1.00 0.00 C ATOM 1731 OD1 ASP A 117 12.402 2.174 5.318 1.00 0.00 O ATOM 1732 OD2 ASP A 117 10.846 3.715 5.123 1.00 0.00 O ATOM 0 H ASP A 117 8.842 -1.225 4.927 1.00 0.00 H new ATOM 0 HA ASP A 117 11.150 0.123 5.962 1.00 0.00 H new ATOM 0 HB2 ASP A 117 10.554 1.133 3.569 1.00 0.00 H new ATOM 0 HB3 ASP A 117 9.269 1.930 4.454 1.00 0.00 H new ATOM 1737 N THR A 118 9.572 1.411 7.574 1.00 0.00 N ATOM 1738 CA THR A 118 8.710 1.769 8.694 1.00 0.00 C ATOM 1739 C THR A 118 7.370 2.306 8.205 1.00 0.00 C ATOM 1740 O THR A 118 7.294 2.965 7.168 1.00 0.00 O ATOM 1741 CB THR A 118 9.373 2.823 9.600 1.00 0.00 C ATOM 1742 OG1 THR A 118 8.505 3.147 10.691 1.00 0.00 O ATOM 1743 CG2 THR A 118 9.700 4.084 8.814 1.00 0.00 C ATOM 0 H THR A 118 10.492 1.852 7.592 1.00 0.00 H new ATOM 0 HA THR A 118 8.546 0.858 9.270 1.00 0.00 H new ATOM 0 HB THR A 118 10.302 2.404 9.987 1.00 0.00 H new ATOM 0 HG1 THR A 118 8.935 3.817 11.263 1.00 0.00 H new ATOM 0 HG21 THR A 118 10.167 4.814 9.475 1.00 0.00 H new ATOM 0 HG22 THR A 118 10.385 3.839 8.002 1.00 0.00 H new ATOM 0 HG23 THR A 118 8.783 4.504 8.401 1.00 0.00 H new ATOM 1751 N CYS A 119 6.313 2.022 8.960 1.00 0.00 N ATOM 1752 CA CYS A 119 4.974 2.476 8.604 1.00 0.00 C ATOM 1753 C CYS A 119 4.702 3.865 9.175 1.00 0.00 C ATOM 1754 O CYS A 119 3.559 4.215 9.466 1.00 0.00 O ATOM 1755 CB CYS A 119 3.925 1.488 9.116 1.00 0.00 C ATOM 1756 SG CYS A 119 4.321 -0.258 8.780 1.00 0.00 S ATOM 0 H CYS A 119 6.359 1.479 9.822 1.00 0.00 H new ATOM 0 HA CYS A 119 4.912 2.530 7.517 1.00 0.00 H new ATOM 0 HB2 CYS A 119 3.809 1.623 10.191 1.00 0.00 H new ATOM 0 HB3 CYS A 119 2.964 1.726 8.660 1.00 0.00 H new ATOM 1761 N ALA A 120 5.762 4.653 9.331 1.00 0.00 N ATOM 1762 CA ALA A 120 5.637 6.003 9.864 1.00 0.00 C ATOM 1763 C ALA A 120 6.242 7.028 8.910 1.00 0.00 C ATOM 1764 O ALA A 120 5.990 8.228 9.029 1.00 0.00 O ATOM 1765 CB ALA A 120 6.302 6.095 11.230 1.00 0.00 C ATOM 0 H ALA A 120 6.716 4.379 9.096 1.00 0.00 H new ATOM 0 HA ALA A 120 4.576 6.227 9.972 1.00 0.00 H new ATOM 0 HB1 ALA A 120 6.201 7.109 11.616 1.00 0.00 H new ATOM 0 HB2 ALA A 120 5.823 5.396 11.916 1.00 0.00 H new ATOM 0 HB3 ALA A 120 7.359 5.846 11.138 1.00 0.00 H new ATOM 1771 N THR A 121 7.041 6.548 7.962 1.00 0.00 N ATOM 1772 CA THR A 121 7.683 7.422 6.989 1.00 0.00 C ATOM 1773 C THR A 121 6.656 8.058 6.059 1.00 0.00 C ATOM 1774 O THR A 121 5.892 7.374 5.377 1.00 0.00 O ATOM 1775 CB THR A 121 8.719 6.657 6.144 1.00 0.00 C ATOM 1776 OG1 THR A 121 9.776 6.177 6.981 1.00 0.00 O ATOM 1777 CG2 THR A 121 9.294 7.549 5.054 1.00 0.00 C ATOM 0 H THR A 121 7.259 5.558 7.848 1.00 0.00 H new ATOM 0 HA THR A 121 8.191 8.204 7.554 1.00 0.00 H new ATOM 0 HB THR A 121 8.217 5.812 5.673 1.00 0.00 H new ATOM 0 HG1 THR A 121 10.232 5.431 6.537 1.00 0.00 H new ATOM 0 HG21 THR A 121 10.023 6.987 4.471 1.00 0.00 H new ATOM 0 HG22 THR A 121 8.491 7.889 4.400 1.00 0.00 H new ATOM 0 HG23 THR A 121 9.781 8.412 5.509 1.00 0.00 H new ATOM 1785 N PRO A 122 6.634 9.399 6.028 1.00 0.00 N ATOM 1786 CA PRO A 122 5.705 10.156 5.185 1.00 0.00 C ATOM 1787 C PRO A 122 6.035 10.030 3.701 1.00 0.00 C ATOM 1788 O PRO A 122 6.999 10.623 3.217 1.00 0.00 O ATOM 1789 CB PRO A 122 5.897 11.601 5.654 1.00 0.00 C ATOM 1790 CG PRO A 122 7.277 11.636 6.215 1.00 0.00 C ATOM 1791 CD PRO A 122 7.515 10.278 6.815 1.00 0.00 C ATOM 0 HA PRO A 122 4.681 9.795 5.281 1.00 0.00 H new ATOM 0 HB2 PRO A 122 5.787 12.303 4.828 1.00 0.00 H new ATOM 0 HB3 PRO A 122 5.157 11.875 6.406 1.00 0.00 H new ATOM 0 HG2 PRO A 122 8.009 11.853 5.437 1.00 0.00 H new ATOM 0 HG3 PRO A 122 7.372 12.418 6.969 1.00 0.00 H new ATOM 0 HD2 PRO A 122 8.560 9.979 6.731 1.00 0.00 H new ATOM 0 HD3 PRO A 122 7.261 10.257 7.875 1.00 0.00 H new ATOM 1799 N ARG A 123 5.228 9.254 2.985 1.00 0.00 N ATOM 1800 CA ARG A 123 5.435 9.050 1.556 1.00 0.00 C ATOM 1801 C ARG A 123 4.104 9.036 0.810 1.00 0.00 C ATOM 1802 O ARG A 123 3.038 8.845 1.396 1.00 0.00 O ATOM 1803 CB ARG A 123 6.184 7.739 1.310 1.00 0.00 C ATOM 1804 CG ARG A 123 7.695 7.896 1.287 1.00 0.00 C ATOM 1805 CD ARG A 123 8.395 6.546 1.262 1.00 0.00 C ATOM 1806 NE ARG A 123 9.730 6.611 1.851 1.00 0.00 N ATOM 1807 CZ ARG A 123 10.381 5.550 2.315 1.00 0.00 C ATOM 1808 NH1 ARG A 123 9.822 4.348 2.259 1.00 0.00 N ATOM 1809 NH2 ARG A 123 11.593 5.689 2.836 1.00 0.00 N ATOM 0 H ARG A 123 4.425 8.757 3.371 1.00 0.00 H new ATOM 0 HA ARG A 123 6.034 9.879 1.179 1.00 0.00 H new ATOM 0 HB2 ARG A 123 5.913 7.024 2.087 1.00 0.00 H new ATOM 0 HB3 ARG A 123 5.857 7.316 0.360 1.00 0.00 H new ATOM 0 HG2 ARG A 123 7.988 8.475 0.412 1.00 0.00 H new ATOM 0 HG3 ARG A 123 8.017 8.458 2.164 1.00 0.00 H new ATOM 0 HD2 ARG A 123 7.794 5.816 1.805 1.00 0.00 H new ATOM 0 HD3 ARG A 123 8.470 6.195 0.233 1.00 0.00 H new ATOM 0 HE ARG A 123 10.187 7.521 1.909 1.00 0.00 H new ATOM 0 HH11 ARG A 123 8.890 4.237 1.859 1.00 0.00 H new ATOM 0 HH12 ARG A 123 10.324 3.535 2.616 1.00 0.00 H new ATOM 0 HH21 ARG A 123 12.026 6.611 2.881 1.00 0.00 H new ATOM 0 HH22 ARG A 123 12.092 4.874 3.192 1.00 0.00 H new ATOM 1823 N PRO A 124 4.164 9.243 -0.514 1.00 0.00 N ATOM 1824 CA PRO A 124 2.973 9.259 -1.368 1.00 0.00 C ATOM 1825 C PRO A 124 2.346 7.876 -1.514 1.00 0.00 C ATOM 1826 O PRO A 124 2.964 6.865 -1.180 1.00 0.00 O ATOM 1827 CB PRO A 124 3.510 9.748 -2.716 1.00 0.00 C ATOM 1828 CG PRO A 124 4.951 9.370 -2.709 1.00 0.00 C ATOM 1829 CD PRO A 124 5.401 9.477 -1.279 1.00 0.00 C ATOM 0 HA PRO A 124 2.183 9.887 -0.955 1.00 0.00 H new ATOM 0 HB2 PRO A 124 2.982 9.279 -3.546 1.00 0.00 H new ATOM 0 HB3 PRO A 124 3.384 10.825 -2.825 1.00 0.00 H new ATOM 0 HG2 PRO A 124 5.090 8.357 -3.087 1.00 0.00 H new ATOM 0 HG3 PRO A 124 5.531 10.033 -3.351 1.00 0.00 H new ATOM 0 HD2 PRO A 124 6.166 8.738 -1.042 1.00 0.00 H new ATOM 0 HD3 PRO A 124 5.827 10.457 -1.064 1.00 0.00 H new ATOM 1837 N PHE A 125 1.116 7.840 -2.015 1.00 0.00 N ATOM 1838 CA PHE A 125 0.405 6.581 -2.205 1.00 0.00 C ATOM 1839 C PHE A 125 -0.521 6.656 -3.415 1.00 0.00 C ATOM 1840 O PHE A 125 -0.663 7.710 -4.037 1.00 0.00 O ATOM 1841 CB PHE A 125 -0.401 6.232 -0.953 1.00 0.00 C ATOM 1842 CG PHE A 125 -1.027 7.426 -0.291 1.00 0.00 C ATOM 1843 CD1 PHE A 125 -0.249 8.333 0.410 1.00 0.00 C ATOM 1844 CD2 PHE A 125 -2.393 7.641 -0.370 1.00 0.00 C ATOM 1845 CE1 PHE A 125 -0.823 9.433 1.020 1.00 0.00 C ATOM 1846 CE2 PHE A 125 -2.973 8.739 0.238 1.00 0.00 C ATOM 1847 CZ PHE A 125 -2.186 9.636 0.933 1.00 0.00 C ATOM 0 H PHE A 125 0.591 8.668 -2.297 1.00 0.00 H new ATOM 0 HA PHE A 125 1.144 5.799 -2.383 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -1.184 5.523 -1.221 1.00 0.00 H new ATOM 0 HB3 PHE A 125 0.252 5.731 -0.238 1.00 0.00 H new ATOM 0 HD1 PHE A 125 0.818 8.179 0.481 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -3.012 6.943 -0.913 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -0.206 10.133 1.564 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -4.039 8.895 0.170 1.00 0.00 H new ATOM 0 HZ PHE A 125 -2.636 10.495 1.408 1.00 0.00 H new ATOM 1857 N ILE A 126 -1.148 5.532 -3.744 1.00 0.00 N ATOM 1858 CA ILE A 126 -2.061 5.470 -4.879 1.00 0.00 C ATOM 1859 C ILE A 126 -3.386 4.827 -4.484 1.00 0.00 C ATOM 1860 O ILE A 126 -3.438 3.643 -4.147 1.00 0.00 O ATOM 1861 CB ILE A 126 -1.449 4.682 -6.051 1.00 0.00 C ATOM 1862 CG1 ILE A 126 -0.260 5.443 -6.641 1.00 0.00 C ATOM 1863 CG2 ILE A 126 -2.500 4.420 -7.120 1.00 0.00 C ATOM 1864 CD1 ILE A 126 0.317 4.796 -7.881 1.00 0.00 C ATOM 0 H ILE A 126 -1.041 4.651 -3.241 1.00 0.00 H new ATOM 0 HA ILE A 126 -2.240 6.497 -5.197 1.00 0.00 H new ATOM 0 HB ILE A 126 -1.092 3.722 -5.677 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -0.573 6.459 -6.883 1.00 0.00 H new ATOM 0 HG13 ILE A 126 0.521 5.522 -5.885 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -2.052 3.862 -7.942 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -3.318 3.841 -6.692 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -2.884 5.369 -7.493 1.00 0.00 H new ATOM 0 HD11 ILE A 126 1.156 5.390 -8.244 1.00 0.00 H new ATOM 0 HD12 ILE A 126 0.661 3.790 -7.640 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -0.450 4.741 -8.653 1.00 0.00 H new ATOM 1876 N CYS A 127 -4.456 5.613 -4.530 1.00 0.00 N ATOM 1877 CA CYS A 127 -5.783 5.121 -4.179 1.00 0.00 C ATOM 1878 C CYS A 127 -6.463 4.481 -5.386 1.00 0.00 C ATOM 1879 O CYS A 127 -6.296 4.936 -6.517 1.00 0.00 O ATOM 1880 CB CYS A 127 -6.647 6.262 -3.639 1.00 0.00 C ATOM 1881 SG CYS A 127 -5.826 7.280 -2.370 1.00 0.00 S ATOM 0 H CYS A 127 -4.430 6.594 -4.807 1.00 0.00 H new ATOM 0 HA CYS A 127 -5.668 4.363 -3.404 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -6.943 6.904 -4.469 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -7.561 5.843 -3.218 1.00 0.00 H new ATOM 1886 N GLN A 128 -7.229 3.424 -5.135 1.00 0.00 N ATOM 1887 CA GLN A 128 -7.933 2.722 -6.201 1.00 0.00 C ATOM 1888 C GLN A 128 -9.389 2.473 -5.820 1.00 0.00 C ATOM 1889 O GLN A 128 -9.762 2.575 -4.651 1.00 0.00 O ATOM 1890 CB GLN A 128 -7.241 1.394 -6.511 1.00 0.00 C ATOM 1891 CG GLN A 128 -7.873 0.632 -7.664 1.00 0.00 C ATOM 1892 CD GLN A 128 -7.027 -0.539 -8.123 1.00 0.00 C ATOM 1893 OE1 GLN A 128 -6.399 -0.490 -9.182 1.00 0.00 O ATOM 1894 NE2 GLN A 128 -7.005 -1.602 -7.327 1.00 0.00 N ATOM 0 H GLN A 128 -7.378 3.036 -4.204 1.00 0.00 H new ATOM 0 HA GLN A 128 -7.911 3.351 -7.091 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -6.194 1.586 -6.744 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -7.260 0.768 -5.619 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -8.855 0.269 -7.360 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -8.030 1.312 -8.501 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -7.540 -1.600 -6.459 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -6.453 -2.420 -7.584 1.00 0.00 H new ATOM 1903 N LYS A 129 -10.208 2.147 -6.814 1.00 0.00 N ATOM 1904 CA LYS A 129 -11.623 1.882 -6.584 1.00 0.00 C ATOM 1905 C LYS A 129 -11.887 0.383 -6.485 1.00 0.00 C ATOM 1906 O LYS A 129 -11.139 -0.427 -7.033 1.00 0.00 O ATOM 1907 CB LYS A 129 -12.466 2.486 -7.710 1.00 0.00 C ATOM 1908 CG LYS A 129 -12.364 3.998 -7.802 1.00 0.00 C ATOM 1909 CD LYS A 129 -12.941 4.518 -9.108 1.00 0.00 C ATOM 1910 CE LYS A 129 -14.455 4.644 -9.037 1.00 0.00 C ATOM 1911 NZ LYS A 129 -14.996 5.466 -10.155 1.00 0.00 N ATOM 0 H LYS A 129 -9.916 2.060 -7.787 1.00 0.00 H new ATOM 0 HA LYS A 129 -11.905 2.346 -5.639 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -12.154 2.051 -8.659 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -13.509 2.209 -7.560 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -12.893 4.451 -6.964 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -11.320 4.299 -7.719 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -12.504 5.490 -9.339 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -12.669 3.845 -9.921 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -14.904 3.651 -9.066 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -14.738 5.094 -8.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -15.648 6.182 -9.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -14.212 5.939 -10.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -15.506 4.852 -10.822 1.00 0.00 H new ATOM 1925 N HIS A 130 -12.957 0.020 -5.784 1.00 0.00 N ATOM 1926 CA HIS A 130 -13.320 -1.382 -5.615 1.00 0.00 C ATOM 1927 C HIS A 130 -13.791 -1.984 -6.935 1.00 0.00 C ATOM 1928 O HIS A 130 -13.196 -2.935 -7.442 1.00 0.00 O ATOM 1929 CB HIS A 130 -14.416 -1.523 -4.557 1.00 0.00 C ATOM 1930 CG HIS A 130 -15.157 -2.823 -4.632 1.00 0.00 C ATOM 1931 ND1 HIS A 130 -16.516 -2.927 -4.424 1.00 0.00 N ATOM 1932 CD2 HIS A 130 -14.721 -4.077 -4.896 1.00 0.00 C ATOM 1933 CE1 HIS A 130 -16.884 -4.189 -4.554 1.00 0.00 C ATOM 1934 NE2 HIS A 130 -15.813 -4.907 -4.841 1.00 0.00 N ATOM 0 H HIS A 130 -13.587 0.677 -5.324 1.00 0.00 H new ATOM 0 HA HIS A 130 -12.434 -1.924 -5.284 1.00 0.00 H new ATOM 0 HB2 HIS A 130 -13.969 -1.425 -3.568 1.00 0.00 H new ATOM 0 HB3 HIS A 130 -15.125 -0.703 -4.669 1.00 0.00 H new ATOM 0 HD2 HIS A 130 -13.704 -4.370 -5.110 1.00 0.00 H new ATOM 0 HE1 HIS A 130 -17.889 -4.569 -4.444 1.00 0.00 H new ATOM 0 HE2 HIS A 130 -15.800 -5.915 -4.997 1.00 0.00 H new ATOM 1943 N ARG A 131 -14.864 -1.424 -7.486 1.00 0.00 N ATOM 1944 CA ARG A 131 -15.415 -1.907 -8.746 1.00 0.00 C ATOM 1945 C ARG A 131 -15.265 -0.857 -9.843 1.00 0.00 C ATOM 1946 O ARG A 131 -16.140 -0.012 -10.032 1.00 0.00 O ATOM 1947 CB ARG A 131 -16.891 -2.273 -8.575 1.00 0.00 C ATOM 1948 CG ARG A 131 -17.116 -3.720 -8.169 1.00 0.00 C ATOM 1949 CD ARG A 131 -17.189 -4.634 -9.382 1.00 0.00 C ATOM 1950 NE ARG A 131 -17.487 -6.015 -9.010 1.00 0.00 N ATOM 1951 CZ ARG A 131 -17.954 -6.921 -9.861 1.00 0.00 C ATOM 1952 NH1 ARG A 131 -18.175 -6.594 -11.127 1.00 0.00 N ATOM 1953 NH2 ARG A 131 -18.201 -8.157 -9.447 1.00 0.00 N ATOM 0 H ARG A 131 -15.368 -0.636 -7.079 1.00 0.00 H new ATOM 0 HA ARG A 131 -14.858 -2.797 -9.039 1.00 0.00 H new ATOM 0 HB2 ARG A 131 -17.334 -1.620 -7.823 1.00 0.00 H new ATOM 0 HB3 ARG A 131 -17.415 -2.081 -9.511 1.00 0.00 H new ATOM 0 HG2 ARG A 131 -16.307 -4.046 -7.515 1.00 0.00 H new ATOM 0 HG3 ARG A 131 -18.040 -3.799 -7.596 1.00 0.00 H new ATOM 0 HD2 ARG A 131 -17.956 -4.269 -10.065 1.00 0.00 H new ATOM 0 HD3 ARG A 131 -16.241 -4.600 -9.919 1.00 0.00 H new ATOM 0 HE ARG A 131 -17.328 -6.299 -8.043 1.00 0.00 H new ATOM 0 HH11 ARG A 131 -17.986 -5.645 -11.449 1.00 0.00 H new ATOM 0 HH12 ARG A 131 -18.534 -7.292 -11.779 1.00 0.00 H new ATOM 0 HH21 ARG A 131 -18.032 -8.412 -8.474 1.00 0.00 H new ATOM 0 HH22 ARG A 131 -18.560 -8.852 -10.102 1.00 0.00 H new ATOM 1967 N TYR A 132 -14.150 -0.917 -10.564 1.00 0.00 N ATOM 1968 CA TYR A 132 -13.884 0.030 -11.640 1.00 0.00 C ATOM 1969 C TYR A 132 -15.142 0.287 -12.463 1.00 0.00 C ATOM 1970 O TYR A 132 -15.594 -0.577 -13.214 1.00 0.00 O ATOM 1971 CB TYR A 132 -12.768 -0.496 -12.545 1.00 0.00 C ATOM 1972 CG TYR A 132 -12.863 -1.978 -12.825 1.00 0.00 C ATOM 1973 CD1 TYR A 132 -12.367 -2.909 -11.920 1.00 0.00 C ATOM 1974 CD2 TYR A 132 -13.447 -2.449 -13.994 1.00 0.00 C ATOM 1975 CE1 TYR A 132 -12.450 -4.265 -12.171 1.00 0.00 C ATOM 1976 CE2 TYR A 132 -13.536 -3.803 -14.253 1.00 0.00 C ATOM 1977 CZ TYR A 132 -13.036 -4.707 -13.339 1.00 0.00 C ATOM 1978 OH TYR A 132 -13.122 -6.056 -13.595 1.00 0.00 O ATOM 0 H TYR A 132 -13.416 -1.611 -10.422 1.00 0.00 H new ATOM 0 HA TYR A 132 -13.567 0.971 -11.191 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -12.793 0.046 -13.490 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -11.805 -0.284 -12.081 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -11.909 -2.566 -11.004 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -13.838 -1.744 -14.713 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -12.059 -4.975 -11.457 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -13.995 -4.152 -15.166 1.00 0.00 H new ATOM 0 HH TYR A 132 -13.563 -6.198 -14.459 1.00 0.00 H new ATOM 1988 N ASP A 133 -15.703 1.483 -12.315 1.00 0.00 N ATOM 1989 CA ASP A 133 -16.908 1.857 -13.046 1.00 0.00 C ATOM 1990 C ASP A 133 -17.078 3.373 -13.073 1.00 0.00 C ATOM 1991 O ASP A 133 -16.465 4.090 -12.283 1.00 0.00 O ATOM 1992 CB ASP A 133 -18.138 1.205 -12.411 1.00 0.00 C ATOM 1993 CG ASP A 133 -19.436 1.798 -12.922 1.00 0.00 C ATOM 1994 OD1 ASP A 133 -19.596 1.900 -14.156 1.00 0.00 O ATOM 1995 OD2 ASP A 133 -20.292 2.161 -12.087 1.00 0.00 O ATOM 0 H ASP A 133 -15.343 2.209 -11.696 1.00 0.00 H new ATOM 0 HA ASP A 133 -16.807 1.502 -14.072 1.00 0.00 H new ATOM 0 HB2 ASP A 133 -18.125 0.135 -12.617 1.00 0.00 H new ATOM 0 HB3 ASP A 133 -18.090 1.322 -11.328 1.00 0.00 H new ATOM 2000 N SER A 134 -17.914 3.853 -13.989 1.00 0.00 N ATOM 2001 CA SER A 134 -18.160 5.284 -14.123 1.00 0.00 C ATOM 2002 C SER A 134 -19.570 5.638 -13.659 1.00 0.00 C ATOM 2003 O SER A 134 -20.280 6.397 -14.319 1.00 0.00 O ATOM 2004 CB SER A 134 -17.964 5.723 -15.575 1.00 0.00 C ATOM 2005 OG SER A 134 -19.019 5.256 -16.396 1.00 0.00 O ATOM 0 H SER A 134 -18.432 3.272 -14.649 1.00 0.00 H new ATOM 0 HA SER A 134 -17.445 5.811 -13.492 1.00 0.00 H new ATOM 0 HB2 SER A 134 -17.914 6.811 -15.626 1.00 0.00 H new ATOM 0 HB3 SER A 134 -17.013 5.342 -15.948 1.00 0.00 H new ATOM 0 HG SER A 134 -19.848 5.721 -16.159 1.00 0.00 H new ATOM 2011 N ASP A 135 -19.968 5.082 -12.520 1.00 0.00 N ATOM 2012 CA ASP A 135 -21.293 5.339 -11.966 1.00 0.00 C ATOM 2013 C ASP A 135 -21.633 6.824 -12.037 1.00 0.00 C ATOM 2014 O ASP A 135 -20.911 7.664 -11.499 1.00 0.00 O ATOM 2015 CB ASP A 135 -21.365 4.855 -10.517 1.00 0.00 C ATOM 2016 CG ASP A 135 -20.517 5.696 -9.583 1.00 0.00 C ATOM 2017 OD1 ASP A 135 -19.293 5.791 -9.816 1.00 0.00 O ATOM 2018 OD2 ASP A 135 -21.076 6.260 -8.620 1.00 0.00 O ATOM 0 H ASP A 135 -19.393 4.451 -11.962 1.00 0.00 H new ATOM 0 HA ASP A 135 -22.022 4.789 -12.561 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -22.402 4.877 -10.181 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -21.036 3.817 -10.467 1.00 0.00 H new ATOM 2023 N HIS A 136 -22.737 7.141 -12.706 1.00 0.00 N ATOM 2024 CA HIS A 136 -23.174 8.526 -12.849 1.00 0.00 C ATOM 2025 C HIS A 136 -23.779 9.042 -11.546 1.00 0.00 C ATOM 2026 O HIS A 136 -24.759 8.491 -11.044 1.00 0.00 O ATOM 2027 CB HIS A 136 -24.193 8.648 -13.982 1.00 0.00 C ATOM 2028 CG HIS A 136 -24.902 9.966 -14.010 1.00 0.00 C ATOM 2029 ND1 HIS A 136 -26.216 10.106 -14.404 1.00 0.00 N ATOM 2030 CD2 HIS A 136 -24.473 11.209 -13.689 1.00 0.00 C ATOM 2031 CE1 HIS A 136 -26.564 11.378 -14.326 1.00 0.00 C ATOM 2032 NE2 HIS A 136 -25.525 12.069 -13.894 1.00 0.00 N ATOM 0 H HIS A 136 -23.345 6.458 -13.158 1.00 0.00 H new ATOM 0 HA HIS A 136 -22.301 9.133 -13.090 1.00 0.00 H new ATOM 0 HB2 HIS A 136 -23.685 8.498 -14.934 1.00 0.00 H new ATOM 0 HB3 HIS A 136 -24.930 7.850 -13.885 1.00 0.00 H new ATOM 0 HD2 HIS A 136 -23.487 11.475 -13.337 1.00 0.00 H new ATOM 0 HE1 HIS A 136 -27.534 11.784 -14.574 1.00 0.00 H new ATOM 0 HE2 HIS A 136 -25.506 13.077 -13.738 1.00 0.00 H new ATOM 2041 N LYS A 137 -23.188 10.101 -11.004 1.00 0.00 N ATOM 2042 CA LYS A 137 -23.668 10.692 -9.761 1.00 0.00 C ATOM 2043 C LYS A 137 -24.065 12.150 -9.969 1.00 0.00 C ATOM 2044 O LYS A 137 -23.237 13.006 -10.282 1.00 0.00 O ATOM 2045 CB LYS A 137 -22.591 10.596 -8.677 1.00 0.00 C ATOM 2046 CG LYS A 137 -22.535 9.240 -7.994 1.00 0.00 C ATOM 2047 CD LYS A 137 -22.024 9.355 -6.568 1.00 0.00 C ATOM 2048 CE LYS A 137 -20.525 9.605 -6.531 1.00 0.00 C ATOM 2049 NZ LYS A 137 -19.935 9.251 -5.210 1.00 0.00 N ATOM 0 H LYS A 137 -22.375 10.568 -11.406 1.00 0.00 H new ATOM 0 HA LYS A 137 -24.549 10.136 -9.440 1.00 0.00 H new ATOM 0 HB2 LYS A 137 -21.619 10.810 -9.122 1.00 0.00 H new ATOM 0 HB3 LYS A 137 -22.774 11.365 -7.926 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -23.529 8.792 -7.990 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -21.886 8.572 -8.561 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -22.542 10.168 -6.059 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -22.255 8.440 -6.023 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -20.040 9.021 -7.313 1.00 0.00 H new ATOM 0 HE3 LYS A 137 -20.327 10.655 -6.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 -18.912 9.436 -5.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 -20.379 9.826 -4.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -20.102 8.243 -5.014 1.00 0.00 H new ATOM 2063 N PRO A 138 -25.362 12.442 -9.791 1.00 0.00 N ATOM 2064 CA PRO A 138 -25.898 13.797 -9.952 1.00 0.00 C ATOM 2065 C PRO A 138 -25.432 14.740 -8.848 1.00 0.00 C ATOM 2066 O PRO A 138 -25.458 15.959 -9.008 1.00 0.00 O ATOM 2067 CB PRO A 138 -27.412 13.591 -9.877 1.00 0.00 C ATOM 2068 CG PRO A 138 -27.586 12.342 -9.083 1.00 0.00 C ATOM 2069 CD PRO A 138 -26.405 11.473 -9.417 1.00 0.00 C ATOM 0 HA PRO A 138 -25.563 14.260 -10.880 1.00 0.00 H new ATOM 0 HB2 PRO A 138 -27.903 14.437 -9.397 1.00 0.00 H new ATOM 0 HB3 PRO A 138 -27.848 13.492 -10.871 1.00 0.00 H new ATOM 0 HG2 PRO A 138 -27.621 12.560 -8.016 1.00 0.00 H new ATOM 0 HG3 PRO A 138 -28.522 11.844 -9.338 1.00 0.00 H new ATOM 0 HD2 PRO A 138 -26.101 10.864 -8.566 1.00 0.00 H new ATOM 0 HD3 PRO A 138 -26.629 10.788 -10.235 1.00 0.00 H new ATOM 2077 N ASN A 139 -25.007 14.167 -7.727 1.00 0.00 N ATOM 2078 CA ASN A 139 -24.536 14.957 -6.595 1.00 0.00 C ATOM 2079 C ASN A 139 -23.820 16.216 -7.072 1.00 0.00 C ATOM 2080 O ASN A 139 -22.644 16.176 -7.437 1.00 0.00 O ATOM 2081 CB ASN A 139 -23.598 14.123 -5.720 1.00 0.00 C ATOM 2082 CG ASN A 139 -23.572 14.602 -4.281 1.00 0.00 C ATOM 2083 OD1 ASN A 139 -24.565 14.491 -3.561 1.00 0.00 O ATOM 2084 ND2 ASN A 139 -22.434 15.138 -3.856 1.00 0.00 N ATOM 0 H ASN A 139 -24.979 13.158 -7.578 1.00 0.00 H new ATOM 0 HA ASN A 139 -25.403 15.255 -6.005 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -23.912 13.080 -5.747 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -22.590 14.163 -6.132 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -22.357 15.478 -2.897 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -21.637 15.210 -4.488 1.00 0.00 H new ATOM 2091 N THR A 140 -24.536 17.336 -7.066 1.00 0.00 N ATOM 2092 CA THR A 140 -23.970 18.608 -7.498 1.00 0.00 C ATOM 2093 C THR A 140 -23.045 19.188 -6.434 1.00 0.00 C ATOM 2094 O THR A 140 -23.430 19.327 -5.273 1.00 0.00 O ATOM 2095 CB THR A 140 -25.073 19.634 -7.818 1.00 0.00 C ATOM 2096 OG1 THR A 140 -25.952 19.775 -6.696 1.00 0.00 O ATOM 2097 CG2 THR A 140 -25.870 19.209 -9.042 1.00 0.00 C ATOM 0 H THR A 140 -25.510 17.388 -6.766 1.00 0.00 H new ATOM 0 HA THR A 140 -23.397 18.408 -8.403 1.00 0.00 H new ATOM 0 HB THR A 140 -24.597 20.591 -8.029 1.00 0.00 H new ATOM 0 HG1 THR A 140 -25.436 19.709 -5.866 1.00 0.00 H new ATOM 0 HG21 THR A 140 -26.643 19.949 -9.248 1.00 0.00 H new ATOM 0 HG22 THR A 140 -25.204 19.131 -9.901 1.00 0.00 H new ATOM 0 HG23 THR A 140 -26.335 18.241 -8.855 1.00 0.00 H new ATOM 2105 N ILE A 141 -21.825 19.526 -6.838 1.00 0.00 N ATOM 2106 CA ILE A 141 -20.846 20.093 -5.918 1.00 0.00 C ATOM 2107 C ILE A 141 -20.085 21.243 -6.567 1.00 0.00 C ATOM 2108 O ILE A 141 -19.829 21.232 -7.770 1.00 0.00 O ATOM 2109 CB ILE A 141 -19.839 19.029 -5.442 1.00 0.00 C ATOM 2110 CG1 ILE A 141 -18.921 19.611 -4.366 1.00 0.00 C ATOM 2111 CG2 ILE A 141 -19.024 18.508 -6.616 1.00 0.00 C ATOM 2112 CD1 ILE A 141 -19.596 19.781 -3.023 1.00 0.00 C ATOM 0 H ILE A 141 -21.491 19.417 -7.796 1.00 0.00 H new ATOM 0 HA ILE A 141 -21.400 20.467 -5.057 1.00 0.00 H new ATOM 0 HB ILE A 141 -20.391 18.194 -5.010 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -18.055 18.960 -4.248 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -18.549 20.579 -4.702 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -18.317 17.757 -6.263 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -19.692 18.060 -7.352 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -18.479 19.333 -7.075 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -18.886 20.198 -2.309 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -20.446 20.456 -3.126 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -19.943 18.812 -2.665 1.00 0.00 H new ATOM 2124 N GLY A 142 -19.722 22.236 -5.760 1.00 0.00 N ATOM 2125 CA GLY A 142 -18.992 23.380 -6.273 1.00 0.00 C ATOM 2126 C GLY A 142 -17.597 23.015 -6.741 1.00 0.00 C ATOM 2127 O GLY A 142 -16.627 23.159 -5.997 1.00 0.00 O ATOM 0 H GLY A 142 -19.921 22.268 -4.760 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -19.547 23.819 -7.102 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -18.924 24.142 -5.496 1.00 0.00 H new ATOM 2131 N ASP A 143 -17.496 22.539 -7.977 1.00 0.00 N ATOM 2132 CA ASP A 143 -16.210 22.151 -8.545 1.00 0.00 C ATOM 2133 C ASP A 143 -15.516 23.348 -9.186 1.00 0.00 C ATOM 2134 O ASP A 143 -16.014 23.922 -10.154 1.00 0.00 O ATOM 2135 CB ASP A 143 -16.399 21.040 -9.579 1.00 0.00 C ATOM 2136 CG ASP A 143 -15.100 20.655 -10.258 1.00 0.00 C ATOM 2137 OD1 ASP A 143 -14.707 21.344 -11.223 1.00 0.00 O ATOM 2138 OD2 ASP A 143 -14.475 19.663 -9.826 1.00 0.00 O ATOM 0 H ASP A 143 -18.290 22.412 -8.605 1.00 0.00 H new ATOM 0 HA ASP A 143 -15.581 21.780 -7.736 1.00 0.00 H new ATOM 0 HB2 ASP A 143 -16.825 20.163 -9.092 1.00 0.00 H new ATOM 0 HB3 ASP A 143 -17.116 21.366 -10.332 1.00 0.00 H new ATOM 2143 N ALA A 144 -14.363 23.720 -8.640 1.00 0.00 N ATOM 2144 CA ALA A 144 -13.600 24.848 -9.159 1.00 0.00 C ATOM 2145 C ALA A 144 -12.327 24.376 -9.854 1.00 0.00 C ATOM 2146 O ALA A 144 -11.534 23.631 -9.279 1.00 0.00 O ATOM 2147 CB ALA A 144 -13.262 25.818 -8.037 1.00 0.00 C ATOM 0 H ALA A 144 -13.937 23.256 -7.838 1.00 0.00 H new ATOM 0 HA ALA A 144 -14.216 25.363 -9.896 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -12.692 26.655 -8.439 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -14.183 26.189 -7.587 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -12.669 25.306 -7.280 1.00 0.00 H new ATOM 2153 N SER A 145 -12.139 24.815 -11.095 1.00 0.00 N ATOM 2154 CA SER A 145 -10.964 24.434 -11.870 1.00 0.00 C ATOM 2155 C SER A 145 -10.687 22.939 -11.737 1.00 0.00 C ATOM 2156 O SER A 145 -9.540 22.520 -11.583 1.00 0.00 O ATOM 2157 CB SER A 145 -9.743 25.233 -11.412 1.00 0.00 C ATOM 2158 OG SER A 145 -8.772 25.315 -12.441 1.00 0.00 O ATOM 0 H SER A 145 -12.785 25.434 -11.585 1.00 0.00 H new ATOM 0 HA SER A 145 -11.163 24.658 -12.918 1.00 0.00 H new ATOM 0 HB2 SER A 145 -10.051 26.236 -11.117 1.00 0.00 H new ATOM 0 HB3 SER A 145 -9.306 24.762 -10.532 1.00 0.00 H new ATOM 0 HG SER A 145 -8.002 25.832 -12.124 1.00 0.00 H new ATOM 2164 N GLY A 146 -11.747 22.139 -11.797 1.00 0.00 N ATOM 2165 CA GLY A 146 -11.598 20.700 -11.681 1.00 0.00 C ATOM 2166 C GLY A 146 -10.981 20.080 -12.918 1.00 0.00 C ATOM 2167 O GLY A 146 -9.900 19.493 -12.871 1.00 0.00 O ATOM 0 H GLY A 146 -12.706 22.462 -11.924 1.00 0.00 H new ATOM 0 HA2 GLY A 146 -10.977 20.471 -10.815 1.00 0.00 H new ATOM 0 HA3 GLY A 146 -12.574 20.250 -11.501 1.00 0.00 H new ATOM 2171 N PRO A 147 -11.677 20.205 -14.058 1.00 0.00 N ATOM 2172 CA PRO A 147 -11.210 19.658 -15.335 1.00 0.00 C ATOM 2173 C PRO A 147 -9.998 20.406 -15.878 1.00 0.00 C ATOM 2174 O PRO A 147 -10.003 21.634 -15.968 1.00 0.00 O ATOM 2175 CB PRO A 147 -12.414 19.845 -16.262 1.00 0.00 C ATOM 2176 CG PRO A 147 -13.170 20.986 -15.675 1.00 0.00 C ATOM 2177 CD PRO A 147 -12.973 20.892 -14.188 1.00 0.00 C ATOM 0 HA PRO A 147 -10.884 18.622 -15.240 1.00 0.00 H new ATOM 0 HB2 PRO A 147 -12.098 20.062 -17.282 1.00 0.00 H new ATOM 0 HB3 PRO A 147 -13.026 18.944 -16.303 1.00 0.00 H new ATOM 0 HG2 PRO A 147 -12.801 21.937 -16.058 1.00 0.00 H new ATOM 0 HG3 PRO A 147 -14.227 20.927 -15.933 1.00 0.00 H new ATOM 0 HD2 PRO A 147 -12.954 21.877 -13.722 1.00 0.00 H new ATOM 0 HD3 PRO A 147 -13.776 20.329 -13.711 1.00 0.00 H new ATOM 2185 N SER A 148 -8.960 19.658 -16.240 1.00 0.00 N ATOM 2186 CA SER A 148 -7.739 20.252 -16.772 1.00 0.00 C ATOM 2187 C SER A 148 -7.359 19.612 -18.104 1.00 0.00 C ATOM 2188 O SER A 148 -7.933 18.599 -18.504 1.00 0.00 O ATOM 2189 CB SER A 148 -6.592 20.094 -15.771 1.00 0.00 C ATOM 2190 OG SER A 148 -5.469 20.867 -16.157 1.00 0.00 O ATOM 0 H SER A 148 -8.940 18.640 -16.175 1.00 0.00 H new ATOM 0 HA SER A 148 -7.923 21.313 -16.938 1.00 0.00 H new ATOM 0 HB2 SER A 148 -6.925 20.401 -14.780 1.00 0.00 H new ATOM 0 HB3 SER A 148 -6.308 19.044 -15.701 1.00 0.00 H new ATOM 0 HG SER A 148 -4.751 20.750 -15.501 1.00 0.00 H new ATOM 2196 N SER A 149 -6.387 20.211 -18.785 1.00 0.00 N ATOM 2197 CA SER A 149 -5.932 19.702 -20.074 1.00 0.00 C ATOM 2198 C SER A 149 -4.420 19.854 -20.214 1.00 0.00 C ATOM 2199 O SER A 149 -3.862 20.912 -19.927 1.00 0.00 O ATOM 2200 CB SER A 149 -6.638 20.438 -21.214 1.00 0.00 C ATOM 2201 OG SER A 149 -6.077 20.092 -22.469 1.00 0.00 O ATOM 0 H SER A 149 -5.900 21.048 -18.466 1.00 0.00 H new ATOM 0 HA SER A 149 -6.180 18.642 -20.127 1.00 0.00 H new ATOM 0 HB2 SER A 149 -7.700 20.193 -21.207 1.00 0.00 H new ATOM 0 HB3 SER A 149 -6.558 21.514 -21.061 1.00 0.00 H new ATOM 0 HG SER A 149 -6.547 20.574 -23.181 1.00 0.00 H new ATOM 2207 N GLY A 150 -3.763 18.787 -20.659 1.00 0.00 N ATOM 2208 CA GLY A 150 -2.323 18.821 -20.830 1.00 0.00 C ATOM 2209 C GLY A 150 -1.680 17.467 -20.601 1.00 0.00 C ATOM 2210 O GLY A 150 -1.205 17.176 -19.504 1.00 0.00 O ATOM 0 H GLY A 150 -4.203 17.900 -20.904 1.00 0.00 H new ATOM 0 HA2 GLY A 150 -2.088 19.166 -21.837 1.00 0.00 H new ATOM 0 HA3 GLY A 150 -1.895 19.545 -20.137 1.00 0.00 H new TER 2214 GLY A 150