USER MOD reduce.3.24.130724 H: found=0, std=0, add=1059, rem=0, adj=35 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 89 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 1.2: A 112 LYS NZ :NH3+ 156:sc= 0 (180deg=0) USER MOD Set 2.1: A 66 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 2.2: A 68 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 19 SER OG : rot -107:sc= -0.0938 USER MOD Set 3.2: A 22 GLN : amide:sc= 0.721 K(o=0.63,f=-1.7!) 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 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 27:sc= 0.718 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 32:sc= -0.188 USER MOD Single : A 14 ASN : amide:sc= -0.082 K(o=-0.082,f=-0.91) USER MOD Single : A 20 MET CE :methyl -166:sc= -1.61 (180deg=-1.88) USER MOD Single : A 25 ASN : amide:sc= -0.258 K(o=-0.26,f=-1.1) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 33 TYR OH : rot 150:sc= -0.941 USER MOD Single : A 42 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0106) USER MOD Single : A 43 ASN : amide:sc= -6.01! K(o=-6!,f=-1.4) USER MOD Single : A 44 ASN : amide:sc= -4.93! C(o=-4.9!,f=-6!) USER MOD Single : A 46 TYR OH : rot -172:sc= 0.562 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 52 ASN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 GLN : amide:sc= -6.3! C(o=-6.3!,f=-13!) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 ASN : amide:sc= 0.324 K(o=0.32,f=-4.9!) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 73 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 76 ASN : amide:sc= -1.33 K(o=-1.3,f=-5.7!) USER MOD Single : A 81 ASN : amide:sc= -0.143 K(o=-0.14,f=-2.3!) USER MOD Single : A 82 GLN : amide:sc= 0.806 K(o=0.81,f=-3.8!) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 TYR OH : rot 130:sc= -0.585 USER MOD Single : A 93 SER OG : rot -104:sc= 0.397 USER MOD Single : A 94 ASN : amide:sc=-0.00722 K(o=-0.0072,f=-4.1!) USER MOD Single : A 97 THR OG1 : rot 180:sc= -0.0169 USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 TYR OH : rot -13:sc= 1.21 USER MOD Single : A 107 SER OG : rot -84:sc= 1.1 USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 SER OG : rot -21:sc= 0.189! USER MOD Single : A 115 THR OG1 : rot 70:sc= 0.0166 USER MOD Single : A 116 THR OG1 : rot -76:sc= 0.703 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 180:sc= -0.0884 USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=-0.005) USER MOD Single : A 129 LYS NZ :NH3+ -162:sc= -3.01 (180deg=-3.59!) USER MOD Single : A 130 HIS : no HD1:sc= -0.422 K(o=-0.42,f=-1.8) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 136 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 ASN : amide:sc= 0.335 K(o=0.34,f=-3.3!) USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 145 SER OG : rot 58:sc= 0.879 USER MOD Single : A 148 SER OG : rot 38:sc= 1.22 USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -18.405 25.933 -10.723 1.00 0.00 N ATOM 2 CA GLY A 1 -17.190 25.149 -10.597 1.00 0.00 C ATOM 3 C GLY A 1 -16.856 24.390 -11.865 1.00 0.00 C ATOM 4 O GLY A 1 -16.749 24.980 -12.940 1.00 0.00 O ATOM 0 H1 GLY A 1 -18.590 26.433 -9.830 1.00 0.00 H new ATOM 0 H2 GLY A 1 -18.293 26.626 -11.491 1.00 0.00 H new ATOM 0 H3 GLY A 1 -19.204 25.303 -10.939 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -16.360 25.809 -10.343 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -17.300 24.444 -9.773 1.00 0.00 H new ATOM 8 N SER A 2 -16.688 23.077 -11.740 1.00 0.00 N ATOM 9 CA SER A 2 -16.358 22.236 -12.885 1.00 0.00 C ATOM 10 C SER A 2 -17.267 21.013 -12.941 1.00 0.00 C ATOM 11 O SER A 2 -17.277 20.190 -12.024 1.00 0.00 O ATOM 12 CB SER A 2 -14.894 21.796 -12.816 1.00 0.00 C ATOM 13 OG SER A 2 -14.036 22.906 -12.617 1.00 0.00 O ATOM 0 H SER A 2 -16.775 22.573 -10.858 1.00 0.00 H new ATOM 0 HA SER A 2 -16.511 22.822 -13.791 1.00 0.00 H new ATOM 0 HB2 SER A 2 -14.764 21.082 -12.003 1.00 0.00 H new ATOM 0 HB3 SER A 2 -14.622 21.283 -13.738 1.00 0.00 H new ATOM 0 HG SER A 2 -13.107 22.598 -12.575 1.00 0.00 H new ATOM 19 N SER A 3 -18.031 20.899 -14.023 1.00 0.00 N ATOM 20 CA SER A 3 -18.947 19.778 -14.197 1.00 0.00 C ATOM 21 C SER A 3 -18.266 18.460 -13.844 1.00 0.00 C ATOM 22 O SER A 3 -17.103 18.240 -14.179 1.00 0.00 O ATOM 23 CB SER A 3 -19.460 19.731 -15.638 1.00 0.00 C ATOM 24 OG SER A 3 -20.050 20.965 -16.010 1.00 0.00 O ATOM 0 H SER A 3 -18.034 21.569 -14.792 1.00 0.00 H new ATOM 0 HA SER A 3 -19.791 19.922 -13.523 1.00 0.00 H new ATOM 0 HB2 SER A 3 -18.636 19.500 -16.313 1.00 0.00 H new ATOM 0 HB3 SER A 3 -20.191 18.929 -15.741 1.00 0.00 H new ATOM 0 HG SER A 3 -20.368 20.910 -16.935 1.00 0.00 H new ATOM 30 N GLY A 4 -19.001 17.584 -13.165 1.00 0.00 N ATOM 31 CA GLY A 4 -18.453 16.298 -12.777 1.00 0.00 C ATOM 32 C GLY A 4 -17.705 16.360 -11.460 1.00 0.00 C ATOM 33 O GLY A 4 -16.494 16.578 -11.436 1.00 0.00 O ATOM 0 H GLY A 4 -19.967 17.743 -12.877 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -19.261 15.571 -12.698 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -17.780 15.943 -13.557 1.00 0.00 H new ATOM 37 N SER A 5 -18.428 16.168 -10.362 1.00 0.00 N ATOM 38 CA SER A 5 -17.826 16.209 -9.034 1.00 0.00 C ATOM 39 C SER A 5 -16.813 15.081 -8.862 1.00 0.00 C ATOM 40 O SER A 5 -17.184 13.921 -8.679 1.00 0.00 O ATOM 41 CB SER A 5 -18.908 16.107 -7.957 1.00 0.00 C ATOM 42 OG SER A 5 -18.348 16.212 -6.660 1.00 0.00 O ATOM 0 H SER A 5 -19.431 15.983 -10.365 1.00 0.00 H new ATOM 0 HA SER A 5 -17.306 17.161 -8.927 1.00 0.00 H new ATOM 0 HB2 SER A 5 -19.646 16.896 -8.103 1.00 0.00 H new ATOM 0 HB3 SER A 5 -19.433 15.157 -8.054 1.00 0.00 H new ATOM 0 HG SER A 5 -19.060 16.145 -5.990 1.00 0.00 H new ATOM 48 N SER A 6 -15.532 15.430 -8.922 1.00 0.00 N ATOM 49 CA SER A 6 -14.464 14.448 -8.777 1.00 0.00 C ATOM 50 C SER A 6 -13.235 15.074 -8.125 1.00 0.00 C ATOM 51 O SER A 6 -12.678 16.047 -8.631 1.00 0.00 O ATOM 52 CB SER A 6 -14.091 13.864 -10.141 1.00 0.00 C ATOM 53 OG SER A 6 -13.418 14.822 -10.939 1.00 0.00 O ATOM 0 H SER A 6 -15.208 16.386 -9.070 1.00 0.00 H new ATOM 0 HA SER A 6 -14.826 13.646 -8.133 1.00 0.00 H new ATOM 0 HB2 SER A 6 -13.455 12.989 -10.004 1.00 0.00 H new ATOM 0 HB3 SER A 6 -14.991 13.527 -10.654 1.00 0.00 H new ATOM 0 HG SER A 6 -12.966 15.471 -10.360 1.00 0.00 H new ATOM 59 N GLY A 7 -12.818 14.507 -6.997 1.00 0.00 N ATOM 60 CA GLY A 7 -11.658 15.022 -6.293 1.00 0.00 C ATOM 61 C GLY A 7 -10.473 14.078 -6.359 1.00 0.00 C ATOM 62 O GLY A 7 -9.626 14.194 -7.245 1.00 0.00 O ATOM 0 H GLY A 7 -13.263 13.701 -6.558 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -11.376 15.985 -6.719 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -11.919 15.200 -5.250 1.00 0.00 H new ATOM 66 N VAL A 8 -10.412 13.140 -5.419 1.00 0.00 N ATOM 67 CA VAL A 8 -9.323 12.173 -5.373 1.00 0.00 C ATOM 68 C VAL A 8 -9.318 11.291 -6.617 1.00 0.00 C ATOM 69 O VAL A 8 -10.258 10.534 -6.858 1.00 0.00 O ATOM 70 CB VAL A 8 -9.419 11.278 -4.123 1.00 0.00 C ATOM 71 CG1 VAL A 8 -8.338 10.208 -4.148 1.00 0.00 C ATOM 72 CG2 VAL A 8 -9.321 12.117 -2.858 1.00 0.00 C ATOM 0 H VAL A 8 -11.105 13.030 -4.679 1.00 0.00 H new ATOM 0 HA VAL A 8 -8.395 12.743 -5.332 1.00 0.00 H new ATOM 0 HB VAL A 8 -10.389 10.781 -4.127 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -8.422 9.585 -3.257 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -8.460 9.588 -5.036 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -7.357 10.682 -4.168 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -9.391 11.468 -1.985 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -8.367 12.644 -2.844 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -10.135 12.841 -2.838 1.00 0.00 H new ATOM 82 N LYS A 9 -8.253 11.395 -7.404 1.00 0.00 N ATOM 83 CA LYS A 9 -8.123 10.606 -8.624 1.00 0.00 C ATOM 84 C LYS A 9 -7.643 9.193 -8.309 1.00 0.00 C ATOM 85 O LYS A 9 -6.944 8.970 -7.321 1.00 0.00 O ATOM 86 CB LYS A 9 -7.150 11.283 -9.592 1.00 0.00 C ATOM 87 CG LYS A 9 -7.707 12.544 -10.231 1.00 0.00 C ATOM 88 CD LYS A 9 -6.707 13.173 -11.187 1.00 0.00 C ATOM 89 CE LYS A 9 -6.763 12.520 -12.560 1.00 0.00 C ATOM 90 NZ LYS A 9 -5.676 13.010 -13.452 1.00 0.00 N ATOM 0 H LYS A 9 -7.467 12.018 -7.219 1.00 0.00 H new ATOM 0 HA LYS A 9 -9.105 10.541 -9.092 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -6.233 11.531 -9.058 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -6.881 10.576 -10.377 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -8.625 12.306 -10.768 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -7.970 13.262 -9.454 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -6.913 14.239 -11.281 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -5.701 13.077 -10.778 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -6.684 11.438 -12.451 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -7.730 12.724 -13.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -5.749 12.541 -14.378 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -5.766 14.039 -13.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -4.753 12.793 -13.026 1.00 0.00 H new ATOM 104 N PHE A 10 -8.021 8.242 -9.157 1.00 0.00 N ATOM 105 CA PHE A 10 -7.629 6.851 -8.970 1.00 0.00 C ATOM 106 C PHE A 10 -6.387 6.520 -9.793 1.00 0.00 C ATOM 107 O PHE A 10 -6.129 7.141 -10.825 1.00 0.00 O ATOM 108 CB PHE A 10 -8.777 5.917 -9.360 1.00 0.00 C ATOM 109 CG PHE A 10 -9.995 6.072 -8.495 1.00 0.00 C ATOM 110 CD1 PHE A 10 -9.909 5.926 -7.120 1.00 0.00 C ATOM 111 CD2 PHE A 10 -11.227 6.365 -9.058 1.00 0.00 C ATOM 112 CE1 PHE A 10 -11.029 6.067 -6.323 1.00 0.00 C ATOM 113 CE2 PHE A 10 -12.351 6.508 -8.265 1.00 0.00 C ATOM 114 CZ PHE A 10 -12.251 6.360 -6.896 1.00 0.00 C ATOM 0 H PHE A 10 -8.599 8.410 -9.981 1.00 0.00 H new ATOM 0 HA PHE A 10 -7.394 6.705 -7.916 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -9.052 6.105 -10.398 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -8.430 4.885 -9.304 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -8.956 5.699 -6.666 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -11.310 6.483 -10.128 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -10.949 5.948 -5.253 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -13.306 6.735 -8.716 1.00 0.00 H new ATOM 0 HZ PHE A 10 -13.127 6.473 -6.274 1.00 0.00 H new ATOM 124 N LEU A 11 -5.622 5.538 -9.330 1.00 0.00 N ATOM 125 CA LEU A 11 -4.406 5.124 -10.022 1.00 0.00 C ATOM 126 C LEU A 11 -3.508 6.323 -10.311 1.00 0.00 C ATOM 127 O LEU A 11 -2.897 6.413 -11.376 1.00 0.00 O ATOM 128 CB LEU A 11 -4.758 4.410 -11.328 1.00 0.00 C ATOM 129 CG LEU A 11 -5.510 3.085 -11.188 1.00 0.00 C ATOM 130 CD1 LEU A 11 -6.011 2.610 -12.543 1.00 0.00 C ATOM 131 CD2 LEU A 11 -4.618 2.032 -10.548 1.00 0.00 C ATOM 0 H LEU A 11 -5.822 5.013 -8.478 1.00 0.00 H new ATOM 0 HA LEU A 11 -3.864 4.436 -9.373 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -5.361 5.084 -11.936 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -3.835 4.225 -11.877 1.00 0.00 H new ATOM 0 HG LEU A 11 -6.372 3.245 -10.541 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -6.543 1.666 -12.424 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -6.685 3.356 -12.964 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -5.164 2.467 -13.214 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -5.169 1.096 -10.456 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -3.737 1.875 -11.170 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -4.309 2.370 -9.559 1.00 0.00 H new ATOM 143 N THR A 12 -3.431 7.241 -9.353 1.00 0.00 N ATOM 144 CA THR A 12 -2.607 8.434 -9.503 1.00 0.00 C ATOM 145 C THR A 12 -1.830 8.730 -8.225 1.00 0.00 C ATOM 146 O THR A 12 -2.398 8.757 -7.133 1.00 0.00 O ATOM 147 CB THR A 12 -3.460 9.664 -9.868 1.00 0.00 C ATOM 148 OG1 THR A 12 -4.579 9.764 -8.981 1.00 0.00 O ATOM 149 CG2 THR A 12 -3.951 9.574 -11.305 1.00 0.00 C ATOM 0 H THR A 12 -3.929 7.181 -8.465 1.00 0.00 H new ATOM 0 HA THR A 12 -1.906 8.234 -10.313 1.00 0.00 H new ATOM 0 HB THR A 12 -2.838 10.553 -9.769 1.00 0.00 H new ATOM 0 HG1 THR A 12 -4.332 9.411 -8.101 1.00 0.00 H new ATOM 0 HG21 THR A 12 -4.551 10.453 -11.540 1.00 0.00 H new ATOM 0 HG22 THR A 12 -3.096 9.527 -11.979 1.00 0.00 H new ATOM 0 HG23 THR A 12 -4.558 8.677 -11.426 1.00 0.00 H new ATOM 157 N VAL A 13 -0.527 8.952 -8.369 1.00 0.00 N ATOM 158 CA VAL A 13 0.328 9.248 -7.225 1.00 0.00 C ATOM 159 C VAL A 13 -0.018 10.602 -6.616 1.00 0.00 C ATOM 160 O VAL A 13 0.133 11.640 -7.258 1.00 0.00 O ATOM 161 CB VAL A 13 1.817 9.241 -7.621 1.00 0.00 C ATOM 162 CG1 VAL A 13 2.695 9.486 -6.404 1.00 0.00 C ATOM 163 CG2 VAL A 13 2.182 7.928 -8.297 1.00 0.00 C ATOM 0 H VAL A 13 -0.041 8.933 -9.266 1.00 0.00 H new ATOM 0 HA VAL A 13 0.152 8.465 -6.487 1.00 0.00 H new ATOM 0 HB VAL A 13 1.990 10.049 -8.332 1.00 0.00 H new ATOM 0 HG11 VAL A 13 3.743 9.477 -6.704 1.00 0.00 H new ATOM 0 HG12 VAL A 13 2.450 10.454 -5.968 1.00 0.00 H new ATOM 0 HG13 VAL A 13 2.522 8.702 -5.667 1.00 0.00 H new ATOM 0 HG21 VAL A 13 3.237 7.940 -8.570 1.00 0.00 H new ATOM 0 HG22 VAL A 13 1.994 7.101 -7.612 1.00 0.00 H new ATOM 0 HG23 VAL A 13 1.577 7.800 -9.194 1.00 0.00 H new ATOM 173 N ASN A 14 -0.483 10.582 -5.371 1.00 0.00 N ATOM 174 CA ASN A 14 -0.851 11.809 -4.673 1.00 0.00 C ATOM 175 C ASN A 14 0.345 12.391 -3.927 1.00 0.00 C ATOM 176 O ASN A 14 0.793 11.837 -2.923 1.00 0.00 O ATOM 177 CB ASN A 14 -1.995 11.539 -3.694 1.00 0.00 C ATOM 178 CG ASN A 14 -3.078 10.665 -4.296 1.00 0.00 C ATOM 179 OD1 ASN A 14 -3.343 10.724 -5.497 1.00 0.00 O ATOM 180 ND2 ASN A 14 -3.711 9.848 -3.462 1.00 0.00 N ATOM 0 H ASN A 14 -0.614 9.730 -4.825 1.00 0.00 H new ATOM 0 HA ASN A 14 -1.181 12.535 -5.416 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -1.598 11.057 -2.800 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -2.431 12.487 -3.378 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -4.450 9.236 -3.810 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -3.459 9.832 -2.474 1.00 0.00 H new ATOM 187 N ASP A 15 0.858 13.511 -4.425 1.00 0.00 N ATOM 188 CA ASP A 15 2.002 14.169 -3.805 1.00 0.00 C ATOM 189 C ASP A 15 1.911 14.099 -2.284 1.00 0.00 C ATOM 190 O ASP A 15 2.839 13.641 -1.617 1.00 0.00 O ATOM 191 CB ASP A 15 2.084 15.628 -4.257 1.00 0.00 C ATOM 192 CG ASP A 15 2.568 15.765 -5.687 1.00 0.00 C ATOM 193 OD1 ASP A 15 1.802 15.412 -6.608 1.00 0.00 O ATOM 194 OD2 ASP A 15 3.713 16.224 -5.885 1.00 0.00 O ATOM 0 H ASP A 15 0.500 13.982 -5.256 1.00 0.00 H new ATOM 0 HA ASP A 15 2.905 13.647 -4.121 1.00 0.00 H new ATOM 0 HB2 ASP A 15 1.101 16.090 -4.163 1.00 0.00 H new ATOM 0 HB3 ASP A 15 2.757 16.173 -3.595 1.00 0.00 H new ATOM 199 N ASP A 16 0.788 14.557 -1.742 1.00 0.00 N ATOM 200 CA ASP A 16 0.575 14.547 -0.299 1.00 0.00 C ATOM 201 C ASP A 16 1.209 13.313 0.334 1.00 0.00 C ATOM 202 O ASP A 16 0.661 12.213 0.259 1.00 0.00 O ATOM 203 CB ASP A 16 -0.921 14.586 0.018 1.00 0.00 C ATOM 204 CG ASP A 16 -1.515 15.968 -0.169 1.00 0.00 C ATOM 205 OD1 ASP A 16 -1.651 16.404 -1.332 1.00 0.00 O ATOM 206 OD2 ASP A 16 -1.846 16.614 0.848 1.00 0.00 O ATOM 0 H ASP A 16 0.011 14.940 -2.280 1.00 0.00 H new ATOM 0 HA ASP A 16 1.050 15.434 0.120 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -1.445 13.878 -0.625 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -1.080 14.261 1.046 1.00 0.00 H new ATOM 211 N ILE A 17 2.367 13.503 0.958 1.00 0.00 N ATOM 212 CA ILE A 17 3.076 12.405 1.604 1.00 0.00 C ATOM 213 C ILE A 17 2.448 12.063 2.951 1.00 0.00 C ATOM 214 O ILE A 17 2.255 12.937 3.799 1.00 0.00 O ATOM 215 CB ILE A 17 4.564 12.742 1.815 1.00 0.00 C ATOM 216 CG1 ILE A 17 4.708 13.989 2.690 1.00 0.00 C ATOM 217 CG2 ILE A 17 5.255 12.945 0.475 1.00 0.00 C ATOM 218 CD1 ILE A 17 6.144 14.419 2.897 1.00 0.00 C ATOM 0 H ILE A 17 2.834 14.407 1.030 1.00 0.00 H new ATOM 0 HA ILE A 17 2.998 11.544 0.940 1.00 0.00 H new ATOM 0 HB ILE A 17 5.042 11.906 2.326 1.00 0.00 H new ATOM 0 HG12 ILE A 17 4.154 14.809 2.234 1.00 0.00 H new ATOM 0 HG13 ILE A 17 4.251 13.797 3.661 1.00 0.00 H new ATOM 0 HG21 ILE A 17 6.306 13.183 0.640 1.00 0.00 H new ATOM 0 HG22 ILE A 17 5.178 12.033 -0.116 1.00 0.00 H new ATOM 0 HG23 ILE A 17 4.777 13.766 -0.060 1.00 0.00 H new ATOM 0 HD11 ILE A 17 6.170 15.309 3.526 1.00 0.00 H new ATOM 0 HD12 ILE A 17 6.698 13.615 3.381 1.00 0.00 H new ATOM 0 HD13 ILE A 17 6.599 14.643 1.932 1.00 0.00 H new ATOM 230 N LEU A 18 2.132 10.787 3.144 1.00 0.00 N ATOM 231 CA LEU A 18 1.527 10.328 4.389 1.00 0.00 C ATOM 232 C LEU A 18 1.973 8.908 4.720 1.00 0.00 C ATOM 233 O LEU A 18 2.155 8.080 3.827 1.00 0.00 O ATOM 234 CB LEU A 18 0.002 10.387 4.291 1.00 0.00 C ATOM 235 CG LEU A 18 -0.614 11.785 4.234 1.00 0.00 C ATOM 236 CD1 LEU A 18 -2.104 11.701 3.937 1.00 0.00 C ATOM 237 CD2 LEU A 18 -0.370 12.528 5.540 1.00 0.00 C ATOM 0 H LEU A 18 2.285 10.052 2.454 1.00 0.00 H new ATOM 0 HA LEU A 18 1.858 10.989 5.190 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -0.306 9.840 3.400 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -0.418 9.862 5.149 1.00 0.00 H new ATOM 0 HG LEU A 18 -0.135 12.340 3.427 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -2.525 12.706 3.900 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -2.256 11.208 2.977 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -2.600 11.128 4.721 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -0.815 13.521 5.482 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -0.822 11.975 6.363 1.00 0.00 H new ATOM 0 HD23 LEU A 18 0.703 12.620 5.711 1.00 0.00 H new ATOM 249 N SER A 19 2.144 8.631 6.009 1.00 0.00 N ATOM 250 CA SER A 19 2.569 7.311 6.458 1.00 0.00 C ATOM 251 C SER A 19 1.607 6.234 5.966 1.00 0.00 C ATOM 252 O SER A 19 0.560 6.536 5.395 1.00 0.00 O ATOM 253 CB SER A 19 2.659 7.272 7.984 1.00 0.00 C ATOM 254 OG SER A 19 1.370 7.272 8.571 1.00 0.00 O ATOM 0 H SER A 19 1.994 9.304 6.761 1.00 0.00 H new ATOM 0 HA SER A 19 3.555 7.112 6.038 1.00 0.00 H new ATOM 0 HB2 SER A 19 3.204 6.381 8.297 1.00 0.00 H new ATOM 0 HB3 SER A 19 3.224 8.133 8.340 1.00 0.00 H new ATOM 0 HG SER A 19 1.198 8.145 8.982 1.00 0.00 H new ATOM 260 N MET A 20 1.970 4.976 6.194 1.00 0.00 N ATOM 261 CA MET A 20 1.139 3.853 5.776 1.00 0.00 C ATOM 262 C MET A 20 -0.228 3.908 6.449 1.00 0.00 C ATOM 263 O MET A 20 -1.271 3.830 5.799 1.00 0.00 O ATOM 264 CB MET A 20 1.830 2.528 6.105 1.00 0.00 C ATOM 265 CG MET A 20 1.570 1.436 5.082 1.00 0.00 C ATOM 266 SD MET A 20 0.133 0.427 5.493 1.00 0.00 S ATOM 267 CE MET A 20 -0.351 -0.152 3.868 1.00 0.00 C ATOM 0 H MET A 20 2.834 4.709 6.666 1.00 0.00 H new ATOM 0 HA MET A 20 0.996 3.921 4.698 1.00 0.00 H new ATOM 0 HB2 MET A 20 2.904 2.697 6.179 1.00 0.00 H new ATOM 0 HB3 MET A 20 1.493 2.185 7.083 1.00 0.00 H new ATOM 0 HG2 MET A 20 1.422 1.889 4.102 1.00 0.00 H new ATOM 0 HG3 MET A 20 2.449 0.796 5.008 1.00 0.00 H new ATOM 0 HE1 MET A 20 -1.354 -0.577 3.917 1.00 0.00 H new ATOM 0 HE2 MET A 20 -0.344 0.683 3.167 1.00 0.00 H new ATOM 0 HE3 MET A 20 0.350 -0.915 3.530 1.00 0.00 H new ATOM 277 N PRO A 21 -0.226 4.045 7.784 1.00 0.00 N ATOM 278 CA PRO A 21 -1.459 4.114 8.574 1.00 0.00 C ATOM 279 C PRO A 21 -2.224 5.413 8.343 1.00 0.00 C ATOM 280 O PRO A 21 -3.366 5.556 8.778 1.00 0.00 O ATOM 281 CB PRO A 21 -0.959 4.038 10.019 1.00 0.00 C ATOM 282 CG PRO A 21 0.437 4.556 9.964 1.00 0.00 C ATOM 283 CD PRO A 21 0.979 4.145 8.623 1.00 0.00 C ATOM 0 HA PRO A 21 -2.158 3.321 8.308 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -1.578 4.639 10.685 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -0.987 3.015 10.395 1.00 0.00 H new ATOM 0 HG2 PRO A 21 0.456 5.640 10.077 1.00 0.00 H new ATOM 0 HG3 PRO A 21 1.039 4.141 10.772 1.00 0.00 H new ATOM 0 HD2 PRO A 21 1.682 4.880 8.231 1.00 0.00 H new ATOM 0 HD3 PRO A 21 1.510 3.195 8.678 1.00 0.00 H new ATOM 291 N GLN A 22 -1.587 6.356 7.656 1.00 0.00 N ATOM 292 CA GLN A 22 -2.208 7.643 7.369 1.00 0.00 C ATOM 293 C GLN A 22 -2.793 7.662 5.960 1.00 0.00 C ATOM 294 O GLN A 22 -3.810 8.308 5.709 1.00 0.00 O ATOM 295 CB GLN A 22 -1.189 8.772 7.526 1.00 0.00 C ATOM 296 CG GLN A 22 -1.095 9.314 8.943 1.00 0.00 C ATOM 297 CD GLN A 22 0.001 10.350 9.101 1.00 0.00 C ATOM 298 OE1 GLN A 22 1.182 10.012 9.189 1.00 0.00 O ATOM 299 NE2 GLN A 22 -0.385 11.620 9.137 1.00 0.00 N ATOM 0 H GLN A 22 -0.641 6.253 7.288 1.00 0.00 H new ATOM 0 HA GLN A 22 -3.018 7.794 8.082 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -0.208 8.410 7.219 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -1.454 9.586 6.851 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -2.051 9.757 9.223 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -0.912 8.489 9.632 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -1.375 11.855 9.061 1.00 0.00 H new ATOM 0 HE22 GLN A 22 0.308 12.361 9.241 1.00 0.00 H new ATOM 308 N ALA A 23 -2.144 6.950 5.046 1.00 0.00 N ATOM 309 CA ALA A 23 -2.600 6.884 3.663 1.00 0.00 C ATOM 310 C ALA A 23 -3.849 6.018 3.538 1.00 0.00 C ATOM 311 O ALA A 23 -4.931 6.514 3.225 1.00 0.00 O ATOM 312 CB ALA A 23 -1.493 6.351 2.766 1.00 0.00 C ATOM 0 H ALA A 23 -1.300 6.410 5.238 1.00 0.00 H new ATOM 0 HA ALA A 23 -2.856 7.894 3.342 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -1.848 6.307 1.736 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -0.628 7.012 2.824 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -1.208 5.351 3.094 1.00 0.00 H new ATOM 318 N ARG A 24 -3.690 4.721 3.783 1.00 0.00 N ATOM 319 CA ARG A 24 -4.805 3.785 3.696 1.00 0.00 C ATOM 320 C ARG A 24 -6.078 4.402 4.267 1.00 0.00 C ATOM 321 O ARG A 24 -7.168 4.207 3.731 1.00 0.00 O ATOM 322 CB ARG A 24 -4.472 2.492 4.442 1.00 0.00 C ATOM 323 CG ARG A 24 -4.388 2.663 5.950 1.00 0.00 C ATOM 324 CD ARG A 24 -3.430 1.659 6.572 1.00 0.00 C ATOM 325 NE ARG A 24 -3.811 1.313 7.938 1.00 0.00 N ATOM 326 CZ ARG A 24 -4.907 0.626 8.244 1.00 0.00 C ATOM 327 NH1 ARG A 24 -5.724 0.214 7.285 1.00 0.00 N ATOM 328 NH2 ARG A 24 -5.186 0.350 9.511 1.00 0.00 N ATOM 0 H ARG A 24 -2.801 4.295 4.043 1.00 0.00 H new ATOM 0 HA ARG A 24 -4.974 3.556 2.644 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -5.230 1.744 4.211 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -3.521 2.105 4.075 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -4.059 3.675 6.185 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -5.379 2.541 6.387 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -3.406 0.756 5.963 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -2.421 2.072 6.571 1.00 0.00 H new ATOM 0 HE ARG A 24 -3.203 1.615 8.699 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -5.512 0.424 6.310 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -6.564 -0.313 7.522 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -4.559 0.665 10.252 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -6.027 -0.177 9.745 1.00 0.00 H new ATOM 342 N ASN A 25 -5.932 5.146 5.359 1.00 0.00 N ATOM 343 CA ASN A 25 -7.070 5.790 6.003 1.00 0.00 C ATOM 344 C ASN A 25 -7.656 6.879 5.110 1.00 0.00 C ATOM 345 O ASN A 25 -8.874 7.038 5.025 1.00 0.00 O ATOM 346 CB ASN A 25 -6.650 6.389 7.347 1.00 0.00 C ATOM 347 CG ASN A 25 -7.462 7.616 7.713 1.00 0.00 C ATOM 348 OD1 ASN A 25 -8.691 7.602 7.651 1.00 0.00 O ATOM 349 ND2 ASN A 25 -6.776 8.686 8.097 1.00 0.00 N ATOM 0 H ASN A 25 -5.036 5.317 5.816 1.00 0.00 H new ATOM 0 HA ASN A 25 -7.836 5.033 6.173 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -6.762 5.637 8.128 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -5.593 6.654 7.309 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -7.268 9.541 8.355 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -5.757 8.653 8.134 1.00 0.00 H new ATOM 356 N PHE A 26 -6.781 7.627 4.446 1.00 0.00 N ATOM 357 CA PHE A 26 -7.212 8.701 3.559 1.00 0.00 C ATOM 358 C PHE A 26 -8.002 8.148 2.377 1.00 0.00 C ATOM 359 O PHE A 26 -9.178 8.468 2.197 1.00 0.00 O ATOM 360 CB PHE A 26 -6.002 9.490 3.053 1.00 0.00 C ATOM 361 CG PHE A 26 -6.345 10.503 2.000 1.00 0.00 C ATOM 362 CD1 PHE A 26 -6.486 10.124 0.674 1.00 0.00 C ATOM 363 CD2 PHE A 26 -6.526 11.836 2.334 1.00 0.00 C ATOM 364 CE1 PHE A 26 -6.800 11.055 -0.297 1.00 0.00 C ATOM 365 CE2 PHE A 26 -6.841 12.771 1.367 1.00 0.00 C ATOM 366 CZ PHE A 26 -6.980 12.380 0.049 1.00 0.00 C ATOM 0 H PHE A 26 -5.770 7.509 4.505 1.00 0.00 H new ATOM 0 HA PHE A 26 -7.861 9.368 4.127 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -5.532 9.998 3.895 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -5.267 8.793 2.650 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -6.349 9.089 0.397 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -6.419 12.147 3.363 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -6.905 10.747 -1.327 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -6.978 13.807 1.641 1.00 0.00 H new ATOM 0 HZ PHE A 26 -7.229 13.108 -0.709 1.00 0.00 H new ATOM 376 N CYS A 27 -7.349 7.315 1.574 1.00 0.00 N ATOM 377 CA CYS A 27 -7.988 6.716 0.409 1.00 0.00 C ATOM 378 C CYS A 27 -9.405 6.259 0.740 1.00 0.00 C ATOM 379 O CYS A 27 -10.349 6.546 0.004 1.00 0.00 O ATOM 380 CB CYS A 27 -7.164 5.531 -0.098 1.00 0.00 C ATOM 381 SG CYS A 27 -5.562 5.997 -0.829 1.00 0.00 S ATOM 0 H CYS A 27 -6.376 7.039 1.709 1.00 0.00 H new ATOM 0 HA CYS A 27 -8.043 7.473 -0.373 1.00 0.00 H new ATOM 0 HB2 CYS A 27 -6.987 4.844 0.730 1.00 0.00 H new ATOM 0 HB3 CYS A 27 -7.747 4.989 -0.843 1.00 0.00 H new ATOM 386 N ALA A 28 -9.547 5.547 1.854 1.00 0.00 N ATOM 387 CA ALA A 28 -10.848 5.053 2.284 1.00 0.00 C ATOM 388 C ALA A 28 -11.844 6.197 2.446 1.00 0.00 C ATOM 389 O ALA A 28 -12.957 6.142 1.922 1.00 0.00 O ATOM 390 CB ALA A 28 -10.714 4.279 3.588 1.00 0.00 C ATOM 0 H ALA A 28 -8.776 5.300 2.474 1.00 0.00 H new ATOM 0 HA ALA A 28 -11.227 4.382 1.513 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -11.694 3.916 3.898 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -10.043 3.433 3.441 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -10.309 4.934 4.360 1.00 0.00 H new ATOM 396 N SER A 29 -11.437 7.231 3.175 1.00 0.00 N ATOM 397 CA SER A 29 -12.296 8.386 3.409 1.00 0.00 C ATOM 398 C SER A 29 -12.801 8.963 2.090 1.00 0.00 C ATOM 399 O SER A 29 -13.982 9.282 1.952 1.00 0.00 O ATOM 400 CB SER A 29 -11.539 9.461 4.192 1.00 0.00 C ATOM 401 OG SER A 29 -12.425 10.242 4.974 1.00 0.00 O ATOM 0 H SER A 29 -10.518 7.293 3.614 1.00 0.00 H new ATOM 0 HA SER A 29 -13.154 8.057 3.994 1.00 0.00 H new ATOM 0 HB2 SER A 29 -10.798 8.990 4.838 1.00 0.00 H new ATOM 0 HB3 SER A 29 -10.996 10.105 3.500 1.00 0.00 H new ATOM 0 HG SER A 29 -11.916 10.920 5.466 1.00 0.00 H new ATOM 407 N ALA A 30 -11.898 9.095 1.124 1.00 0.00 N ATOM 408 CA ALA A 30 -12.252 9.632 -0.184 1.00 0.00 C ATOM 409 C ALA A 30 -13.205 8.697 -0.921 1.00 0.00 C ATOM 410 O ALA A 30 -14.167 9.143 -1.547 1.00 0.00 O ATOM 411 CB ALA A 30 -10.998 9.871 -1.013 1.00 0.00 C ATOM 0 H ALA A 30 -10.916 8.837 1.223 1.00 0.00 H new ATOM 0 HA ALA A 30 -12.762 10.584 -0.033 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -11.277 10.272 -1.987 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -10.352 10.583 -0.499 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -10.466 8.929 -1.147 1.00 0.00 H new ATOM 417 N GLY A 31 -12.931 7.398 -0.844 1.00 0.00 N ATOM 418 CA GLY A 31 -13.774 6.422 -1.510 1.00 0.00 C ATOM 419 C GLY A 31 -12.970 5.381 -2.263 1.00 0.00 C ATOM 420 O GLY A 31 -13.362 4.948 -3.346 1.00 0.00 O ATOM 0 H GLY A 31 -12.141 7.004 -0.333 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -14.404 5.926 -0.772 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -14.440 6.935 -2.204 1.00 0.00 H new ATOM 424 N GLY A 32 -11.840 4.978 -1.690 1.00 0.00 N ATOM 425 CA GLY A 32 -10.996 3.986 -2.329 1.00 0.00 C ATOM 426 C GLY A 32 -9.965 3.405 -1.382 1.00 0.00 C ATOM 427 O GLY A 32 -9.935 3.747 -0.200 1.00 0.00 O ATOM 0 H GLY A 32 -11.494 5.321 -0.794 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -11.619 3.182 -2.721 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -10.488 4.440 -3.180 1.00 0.00 H new ATOM 431 N TYR A 33 -9.118 2.523 -1.901 1.00 0.00 N ATOM 432 CA TYR A 33 -8.083 1.889 -1.093 1.00 0.00 C ATOM 433 C TYR A 33 -6.781 1.760 -1.878 1.00 0.00 C ATOM 434 O TYR A 33 -6.768 1.876 -3.104 1.00 0.00 O ATOM 435 CB TYR A 33 -8.547 0.510 -0.622 1.00 0.00 C ATOM 436 CG TYR A 33 -9.136 -0.340 -1.725 1.00 0.00 C ATOM 437 CD1 TYR A 33 -8.376 -0.706 -2.829 1.00 0.00 C ATOM 438 CD2 TYR A 33 -10.454 -0.777 -1.663 1.00 0.00 C ATOM 439 CE1 TYR A 33 -8.911 -1.482 -3.839 1.00 0.00 C ATOM 440 CE2 TYR A 33 -10.997 -1.554 -2.668 1.00 0.00 C ATOM 441 CZ TYR A 33 -10.221 -1.904 -3.754 1.00 0.00 C ATOM 442 OH TYR A 33 -10.757 -2.678 -4.758 1.00 0.00 O ATOM 0 H TYR A 33 -9.128 2.231 -2.878 1.00 0.00 H new ATOM 0 HA TYR A 33 -7.900 2.520 -0.223 1.00 0.00 H new ATOM 0 HB2 TYR A 33 -7.701 -0.017 -0.181 1.00 0.00 H new ATOM 0 HB3 TYR A 33 -9.291 0.635 0.165 1.00 0.00 H new ATOM 0 HD1 TYR A 33 -7.349 -0.378 -2.899 1.00 0.00 H new ATOM 0 HD2 TYR A 33 -11.064 -0.504 -0.815 1.00 0.00 H new ATOM 0 HE1 TYR A 33 -8.306 -1.757 -4.691 1.00 0.00 H new ATOM 0 HE2 TYR A 33 -12.023 -1.886 -2.604 1.00 0.00 H new ATOM 0 HH TYR A 33 -11.444 -3.268 -4.384 1.00 0.00 H new ATOM 452 N LEU A 34 -5.689 1.517 -1.163 1.00 0.00 N ATOM 453 CA LEU A 34 -4.380 1.371 -1.791 1.00 0.00 C ATOM 454 C LEU A 34 -4.451 0.420 -2.982 1.00 0.00 C ATOM 455 O LEU A 34 -5.161 -0.585 -2.945 1.00 0.00 O ATOM 456 CB LEU A 34 -3.359 0.857 -0.774 1.00 0.00 C ATOM 457 CG LEU A 34 -2.835 1.886 0.229 1.00 0.00 C ATOM 458 CD1 LEU A 34 -2.197 1.191 1.421 1.00 0.00 C ATOM 459 CD2 LEU A 34 -1.841 2.824 -0.440 1.00 0.00 C ATOM 0 H LEU A 34 -5.683 1.417 -0.148 1.00 0.00 H new ATOM 0 HA LEU A 34 -4.065 2.351 -2.150 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -3.811 0.035 -0.219 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -2.510 0.444 -1.318 1.00 0.00 H new ATOM 0 HG LEU A 34 -3.677 2.478 0.588 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -1.830 1.938 2.124 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -2.938 0.561 1.914 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -1.366 0.574 1.080 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -1.478 3.549 0.288 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -1.001 2.248 -0.827 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -2.331 3.348 -1.261 1.00 0.00 H new ATOM 471 N ALA A 35 -3.709 0.744 -4.036 1.00 0.00 N ATOM 472 CA ALA A 35 -3.685 -0.083 -5.236 1.00 0.00 C ATOM 473 C ALA A 35 -2.739 -1.267 -5.067 1.00 0.00 C ATOM 474 O ALA A 35 -1.656 -1.132 -4.498 1.00 0.00 O ATOM 475 CB ALA A 35 -3.281 0.750 -6.443 1.00 0.00 C ATOM 0 H ALA A 35 -3.117 1.573 -4.083 1.00 0.00 H new ATOM 0 HA ALA A 35 -4.689 -0.474 -5.398 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -3.267 0.120 -7.332 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -3.998 1.559 -6.583 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -2.288 1.169 -6.280 1.00 0.00 H new ATOM 481 N ASP A 36 -3.154 -2.426 -5.565 1.00 0.00 N ATOM 482 CA ASP A 36 -2.343 -3.634 -5.470 1.00 0.00 C ATOM 483 C ASP A 36 -1.150 -3.564 -6.418 1.00 0.00 C ATOM 484 O ASP A 36 -1.100 -2.713 -7.307 1.00 0.00 O ATOM 485 CB ASP A 36 -3.189 -4.869 -5.787 1.00 0.00 C ATOM 486 CG ASP A 36 -4.253 -4.590 -6.830 1.00 0.00 C ATOM 487 OD1 ASP A 36 -4.016 -3.729 -7.704 1.00 0.00 O ATOM 488 OD2 ASP A 36 -5.322 -5.232 -6.773 1.00 0.00 O ATOM 0 H ASP A 36 -4.048 -2.555 -6.039 1.00 0.00 H new ATOM 0 HA ASP A 36 -1.969 -3.711 -4.449 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -2.539 -5.670 -6.140 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -3.665 -5.224 -4.873 1.00 0.00 H new ATOM 493 N ASP A 37 -0.191 -4.462 -6.222 1.00 0.00 N ATOM 494 CA ASP A 37 1.002 -4.502 -7.059 1.00 0.00 C ATOM 495 C ASP A 37 1.323 -5.933 -7.480 1.00 0.00 C ATOM 496 O ASP A 37 2.489 -6.304 -7.619 1.00 0.00 O ATOM 497 CB ASP A 37 2.193 -3.897 -6.315 1.00 0.00 C ATOM 498 CG ASP A 37 3.243 -3.341 -7.257 1.00 0.00 C ATOM 499 OD1 ASP A 37 4.131 -4.113 -7.677 1.00 0.00 O ATOM 500 OD2 ASP A 37 3.178 -2.135 -7.574 1.00 0.00 O ATOM 0 H ASP A 37 -0.217 -5.172 -5.490 1.00 0.00 H new ATOM 0 HA ASP A 37 0.807 -3.914 -7.956 1.00 0.00 H new ATOM 0 HB2 ASP A 37 1.841 -3.102 -5.658 1.00 0.00 H new ATOM 0 HB3 ASP A 37 2.646 -4.658 -5.680 1.00 0.00 H new ATOM 505 N LEU A 38 0.281 -6.732 -7.681 1.00 0.00 N ATOM 506 CA LEU A 38 0.451 -8.124 -8.086 1.00 0.00 C ATOM 507 C LEU A 38 0.057 -8.318 -9.546 1.00 0.00 C ATOM 508 O LEU A 38 -1.114 -8.524 -9.861 1.00 0.00 O ATOM 509 CB LEU A 38 -0.386 -9.041 -7.193 1.00 0.00 C ATOM 510 CG LEU A 38 -1.757 -8.505 -6.778 1.00 0.00 C ATOM 511 CD1 LEU A 38 -2.767 -9.638 -6.686 1.00 0.00 C ATOM 512 CD2 LEU A 38 -1.661 -7.765 -5.452 1.00 0.00 C ATOM 0 H LEU A 38 -0.690 -6.441 -7.570 1.00 0.00 H new ATOM 0 HA LEU A 38 1.504 -8.383 -7.976 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -0.531 -9.988 -7.713 1.00 0.00 H new ATOM 0 HB3 LEU A 38 0.186 -9.257 -6.291 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.097 -7.803 -7.539 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -3.737 -9.238 -6.390 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -2.857 -10.125 -7.657 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -2.432 -10.364 -5.945 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -2.646 -7.390 -5.172 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -1.299 -8.445 -4.681 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -0.969 -6.928 -5.551 1.00 0.00 H new ATOM 524 N GLY A 39 1.044 -8.254 -10.435 1.00 0.00 N ATOM 525 CA GLY A 39 0.780 -8.427 -11.851 1.00 0.00 C ATOM 526 C GLY A 39 1.776 -7.685 -12.721 1.00 0.00 C ATOM 527 O GLY A 39 1.793 -6.455 -12.747 1.00 0.00 O ATOM 0 H GLY A 39 2.022 -8.085 -10.199 1.00 0.00 H new ATOM 0 HA2 GLY A 39 0.809 -9.489 -12.096 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -0.227 -8.075 -12.075 1.00 0.00 H new ATOM 531 N ASP A 40 2.609 -8.435 -13.435 1.00 0.00 N ATOM 532 CA ASP A 40 3.613 -7.842 -14.310 1.00 0.00 C ATOM 533 C ASP A 40 3.073 -6.582 -14.980 1.00 0.00 C ATOM 534 O ASP A 40 3.774 -5.576 -15.090 1.00 0.00 O ATOM 535 CB ASP A 40 4.055 -8.850 -15.371 1.00 0.00 C ATOM 536 CG ASP A 40 2.914 -9.726 -15.849 1.00 0.00 C ATOM 537 OD1 ASP A 40 2.506 -10.632 -15.093 1.00 0.00 O ATOM 538 OD2 ASP A 40 2.429 -9.506 -16.979 1.00 0.00 O ATOM 0 H ASP A 40 2.608 -9.455 -13.425 1.00 0.00 H new ATOM 0 HA ASP A 40 4.474 -7.567 -13.701 1.00 0.00 H new ATOM 0 HB2 ASP A 40 4.480 -8.316 -16.221 1.00 0.00 H new ATOM 0 HB3 ASP A 40 4.846 -9.479 -14.963 1.00 0.00 H new ATOM 543 N ASP A 41 1.824 -6.645 -15.428 1.00 0.00 N ATOM 544 CA ASP A 41 1.190 -5.510 -16.088 1.00 0.00 C ATOM 545 C ASP A 41 1.030 -4.340 -15.123 1.00 0.00 C ATOM 546 O ASP A 41 1.273 -3.187 -15.481 1.00 0.00 O ATOM 547 CB ASP A 41 -0.175 -5.915 -16.648 1.00 0.00 C ATOM 548 CG ASP A 41 -0.130 -7.243 -17.379 1.00 0.00 C ATOM 549 OD1 ASP A 41 0.373 -7.273 -18.521 1.00 0.00 O ATOM 550 OD2 ASP A 41 -0.598 -8.251 -16.809 1.00 0.00 O ATOM 0 H ASP A 41 1.230 -7.470 -15.346 1.00 0.00 H new ATOM 0 HA ASP A 41 1.832 -5.195 -16.910 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -0.895 -5.977 -15.832 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -0.530 -5.141 -17.328 1.00 0.00 H new ATOM 555 N LYS A 42 0.620 -4.643 -13.896 1.00 0.00 N ATOM 556 CA LYS A 42 0.427 -3.618 -12.877 1.00 0.00 C ATOM 557 C LYS A 42 1.767 -3.063 -12.404 1.00 0.00 C ATOM 558 O LYS A 42 1.970 -1.850 -12.370 1.00 0.00 O ATOM 559 CB LYS A 42 -0.348 -4.189 -11.689 1.00 0.00 C ATOM 560 CG LYS A 42 -1.216 -3.164 -10.979 1.00 0.00 C ATOM 561 CD LYS A 42 -2.411 -2.762 -11.827 1.00 0.00 C ATOM 562 CE LYS A 42 -3.341 -1.825 -11.071 1.00 0.00 C ATOM 563 NZ LYS A 42 -4.563 -1.502 -11.858 1.00 0.00 N ATOM 0 H LYS A 42 0.415 -5.592 -13.583 1.00 0.00 H new ATOM 0 HA LYS A 42 -0.148 -2.805 -13.320 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -0.978 -5.008 -12.037 1.00 0.00 H new ATOM 0 HB3 LYS A 42 0.358 -4.612 -10.975 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -1.563 -3.574 -10.031 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -0.621 -2.281 -10.746 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -2.064 -2.275 -12.738 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -2.959 -3.654 -12.131 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -3.629 -2.284 -10.125 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -2.811 -0.904 -10.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -5.194 -0.903 -11.289 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -4.293 -0.995 -12.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -5.056 -2.382 -12.110 1.00 0.00 H new ATOM 577 N ASN A 43 2.679 -3.959 -12.041 1.00 0.00 N ATOM 578 CA ASN A 43 4.000 -3.559 -11.571 1.00 0.00 C ATOM 579 C ASN A 43 4.722 -2.722 -12.623 1.00 0.00 C ATOM 580 O ASN A 43 5.100 -1.580 -12.370 1.00 0.00 O ATOM 581 CB ASN A 43 4.836 -4.792 -11.223 1.00 0.00 C ATOM 582 CG ASN A 43 6.324 -4.499 -11.213 1.00 0.00 C ATOM 583 OD1 ASN A 43 6.944 -4.409 -10.154 1.00 0.00 O ATOM 584 ND2 ASN A 43 6.904 -4.347 -12.398 1.00 0.00 N ATOM 0 H ASN A 43 2.527 -4.967 -12.063 1.00 0.00 H new ATOM 0 HA ASN A 43 3.870 -2.952 -10.675 1.00 0.00 H new ATOM 0 HB2 ASN A 43 4.536 -5.166 -10.244 1.00 0.00 H new ATOM 0 HB3 ASN A 43 4.629 -5.583 -11.944 1.00 0.00 H new ATOM 0 HD21 ASN A 43 7.903 -4.147 -12.455 1.00 0.00 H new ATOM 0 HD22 ASN A 43 6.351 -4.430 -13.251 1.00 0.00 H new ATOM 591 N ASN A 44 4.907 -3.301 -13.805 1.00 0.00 N ATOM 592 CA ASN A 44 5.583 -2.609 -14.897 1.00 0.00 C ATOM 593 C ASN A 44 4.832 -1.338 -15.284 1.00 0.00 C ATOM 594 O ASN A 44 5.414 -0.403 -15.833 1.00 0.00 O ATOM 595 CB ASN A 44 5.710 -3.530 -16.112 1.00 0.00 C ATOM 596 CG ASN A 44 4.561 -3.361 -17.087 1.00 0.00 C ATOM 597 OD1 ASN A 44 4.297 -2.259 -17.568 1.00 0.00 O ATOM 598 ND2 ASN A 44 3.871 -4.456 -17.384 1.00 0.00 N ATOM 0 H ASN A 44 4.599 -4.247 -14.031 1.00 0.00 H new ATOM 0 HA ASN A 44 6.580 -2.331 -14.555 1.00 0.00 H new ATOM 0 HB2 ASN A 44 6.650 -3.325 -16.624 1.00 0.00 H new ATOM 0 HB3 ASN A 44 5.749 -4.566 -15.777 1.00 0.00 H new ATOM 0 HD21 ASN A 44 3.087 -4.404 -18.034 1.00 0.00 H new ATOM 0 HD22 ASN A 44 4.125 -5.349 -16.962 1.00 0.00 H new ATOM 605 N PHE A 45 3.536 -1.312 -14.992 1.00 0.00 N ATOM 606 CA PHE A 45 2.704 -0.157 -15.309 1.00 0.00 C ATOM 607 C PHE A 45 3.020 1.012 -14.381 1.00 0.00 C ATOM 608 O PHE A 45 3.027 2.169 -14.802 1.00 0.00 O ATOM 609 CB PHE A 45 1.223 -0.523 -15.200 1.00 0.00 C ATOM 610 CG PHE A 45 0.332 0.656 -14.932 1.00 0.00 C ATOM 611 CD1 PHE A 45 0.255 1.208 -13.663 1.00 0.00 C ATOM 612 CD2 PHE A 45 -0.428 1.213 -15.948 1.00 0.00 C ATOM 613 CE1 PHE A 45 -0.565 2.293 -13.413 1.00 0.00 C ATOM 614 CE2 PHE A 45 -1.249 2.298 -15.704 1.00 0.00 C ATOM 615 CZ PHE A 45 -1.317 2.839 -14.435 1.00 0.00 C ATOM 0 H PHE A 45 3.039 -2.077 -14.536 1.00 0.00 H new ATOM 0 HA PHE A 45 2.922 0.146 -16.333 1.00 0.00 H new ATOM 0 HB2 PHE A 45 0.907 -1.004 -16.126 1.00 0.00 H new ATOM 0 HB3 PHE A 45 1.095 -1.254 -14.401 1.00 0.00 H new ATOM 0 HD1 PHE A 45 0.842 0.786 -12.861 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -0.378 0.794 -16.942 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -0.617 2.713 -12.419 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -1.837 2.722 -16.505 1.00 0.00 H new ATOM 0 HZ PHE A 45 -1.957 3.687 -14.242 1.00 0.00 H new ATOM 625 N TYR A 46 3.282 0.702 -13.116 1.00 0.00 N ATOM 626 CA TYR A 46 3.596 1.726 -12.127 1.00 0.00 C ATOM 627 C TYR A 46 4.945 2.373 -12.423 1.00 0.00 C ATOM 628 O TYR A 46 5.069 3.598 -12.438 1.00 0.00 O ATOM 629 CB TYR A 46 3.605 1.121 -10.722 1.00 0.00 C ATOM 630 CG TYR A 46 2.242 0.666 -10.250 1.00 0.00 C ATOM 631 CD1 TYR A 46 1.155 1.531 -10.266 1.00 0.00 C ATOM 632 CD2 TYR A 46 2.042 -0.629 -9.789 1.00 0.00 C ATOM 633 CE1 TYR A 46 -0.091 1.120 -9.835 1.00 0.00 C ATOM 634 CE2 TYR A 46 0.799 -1.050 -9.358 1.00 0.00 C ATOM 635 CZ TYR A 46 -0.265 -0.171 -9.382 1.00 0.00 C ATOM 636 OH TYR A 46 -1.505 -0.585 -8.953 1.00 0.00 O ATOM 0 H TYR A 46 3.283 -0.251 -12.751 1.00 0.00 H new ATOM 0 HA TYR A 46 2.825 2.495 -12.179 1.00 0.00 H new ATOM 0 HB2 TYR A 46 4.288 0.272 -10.706 1.00 0.00 H new ATOM 0 HB3 TYR A 46 3.996 1.858 -10.021 1.00 0.00 H new ATOM 0 HD1 TYR A 46 1.287 2.542 -10.622 1.00 0.00 H new ATOM 0 HD2 TYR A 46 2.873 -1.319 -9.767 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -0.925 1.806 -9.853 1.00 0.00 H new ATOM 0 HE2 TYR A 46 0.660 -2.061 -9.004 1.00 0.00 H new ATOM 0 HH TYR A 46 -1.431 -1.475 -8.550 1.00 0.00 H new ATOM 646 N SER A 47 5.955 1.541 -12.657 1.00 0.00 N ATOM 647 CA SER A 47 7.297 2.030 -12.950 1.00 0.00 C ATOM 648 C SER A 47 7.240 3.317 -13.768 1.00 0.00 C ATOM 649 O SER A 47 8.005 4.251 -13.531 1.00 0.00 O ATOM 650 CB SER A 47 8.097 0.967 -13.705 1.00 0.00 C ATOM 651 OG SER A 47 9.448 1.366 -13.868 1.00 0.00 O ATOM 0 H SER A 47 5.869 0.525 -12.649 1.00 0.00 H new ATOM 0 HA SER A 47 7.794 2.244 -12.003 1.00 0.00 H new ATOM 0 HB2 SER A 47 8.056 0.023 -13.162 1.00 0.00 H new ATOM 0 HB3 SER A 47 7.645 0.793 -14.682 1.00 0.00 H new ATOM 0 HG SER A 47 9.939 0.669 -14.352 1.00 0.00 H new ATOM 657 N SER A 48 6.327 3.357 -14.733 1.00 0.00 N ATOM 658 CA SER A 48 6.171 4.526 -15.590 1.00 0.00 C ATOM 659 C SER A 48 5.821 5.761 -14.765 1.00 0.00 C ATOM 660 O SER A 48 6.623 6.687 -14.643 1.00 0.00 O ATOM 661 CB SER A 48 5.086 4.275 -16.639 1.00 0.00 C ATOM 662 OG SER A 48 5.465 3.238 -17.527 1.00 0.00 O ATOM 0 H SER A 48 5.684 2.593 -14.941 1.00 0.00 H new ATOM 0 HA SER A 48 7.120 4.705 -16.095 1.00 0.00 H new ATOM 0 HB2 SER A 48 4.152 4.011 -16.144 1.00 0.00 H new ATOM 0 HB3 SER A 48 4.901 5.190 -17.201 1.00 0.00 H new ATOM 0 HG SER A 48 4.754 3.096 -18.186 1.00 0.00 H new ATOM 668 N ILE A 49 4.617 5.767 -14.202 1.00 0.00 N ATOM 669 CA ILE A 49 4.161 6.886 -13.388 1.00 0.00 C ATOM 670 C ILE A 49 5.016 7.040 -12.135 1.00 0.00 C ATOM 671 O ILE A 49 4.955 8.061 -11.451 1.00 0.00 O ATOM 672 CB ILE A 49 2.687 6.717 -12.973 1.00 0.00 C ATOM 673 CG1 ILE A 49 2.547 5.573 -11.966 1.00 0.00 C ATOM 674 CG2 ILE A 49 1.818 6.463 -14.196 1.00 0.00 C ATOM 675 CD1 ILE A 49 1.245 5.602 -11.196 1.00 0.00 C ATOM 0 H ILE A 49 3.940 5.009 -14.295 1.00 0.00 H new ATOM 0 HA ILE A 49 4.257 7.782 -14.002 1.00 0.00 H new ATOM 0 HB ILE A 49 2.350 7.638 -12.498 1.00 0.00 H new ATOM 0 HG12 ILE A 49 2.626 4.623 -12.494 1.00 0.00 H new ATOM 0 HG13 ILE A 49 3.378 5.616 -11.261 1.00 0.00 H new ATOM 0 HG21 ILE A 49 0.779 6.346 -13.886 1.00 0.00 H new ATOM 0 HG22 ILE A 49 1.899 7.306 -14.882 1.00 0.00 H new ATOM 0 HG23 ILE A 49 2.152 5.555 -14.697 1.00 0.00 H new ATOM 0 HD11 ILE A 49 1.214 4.763 -10.501 1.00 0.00 H new ATOM 0 HD12 ILE A 49 1.172 6.536 -10.640 1.00 0.00 H new ATOM 0 HD13 ILE A 49 0.409 5.528 -11.892 1.00 0.00 H new ATOM 687 N ALA A 50 5.814 6.019 -11.841 1.00 0.00 N ATOM 688 CA ALA A 50 6.685 6.042 -10.672 1.00 0.00 C ATOM 689 C ALA A 50 8.111 6.421 -11.058 1.00 0.00 C ATOM 690 O ALA A 50 9.063 6.097 -10.349 1.00 0.00 O ATOM 691 CB ALA A 50 6.667 4.690 -9.974 1.00 0.00 C ATOM 0 H ALA A 50 5.875 5.165 -12.396 1.00 0.00 H new ATOM 0 HA ALA A 50 6.309 6.799 -9.984 1.00 0.00 H new ATOM 0 HB1 ALA A 50 7.322 4.721 -9.103 1.00 0.00 H new ATOM 0 HB2 ALA A 50 5.651 4.458 -9.656 1.00 0.00 H new ATOM 0 HB3 ALA A 50 7.016 3.920 -10.663 1.00 0.00 H new ATOM 697 N ALA A 51 8.251 7.109 -12.186 1.00 0.00 N ATOM 698 CA ALA A 51 9.561 7.534 -12.665 1.00 0.00 C ATOM 699 C ALA A 51 10.359 8.208 -11.554 1.00 0.00 C ATOM 700 O ALA A 51 10.215 9.406 -11.313 1.00 0.00 O ATOM 701 CB ALA A 51 9.410 8.472 -13.853 1.00 0.00 C ATOM 0 H ALA A 51 7.473 7.384 -12.786 1.00 0.00 H new ATOM 0 HA ALA A 51 10.109 6.648 -12.984 1.00 0.00 H new ATOM 0 HB1 ALA A 51 10.396 8.781 -14.200 1.00 0.00 H new ATOM 0 HB2 ALA A 51 8.887 7.957 -14.659 1.00 0.00 H new ATOM 0 HB3 ALA A 51 8.839 9.351 -13.553 1.00 0.00 H new ATOM 707 N ASN A 52 11.200 7.430 -10.880 1.00 0.00 N ATOM 708 CA ASN A 52 12.020 7.953 -9.793 1.00 0.00 C ATOM 709 C ASN A 52 11.149 8.443 -8.641 1.00 0.00 C ATOM 710 O ASN A 52 11.455 9.448 -7.999 1.00 0.00 O ATOM 711 CB ASN A 52 12.906 9.093 -10.298 1.00 0.00 C ATOM 712 CG ASN A 52 13.809 8.663 -11.439 1.00 0.00 C ATOM 713 OD1 ASN A 52 14.092 7.476 -11.607 1.00 0.00 O ATOM 714 ND2 ASN A 52 14.265 9.628 -12.228 1.00 0.00 N ATOM 0 H ASN A 52 11.331 6.436 -11.067 1.00 0.00 H new ATOM 0 HA ASN A 52 12.653 7.144 -9.427 1.00 0.00 H new ATOM 0 HB2 ASN A 52 12.277 9.919 -10.628 1.00 0.00 H new ATOM 0 HB3 ASN A 52 13.517 9.466 -9.476 1.00 0.00 H new ATOM 0 HD21 ASN A 52 14.876 9.400 -13.012 1.00 0.00 H new ATOM 0 HD22 ASN A 52 14.004 10.598 -12.051 1.00 0.00 H new ATOM 721 N THR A 53 10.060 7.725 -8.383 1.00 0.00 N ATOM 722 CA THR A 53 9.143 8.086 -7.309 1.00 0.00 C ATOM 723 C THR A 53 8.806 6.877 -6.444 1.00 0.00 C ATOM 724 O THR A 53 8.407 5.831 -6.954 1.00 0.00 O ATOM 725 CB THR A 53 7.838 8.688 -7.863 1.00 0.00 C ATOM 726 OG1 THR A 53 8.135 9.776 -8.745 1.00 0.00 O ATOM 727 CG2 THR A 53 6.943 9.174 -6.732 1.00 0.00 C ATOM 0 H THR A 53 9.792 6.890 -8.904 1.00 0.00 H new ATOM 0 HA THR A 53 9.649 8.835 -6.700 1.00 0.00 H new ATOM 0 HB THR A 53 7.310 7.909 -8.414 1.00 0.00 H new ATOM 0 HG1 THR A 53 7.300 10.152 -9.094 1.00 0.00 H new ATOM 0 HG21 THR A 53 6.028 9.595 -7.148 1.00 0.00 H new ATOM 0 HG22 THR A 53 6.694 8.337 -6.080 1.00 0.00 H new ATOM 0 HG23 THR A 53 7.466 9.939 -6.157 1.00 0.00 H new ATOM 735 N GLN A 54 8.967 7.029 -5.134 1.00 0.00 N ATOM 736 CA GLN A 54 8.679 5.948 -4.198 1.00 0.00 C ATOM 737 C GLN A 54 7.365 6.199 -3.465 1.00 0.00 C ATOM 738 O GLN A 54 7.179 7.245 -2.844 1.00 0.00 O ATOM 739 CB GLN A 54 9.820 5.800 -3.190 1.00 0.00 C ATOM 740 CG GLN A 54 11.176 5.567 -3.836 1.00 0.00 C ATOM 741 CD GLN A 54 12.327 5.822 -2.884 1.00 0.00 C ATOM 742 OE1 GLN A 54 12.140 6.376 -1.800 1.00 0.00 O ATOM 743 NE2 GLN A 54 13.527 5.419 -3.284 1.00 0.00 N ATOM 0 H GLN A 54 9.295 7.890 -4.696 1.00 0.00 H new ATOM 0 HA GLN A 54 8.585 5.023 -4.767 1.00 0.00 H new ATOM 0 HB2 GLN A 54 9.869 6.699 -2.575 1.00 0.00 H new ATOM 0 HB3 GLN A 54 9.598 4.968 -2.522 1.00 0.00 H new ATOM 0 HG2 GLN A 54 11.230 4.540 -4.199 1.00 0.00 H new ATOM 0 HG3 GLN A 54 11.277 6.218 -4.705 1.00 0.00 H new ATOM 0 HE21 GLN A 54 13.636 4.964 -4.190 1.00 0.00 H new ATOM 0 HE22 GLN A 54 14.340 5.564 -2.685 1.00 0.00 H new ATOM 752 N PHE A 55 6.457 5.232 -3.542 1.00 0.00 N ATOM 753 CA PHE A 55 5.160 5.348 -2.886 1.00 0.00 C ATOM 754 C PHE A 55 4.772 4.036 -2.209 1.00 0.00 C ATOM 755 O PHE A 55 5.407 3.004 -2.426 1.00 0.00 O ATOM 756 CB PHE A 55 4.086 5.748 -3.900 1.00 0.00 C ATOM 757 CG PHE A 55 3.931 4.768 -5.027 1.00 0.00 C ATOM 758 CD1 PHE A 55 4.920 4.635 -5.988 1.00 0.00 C ATOM 759 CD2 PHE A 55 2.796 3.979 -5.125 1.00 0.00 C ATOM 760 CE1 PHE A 55 4.780 3.734 -7.027 1.00 0.00 C ATOM 761 CE2 PHE A 55 2.650 3.076 -6.162 1.00 0.00 C ATOM 762 CZ PHE A 55 3.644 2.953 -7.113 1.00 0.00 C ATOM 0 H PHE A 55 6.595 4.360 -4.052 1.00 0.00 H new ATOM 0 HA PHE A 55 5.236 6.122 -2.122 1.00 0.00 H new ATOM 0 HB2 PHE A 55 3.131 5.851 -3.384 1.00 0.00 H new ATOM 0 HB3 PHE A 55 4.333 6.727 -4.312 1.00 0.00 H new ATOM 0 HD1 PHE A 55 5.811 5.242 -5.925 1.00 0.00 H new ATOM 0 HD2 PHE A 55 2.017 4.070 -4.383 1.00 0.00 H new ATOM 0 HE1 PHE A 55 5.558 3.641 -7.770 1.00 0.00 H new ATOM 0 HE2 PHE A 55 1.760 2.468 -6.228 1.00 0.00 H new ATOM 0 HZ PHE A 55 3.533 2.247 -7.923 1.00 0.00 H new ATOM 772 N TRP A 56 3.729 4.086 -1.390 1.00 0.00 N ATOM 773 CA TRP A 56 3.257 2.902 -0.680 1.00 0.00 C ATOM 774 C TRP A 56 2.413 2.020 -1.594 1.00 0.00 C ATOM 775 O TRP A 56 2.094 2.404 -2.720 1.00 0.00 O ATOM 776 CB TRP A 56 2.443 3.310 0.549 1.00 0.00 C ATOM 777 CG TRP A 56 3.256 4.015 1.592 1.00 0.00 C ATOM 778 CD1 TRP A 56 3.124 5.313 1.995 1.00 0.00 C ATOM 779 CD2 TRP A 56 4.327 3.460 2.364 1.00 0.00 C ATOM 780 NE1 TRP A 56 4.048 5.599 2.971 1.00 0.00 N ATOM 781 CE2 TRP A 56 4.798 4.478 3.215 1.00 0.00 C ATOM 782 CE3 TRP A 56 4.932 2.202 2.420 1.00 0.00 C ATOM 783 CZ2 TRP A 56 5.846 4.275 4.109 1.00 0.00 C ATOM 784 CZ3 TRP A 56 5.972 2.002 3.307 1.00 0.00 C ATOM 785 CH2 TRP A 56 6.420 3.034 4.143 1.00 0.00 C ATOM 0 H TRP A 56 3.193 4.933 -1.200 1.00 0.00 H new ATOM 0 HA TRP A 56 4.128 2.331 -0.357 1.00 0.00 H new ATOM 0 HB2 TRP A 56 1.626 3.959 0.235 1.00 0.00 H new ATOM 0 HB3 TRP A 56 1.993 2.420 0.989 1.00 0.00 H new ATOM 0 HD1 TRP A 56 2.400 6.012 1.604 1.00 0.00 H new ATOM 0 HE1 TRP A 56 4.158 6.499 3.438 1.00 0.00 H new ATOM 0 HE3 TRP A 56 4.593 1.400 1.781 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 6.193 5.069 4.753 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 6.448 1.034 3.357 1.00 0.00 H new ATOM 0 HH2 TRP A 56 7.234 2.846 4.827 1.00 0.00 H new ATOM 796 N ILE A 57 2.056 0.839 -1.104 1.00 0.00 N ATOM 797 CA ILE A 57 1.248 -0.096 -1.877 1.00 0.00 C ATOM 798 C ILE A 57 0.298 -0.878 -0.976 1.00 0.00 C ATOM 799 O ILE A 57 0.233 -0.641 0.229 1.00 0.00 O ATOM 800 CB ILE A 57 2.129 -1.089 -2.659 1.00 0.00 C ATOM 801 CG1 ILE A 57 3.052 -1.848 -1.703 1.00 0.00 C ATOM 802 CG2 ILE A 57 2.940 -0.356 -3.717 1.00 0.00 C ATOM 803 CD1 ILE A 57 3.776 -3.005 -2.354 1.00 0.00 C ATOM 0 H ILE A 57 2.313 0.506 -0.175 1.00 0.00 H new ATOM 0 HA ILE A 57 0.668 0.498 -2.584 1.00 0.00 H new ATOM 0 HB ILE A 57 1.483 -1.811 -3.159 1.00 0.00 H new ATOM 0 HG12 ILE A 57 3.786 -1.155 -1.293 1.00 0.00 H new ATOM 0 HG13 ILE A 57 2.465 -2.223 -0.865 1.00 0.00 H new ATOM 0 HG21 ILE A 57 3.558 -1.070 -4.262 1.00 0.00 H new ATOM 0 HG22 ILE A 57 2.265 0.144 -4.412 1.00 0.00 H new ATOM 0 HG23 ILE A 57 3.580 0.385 -3.237 1.00 0.00 H new ATOM 0 HD11 ILE A 57 4.412 -3.497 -1.618 1.00 0.00 H new ATOM 0 HD12 ILE A 57 3.048 -3.719 -2.740 1.00 0.00 H new ATOM 0 HD13 ILE A 57 4.391 -2.634 -3.174 1.00 0.00 H new ATOM 815 N GLY A 58 -0.437 -1.814 -1.570 1.00 0.00 N ATOM 816 CA GLY A 58 -1.373 -2.618 -0.806 1.00 0.00 C ATOM 817 C GLY A 58 -0.680 -3.672 0.035 1.00 0.00 C ATOM 818 O GLY A 58 -1.273 -4.227 0.961 1.00 0.00 O ATOM 0 H GLY A 58 -0.401 -2.029 -2.566 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -1.960 -1.968 -0.157 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -2.072 -3.103 -1.488 1.00 0.00 H new ATOM 822 N LEU A 59 0.578 -3.951 -0.288 1.00 0.00 N ATOM 823 CA LEU A 59 1.353 -4.947 0.443 1.00 0.00 C ATOM 824 C LEU A 59 1.812 -4.399 1.790 1.00 0.00 C ATOM 825 O LEU A 59 2.529 -3.400 1.854 1.00 0.00 O ATOM 826 CB LEU A 59 2.565 -5.385 -0.381 1.00 0.00 C ATOM 827 CG LEU A 59 3.180 -6.734 -0.006 1.00 0.00 C ATOM 828 CD1 LEU A 59 2.185 -7.860 -0.246 1.00 0.00 C ATOM 829 CD2 LEU A 59 4.459 -6.975 -0.794 1.00 0.00 C ATOM 0 H LEU A 59 1.083 -3.501 -1.052 1.00 0.00 H new ATOM 0 HA LEU A 59 0.712 -5.810 0.622 1.00 0.00 H new ATOM 0 HB2 LEU A 59 2.272 -5.421 -1.430 1.00 0.00 H new ATOM 0 HB3 LEU A 59 3.336 -4.620 -0.292 1.00 0.00 H new ATOM 0 HG LEU A 59 3.428 -6.715 1.055 1.00 0.00 H new ATOM 0 HD11 LEU A 59 2.640 -8.812 0.026 1.00 0.00 H new ATOM 0 HD12 LEU A 59 1.296 -7.696 0.363 1.00 0.00 H new ATOM 0 HD13 LEU A 59 1.905 -7.880 -1.299 1.00 0.00 H new ATOM 0 HD21 LEU A 59 4.883 -7.940 -0.514 1.00 0.00 H new ATOM 0 HD22 LEU A 59 4.235 -6.973 -1.861 1.00 0.00 H new ATOM 0 HD23 LEU A 59 5.177 -6.185 -0.573 1.00 0.00 H new ATOM 841 N PHE A 60 1.395 -5.060 2.865 1.00 0.00 N ATOM 842 CA PHE A 60 1.765 -4.640 4.212 1.00 0.00 C ATOM 843 C PHE A 60 1.874 -5.841 5.146 1.00 0.00 C ATOM 844 O PHE A 60 1.060 -6.764 5.088 1.00 0.00 O ATOM 845 CB PHE A 60 0.737 -3.646 4.759 1.00 0.00 C ATOM 846 CG PHE A 60 -0.576 -4.280 5.121 1.00 0.00 C ATOM 847 CD1 PHE A 60 -0.669 -5.142 6.202 1.00 0.00 C ATOM 848 CD2 PHE A 60 -1.716 -4.013 4.381 1.00 0.00 C ATOM 849 CE1 PHE A 60 -1.876 -5.727 6.537 1.00 0.00 C ATOM 850 CE2 PHE A 60 -2.926 -4.595 4.711 1.00 0.00 C ATOM 851 CZ PHE A 60 -3.006 -5.452 5.791 1.00 0.00 C ATOM 0 H PHE A 60 0.801 -5.888 2.830 1.00 0.00 H new ATOM 0 HA PHE A 60 2.739 -4.154 4.159 1.00 0.00 H new ATOM 0 HB2 PHE A 60 1.150 -3.156 5.641 1.00 0.00 H new ATOM 0 HB3 PHE A 60 0.563 -2.869 4.015 1.00 0.00 H new ATOM 0 HD1 PHE A 60 0.211 -5.359 6.789 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -1.659 -3.342 3.536 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -1.936 -6.398 7.381 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -3.807 -4.380 4.125 1.00 0.00 H new ATOM 0 HZ PHE A 60 -3.950 -5.906 6.052 1.00 0.00 H new ATOM 861 N LYS A 61 2.886 -5.824 6.007 1.00 0.00 N ATOM 862 CA LYS A 61 3.104 -6.910 6.955 1.00 0.00 C ATOM 863 C LYS A 61 2.153 -6.796 8.142 1.00 0.00 C ATOM 864 O LYS A 61 1.910 -5.702 8.650 1.00 0.00 O ATOM 865 CB LYS A 61 4.553 -6.903 7.446 1.00 0.00 C ATOM 866 CG LYS A 61 4.900 -8.085 8.334 1.00 0.00 C ATOM 867 CD LYS A 61 6.400 -8.326 8.381 1.00 0.00 C ATOM 868 CE LYS A 61 6.870 -9.144 7.187 1.00 0.00 C ATOM 869 NZ LYS A 61 8.351 -9.299 7.171 1.00 0.00 N ATOM 0 H LYS A 61 3.569 -5.069 6.068 1.00 0.00 H new ATOM 0 HA LYS A 61 2.905 -7.851 6.442 1.00 0.00 H new ATOM 0 HB2 LYS A 61 5.220 -6.899 6.584 1.00 0.00 H new ATOM 0 HB3 LYS A 61 4.737 -5.980 7.996 1.00 0.00 H new ATOM 0 HG2 LYS A 61 4.528 -7.905 9.343 1.00 0.00 H new ATOM 0 HG3 LYS A 61 4.398 -8.979 7.964 1.00 0.00 H new ATOM 0 HD2 LYS A 61 6.923 -7.370 8.397 1.00 0.00 H new ATOM 0 HD3 LYS A 61 6.658 -8.846 9.304 1.00 0.00 H new ATOM 0 HE2 LYS A 61 6.402 -10.128 7.214 1.00 0.00 H new ATOM 0 HE3 LYS A 61 6.545 -8.661 6.265 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 8.632 -9.862 6.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 8.798 -8.361 7.120 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 8.659 -9.782 8.039 1.00 0.00 H new ATOM 883 N ASN A 62 1.619 -7.932 8.578 1.00 0.00 N ATOM 884 CA ASN A 62 0.695 -7.958 9.706 1.00 0.00 C ATOM 885 C ASN A 62 1.416 -8.351 10.992 1.00 0.00 C ATOM 886 O ASN A 62 2.620 -8.610 10.985 1.00 0.00 O ATOM 887 CB ASN A 62 -0.450 -8.935 9.432 1.00 0.00 C ATOM 888 CG ASN A 62 -1.738 -8.526 10.121 1.00 0.00 C ATOM 889 OD1 ASN A 62 -1.748 -7.619 10.953 1.00 0.00 O ATOM 890 ND2 ASN A 62 -2.832 -9.195 9.777 1.00 0.00 N ATOM 0 H ASN A 62 1.810 -8.846 8.168 1.00 0.00 H new ATOM 0 HA ASN A 62 0.287 -6.955 9.831 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -0.621 -8.998 8.357 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -0.162 -9.931 9.768 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -3.727 -8.964 10.207 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -2.777 -9.940 9.082 1.00 0.00 H new ATOM 897 N SER A 63 0.673 -8.393 12.092 1.00 0.00 N ATOM 898 CA SER A 63 1.242 -8.752 13.386 1.00 0.00 C ATOM 899 C SER A 63 1.968 -10.091 13.308 1.00 0.00 C ATOM 900 O SER A 63 3.149 -10.190 13.641 1.00 0.00 O ATOM 901 CB SER A 63 0.144 -8.815 14.450 1.00 0.00 C ATOM 902 OG SER A 63 -0.111 -7.532 14.996 1.00 0.00 O ATOM 0 H SER A 63 -0.325 -8.183 12.114 1.00 0.00 H new ATOM 0 HA SER A 63 1.963 -7.983 13.664 1.00 0.00 H new ATOM 0 HB2 SER A 63 -0.770 -9.215 14.011 1.00 0.00 H new ATOM 0 HB3 SER A 63 0.442 -9.499 15.244 1.00 0.00 H new ATOM 0 HG SER A 63 -0.817 -7.599 15.672 1.00 0.00 H new ATOM 908 N ASP A 64 1.252 -11.120 12.866 1.00 0.00 N ATOM 909 CA ASP A 64 1.827 -12.454 12.742 1.00 0.00 C ATOM 910 C ASP A 64 3.204 -12.395 12.088 1.00 0.00 C ATOM 911 O ASP A 64 4.154 -13.017 12.560 1.00 0.00 O ATOM 912 CB ASP A 64 0.900 -13.358 11.928 1.00 0.00 C ATOM 913 CG ASP A 64 1.063 -14.824 12.282 1.00 0.00 C ATOM 914 OD1 ASP A 64 2.209 -15.319 12.245 1.00 0.00 O ATOM 915 OD2 ASP A 64 0.045 -15.475 12.596 1.00 0.00 O ATOM 0 H ASP A 64 0.273 -11.055 12.588 1.00 0.00 H new ATOM 0 HA ASP A 64 1.939 -12.869 13.744 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -0.135 -13.059 12.097 1.00 0.00 H new ATOM 0 HB3 ASP A 64 1.102 -13.219 10.866 1.00 0.00 H new ATOM 920 N GLY A 65 3.303 -11.641 10.997 1.00 0.00 N ATOM 921 CA GLY A 65 4.567 -11.515 10.295 1.00 0.00 C ATOM 922 C GLY A 65 4.449 -11.857 8.823 1.00 0.00 C ATOM 923 O GLY A 65 5.450 -11.911 8.110 1.00 0.00 O ATOM 0 H GLY A 65 2.531 -11.116 10.587 1.00 0.00 H new ATOM 0 HA2 GLY A 65 4.937 -10.495 10.399 1.00 0.00 H new ATOM 0 HA3 GLY A 65 5.304 -12.170 10.759 1.00 0.00 H new ATOM 927 N GLN A 66 3.222 -12.090 8.368 1.00 0.00 N ATOM 928 CA GLN A 66 2.978 -12.431 6.971 1.00 0.00 C ATOM 929 C GLN A 66 2.549 -11.201 6.177 1.00 0.00 C ATOM 930 O GLN A 66 2.001 -10.250 6.735 1.00 0.00 O ATOM 931 CB GLN A 66 1.906 -13.518 6.869 1.00 0.00 C ATOM 932 CG GLN A 66 2.109 -14.666 7.845 1.00 0.00 C ATOM 933 CD GLN A 66 1.478 -15.958 7.365 1.00 0.00 C ATOM 934 OE1 GLN A 66 0.283 -16.187 7.554 1.00 0.00 O ATOM 935 NE2 GLN A 66 2.280 -16.811 6.739 1.00 0.00 N ATOM 0 H GLN A 66 2.382 -12.049 8.946 1.00 0.00 H new ATOM 0 HA GLN A 66 3.909 -12.808 6.547 1.00 0.00 H new ATOM 0 HB2 GLN A 66 0.928 -13.070 7.046 1.00 0.00 H new ATOM 0 HB3 GLN A 66 1.896 -13.913 5.853 1.00 0.00 H new ATOM 0 HG2 GLN A 66 3.177 -14.823 7.999 1.00 0.00 H new ATOM 0 HG3 GLN A 66 1.684 -14.396 8.812 1.00 0.00 H new ATOM 0 HE21 GLN A 66 3.264 -16.580 6.604 1.00 0.00 H new ATOM 0 HE22 GLN A 66 1.912 -17.697 6.393 1.00 0.00 H new ATOM 944 N PHE A 67 2.803 -11.227 4.873 1.00 0.00 N ATOM 945 CA PHE A 67 2.444 -10.113 4.003 1.00 0.00 C ATOM 946 C PHE A 67 1.022 -10.273 3.474 1.00 0.00 C ATOM 947 O PHE A 67 0.655 -11.327 2.955 1.00 0.00 O ATOM 948 CB PHE A 67 3.427 -10.015 2.834 1.00 0.00 C ATOM 949 CG PHE A 67 4.764 -9.451 3.221 1.00 0.00 C ATOM 950 CD1 PHE A 67 4.916 -8.093 3.455 1.00 0.00 C ATOM 951 CD2 PHE A 67 5.868 -10.277 3.352 1.00 0.00 C ATOM 952 CE1 PHE A 67 6.146 -7.572 3.810 1.00 0.00 C ATOM 953 CE2 PHE A 67 7.100 -9.761 3.708 1.00 0.00 C ATOM 954 CZ PHE A 67 7.239 -8.407 3.938 1.00 0.00 C ATOM 0 H PHE A 67 3.256 -12.007 4.396 1.00 0.00 H new ATOM 0 HA PHE A 67 2.494 -9.195 4.589 1.00 0.00 H new ATOM 0 HB2 PHE A 67 3.570 -11.007 2.406 1.00 0.00 H new ATOM 0 HB3 PHE A 67 2.990 -9.391 2.054 1.00 0.00 H new ATOM 0 HD1 PHE A 67 4.065 -7.435 3.359 1.00 0.00 H new ATOM 0 HD2 PHE A 67 5.765 -11.337 3.174 1.00 0.00 H new ATOM 0 HE1 PHE A 67 6.253 -6.512 3.987 1.00 0.00 H new ATOM 0 HE2 PHE A 67 7.953 -10.416 3.806 1.00 0.00 H new ATOM 0 HZ PHE A 67 8.200 -8.001 4.217 1.00 0.00 H new ATOM 964 N TYR A 68 0.225 -9.219 3.609 1.00 0.00 N ATOM 965 CA TYR A 68 -1.158 -9.241 3.149 1.00 0.00 C ATOM 966 C TYR A 68 -1.397 -8.171 2.088 1.00 0.00 C ATOM 967 O TYR A 68 -0.514 -7.365 1.794 1.00 0.00 O ATOM 968 CB TYR A 68 -2.113 -9.031 4.325 1.00 0.00 C ATOM 969 CG TYR A 68 -2.070 -10.145 5.346 1.00 0.00 C ATOM 970 CD1 TYR A 68 -0.996 -10.274 6.218 1.00 0.00 C ATOM 971 CD2 TYR A 68 -3.104 -11.069 5.441 1.00 0.00 C ATOM 972 CE1 TYR A 68 -0.951 -11.290 7.152 1.00 0.00 C ATOM 973 CE2 TYR A 68 -3.069 -12.088 6.373 1.00 0.00 C ATOM 974 CZ TYR A 68 -1.990 -12.194 7.226 1.00 0.00 C ATOM 975 OH TYR A 68 -1.951 -13.208 8.156 1.00 0.00 O ATOM 0 H TYR A 68 0.514 -8.338 4.034 1.00 0.00 H new ATOM 0 HA TYR A 68 -1.350 -10.217 2.704 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -1.869 -8.089 4.817 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -3.130 -8.938 3.944 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -0.182 -9.567 6.164 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -3.950 -10.989 4.774 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -0.107 -11.376 7.821 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -3.881 -12.797 6.433 1.00 0.00 H new ATOM 0 HH TYR A 68 -2.760 -13.756 8.077 1.00 0.00 H new ATOM 985 N TRP A 69 -2.596 -8.170 1.518 1.00 0.00 N ATOM 986 CA TRP A 69 -2.953 -7.198 0.490 1.00 0.00 C ATOM 987 C TRP A 69 -4.137 -6.346 0.933 1.00 0.00 C ATOM 988 O TRP A 69 -5.235 -6.859 1.150 1.00 0.00 O ATOM 989 CB TRP A 69 -3.284 -7.911 -0.822 1.00 0.00 C ATOM 990 CG TRP A 69 -2.085 -8.511 -1.491 1.00 0.00 C ATOM 991 CD1 TRP A 69 -1.789 -9.839 -1.605 1.00 0.00 C ATOM 992 CD2 TRP A 69 -1.021 -7.804 -2.137 1.00 0.00 C ATOM 993 NE1 TRP A 69 -0.604 -10.000 -2.283 1.00 0.00 N ATOM 994 CE2 TRP A 69 -0.114 -8.767 -2.621 1.00 0.00 C ATOM 995 CE3 TRP A 69 -0.747 -6.451 -2.356 1.00 0.00 C ATOM 996 CZ2 TRP A 69 1.046 -8.418 -3.308 1.00 0.00 C ATOM 997 CZ3 TRP A 69 0.404 -6.106 -3.038 1.00 0.00 C ATOM 998 CH2 TRP A 69 1.289 -7.086 -3.508 1.00 0.00 C ATOM 0 H TRP A 69 -3.338 -8.831 1.750 1.00 0.00 H new ATOM 0 HA TRP A 69 -2.097 -6.542 0.333 1.00 0.00 H new ATOM 0 HB2 TRP A 69 -4.013 -8.697 -0.626 1.00 0.00 H new ATOM 0 HB3 TRP A 69 -3.755 -7.202 -1.503 1.00 0.00 H new ATOM 0 HD1 TRP A 69 -2.396 -10.644 -1.219 1.00 0.00 H new ATOM 0 HE1 TRP A 69 -0.162 -10.893 -2.499 1.00 0.00 H new ATOM 0 HE3 TRP A 69 -1.423 -5.689 -1.998 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 1.730 -9.172 -3.670 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 0.626 -5.063 -3.212 1.00 0.00 H new ATOM 0 HH2 TRP A 69 2.180 -6.784 -4.038 1.00 0.00 H new ATOM 1009 N ASP A 70 -3.907 -5.045 1.067 1.00 0.00 N ATOM 1010 CA ASP A 70 -4.956 -4.122 1.483 1.00 0.00 C ATOM 1011 C ASP A 70 -6.174 -4.236 0.571 1.00 0.00 C ATOM 1012 O ASP A 70 -6.097 -3.948 -0.623 1.00 0.00 O ATOM 1013 CB ASP A 70 -4.433 -2.685 1.477 1.00 0.00 C ATOM 1014 CG ASP A 70 -5.187 -1.789 2.440 1.00 0.00 C ATOM 1015 OD1 ASP A 70 -5.367 -2.193 3.608 1.00 0.00 O ATOM 1016 OD2 ASP A 70 -5.599 -0.685 2.026 1.00 0.00 O ATOM 0 H ASP A 70 -3.003 -4.605 0.894 1.00 0.00 H new ATOM 0 HA ASP A 70 -5.257 -4.387 2.497 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -3.375 -2.686 1.739 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -4.512 -2.277 0.469 1.00 0.00 H new ATOM 1021 N ARG A 71 -7.297 -4.659 1.143 1.00 0.00 N ATOM 1022 CA ARG A 71 -8.530 -4.814 0.381 1.00 0.00 C ATOM 1023 C ARG A 71 -9.586 -3.816 0.848 1.00 0.00 C ATOM 1024 O ARG A 71 -10.783 -4.027 0.654 1.00 0.00 O ATOM 1025 CB ARG A 71 -9.065 -6.241 0.520 1.00 0.00 C ATOM 1026 CG ARG A 71 -8.352 -7.247 -0.368 1.00 0.00 C ATOM 1027 CD ARG A 71 -8.713 -7.052 -1.832 1.00 0.00 C ATOM 1028 NE ARG A 71 -8.209 -8.138 -2.670 1.00 0.00 N ATOM 1029 CZ ARG A 71 -8.173 -8.086 -3.997 1.00 0.00 C ATOM 1030 NH1 ARG A 71 -8.608 -7.008 -4.633 1.00 0.00 N ATOM 1031 NH2 ARG A 71 -7.701 -9.115 -4.689 1.00 0.00 N ATOM 0 H ARG A 71 -7.378 -4.900 2.131 1.00 0.00 H new ATOM 0 HA ARG A 71 -8.307 -4.618 -0.668 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -8.971 -6.556 1.559 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -10.128 -6.246 0.280 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -7.274 -7.146 -0.241 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -8.616 -8.258 -0.059 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -9.797 -6.989 -1.933 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -8.305 -6.104 -2.183 1.00 0.00 H new ATOM 0 HE ARG A 71 -7.866 -8.982 -2.211 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -8.972 -6.216 -4.104 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -8.579 -6.971 -5.652 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -7.366 -9.946 -4.202 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -7.673 -9.075 -5.708 1.00 0.00 H new ATOM 1045 N GLY A 72 -9.134 -2.729 1.465 1.00 0.00 N ATOM 1046 CA GLY A 72 -10.052 -1.715 1.950 1.00 0.00 C ATOM 1047 C GLY A 72 -9.997 -1.556 3.457 1.00 0.00 C ATOM 1048 O GLY A 72 -9.274 -2.284 4.137 1.00 0.00 O ATOM 0 H GLY A 72 -8.148 -2.532 1.638 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -9.817 -0.761 1.478 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -11.067 -1.976 1.652 1.00 0.00 H new ATOM 1052 N GLN A 73 -10.760 -0.601 3.978 1.00 0.00 N ATOM 1053 CA GLN A 73 -10.793 -0.348 5.413 1.00 0.00 C ATOM 1054 C GLN A 73 -11.596 -1.423 6.138 1.00 0.00 C ATOM 1055 O GLN A 73 -12.808 -1.535 5.955 1.00 0.00 O ATOM 1056 CB GLN A 73 -11.392 1.031 5.696 1.00 0.00 C ATOM 1057 CG GLN A 73 -11.412 1.395 7.172 1.00 0.00 C ATOM 1058 CD GLN A 73 -12.169 2.680 7.446 1.00 0.00 C ATOM 1059 OE1 GLN A 73 -11.954 3.694 6.781 1.00 0.00 O ATOM 1060 NE2 GLN A 73 -13.061 2.644 8.429 1.00 0.00 N ATOM 0 H GLN A 73 -11.363 0.010 3.428 1.00 0.00 H new ATOM 0 HA GLN A 73 -9.768 -0.374 5.784 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -10.822 1.784 5.152 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -12.411 1.062 5.309 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -11.868 0.582 7.737 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -10.388 1.497 7.531 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -13.207 1.782 8.954 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -13.601 3.479 8.659 1.00 0.00 H new ATOM 1069 N GLY A 74 -10.912 -2.211 6.961 1.00 0.00 N ATOM 1070 CA GLY A 74 -11.579 -3.268 7.701 1.00 0.00 C ATOM 1071 C GLY A 74 -11.748 -4.531 6.881 1.00 0.00 C ATOM 1072 O GLY A 74 -11.601 -5.639 7.398 1.00 0.00 O ATOM 0 H GLY A 74 -9.909 -2.137 7.129 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -11.006 -3.496 8.600 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -12.558 -2.917 8.028 1.00 0.00 H new ATOM 1076 N ILE A 75 -12.061 -4.366 5.600 1.00 0.00 N ATOM 1077 CA ILE A 75 -12.251 -5.503 4.708 1.00 0.00 C ATOM 1078 C ILE A 75 -11.196 -6.576 4.953 1.00 0.00 C ATOM 1079 O ILE A 75 -10.044 -6.270 5.255 1.00 0.00 O ATOM 1080 CB ILE A 75 -12.198 -5.074 3.230 1.00 0.00 C ATOM 1081 CG1 ILE A 75 -13.286 -4.039 2.937 1.00 0.00 C ATOM 1082 CG2 ILE A 75 -12.352 -6.285 2.321 1.00 0.00 C ATOM 1083 CD1 ILE A 75 -14.679 -4.626 2.883 1.00 0.00 C ATOM 0 H ILE A 75 -12.188 -3.456 5.157 1.00 0.00 H new ATOM 0 HA ILE A 75 -13.238 -5.912 4.924 1.00 0.00 H new ATOM 0 HB ILE A 75 -11.228 -4.618 3.034 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -13.256 -3.265 3.704 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -13.068 -3.554 1.986 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -12.313 -5.966 1.280 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -11.544 -6.991 2.515 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -13.310 -6.767 2.517 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -15.399 -3.835 2.671 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -14.726 -5.380 2.097 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -14.917 -5.087 3.842 1.00 0.00 H new ATOM 1095 N ASN A 76 -11.598 -7.836 4.817 1.00 0.00 N ATOM 1096 CA ASN A 76 -10.687 -8.956 5.022 1.00 0.00 C ATOM 1097 C ASN A 76 -9.547 -8.922 4.008 1.00 0.00 C ATOM 1098 O ASN A 76 -9.761 -8.954 2.796 1.00 0.00 O ATOM 1099 CB ASN A 76 -11.442 -10.282 4.914 1.00 0.00 C ATOM 1100 CG ASN A 76 -12.183 -10.419 3.598 1.00 0.00 C ATOM 1101 OD1 ASN A 76 -12.188 -9.502 2.777 1.00 0.00 O ATOM 1102 ND2 ASN A 76 -12.815 -11.569 3.393 1.00 0.00 N ATOM 0 H ASN A 76 -12.549 -8.107 4.566 1.00 0.00 H new ATOM 0 HA ASN A 76 -10.263 -8.869 6.022 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -10.738 -11.108 5.019 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -12.152 -10.361 5.738 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -13.332 -11.720 2.527 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -12.784 -12.302 4.102 1.00 0.00 H new ATOM 1109 N PRO A 77 -8.307 -8.858 4.513 1.00 0.00 N ATOM 1110 CA PRO A 77 -7.109 -8.820 3.669 1.00 0.00 C ATOM 1111 C PRO A 77 -6.857 -10.147 2.962 1.00 0.00 C ATOM 1112 O PRO A 77 -7.487 -11.157 3.273 1.00 0.00 O ATOM 1113 CB PRO A 77 -5.984 -8.521 4.663 1.00 0.00 C ATOM 1114 CG PRO A 77 -6.489 -9.027 5.970 1.00 0.00 C ATOM 1115 CD PRO A 77 -7.978 -8.816 5.948 1.00 0.00 C ATOM 0 HA PRO A 77 -7.196 -8.084 2.870 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -5.059 -9.021 4.376 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -5.769 -7.453 4.708 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -6.246 -10.082 6.100 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -6.031 -8.489 6.800 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -8.502 -9.594 6.503 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -8.255 -7.862 6.396 1.00 0.00 H new ATOM 1123 N ASP A 78 -5.931 -10.137 2.009 1.00 0.00 N ATOM 1124 CA ASP A 78 -5.594 -11.340 1.258 1.00 0.00 C ATOM 1125 C ASP A 78 -4.145 -11.748 1.506 1.00 0.00 C ATOM 1126 O ASP A 78 -3.225 -10.950 1.323 1.00 0.00 O ATOM 1127 CB ASP A 78 -5.825 -11.116 -0.238 1.00 0.00 C ATOM 1128 CG ASP A 78 -7.236 -11.467 -0.665 1.00 0.00 C ATOM 1129 OD1 ASP A 78 -8.168 -10.715 -0.311 1.00 0.00 O ATOM 1130 OD2 ASP A 78 -7.409 -12.494 -1.354 1.00 0.00 O ATOM 0 H ASP A 78 -5.401 -9.309 1.739 1.00 0.00 H new ATOM 0 HA ASP A 78 -6.243 -12.146 1.601 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -5.624 -10.073 -0.481 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -5.116 -11.718 -0.806 1.00 0.00 H new ATOM 1135 N LEU A 79 -3.950 -12.994 1.923 1.00 0.00 N ATOM 1136 CA LEU A 79 -2.612 -13.508 2.198 1.00 0.00 C ATOM 1137 C LEU A 79 -1.780 -13.568 0.921 1.00 0.00 C ATOM 1138 O LEU A 79 -2.173 -14.200 -0.060 1.00 0.00 O ATOM 1139 CB LEU A 79 -2.699 -14.898 2.830 1.00 0.00 C ATOM 1140 CG LEU A 79 -1.559 -15.277 3.777 1.00 0.00 C ATOM 1141 CD1 LEU A 79 -0.244 -15.369 3.019 1.00 0.00 C ATOM 1142 CD2 LEU A 79 -1.453 -14.270 4.913 1.00 0.00 C ATOM 0 H LEU A 79 -4.701 -13.667 2.078 1.00 0.00 H new ATOM 0 HA LEU A 79 -2.124 -12.828 2.896 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -3.639 -14.968 3.378 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -2.741 -15.637 2.030 1.00 0.00 H new ATOM 0 HG LEU A 79 -1.777 -16.256 4.205 1.00 0.00 H new ATOM 0 HD11 LEU A 79 0.555 -15.640 3.709 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -0.325 -16.128 2.241 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -0.019 -14.405 2.563 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.637 -14.555 5.577 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -1.258 -13.279 4.504 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -2.388 -14.254 5.473 1.00 0.00 H new ATOM 1154 N LEU A 80 -0.626 -12.909 0.942 1.00 0.00 N ATOM 1155 CA LEU A 80 0.265 -12.890 -0.213 1.00 0.00 C ATOM 1156 C LEU A 80 0.721 -14.300 -0.573 1.00 0.00 C ATOM 1157 O LEU A 80 1.739 -14.779 -0.077 1.00 0.00 O ATOM 1158 CB LEU A 80 1.480 -12.005 0.070 1.00 0.00 C ATOM 1159 CG LEU A 80 2.568 -11.995 -1.004 1.00 0.00 C ATOM 1160 CD1 LEU A 80 2.264 -10.947 -2.062 1.00 0.00 C ATOM 1161 CD2 LEU A 80 3.933 -11.745 -0.378 1.00 0.00 C ATOM 0 H LEU A 80 -0.286 -12.381 1.746 1.00 0.00 H new ATOM 0 HA LEU A 80 -0.286 -12.480 -1.059 1.00 0.00 H new ATOM 0 HB2 LEU A 80 1.133 -10.982 0.217 1.00 0.00 H new ATOM 0 HB3 LEU A 80 1.928 -12.327 1.010 1.00 0.00 H new ATOM 0 HG LEU A 80 2.585 -12.973 -1.486 1.00 0.00 H new ATOM 0 HD11 LEU A 80 3.049 -10.955 -2.818 1.00 0.00 H new ATOM 0 HD12 LEU A 80 1.306 -11.171 -2.532 1.00 0.00 H new ATOM 0 HD13 LEU A 80 2.218 -9.963 -1.596 1.00 0.00 H new ATOM 0 HD21 LEU A 80 4.695 -11.741 -1.157 1.00 0.00 H new ATOM 0 HD22 LEU A 80 3.929 -10.781 0.131 1.00 0.00 H new ATOM 0 HD23 LEU A 80 4.153 -12.534 0.341 1.00 0.00 H new ATOM 1173 N ASN A 81 -0.040 -14.959 -1.442 1.00 0.00 N ATOM 1174 CA ASN A 81 0.287 -16.314 -1.870 1.00 0.00 C ATOM 1175 C ASN A 81 0.407 -16.390 -3.389 1.00 0.00 C ATOM 1176 O ASN A 81 -0.278 -17.182 -4.036 1.00 0.00 O ATOM 1177 CB ASN A 81 -0.778 -17.297 -1.381 1.00 0.00 C ATOM 1178 CG ASN A 81 -0.216 -18.683 -1.134 1.00 0.00 C ATOM 1179 OD1 ASN A 81 0.994 -18.859 -0.994 1.00 0.00 O ATOM 1180 ND2 ASN A 81 -1.095 -19.677 -1.079 1.00 0.00 N ATOM 0 H ASN A 81 -0.887 -14.576 -1.863 1.00 0.00 H new ATOM 0 HA ASN A 81 1.248 -16.584 -1.433 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -1.222 -16.919 -0.460 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -1.578 -17.359 -2.119 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -0.776 -20.632 -0.915 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -2.089 -19.486 -1.201 1.00 0.00 H new ATOM 1187 N GLN A 82 1.282 -15.562 -3.951 1.00 0.00 N ATOM 1188 CA GLN A 82 1.491 -15.537 -5.394 1.00 0.00 C ATOM 1189 C GLN A 82 2.877 -16.061 -5.752 1.00 0.00 C ATOM 1190 O GLN A 82 3.859 -15.822 -5.050 1.00 0.00 O ATOM 1191 CB GLN A 82 1.316 -14.115 -5.930 1.00 0.00 C ATOM 1192 CG GLN A 82 2.184 -13.087 -5.222 1.00 0.00 C ATOM 1193 CD GLN A 82 1.753 -11.662 -5.510 1.00 0.00 C ATOM 1194 OE1 GLN A 82 0.687 -11.224 -5.076 1.00 0.00 O ATOM 1195 NE2 GLN A 82 2.582 -10.930 -6.245 1.00 0.00 N ATOM 0 H GLN A 82 1.857 -14.900 -3.430 1.00 0.00 H new ATOM 0 HA GLN A 82 0.747 -16.186 -5.856 1.00 0.00 H new ATOM 0 HB2 GLN A 82 1.551 -14.105 -6.994 1.00 0.00 H new ATOM 0 HB3 GLN A 82 0.270 -13.825 -5.832 1.00 0.00 H new ATOM 0 HG2 GLN A 82 2.146 -13.264 -4.147 1.00 0.00 H new ATOM 0 HG3 GLN A 82 3.221 -13.218 -5.531 1.00 0.00 H new ATOM 0 HE21 GLN A 82 3.455 -11.334 -6.584 1.00 0.00 H new ATOM 0 HE22 GLN A 82 2.346 -9.964 -6.471 1.00 0.00 H new ATOM 1204 N PRO A 83 2.961 -16.795 -6.872 1.00 0.00 N ATOM 1205 CA PRO A 83 4.222 -17.369 -7.350 1.00 0.00 C ATOM 1206 C PRO A 83 5.188 -16.304 -7.858 1.00 0.00 C ATOM 1207 O PRO A 83 6.405 -16.488 -7.820 1.00 0.00 O ATOM 1208 CB PRO A 83 3.784 -18.285 -8.495 1.00 0.00 C ATOM 1209 CG PRO A 83 2.498 -17.705 -8.973 1.00 0.00 C ATOM 1210 CD PRO A 83 1.831 -17.120 -7.758 1.00 0.00 C ATOM 0 HA PRO A 83 4.761 -17.886 -6.556 1.00 0.00 H new ATOM 0 HB2 PRO A 83 4.528 -18.307 -9.291 1.00 0.00 H new ATOM 0 HB3 PRO A 83 3.652 -19.311 -8.153 1.00 0.00 H new ATOM 0 HG2 PRO A 83 2.672 -16.940 -9.729 1.00 0.00 H new ATOM 0 HG3 PRO A 83 1.872 -18.470 -9.432 1.00 0.00 H new ATOM 0 HD2 PRO A 83 1.248 -16.233 -8.007 1.00 0.00 H new ATOM 0 HD3 PRO A 83 1.148 -17.831 -7.293 1.00 0.00 H new ATOM 1218 N ILE A 84 4.638 -15.192 -8.334 1.00 0.00 N ATOM 1219 CA ILE A 84 5.452 -14.098 -8.848 1.00 0.00 C ATOM 1220 C ILE A 84 5.572 -12.974 -7.825 1.00 0.00 C ATOM 1221 O ILE A 84 4.579 -12.550 -7.231 1.00 0.00 O ATOM 1222 CB ILE A 84 4.868 -13.528 -10.154 1.00 0.00 C ATOM 1223 CG1 ILE A 84 4.785 -14.622 -11.221 1.00 0.00 C ATOM 1224 CG2 ILE A 84 5.713 -12.363 -10.648 1.00 0.00 C ATOM 1225 CD1 ILE A 84 4.172 -14.152 -12.522 1.00 0.00 C ATOM 0 H ILE A 84 3.633 -15.025 -8.374 1.00 0.00 H new ATOM 0 HA ILE A 84 6.441 -14.509 -9.050 1.00 0.00 H new ATOM 0 HB ILE A 84 3.861 -13.163 -9.955 1.00 0.00 H new ATOM 0 HG12 ILE A 84 5.787 -15.003 -11.418 1.00 0.00 H new ATOM 0 HG13 ILE A 84 4.198 -15.454 -10.832 1.00 0.00 H new ATOM 0 HG21 ILE A 84 5.288 -11.971 -11.572 1.00 0.00 H new ATOM 0 HG22 ILE A 84 5.727 -11.577 -9.893 1.00 0.00 H new ATOM 0 HG23 ILE A 84 6.731 -12.705 -10.834 1.00 0.00 H new ATOM 0 HD11 ILE A 84 4.145 -14.979 -13.231 1.00 0.00 H new ATOM 0 HD12 ILE A 84 3.158 -13.798 -12.339 1.00 0.00 H new ATOM 0 HD13 ILE A 84 4.771 -13.340 -12.934 1.00 0.00 H new ATOM 1237 N THR A 85 6.794 -12.491 -7.623 1.00 0.00 N ATOM 1238 CA THR A 85 7.044 -11.416 -6.673 1.00 0.00 C ATOM 1239 C THR A 85 8.100 -10.450 -7.200 1.00 0.00 C ATOM 1240 O THR A 85 8.794 -10.745 -8.173 1.00 0.00 O ATOM 1241 CB THR A 85 7.504 -11.966 -5.310 1.00 0.00 C ATOM 1242 OG1 THR A 85 8.614 -12.853 -5.488 1.00 0.00 O ATOM 1243 CG2 THR A 85 6.369 -12.701 -4.612 1.00 0.00 C ATOM 0 H THR A 85 7.627 -12.829 -8.106 1.00 0.00 H new ATOM 0 HA THR A 85 6.101 -10.885 -6.543 1.00 0.00 H new ATOM 0 HB THR A 85 7.808 -11.124 -4.688 1.00 0.00 H new ATOM 0 HG1 THR A 85 8.901 -13.197 -4.616 1.00 0.00 H new ATOM 0 HG21 THR A 85 6.718 -13.081 -3.652 1.00 0.00 H new ATOM 0 HG22 THR A 85 5.537 -12.016 -4.451 1.00 0.00 H new ATOM 0 HG23 THR A 85 6.039 -13.534 -5.233 1.00 0.00 H new ATOM 1251 N TYR A 86 8.216 -9.297 -6.552 1.00 0.00 N ATOM 1252 CA TYR A 86 9.186 -8.287 -6.957 1.00 0.00 C ATOM 1253 C TYR A 86 10.057 -7.864 -5.778 1.00 0.00 C ATOM 1254 O TYR A 86 10.696 -6.812 -5.810 1.00 0.00 O ATOM 1255 CB TYR A 86 8.471 -7.067 -7.541 1.00 0.00 C ATOM 1256 CG TYR A 86 7.436 -7.414 -8.587 1.00 0.00 C ATOM 1257 CD1 TYR A 86 7.807 -8.006 -9.788 1.00 0.00 C ATOM 1258 CD2 TYR A 86 6.089 -7.151 -8.375 1.00 0.00 C ATOM 1259 CE1 TYR A 86 6.865 -8.325 -10.748 1.00 0.00 C ATOM 1260 CE2 TYR A 86 5.140 -7.468 -9.328 1.00 0.00 C ATOM 1261 CZ TYR A 86 5.533 -8.054 -10.513 1.00 0.00 C ATOM 1262 OH TYR A 86 4.592 -8.370 -11.465 1.00 0.00 O ATOM 0 H TYR A 86 7.650 -9.038 -5.744 1.00 0.00 H new ATOM 0 HA TYR A 86 9.828 -8.724 -7.722 1.00 0.00 H new ATOM 0 HB2 TYR A 86 7.988 -6.518 -6.733 1.00 0.00 H new ATOM 0 HB3 TYR A 86 9.211 -6.399 -7.982 1.00 0.00 H new ATOM 0 HD1 TYR A 86 8.849 -8.221 -9.975 1.00 0.00 H new ATOM 0 HD2 TYR A 86 5.778 -6.691 -7.449 1.00 0.00 H new ATOM 0 HE1 TYR A 86 7.170 -8.784 -11.677 1.00 0.00 H new ATOM 0 HE2 TYR A 86 4.096 -7.258 -9.146 1.00 0.00 H new ATOM 0 HH TYR A 86 3.862 -8.874 -11.049 1.00 0.00 H new ATOM 1272 N TRP A 87 10.078 -8.692 -4.740 1.00 0.00 N ATOM 1273 CA TRP A 87 10.871 -8.405 -3.550 1.00 0.00 C ATOM 1274 C TRP A 87 12.284 -7.974 -3.928 1.00 0.00 C ATOM 1275 O TRP A 87 12.979 -8.673 -4.666 1.00 0.00 O ATOM 1276 CB TRP A 87 10.925 -9.634 -2.640 1.00 0.00 C ATOM 1277 CG TRP A 87 9.613 -9.949 -1.989 1.00 0.00 C ATOM 1278 CD1 TRP A 87 8.867 -11.081 -2.154 1.00 0.00 C ATOM 1279 CD2 TRP A 87 8.890 -9.120 -1.072 1.00 0.00 C ATOM 1280 NE1 TRP A 87 7.725 -11.007 -1.394 1.00 0.00 N ATOM 1281 CE2 TRP A 87 7.716 -9.814 -0.720 1.00 0.00 C ATOM 1282 CE3 TRP A 87 9.122 -7.861 -0.512 1.00 0.00 C ATOM 1283 CZ2 TRP A 87 6.778 -9.288 0.165 1.00 0.00 C ATOM 1284 CZ3 TRP A 87 8.190 -7.341 0.366 1.00 0.00 C ATOM 1285 CH2 TRP A 87 7.030 -8.054 0.698 1.00 0.00 C ATOM 0 H TRP A 87 9.555 -9.567 -4.698 1.00 0.00 H new ATOM 0 HA TRP A 87 10.393 -7.585 -3.014 1.00 0.00 H new ATOM 0 HB2 TRP A 87 11.249 -10.496 -3.224 1.00 0.00 H new ATOM 0 HB3 TRP A 87 11.676 -9.472 -1.867 1.00 0.00 H new ATOM 0 HD1 TRP A 87 9.135 -11.912 -2.789 1.00 0.00 H new ATOM 0 HE1 TRP A 87 7.001 -11.724 -1.340 1.00 0.00 H new ATOM 0 HE3 TRP A 87 10.013 -7.304 -0.761 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 5.883 -9.835 0.421 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 8.358 -6.368 0.804 1.00 0.00 H new ATOM 0 HH2 TRP A 87 6.321 -7.621 1.388 1.00 0.00 H new ATOM 1296 N ALA A 88 12.703 -6.821 -3.418 1.00 0.00 N ATOM 1297 CA ALA A 88 14.034 -6.299 -3.701 1.00 0.00 C ATOM 1298 C ALA A 88 15.115 -7.259 -3.216 1.00 0.00 C ATOM 1299 O ALA A 88 14.826 -8.234 -2.524 1.00 0.00 O ATOM 1300 CB ALA A 88 14.213 -4.932 -3.058 1.00 0.00 C ATOM 0 H ALA A 88 12.140 -6.230 -2.806 1.00 0.00 H new ATOM 0 HA ALA A 88 14.134 -6.196 -4.781 1.00 0.00 H new ATOM 0 HB1 ALA A 88 15.212 -4.555 -3.278 1.00 0.00 H new ATOM 0 HB2 ALA A 88 13.469 -4.242 -3.456 1.00 0.00 H new ATOM 0 HB3 ALA A 88 14.087 -5.018 -1.979 1.00 0.00 H new ATOM 1306 N ASN A 89 16.360 -6.977 -3.585 1.00 0.00 N ATOM 1307 CA ASN A 89 17.484 -7.817 -3.188 1.00 0.00 C ATOM 1308 C ASN A 89 17.432 -8.125 -1.694 1.00 0.00 C ATOM 1309 O ASN A 89 17.501 -7.222 -0.861 1.00 0.00 O ATOM 1310 CB ASN A 89 18.807 -7.131 -3.533 1.00 0.00 C ATOM 1311 CG ASN A 89 19.911 -8.125 -3.837 1.00 0.00 C ATOM 1312 OD1 ASN A 89 20.499 -8.714 -2.930 1.00 0.00 O ATOM 1313 ND2 ASN A 89 20.199 -8.315 -5.120 1.00 0.00 N ATOM 0 H ASN A 89 16.616 -6.173 -4.158 1.00 0.00 H new ATOM 0 HA ASN A 89 17.415 -8.756 -3.737 1.00 0.00 H new ATOM 0 HB2 ASN A 89 18.661 -6.479 -4.394 1.00 0.00 H new ATOM 0 HB3 ASN A 89 19.112 -6.496 -2.701 1.00 0.00 H new ATOM 0 HD21 ASN A 89 20.933 -8.971 -5.386 1.00 0.00 H new ATOM 0 HD22 ASN A 89 19.686 -7.805 -5.839 1.00 0.00 H new ATOM 1320 N GLY A 90 17.311 -9.407 -1.363 1.00 0.00 N ATOM 1321 CA GLY A 90 17.253 -9.811 0.029 1.00 0.00 C ATOM 1322 C GLY A 90 15.856 -9.699 0.607 1.00 0.00 C ATOM 1323 O GLY A 90 15.521 -10.384 1.573 1.00 0.00 O ATOM 0 H GLY A 90 17.252 -10.173 -2.034 1.00 0.00 H new ATOM 0 HA2 GLY A 90 17.599 -10.841 0.120 1.00 0.00 H new ATOM 0 HA3 GLY A 90 17.935 -9.193 0.612 1.00 0.00 H new ATOM 1327 N GLU A 91 15.040 -8.832 0.016 1.00 0.00 N ATOM 1328 CA GLU A 91 13.673 -8.632 0.481 1.00 0.00 C ATOM 1329 C GLU A 91 12.830 -9.882 0.248 1.00 0.00 C ATOM 1330 O GLU A 91 13.091 -10.679 -0.654 1.00 0.00 O ATOM 1331 CB GLU A 91 13.038 -7.436 -0.232 1.00 0.00 C ATOM 1332 CG GLU A 91 13.693 -6.108 0.106 1.00 0.00 C ATOM 1333 CD GLU A 91 14.163 -6.039 1.546 1.00 0.00 C ATOM 1334 OE1 GLU A 91 15.132 -6.747 1.889 1.00 0.00 O ATOM 1335 OE2 GLU A 91 13.560 -5.276 2.331 1.00 0.00 O ATOM 0 H GLU A 91 15.302 -8.257 -0.785 1.00 0.00 H new ATOM 0 HA GLU A 91 13.707 -8.432 1.552 1.00 0.00 H new ATOM 0 HB2 GLU A 91 13.093 -7.595 -1.309 1.00 0.00 H new ATOM 0 HB3 GLU A 91 11.981 -7.387 0.030 1.00 0.00 H new ATOM 0 HG2 GLU A 91 14.543 -5.947 -0.558 1.00 0.00 H new ATOM 0 HG3 GLU A 91 12.985 -5.300 -0.080 1.00 0.00 H new ATOM 1342 N PRO A 92 11.794 -10.061 1.082 1.00 0.00 N ATOM 1343 CA PRO A 92 11.474 -9.120 2.160 1.00 0.00 C ATOM 1344 C PRO A 92 12.507 -9.150 3.281 1.00 0.00 C ATOM 1345 O PRO A 92 13.255 -10.117 3.423 1.00 0.00 O ATOM 1346 CB PRO A 92 10.118 -9.614 2.670 1.00 0.00 C ATOM 1347 CG PRO A 92 10.085 -11.062 2.321 1.00 0.00 C ATOM 1348 CD PRO A 92 10.856 -11.195 1.036 1.00 0.00 C ATOM 0 HA PRO A 92 11.464 -8.088 1.810 1.00 0.00 H new ATOM 0 HB2 PRO A 92 10.021 -9.464 3.745 1.00 0.00 H new ATOM 0 HB3 PRO A 92 9.297 -9.074 2.198 1.00 0.00 H new ATOM 0 HG2 PRO A 92 10.535 -11.664 3.110 1.00 0.00 H new ATOM 0 HG3 PRO A 92 9.060 -11.411 2.199 1.00 0.00 H new ATOM 0 HD2 PRO A 92 11.381 -12.149 0.979 1.00 0.00 H new ATOM 0 HD3 PRO A 92 10.201 -11.140 0.167 1.00 0.00 H new ATOM 1356 N SER A 93 12.544 -8.084 4.074 1.00 0.00 N ATOM 1357 CA SER A 93 13.488 -7.987 5.181 1.00 0.00 C ATOM 1358 C SER A 93 12.891 -8.570 6.457 1.00 0.00 C ATOM 1359 O SER A 93 11.672 -8.626 6.616 1.00 0.00 O ATOM 1360 CB SER A 93 13.887 -6.528 5.411 1.00 0.00 C ATOM 1361 OG SER A 93 15.173 -6.438 6.002 1.00 0.00 O ATOM 0 H SER A 93 11.931 -7.275 3.970 1.00 0.00 H new ATOM 0 HA SER A 93 14.376 -8.563 4.921 1.00 0.00 H new ATOM 0 HB2 SER A 93 13.881 -5.992 4.462 1.00 0.00 H new ATOM 0 HB3 SER A 93 13.153 -6.044 6.055 1.00 0.00 H new ATOM 0 HG SER A 93 15.082 -6.216 6.952 1.00 0.00 H new ATOM 1367 N ASN A 94 13.760 -9.005 7.365 1.00 0.00 N ATOM 1368 CA ASN A 94 13.319 -9.585 8.628 1.00 0.00 C ATOM 1369 C ASN A 94 13.537 -8.609 9.780 1.00 0.00 C ATOM 1370 O ASN A 94 13.833 -9.016 10.904 1.00 0.00 O ATOM 1371 CB ASN A 94 14.069 -10.891 8.902 1.00 0.00 C ATOM 1372 CG ASN A 94 15.569 -10.741 8.740 1.00 0.00 C ATOM 1373 OD1 ASN A 94 16.093 -9.627 8.702 1.00 0.00 O ATOM 1374 ND2 ASN A 94 16.269 -11.865 8.643 1.00 0.00 N ATOM 0 H ASN A 94 14.773 -8.967 7.249 1.00 0.00 H new ATOM 0 HA ASN A 94 12.252 -9.795 8.550 1.00 0.00 H new ATOM 0 HB2 ASN A 94 13.848 -11.228 9.915 1.00 0.00 H new ATOM 0 HB3 ASN A 94 13.708 -11.663 8.223 1.00 0.00 H new ATOM 0 HD21 ASN A 94 17.282 -11.827 8.532 1.00 0.00 H new ATOM 0 HD22 ASN A 94 15.794 -12.767 8.679 1.00 0.00 H new ATOM 1381 N ASP A 95 13.387 -7.321 9.493 1.00 0.00 N ATOM 1382 CA ASP A 95 13.565 -6.286 10.506 1.00 0.00 C ATOM 1383 C ASP A 95 12.250 -5.993 11.220 1.00 0.00 C ATOM 1384 O ASP A 95 11.195 -5.856 10.600 1.00 0.00 O ATOM 1385 CB ASP A 95 14.110 -5.007 9.868 1.00 0.00 C ATOM 1386 CG ASP A 95 15.607 -5.068 9.636 1.00 0.00 C ATOM 1387 OD1 ASP A 95 16.037 -5.807 8.725 1.00 0.00 O ATOM 1388 OD2 ASP A 95 16.348 -4.376 10.364 1.00 0.00 O ATOM 0 H ASP A 95 13.143 -6.968 8.568 1.00 0.00 H new ATOM 0 HA ASP A 95 14.283 -6.650 11.241 1.00 0.00 H new ATOM 0 HB2 ASP A 95 13.605 -4.835 8.918 1.00 0.00 H new ATOM 0 HB3 ASP A 95 13.879 -4.157 10.510 1.00 0.00 H new ATOM 1393 N PRO A 96 12.311 -5.894 12.557 1.00 0.00 N ATOM 1394 CA PRO A 96 11.134 -5.617 13.385 1.00 0.00 C ATOM 1395 C PRO A 96 10.622 -4.192 13.205 1.00 0.00 C ATOM 1396 O PRO A 96 9.461 -3.897 13.493 1.00 0.00 O ATOM 1397 CB PRO A 96 11.647 -5.825 14.812 1.00 0.00 C ATOM 1398 CG PRO A 96 13.114 -5.577 14.727 1.00 0.00 C ATOM 1399 CD PRO A 96 13.535 -6.046 13.362 1.00 0.00 C ATOM 0 HA PRO A 96 10.291 -6.257 13.123 1.00 0.00 H new ATOM 0 HB2 PRO A 96 11.169 -5.137 15.509 1.00 0.00 H new ATOM 0 HB3 PRO A 96 11.436 -6.834 15.165 1.00 0.00 H new ATOM 0 HG2 PRO A 96 13.339 -4.519 14.863 1.00 0.00 H new ATOM 0 HG3 PRO A 96 13.647 -6.119 15.508 1.00 0.00 H new ATOM 0 HD2 PRO A 96 14.354 -5.446 12.966 1.00 0.00 H new ATOM 0 HD3 PRO A 96 13.878 -7.080 13.381 1.00 0.00 H new ATOM 1407 N THR A 97 11.494 -3.310 12.727 1.00 0.00 N ATOM 1408 CA THR A 97 11.130 -1.916 12.510 1.00 0.00 C ATOM 1409 C THR A 97 10.370 -1.743 11.200 1.00 0.00 C ATOM 1410 O THR A 97 9.354 -1.051 11.147 1.00 0.00 O ATOM 1411 CB THR A 97 12.374 -1.007 12.492 1.00 0.00 C ATOM 1412 OG1 THR A 97 13.293 -1.453 11.488 1.00 0.00 O ATOM 1413 CG2 THR A 97 13.060 -1.002 13.849 1.00 0.00 C ATOM 0 H THR A 97 12.458 -3.537 12.483 1.00 0.00 H new ATOM 0 HA THR A 97 10.487 -1.625 13.341 1.00 0.00 H new ATOM 0 HB THR A 97 12.051 0.008 12.262 1.00 0.00 H new ATOM 0 HG1 THR A 97 14.080 -0.869 11.482 1.00 0.00 H new ATOM 0 HG21 THR A 97 13.935 -0.354 13.812 1.00 0.00 H new ATOM 0 HG22 THR A 97 12.367 -0.633 14.606 1.00 0.00 H new ATOM 0 HG23 THR A 97 13.370 -2.015 14.104 1.00 0.00 H new ATOM 1421 N ARG A 98 10.869 -2.378 10.144 1.00 0.00 N ATOM 1422 CA ARG A 98 10.237 -2.294 8.833 1.00 0.00 C ATOM 1423 C ARG A 98 9.210 -3.408 8.652 1.00 0.00 C ATOM 1424 O ARG A 98 9.560 -4.587 8.620 1.00 0.00 O ATOM 1425 CB ARG A 98 11.292 -2.374 7.728 1.00 0.00 C ATOM 1426 CG ARG A 98 12.475 -1.446 7.947 1.00 0.00 C ATOM 1427 CD ARG A 98 13.665 -1.848 7.089 1.00 0.00 C ATOM 1428 NE ARG A 98 13.557 -1.333 5.727 1.00 0.00 N ATOM 1429 CZ ARG A 98 14.601 -1.138 4.930 1.00 0.00 C ATOM 1430 NH1 ARG A 98 15.826 -1.416 5.356 1.00 0.00 N ATOM 1431 NH2 ARG A 98 14.422 -0.667 3.702 1.00 0.00 N ATOM 0 H ARG A 98 11.709 -2.956 10.171 1.00 0.00 H new ATOM 0 HA ARG A 98 9.723 -1.335 8.766 1.00 0.00 H new ATOM 0 HB2 ARG A 98 11.654 -3.400 7.657 1.00 0.00 H new ATOM 0 HB3 ARG A 98 10.825 -2.134 6.773 1.00 0.00 H new ATOM 0 HG2 ARG A 98 12.184 -0.422 7.711 1.00 0.00 H new ATOM 0 HG3 ARG A 98 12.761 -1.462 8.999 1.00 0.00 H new ATOM 0 HD2 ARG A 98 14.583 -1.477 7.545 1.00 0.00 H new ATOM 0 HD3 ARG A 98 13.741 -2.935 7.061 1.00 0.00 H new ATOM 0 HE ARG A 98 12.628 -1.111 5.368 1.00 0.00 H new ATOM 0 HH11 ARG A 98 15.968 -1.781 6.298 1.00 0.00 H new ATOM 0 HH12 ARG A 98 16.626 -1.265 4.742 1.00 0.00 H new ATOM 0 HH21 ARG A 98 13.481 -0.454 3.369 1.00 0.00 H new ATOM 0 HH22 ARG A 98 15.225 -0.518 3.091 1.00 0.00 H new ATOM 1445 N GLN A 99 7.943 -3.024 8.536 1.00 0.00 N ATOM 1446 CA GLN A 99 6.865 -3.991 8.360 1.00 0.00 C ATOM 1447 C GLN A 99 6.080 -3.705 7.085 1.00 0.00 C ATOM 1448 O GLN A 99 5.612 -4.624 6.412 1.00 0.00 O ATOM 1449 CB GLN A 99 5.927 -3.966 9.568 1.00 0.00 C ATOM 1450 CG GLN A 99 6.653 -3.896 10.902 1.00 0.00 C ATOM 1451 CD GLN A 99 5.865 -4.533 12.029 1.00 0.00 C ATOM 1452 OE1 GLN A 99 5.292 -3.839 12.870 1.00 0.00 O ATOM 1453 NE2 GLN A 99 5.832 -5.860 12.053 1.00 0.00 N ATOM 0 H GLN A 99 7.638 -2.051 8.561 1.00 0.00 H new ATOM 0 HA GLN A 99 7.310 -4.982 8.275 1.00 0.00 H new ATOM 0 HB2 GLN A 99 5.260 -3.108 9.482 1.00 0.00 H new ATOM 0 HB3 GLN A 99 5.302 -4.859 9.551 1.00 0.00 H new ATOM 0 HG2 GLN A 99 7.619 -4.394 10.812 1.00 0.00 H new ATOM 0 HG3 GLN A 99 6.853 -2.853 11.148 1.00 0.00 H new ATOM 0 HE21 GLN A 99 6.321 -6.395 11.336 1.00 0.00 H new ATOM 0 HE22 GLN A 99 5.317 -6.344 12.789 1.00 0.00 H new ATOM 1462 N CYS A 100 5.938 -2.425 6.758 1.00 0.00 N ATOM 1463 CA CYS A 100 5.209 -2.017 5.563 1.00 0.00 C ATOM 1464 C CYS A 100 6.114 -2.050 4.335 1.00 0.00 C ATOM 1465 O CYS A 100 7.338 -2.003 4.451 1.00 0.00 O ATOM 1466 CB CYS A 100 4.632 -0.612 5.748 1.00 0.00 C ATOM 1467 SG CYS A 100 3.391 -0.486 7.075 1.00 0.00 S ATOM 0 H CYS A 100 6.318 -1.652 7.304 1.00 0.00 H new ATOM 0 HA CYS A 100 4.392 -2.721 5.408 1.00 0.00 H new ATOM 0 HB2 CYS A 100 5.448 0.079 5.961 1.00 0.00 H new ATOM 0 HB3 CYS A 100 4.179 -0.291 4.810 1.00 0.00 H new ATOM 1472 N VAL A 101 5.502 -2.131 3.158 1.00 0.00 N ATOM 1473 CA VAL A 101 6.251 -2.169 1.908 1.00 0.00 C ATOM 1474 C VAL A 101 5.867 -1.005 1.001 1.00 0.00 C ATOM 1475 O VAL A 101 4.699 -0.624 0.923 1.00 0.00 O ATOM 1476 CB VAL A 101 6.017 -3.491 1.153 1.00 0.00 C ATOM 1477 CG1 VAL A 101 6.898 -3.563 -0.085 1.00 0.00 C ATOM 1478 CG2 VAL A 101 6.273 -4.679 2.069 1.00 0.00 C ATOM 0 H VAL A 101 4.489 -2.172 3.044 1.00 0.00 H new ATOM 0 HA VAL A 101 7.306 -2.090 2.170 1.00 0.00 H new ATOM 0 HB VAL A 101 4.976 -3.526 0.831 1.00 0.00 H new ATOM 0 HG11 VAL A 101 6.719 -4.504 -0.605 1.00 0.00 H new ATOM 0 HG12 VAL A 101 6.662 -2.731 -0.748 1.00 0.00 H new ATOM 0 HG13 VAL A 101 7.946 -3.506 0.210 1.00 0.00 H new ATOM 0 HG21 VAL A 101 6.103 -5.605 1.520 1.00 0.00 H new ATOM 0 HG22 VAL A 101 7.304 -4.651 2.422 1.00 0.00 H new ATOM 0 HG23 VAL A 101 5.596 -4.633 2.922 1.00 0.00 H new ATOM 1488 N TYR A 102 6.858 -0.443 0.318 1.00 0.00 N ATOM 1489 CA TYR A 102 6.625 0.680 -0.582 1.00 0.00 C ATOM 1490 C TYR A 102 7.301 0.447 -1.930 1.00 0.00 C ATOM 1491 O TYR A 102 8.427 -0.047 -1.996 1.00 0.00 O ATOM 1492 CB TYR A 102 7.141 1.977 0.042 1.00 0.00 C ATOM 1493 CG TYR A 102 8.622 2.201 -0.163 1.00 0.00 C ATOM 1494 CD1 TYR A 102 9.106 2.727 -1.354 1.00 0.00 C ATOM 1495 CD2 TYR A 102 9.537 1.887 0.834 1.00 0.00 C ATOM 1496 CE1 TYR A 102 10.459 2.933 -1.547 1.00 0.00 C ATOM 1497 CE2 TYR A 102 10.891 2.090 0.651 1.00 0.00 C ATOM 1498 CZ TYR A 102 11.347 2.614 -0.541 1.00 0.00 C ATOM 1499 OH TYR A 102 12.695 2.817 -0.728 1.00 0.00 O ATOM 0 H TYR A 102 7.830 -0.747 0.370 1.00 0.00 H new ATOM 0 HA TYR A 102 5.551 0.765 -0.744 1.00 0.00 H new ATOM 0 HB2 TYR A 102 6.593 2.818 -0.383 1.00 0.00 H new ATOM 0 HB3 TYR A 102 6.928 1.966 1.111 1.00 0.00 H new ATOM 0 HD1 TYR A 102 8.413 2.979 -2.143 1.00 0.00 H new ATOM 0 HD2 TYR A 102 9.184 1.477 1.769 1.00 0.00 H new ATOM 0 HE1 TYR A 102 10.819 3.341 -2.480 1.00 0.00 H new ATOM 0 HE2 TYR A 102 11.589 1.840 1.437 1.00 0.00 H new ATOM 0 HH TYR A 102 12.872 2.983 -1.677 1.00 0.00 H new ATOM 1509 N PHE A 103 6.606 0.808 -3.004 1.00 0.00 N ATOM 1510 CA PHE A 103 7.138 0.639 -4.351 1.00 0.00 C ATOM 1511 C PHE A 103 8.336 1.555 -4.581 1.00 0.00 C ATOM 1512 O PHE A 103 8.213 2.779 -4.538 1.00 0.00 O ATOM 1513 CB PHE A 103 6.053 0.929 -5.390 1.00 0.00 C ATOM 1514 CG PHE A 103 6.443 0.542 -6.788 1.00 0.00 C ATOM 1515 CD1 PHE A 103 7.482 1.190 -7.436 1.00 0.00 C ATOM 1516 CD2 PHE A 103 5.771 -0.470 -7.454 1.00 0.00 C ATOM 1517 CE1 PHE A 103 7.844 0.836 -8.722 1.00 0.00 C ATOM 1518 CE2 PHE A 103 6.128 -0.829 -8.740 1.00 0.00 C ATOM 1519 CZ PHE A 103 7.166 -0.174 -9.375 1.00 0.00 C ATOM 0 H PHE A 103 5.673 1.219 -2.967 1.00 0.00 H new ATOM 0 HA PHE A 103 7.467 -0.395 -4.458 1.00 0.00 H new ATOM 0 HB2 PHE A 103 5.144 0.394 -5.114 1.00 0.00 H new ATOM 0 HB3 PHE A 103 5.816 1.993 -5.369 1.00 0.00 H new ATOM 0 HD1 PHE A 103 8.015 1.981 -6.930 1.00 0.00 H new ATOM 0 HD2 PHE A 103 4.959 -0.984 -6.962 1.00 0.00 H new ATOM 0 HE1 PHE A 103 8.656 1.349 -9.216 1.00 0.00 H new ATOM 0 HE2 PHE A 103 5.597 -1.620 -9.248 1.00 0.00 H new ATOM 0 HZ PHE A 103 7.446 -0.452 -10.380 1.00 0.00 H new ATOM 1529 N ASP A 104 9.495 0.953 -4.826 1.00 0.00 N ATOM 1530 CA ASP A 104 10.717 1.713 -5.064 1.00 0.00 C ATOM 1531 C ASP A 104 10.924 1.955 -6.556 1.00 0.00 C ATOM 1532 O ASP A 104 11.474 1.111 -7.261 1.00 0.00 O ATOM 1533 CB ASP A 104 11.923 0.975 -4.482 1.00 0.00 C ATOM 1534 CG ASP A 104 13.094 1.900 -4.216 1.00 0.00 C ATOM 1535 OD1 ASP A 104 12.917 2.880 -3.462 1.00 0.00 O ATOM 1536 OD2 ASP A 104 14.188 1.646 -4.762 1.00 0.00 O ATOM 0 H ASP A 104 9.614 -0.059 -4.865 1.00 0.00 H new ATOM 0 HA ASP A 104 10.618 2.679 -4.568 1.00 0.00 H new ATOM 0 HB2 ASP A 104 11.632 0.485 -3.553 1.00 0.00 H new ATOM 0 HB3 ASP A 104 12.233 0.190 -5.172 1.00 0.00 H new ATOM 1541 N GLY A 105 10.479 3.115 -7.029 1.00 0.00 N ATOM 1542 CA GLY A 105 10.623 3.447 -8.435 1.00 0.00 C ATOM 1543 C GLY A 105 12.051 3.799 -8.803 1.00 0.00 C ATOM 1544 O GLY A 105 12.434 3.726 -9.971 1.00 0.00 O ATOM 0 H GLY A 105 10.022 3.831 -6.464 1.00 0.00 H new ATOM 0 HA2 GLY A 105 10.292 2.603 -9.040 1.00 0.00 H new ATOM 0 HA3 GLY A 105 9.971 4.287 -8.676 1.00 0.00 H new ATOM 1548 N ARG A 106 12.840 4.184 -7.805 1.00 0.00 N ATOM 1549 CA ARG A 106 14.233 4.552 -8.031 1.00 0.00 C ATOM 1550 C ARG A 106 15.123 3.313 -8.068 1.00 0.00 C ATOM 1551 O ARG A 106 16.345 3.418 -8.172 1.00 0.00 O ATOM 1552 CB ARG A 106 14.714 5.507 -6.937 1.00 0.00 C ATOM 1553 CG ARG A 106 14.111 6.898 -7.035 1.00 0.00 C ATOM 1554 CD ARG A 106 14.753 7.855 -6.042 1.00 0.00 C ATOM 1555 NE ARG A 106 14.055 7.863 -4.759 1.00 0.00 N ATOM 1556 CZ ARG A 106 14.163 8.844 -3.870 1.00 0.00 C ATOM 1557 NH1 ARG A 106 14.936 9.891 -4.124 1.00 0.00 N ATOM 1558 NH2 ARG A 106 13.496 8.779 -2.725 1.00 0.00 N ATOM 0 H ARG A 106 12.539 4.249 -6.833 1.00 0.00 H new ATOM 0 HA ARG A 106 14.299 5.054 -8.996 1.00 0.00 H new ATOM 0 HB2 ARG A 106 14.470 5.082 -5.963 1.00 0.00 H new ATOM 0 HB3 ARG A 106 15.800 5.587 -6.988 1.00 0.00 H new ATOM 0 HG2 ARG A 106 14.240 7.281 -8.047 1.00 0.00 H new ATOM 0 HG3 ARG A 106 13.038 6.845 -6.849 1.00 0.00 H new ATOM 0 HD2 ARG A 106 15.794 7.571 -5.886 1.00 0.00 H new ATOM 0 HD3 ARG A 106 14.756 8.862 -6.459 1.00 0.00 H new ATOM 0 HE ARG A 106 13.452 7.072 -4.533 1.00 0.00 H new ATOM 0 HH11 ARG A 106 15.449 9.944 -5.004 1.00 0.00 H new ATOM 0 HH12 ARG A 106 15.017 10.643 -3.440 1.00 0.00 H new ATOM 0 HH21 ARG A 106 12.900 7.975 -2.527 1.00 0.00 H new ATOM 0 HH22 ARG A 106 13.579 9.533 -2.043 1.00 0.00 H new ATOM 1572 N SER A 107 14.502 2.141 -7.980 1.00 0.00 N ATOM 1573 CA SER A 107 15.238 0.883 -7.999 1.00 0.00 C ATOM 1574 C SER A 107 15.747 0.572 -9.403 1.00 0.00 C ATOM 1575 O SER A 107 14.977 0.544 -10.363 1.00 0.00 O ATOM 1576 CB SER A 107 14.350 -0.260 -7.502 1.00 0.00 C ATOM 1577 OG SER A 107 14.788 -1.506 -8.013 1.00 0.00 O ATOM 0 H SER A 107 13.491 2.037 -7.895 1.00 0.00 H new ATOM 0 HA SER A 107 16.096 0.983 -7.334 1.00 0.00 H new ATOM 0 HB2 SER A 107 14.362 -0.286 -6.412 1.00 0.00 H new ATOM 0 HB3 SER A 107 13.318 -0.081 -7.806 1.00 0.00 H new ATOM 0 HG SER A 107 14.420 -1.639 -8.911 1.00 0.00 H new ATOM 1583 N GLY A 108 17.051 0.338 -9.515 1.00 0.00 N ATOM 1584 CA GLY A 108 17.642 0.032 -10.805 1.00 0.00 C ATOM 1585 C GLY A 108 16.829 -0.978 -11.590 1.00 0.00 C ATOM 1586 O GLY A 108 16.799 -0.939 -12.821 1.00 0.00 O ATOM 0 H GLY A 108 17.709 0.355 -8.736 1.00 0.00 H new ATOM 0 HA2 GLY A 108 17.734 0.950 -11.386 1.00 0.00 H new ATOM 0 HA3 GLY A 108 18.650 -0.354 -10.657 1.00 0.00 H new ATOM 1590 N ASP A 109 16.169 -1.885 -10.879 1.00 0.00 N ATOM 1591 CA ASP A 109 15.352 -2.911 -11.517 1.00 0.00 C ATOM 1592 C ASP A 109 13.891 -2.779 -11.101 1.00 0.00 C ATOM 1593 O ASP A 109 13.586 -2.309 -10.004 1.00 0.00 O ATOM 1594 CB ASP A 109 15.874 -4.304 -11.159 1.00 0.00 C ATOM 1595 CG ASP A 109 15.227 -5.395 -11.990 1.00 0.00 C ATOM 1596 OD1 ASP A 109 14.824 -5.108 -13.137 1.00 0.00 O ATOM 1597 OD2 ASP A 109 15.124 -6.536 -11.493 1.00 0.00 O ATOM 0 H ASP A 109 16.184 -1.931 -9.860 1.00 0.00 H new ATOM 0 HA ASP A 109 15.417 -2.773 -12.596 1.00 0.00 H new ATOM 0 HB2 ASP A 109 16.954 -4.333 -11.304 1.00 0.00 H new ATOM 0 HB3 ASP A 109 15.689 -4.498 -10.102 1.00 0.00 H new ATOM 1602 N LYS A 110 12.989 -3.194 -11.984 1.00 0.00 N ATOM 1603 CA LYS A 110 11.559 -3.123 -11.710 1.00 0.00 C ATOM 1604 C LYS A 110 11.110 -4.304 -10.855 1.00 0.00 C ATOM 1605 O LYS A 110 10.213 -4.173 -10.022 1.00 0.00 O ATOM 1606 CB LYS A 110 10.768 -3.098 -13.020 1.00 0.00 C ATOM 1607 CG LYS A 110 11.158 -4.204 -13.986 1.00 0.00 C ATOM 1608 CD LYS A 110 10.136 -4.356 -15.100 1.00 0.00 C ATOM 1609 CE LYS A 110 9.036 -5.334 -14.718 1.00 0.00 C ATOM 1610 NZ LYS A 110 9.373 -6.730 -15.114 1.00 0.00 N ATOM 0 H LYS A 110 13.224 -3.584 -12.897 1.00 0.00 H new ATOM 0 HA LYS A 110 11.365 -2.203 -11.159 1.00 0.00 H new ATOM 0 HB2 LYS A 110 9.705 -3.182 -12.795 1.00 0.00 H new ATOM 0 HB3 LYS A 110 10.916 -2.134 -13.506 1.00 0.00 H new ATOM 0 HG2 LYS A 110 12.136 -3.986 -14.415 1.00 0.00 H new ATOM 0 HG3 LYS A 110 11.251 -5.146 -13.445 1.00 0.00 H new ATOM 0 HD2 LYS A 110 9.697 -3.384 -15.328 1.00 0.00 H new ATOM 0 HD3 LYS A 110 10.633 -4.702 -16.006 1.00 0.00 H new ATOM 0 HE2 LYS A 110 8.870 -5.292 -13.642 1.00 0.00 H new ATOM 0 HE3 LYS A 110 8.103 -5.036 -15.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 8.599 -7.366 -14.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 9.506 -6.776 -16.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 10.250 -7.024 -14.638 1.00 0.00 H new ATOM 1624 N SER A 111 11.740 -5.455 -11.065 1.00 0.00 N ATOM 1625 CA SER A 111 11.403 -6.659 -10.315 1.00 0.00 C ATOM 1626 C SER A 111 11.922 -6.570 -8.883 1.00 0.00 C ATOM 1627 O SER A 111 11.526 -7.350 -8.016 1.00 0.00 O ATOM 1628 CB SER A 111 11.986 -7.894 -11.004 1.00 0.00 C ATOM 1629 OG SER A 111 11.809 -9.053 -10.207 1.00 0.00 O ATOM 0 H SER A 111 12.487 -5.579 -11.749 1.00 0.00 H new ATOM 0 HA SER A 111 10.317 -6.747 -10.285 1.00 0.00 H new ATOM 0 HB2 SER A 111 11.504 -8.037 -11.971 1.00 0.00 H new ATOM 0 HB3 SER A 111 13.048 -7.740 -11.197 1.00 0.00 H new ATOM 0 HG SER A 111 11.671 -8.790 -9.273 1.00 0.00 H new ATOM 1635 N LYS A 112 12.811 -5.612 -8.641 1.00 0.00 N ATOM 1636 CA LYS A 112 13.385 -5.418 -7.315 1.00 0.00 C ATOM 1637 C LYS A 112 12.962 -4.073 -6.731 1.00 0.00 C ATOM 1638 O LYS A 112 13.725 -3.432 -6.008 1.00 0.00 O ATOM 1639 CB LYS A 112 14.912 -5.500 -7.380 1.00 0.00 C ATOM 1640 CG LYS A 112 15.432 -6.886 -7.721 1.00 0.00 C ATOM 1641 CD LYS A 112 16.951 -6.921 -7.745 1.00 0.00 C ATOM 1642 CE LYS A 112 17.470 -8.260 -8.247 1.00 0.00 C ATOM 1643 NZ LYS A 112 18.935 -8.224 -8.509 1.00 0.00 N ATOM 0 H LYS A 112 13.149 -4.958 -9.347 1.00 0.00 H new ATOM 0 HA LYS A 112 13.012 -6.210 -6.666 1.00 0.00 H new ATOM 0 HB2 LYS A 112 15.274 -4.792 -8.125 1.00 0.00 H new ATOM 0 HB3 LYS A 112 15.325 -5.192 -6.420 1.00 0.00 H new ATOM 0 HG2 LYS A 112 15.062 -7.605 -6.990 1.00 0.00 H new ATOM 0 HG3 LYS A 112 15.045 -7.192 -8.693 1.00 0.00 H new ATOM 0 HD2 LYS A 112 17.324 -6.122 -8.385 1.00 0.00 H new ATOM 0 HD3 LYS A 112 17.336 -6.733 -6.743 1.00 0.00 H new ATOM 0 HE2 LYS A 112 17.252 -9.033 -7.510 1.00 0.00 H new ATOM 0 HE3 LYS A 112 16.944 -8.533 -9.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 19.322 -9.187 -8.450 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 19.108 -7.839 -9.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 19.400 -7.620 -7.801 1.00 0.00 H new ATOM 1657 N VAL A 113 11.742 -3.653 -7.048 1.00 0.00 N ATOM 1658 CA VAL A 113 11.217 -2.386 -6.553 1.00 0.00 C ATOM 1659 C VAL A 113 10.637 -2.541 -5.152 1.00 0.00 C ATOM 1660 O VAL A 113 10.679 -1.613 -4.345 1.00 0.00 O ATOM 1661 CB VAL A 113 10.129 -1.825 -7.488 1.00 0.00 C ATOM 1662 CG1 VAL A 113 10.681 -1.627 -8.892 1.00 0.00 C ATOM 1663 CG2 VAL A 113 8.918 -2.745 -7.508 1.00 0.00 C ATOM 0 H VAL A 113 11.098 -4.172 -7.646 1.00 0.00 H new ATOM 0 HA VAL A 113 12.054 -1.688 -6.522 1.00 0.00 H new ATOM 0 HB VAL A 113 9.813 -0.854 -7.107 1.00 0.00 H new ATOM 0 HG11 VAL A 113 9.898 -1.230 -9.538 1.00 0.00 H new ATOM 0 HG12 VAL A 113 11.515 -0.926 -8.860 1.00 0.00 H new ATOM 0 HG13 VAL A 113 11.026 -2.583 -9.285 1.00 0.00 H new ATOM 0 HG21 VAL A 113 8.159 -2.333 -8.174 1.00 0.00 H new ATOM 0 HG22 VAL A 113 9.216 -3.731 -7.864 1.00 0.00 H new ATOM 0 HG23 VAL A 113 8.509 -2.831 -6.501 1.00 0.00 H new ATOM 1673 N TRP A 114 10.096 -3.721 -4.870 1.00 0.00 N ATOM 1674 CA TRP A 114 9.506 -3.999 -3.565 1.00 0.00 C ATOM 1675 C TRP A 114 10.544 -3.855 -2.457 1.00 0.00 C ATOM 1676 O TRP A 114 11.565 -4.545 -2.455 1.00 0.00 O ATOM 1677 CB TRP A 114 8.909 -5.406 -3.541 1.00 0.00 C ATOM 1678 CG TRP A 114 7.571 -5.495 -4.211 1.00 0.00 C ATOM 1679 CD1 TRP A 114 7.002 -4.563 -5.032 1.00 0.00 C ATOM 1680 CD2 TRP A 114 6.634 -6.573 -4.115 1.00 0.00 C ATOM 1681 NE1 TRP A 114 5.768 -4.997 -5.451 1.00 0.00 N ATOM 1682 CE2 TRP A 114 5.519 -6.228 -4.904 1.00 0.00 C ATOM 1683 CE3 TRP A 114 6.629 -7.797 -3.441 1.00 0.00 C ATOM 1684 CZ2 TRP A 114 4.413 -7.063 -5.034 1.00 0.00 C ATOM 1685 CZ3 TRP A 114 5.530 -8.625 -3.571 1.00 0.00 C ATOM 1686 CH2 TRP A 114 4.435 -8.255 -4.363 1.00 0.00 C ATOM 0 H TRP A 114 10.054 -4.500 -5.527 1.00 0.00 H new ATOM 0 HA TRP A 114 8.712 -3.273 -3.391 1.00 0.00 H new ATOM 0 HB2 TRP A 114 9.599 -6.094 -4.030 1.00 0.00 H new ATOM 0 HB3 TRP A 114 8.812 -5.734 -2.506 1.00 0.00 H new ATOM 0 HD1 TRP A 114 7.456 -3.623 -5.311 1.00 0.00 H new ATOM 0 HE1 TRP A 114 5.139 -4.485 -6.070 1.00 0.00 H new ATOM 0 HE3 TRP A 114 7.469 -8.091 -2.829 1.00 0.00 H new ATOM 0 HZ2 TRP A 114 3.567 -6.780 -5.643 1.00 0.00 H new ATOM 0 HZ3 TRP A 114 5.515 -9.573 -3.054 1.00 0.00 H new ATOM 0 HH2 TRP A 114 3.591 -8.924 -4.445 1.00 0.00 H new ATOM 1697 N THR A 115 10.278 -2.956 -1.515 1.00 0.00 N ATOM 1698 CA THR A 115 11.190 -2.722 -0.402 1.00 0.00 C ATOM 1699 C THR A 115 10.425 -2.430 0.883 1.00 0.00 C ATOM 1700 O THR A 115 9.448 -1.680 0.881 1.00 0.00 O ATOM 1701 CB THR A 115 12.145 -1.549 -0.695 1.00 0.00 C ATOM 1702 OG1 THR A 115 12.886 -1.808 -1.893 1.00 0.00 O ATOM 1703 CG2 THR A 115 13.105 -1.330 0.464 1.00 0.00 C ATOM 0 H THR A 115 9.438 -2.378 -1.500 1.00 0.00 H new ATOM 0 HA THR A 115 11.774 -3.634 -0.275 1.00 0.00 H new ATOM 0 HB THR A 115 11.547 -0.647 -0.826 1.00 0.00 H new ATOM 0 HG1 THR A 115 12.287 -1.751 -2.667 1.00 0.00 H new ATOM 0 HG21 THR A 115 13.769 -0.497 0.234 1.00 0.00 H new ATOM 0 HG22 THR A 115 12.539 -1.104 1.368 1.00 0.00 H new ATOM 0 HG23 THR A 115 13.696 -2.232 0.622 1.00 0.00 H new ATOM 1711 N THR A 116 10.875 -3.028 1.983 1.00 0.00 N ATOM 1712 CA THR A 116 10.232 -2.833 3.276 1.00 0.00 C ATOM 1713 C THR A 116 10.730 -1.560 3.951 1.00 0.00 C ATOM 1714 O THR A 116 11.833 -1.089 3.673 1.00 0.00 O ATOM 1715 CB THR A 116 10.482 -4.029 4.214 1.00 0.00 C ATOM 1716 OG1 THR A 116 11.888 -4.200 4.425 1.00 0.00 O ATOM 1717 CG2 THR A 116 9.892 -5.305 3.632 1.00 0.00 C ATOM 0 H THR A 116 11.682 -3.651 2.003 1.00 0.00 H new ATOM 0 HA THR A 116 9.162 -2.746 3.087 1.00 0.00 H new ATOM 0 HB THR A 116 9.994 -3.824 5.167 1.00 0.00 H new ATOM 0 HG1 THR A 116 12.289 -4.619 3.635 1.00 0.00 H new ATOM 0 HG21 THR A 116 10.081 -6.136 4.312 1.00 0.00 H new ATOM 0 HG22 THR A 116 8.817 -5.181 3.500 1.00 0.00 H new ATOM 0 HG23 THR A 116 10.355 -5.513 2.667 1.00 0.00 H new ATOM 1725 N ASP A 117 9.911 -1.008 4.839 1.00 0.00 N ATOM 1726 CA ASP A 117 10.269 0.211 5.556 1.00 0.00 C ATOM 1727 C ASP A 117 9.273 0.496 6.675 1.00 0.00 C ATOM 1728 O ASP A 117 8.180 -0.071 6.708 1.00 0.00 O ATOM 1729 CB ASP A 117 10.326 1.397 4.592 1.00 0.00 C ATOM 1730 CG ASP A 117 11.285 2.475 5.056 1.00 0.00 C ATOM 1731 OD1 ASP A 117 10.920 3.239 5.974 1.00 0.00 O ATOM 1732 OD2 ASP A 117 12.401 2.556 4.501 1.00 0.00 O ATOM 0 H ASP A 117 8.994 -1.385 5.080 1.00 0.00 H new ATOM 0 HA ASP A 117 11.254 0.066 6.000 1.00 0.00 H new ATOM 0 HB2 ASP A 117 10.629 1.045 3.606 1.00 0.00 H new ATOM 0 HB3 ASP A 117 9.328 1.823 4.486 1.00 0.00 H new ATOM 1737 N THR A 118 9.657 1.379 7.592 1.00 0.00 N ATOM 1738 CA THR A 118 8.800 1.738 8.714 1.00 0.00 C ATOM 1739 C THR A 118 7.478 2.323 8.230 1.00 0.00 C ATOM 1740 O THR A 118 7.425 2.998 7.201 1.00 0.00 O ATOM 1741 CB THR A 118 9.488 2.754 9.645 1.00 0.00 C ATOM 1742 OG1 THR A 118 8.615 3.096 10.727 1.00 0.00 O ATOM 1743 CG2 THR A 118 9.874 4.012 8.881 1.00 0.00 C ATOM 0 H THR A 118 10.557 1.859 7.579 1.00 0.00 H new ATOM 0 HA THR A 118 8.607 0.821 9.270 1.00 0.00 H new ATOM 0 HB THR A 118 10.394 2.296 10.041 1.00 0.00 H new ATOM 0 HG1 THR A 118 9.060 3.741 11.315 1.00 0.00 H new ATOM 0 HG21 THR A 118 10.358 4.715 9.559 1.00 0.00 H new ATOM 0 HG22 THR A 118 10.561 3.752 8.076 1.00 0.00 H new ATOM 0 HG23 THR A 118 8.979 4.471 8.460 1.00 0.00 H new ATOM 1751 N CYS A 119 6.411 2.062 8.978 1.00 0.00 N ATOM 1752 CA CYS A 119 5.088 2.562 8.626 1.00 0.00 C ATOM 1753 C CYS A 119 4.862 3.956 9.205 1.00 0.00 C ATOM 1754 O CYS A 119 3.731 4.343 9.495 1.00 0.00 O ATOM 1755 CB CYS A 119 4.006 1.607 9.133 1.00 0.00 C ATOM 1756 SG CYS A 119 4.351 -0.151 8.799 1.00 0.00 S ATOM 0 H CYS A 119 6.437 1.506 9.833 1.00 0.00 H new ATOM 0 HA CYS A 119 5.028 2.624 7.539 1.00 0.00 H new ATOM 0 HB2 CYS A 119 3.889 1.746 10.208 1.00 0.00 H new ATOM 0 HB3 CYS A 119 3.055 1.874 8.671 1.00 0.00 H new ATOM 1761 N ALA A 120 5.948 4.706 9.368 1.00 0.00 N ATOM 1762 CA ALA A 120 5.869 6.057 9.909 1.00 0.00 C ATOM 1763 C ALA A 120 6.465 7.072 8.940 1.00 0.00 C ATOM 1764 O ALA A 120 6.267 8.279 9.088 1.00 0.00 O ATOM 1765 CB ALA A 120 6.576 6.129 11.254 1.00 0.00 C ATOM 0 H ALA A 120 6.892 4.400 9.133 1.00 0.00 H new ATOM 0 HA ALA A 120 4.817 6.304 10.051 1.00 0.00 H new ATOM 0 HB1 ALA A 120 6.509 7.144 11.646 1.00 0.00 H new ATOM 0 HB2 ALA A 120 6.102 5.438 11.952 1.00 0.00 H new ATOM 0 HB3 ALA A 120 7.624 5.857 11.129 1.00 0.00 H new ATOM 1771 N THR A 121 7.198 6.576 7.948 1.00 0.00 N ATOM 1772 CA THR A 121 7.825 7.440 6.956 1.00 0.00 C ATOM 1773 C THR A 121 6.788 8.037 6.012 1.00 0.00 C ATOM 1774 O THR A 121 6.012 7.325 5.373 1.00 0.00 O ATOM 1775 CB THR A 121 8.876 6.676 6.129 1.00 0.00 C ATOM 1776 OG1 THR A 121 9.991 6.326 6.956 1.00 0.00 O ATOM 1777 CG2 THR A 121 9.354 7.514 4.953 1.00 0.00 C ATOM 0 H THR A 121 7.372 5.580 7.810 1.00 0.00 H new ATOM 0 HA THR A 121 8.318 8.243 7.504 1.00 0.00 H new ATOM 0 HB THR A 121 8.412 5.769 5.743 1.00 0.00 H new ATOM 0 HG1 THR A 121 10.654 5.839 6.423 1.00 0.00 H new ATOM 0 HG21 THR A 121 10.096 6.953 4.384 1.00 0.00 H new ATOM 0 HG22 THR A 121 8.508 7.753 4.309 1.00 0.00 H new ATOM 0 HG23 THR A 121 9.802 8.437 5.322 1.00 0.00 H new ATOM 1785 N PRO A 122 6.771 9.375 5.919 1.00 0.00 N ATOM 1786 CA PRO A 122 5.834 10.097 5.053 1.00 0.00 C ATOM 1787 C PRO A 122 6.142 9.900 3.573 1.00 0.00 C ATOM 1788 O PRO A 122 7.121 10.439 3.056 1.00 0.00 O ATOM 1789 CB PRO A 122 6.038 11.560 5.452 1.00 0.00 C ATOM 1790 CG PRO A 122 7.425 11.616 5.992 1.00 0.00 C ATOM 1791 CD PRO A 122 7.667 10.286 6.651 1.00 0.00 C ATOM 0 HA PRO A 122 4.810 9.746 5.178 1.00 0.00 H new ATOM 0 HB2 PRO A 122 5.920 12.224 4.596 1.00 0.00 H new ATOM 0 HB3 PRO A 122 5.309 11.872 6.200 1.00 0.00 H new ATOM 0 HG2 PRO A 122 8.147 11.794 5.195 1.00 0.00 H new ATOM 0 HG3 PRO A 122 7.533 12.431 6.707 1.00 0.00 H new ATOM 0 HD2 PRO A 122 8.709 9.979 6.566 1.00 0.00 H new ATOM 0 HD3 PRO A 122 7.429 10.315 7.714 1.00 0.00 H new ATOM 1799 N ARG A 123 5.301 9.124 2.896 1.00 0.00 N ATOM 1800 CA ARG A 123 5.485 8.856 1.475 1.00 0.00 C ATOM 1801 C ARG A 123 4.145 8.855 0.744 1.00 0.00 C ATOM 1802 O ARG A 123 3.086 8.656 1.339 1.00 0.00 O ATOM 1803 CB ARG A 123 6.188 7.512 1.275 1.00 0.00 C ATOM 1804 CG ARG A 123 7.701 7.592 1.401 1.00 0.00 C ATOM 1805 CD ARG A 123 8.381 6.431 0.693 1.00 0.00 C ATOM 1806 NE ARG A 123 9.828 6.443 0.887 1.00 0.00 N ATOM 1807 CZ ARG A 123 10.634 7.352 0.350 1.00 0.00 C ATOM 1808 NH1 ARG A 123 10.137 8.318 -0.410 1.00 0.00 N ATOM 1809 NH2 ARG A 123 11.941 7.297 0.574 1.00 0.00 N ATOM 0 H ARG A 123 4.486 8.670 3.309 1.00 0.00 H new ATOM 0 HA ARG A 123 6.106 9.649 1.058 1.00 0.00 H new ATOM 0 HB2 ARG A 123 5.808 6.800 2.008 1.00 0.00 H new ATOM 0 HB3 ARG A 123 5.934 7.122 0.290 1.00 0.00 H new ATOM 0 HG2 ARG A 123 8.053 8.533 0.979 1.00 0.00 H new ATOM 0 HG3 ARG A 123 7.980 7.591 2.455 1.00 0.00 H new ATOM 0 HD2 ARG A 123 7.973 5.491 1.065 1.00 0.00 H new ATOM 0 HD3 ARG A 123 8.158 6.476 -0.373 1.00 0.00 H new ATOM 0 HE ARG A 123 10.243 5.713 1.467 1.00 0.00 H new ATOM 0 HH11 ARG A 123 9.133 8.365 -0.584 1.00 0.00 H new ATOM 0 HH12 ARG A 123 10.759 9.015 -0.821 1.00 0.00 H new ATOM 0 HH21 ARG A 123 12.327 6.556 1.159 1.00 0.00 H new ATOM 0 HH22 ARG A 123 12.559 7.996 0.161 1.00 0.00 H new ATOM 1823 N PRO A 124 4.192 9.083 -0.577 1.00 0.00 N ATOM 1824 CA PRO A 124 2.991 9.113 -1.418 1.00 0.00 C ATOM 1825 C PRO A 124 2.361 7.734 -1.578 1.00 0.00 C ATOM 1826 O PRO A 124 2.987 6.716 -1.281 1.00 0.00 O ATOM 1827 CB PRO A 124 3.513 9.622 -2.763 1.00 0.00 C ATOM 1828 CG PRO A 124 4.954 9.243 -2.779 1.00 0.00 C ATOM 1829 CD PRO A 124 5.420 9.327 -1.352 1.00 0.00 C ATOM 0 HA PRO A 124 2.207 9.735 -0.987 1.00 0.00 H new ATOM 0 HB2 PRO A 124 2.975 9.167 -3.594 1.00 0.00 H new ATOM 0 HB3 PRO A 124 3.386 10.701 -2.854 1.00 0.00 H new ATOM 0 HG2 PRO A 124 5.088 8.236 -3.175 1.00 0.00 H new ATOM 0 HG3 PRO A 124 5.527 9.916 -3.417 1.00 0.00 H new ATOM 0 HD2 PRO A 124 6.186 8.583 -1.135 1.00 0.00 H new ATOM 0 HD3 PRO A 124 5.850 10.303 -1.127 1.00 0.00 H new ATOM 1837 N PHE A 125 1.119 7.707 -2.050 1.00 0.00 N ATOM 1838 CA PHE A 125 0.403 6.452 -2.249 1.00 0.00 C ATOM 1839 C PHE A 125 -0.563 6.558 -3.426 1.00 0.00 C ATOM 1840 O PHE A 125 -0.765 7.639 -3.981 1.00 0.00 O ATOM 1841 CB PHE A 125 -0.360 6.069 -0.980 1.00 0.00 C ATOM 1842 CG PHE A 125 -1.049 7.229 -0.321 1.00 0.00 C ATOM 1843 CD1 PHE A 125 -0.312 8.245 0.268 1.00 0.00 C ATOM 1844 CD2 PHE A 125 -2.432 7.306 -0.290 1.00 0.00 C ATOM 1845 CE1 PHE A 125 -0.943 9.314 0.876 1.00 0.00 C ATOM 1846 CE2 PHE A 125 -3.068 8.372 0.316 1.00 0.00 C ATOM 1847 CZ PHE A 125 -2.323 9.378 0.899 1.00 0.00 C ATOM 0 H PHE A 125 0.587 8.540 -2.302 1.00 0.00 H new ATOM 0 HA PHE A 125 1.135 5.676 -2.472 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -1.101 5.309 -1.227 1.00 0.00 H new ATOM 0 HB3 PHE A 125 0.334 5.618 -0.271 1.00 0.00 H new ATOM 0 HD1 PHE A 125 0.767 8.201 0.252 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -3.020 6.523 -0.745 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -0.358 10.099 1.333 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -4.147 8.419 0.334 1.00 0.00 H new ATOM 0 HZ PHE A 125 -2.818 10.213 1.372 1.00 0.00 H new ATOM 1857 N ILE A 126 -1.156 5.430 -3.800 1.00 0.00 N ATOM 1858 CA ILE A 126 -2.101 5.395 -4.909 1.00 0.00 C ATOM 1859 C ILE A 126 -3.400 4.706 -4.504 1.00 0.00 C ATOM 1860 O ILE A 126 -3.400 3.539 -4.111 1.00 0.00 O ATOM 1861 CB ILE A 126 -1.508 4.669 -6.131 1.00 0.00 C ATOM 1862 CG1 ILE A 126 -0.412 5.521 -6.775 1.00 0.00 C ATOM 1863 CG2 ILE A 126 -2.601 4.352 -7.141 1.00 0.00 C ATOM 1864 CD1 ILE A 126 0.222 4.874 -7.987 1.00 0.00 C ATOM 0 H ILE A 126 -0.999 4.528 -3.351 1.00 0.00 H new ATOM 0 HA ILE A 126 -2.310 6.431 -5.177 1.00 0.00 H new ATOM 0 HB ILE A 126 -1.065 3.731 -5.798 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -0.834 6.483 -7.066 1.00 0.00 H new ATOM 0 HG13 ILE A 126 0.362 5.723 -6.035 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -2.166 3.839 -7.999 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -3.351 3.711 -6.677 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -3.070 5.278 -7.472 1.00 0.00 H new ATOM 0 HD11 ILE A 126 0.990 5.534 -8.392 1.00 0.00 H new ATOM 0 HD12 ILE A 126 0.674 3.925 -7.698 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -0.541 4.696 -8.745 1.00 0.00 H new ATOM 1876 N CYS A 127 -4.506 5.436 -4.603 1.00 0.00 N ATOM 1877 CA CYS A 127 -5.813 4.896 -4.248 1.00 0.00 C ATOM 1878 C CYS A 127 -6.477 4.241 -5.456 1.00 0.00 C ATOM 1879 O CYS A 127 -6.205 4.607 -6.599 1.00 0.00 O ATOM 1880 CB CYS A 127 -6.712 6.004 -3.696 1.00 0.00 C ATOM 1881 SG CYS A 127 -5.899 7.082 -2.474 1.00 0.00 S ATOM 0 H CYS A 127 -4.523 6.403 -4.926 1.00 0.00 H new ATOM 0 HA CYS A 127 -5.669 4.137 -3.479 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -7.067 6.616 -4.525 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -7.590 5.550 -3.237 1.00 0.00 H new ATOM 1886 N GLN A 128 -7.347 3.272 -5.192 1.00 0.00 N ATOM 1887 CA GLN A 128 -8.049 2.566 -6.258 1.00 0.00 C ATOM 1888 C GLN A 128 -9.406 2.064 -5.776 1.00 0.00 C ATOM 1889 O GLN A 128 -9.503 1.391 -4.749 1.00 0.00 O ATOM 1890 CB GLN A 128 -7.207 1.392 -6.761 1.00 0.00 C ATOM 1891 CG GLN A 128 -7.928 0.517 -7.774 1.00 0.00 C ATOM 1892 CD GLN A 128 -7.240 -0.817 -7.987 1.00 0.00 C ATOM 1893 OE1 GLN A 128 -6.020 -0.882 -8.136 1.00 0.00 O ATOM 1894 NE2 GLN A 128 -8.021 -1.891 -8.002 1.00 0.00 N ATOM 0 H GLN A 128 -7.583 2.958 -4.251 1.00 0.00 H new ATOM 0 HA GLN A 128 -8.211 3.266 -7.078 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -6.293 1.778 -7.212 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -6.909 0.779 -5.911 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -8.950 0.345 -7.437 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -7.991 1.045 -8.725 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -9.028 -1.791 -7.874 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -7.614 -2.816 -8.141 1.00 0.00 H new ATOM 1903 N LYS A 129 -10.454 2.396 -6.523 1.00 0.00 N ATOM 1904 CA LYS A 129 -11.806 1.979 -6.173 1.00 0.00 C ATOM 1905 C LYS A 129 -11.972 0.472 -6.344 1.00 0.00 C ATOM 1906 O LYS A 129 -11.029 -0.229 -6.711 1.00 0.00 O ATOM 1907 CB LYS A 129 -12.830 2.717 -7.040 1.00 0.00 C ATOM 1908 CG LYS A 129 -12.603 2.541 -8.531 1.00 0.00 C ATOM 1909 CD LYS A 129 -13.423 3.533 -9.340 1.00 0.00 C ATOM 1910 CE LYS A 129 -14.848 3.043 -9.543 1.00 0.00 C ATOM 1911 NZ LYS A 129 -14.956 2.113 -10.701 1.00 0.00 N ATOM 0 H LYS A 129 -10.392 2.953 -7.375 1.00 0.00 H new ATOM 0 HA LYS A 129 -11.977 2.229 -5.126 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -13.829 2.362 -6.789 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -12.799 3.780 -6.799 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -11.545 2.672 -8.757 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -12.868 1.525 -8.823 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -13.437 4.496 -8.830 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -12.950 3.693 -10.309 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -15.191 2.539 -8.639 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -15.507 3.897 -9.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -15.950 2.041 -10.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -14.385 2.475 -11.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -14.609 1.173 -10.425 1.00 0.00 H new ATOM 1925 N HIS A 130 -13.178 -0.020 -6.077 1.00 0.00 N ATOM 1926 CA HIS A 130 -13.468 -1.444 -6.204 1.00 0.00 C ATOM 1927 C HIS A 130 -13.682 -1.827 -7.665 1.00 0.00 C ATOM 1928 O HIS A 130 -14.628 -2.541 -7.998 1.00 0.00 O ATOM 1929 CB HIS A 130 -14.704 -1.809 -5.382 1.00 0.00 C ATOM 1930 CG HIS A 130 -14.578 -1.473 -3.928 1.00 0.00 C ATOM 1931 ND1 HIS A 130 -14.373 -0.189 -3.468 1.00 0.00 N ATOM 1932 CD2 HIS A 130 -14.631 -2.261 -2.829 1.00 0.00 C ATOM 1933 CE1 HIS A 130 -14.304 -0.203 -2.149 1.00 0.00 C ATOM 1934 NE2 HIS A 130 -14.458 -1.448 -1.736 1.00 0.00 N ATOM 0 H HIS A 130 -13.970 0.546 -5.772 1.00 0.00 H new ATOM 0 HA HIS A 130 -12.611 -2.000 -5.824 1.00 0.00 H new ATOM 0 HB2 HIS A 130 -15.570 -1.289 -5.793 1.00 0.00 H new ATOM 0 HB3 HIS A 130 -14.896 -2.877 -5.484 1.00 0.00 H new ATOM 0 HD2 HIS A 130 -14.781 -3.330 -2.814 1.00 0.00 H new ATOM 0 HE1 HIS A 130 -14.148 0.658 -1.516 1.00 0.00 H new ATOM 0 HE2 HIS A 130 -14.450 -1.756 -0.763 1.00 0.00 H new ATOM 1943 N ARG A 131 -12.798 -1.347 -8.534 1.00 0.00 N ATOM 1944 CA ARG A 131 -12.892 -1.637 -9.959 1.00 0.00 C ATOM 1945 C ARG A 131 -14.349 -1.696 -10.407 1.00 0.00 C ATOM 1946 O ARG A 131 -14.712 -2.498 -11.269 1.00 0.00 O ATOM 1947 CB ARG A 131 -12.194 -2.961 -10.279 1.00 0.00 C ATOM 1948 CG ARG A 131 -11.749 -3.081 -11.727 1.00 0.00 C ATOM 1949 CD ARG A 131 -10.571 -4.032 -11.870 1.00 0.00 C ATOM 1950 NE ARG A 131 -10.000 -3.997 -13.214 1.00 0.00 N ATOM 1951 CZ ARG A 131 -10.534 -4.625 -14.256 1.00 0.00 C ATOM 1952 NH1 ARG A 131 -11.647 -5.331 -14.110 1.00 0.00 N ATOM 1953 NH2 ARG A 131 -9.956 -4.545 -15.448 1.00 0.00 N ATOM 0 H ARG A 131 -12.008 -0.755 -8.275 1.00 0.00 H new ATOM 0 HA ARG A 131 -12.396 -0.832 -10.502 1.00 0.00 H new ATOM 0 HB2 ARG A 131 -11.325 -3.070 -9.631 1.00 0.00 H new ATOM 0 HB3 ARG A 131 -12.870 -3.784 -10.046 1.00 0.00 H new ATOM 0 HG2 ARG A 131 -12.580 -3.436 -12.336 1.00 0.00 H new ATOM 0 HG3 ARG A 131 -11.472 -2.097 -12.107 1.00 0.00 H new ATOM 0 HD2 ARG A 131 -9.803 -3.770 -11.143 1.00 0.00 H new ATOM 0 HD3 ARG A 131 -10.894 -5.047 -11.640 1.00 0.00 H new ATOM 0 HE ARG A 131 -9.145 -3.461 -13.361 1.00 0.00 H new ATOM 0 HH11 ARG A 131 -12.095 -5.393 -13.196 1.00 0.00 H new ATOM 0 HH12 ARG A 131 -12.055 -5.812 -14.912 1.00 0.00 H new ATOM 0 HH21 ARG A 131 -9.101 -4.001 -15.565 1.00 0.00 H new ATOM 0 HH22 ARG A 131 -10.367 -5.027 -16.247 1.00 0.00 H new ATOM 1967 N TYR A 132 -15.179 -0.844 -9.817 1.00 0.00 N ATOM 1968 CA TYR A 132 -16.597 -0.801 -10.153 1.00 0.00 C ATOM 1969 C TYR A 132 -17.217 0.528 -9.732 1.00 0.00 C ATOM 1970 O TYR A 132 -16.844 1.104 -8.710 1.00 0.00 O ATOM 1971 CB TYR A 132 -17.337 -1.958 -9.478 1.00 0.00 C ATOM 1972 CG TYR A 132 -18.679 -2.264 -10.104 1.00 0.00 C ATOM 1973 CD1 TYR A 132 -19.730 -1.358 -10.020 1.00 0.00 C ATOM 1974 CD2 TYR A 132 -18.897 -3.459 -10.778 1.00 0.00 C ATOM 1975 CE1 TYR A 132 -20.958 -1.634 -10.589 1.00 0.00 C ATOM 1976 CE2 TYR A 132 -20.122 -3.743 -11.352 1.00 0.00 C ATOM 1977 CZ TYR A 132 -21.149 -2.827 -11.254 1.00 0.00 C ATOM 1978 OH TYR A 132 -22.371 -3.107 -11.823 1.00 0.00 O ATOM 0 H TYR A 132 -14.894 -0.173 -9.103 1.00 0.00 H new ATOM 0 HA TYR A 132 -16.691 -0.899 -11.235 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -16.714 -2.851 -9.520 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -17.483 -1.720 -8.424 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -19.584 -0.422 -9.501 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -18.095 -4.179 -10.855 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -21.764 -0.919 -10.514 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -20.274 -4.676 -11.874 1.00 0.00 H new ATOM 0 HH TYR A 132 -22.338 -3.987 -12.254 1.00 0.00 H new ATOM 1988 N ASP A 133 -18.165 1.009 -10.528 1.00 0.00 N ATOM 1989 CA ASP A 133 -18.839 2.269 -10.239 1.00 0.00 C ATOM 1990 C ASP A 133 -20.289 2.029 -9.828 1.00 0.00 C ATOM 1991 O ASP A 133 -21.151 1.784 -10.672 1.00 0.00 O ATOM 1992 CB ASP A 133 -18.789 3.191 -11.459 1.00 0.00 C ATOM 1993 CG ASP A 133 -19.666 4.416 -11.296 1.00 0.00 C ATOM 1994 OD1 ASP A 133 -19.260 5.343 -10.564 1.00 0.00 O ATOM 1995 OD2 ASP A 133 -20.759 4.448 -11.899 1.00 0.00 O ATOM 0 H ASP A 133 -18.484 0.545 -11.379 1.00 0.00 H new ATOM 0 HA ASP A 133 -18.319 2.748 -9.409 1.00 0.00 H new ATOM 0 HB2 ASP A 133 -17.760 3.505 -11.631 1.00 0.00 H new ATOM 0 HB3 ASP A 133 -19.105 2.637 -12.343 1.00 0.00 H new ATOM 2000 N SER A 134 -20.549 2.099 -8.527 1.00 0.00 N ATOM 2001 CA SER A 134 -21.893 1.884 -8.003 1.00 0.00 C ATOM 2002 C SER A 134 -22.403 3.131 -7.287 1.00 0.00 C ATOM 2003 O SER A 134 -21.658 4.089 -7.080 1.00 0.00 O ATOM 2004 CB SER A 134 -21.904 0.692 -7.044 1.00 0.00 C ATOM 2005 OG SER A 134 -21.129 0.958 -5.889 1.00 0.00 O ATOM 0 H SER A 134 -19.847 2.303 -7.816 1.00 0.00 H new ATOM 0 HA SER A 134 -22.554 1.672 -8.843 1.00 0.00 H new ATOM 0 HB2 SER A 134 -22.930 0.465 -6.753 1.00 0.00 H new ATOM 0 HB3 SER A 134 -21.514 -0.190 -7.552 1.00 0.00 H new ATOM 0 HG SER A 134 -21.154 0.181 -5.292 1.00 0.00 H new ATOM 2011 N ASP A 135 -23.677 3.111 -6.914 1.00 0.00 N ATOM 2012 CA ASP A 135 -24.289 4.239 -6.220 1.00 0.00 C ATOM 2013 C ASP A 135 -25.025 3.773 -4.968 1.00 0.00 C ATOM 2014 O ASP A 135 -26.237 3.560 -4.991 1.00 0.00 O ATOM 2015 CB ASP A 135 -25.255 4.974 -7.151 1.00 0.00 C ATOM 2016 CG ASP A 135 -24.634 5.290 -8.498 1.00 0.00 C ATOM 2017 OD1 ASP A 135 -23.914 6.306 -8.596 1.00 0.00 O ATOM 2018 OD2 ASP A 135 -24.867 4.520 -9.453 1.00 0.00 O ATOM 0 H ASP A 135 -24.307 2.326 -7.080 1.00 0.00 H new ATOM 0 HA ASP A 135 -23.495 4.923 -5.919 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -26.146 4.365 -7.299 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -25.578 5.901 -6.677 1.00 0.00 H new ATOM 2023 N HIS A 136 -24.283 3.616 -3.876 1.00 0.00 N ATOM 2024 CA HIS A 136 -24.866 3.174 -2.614 1.00 0.00 C ATOM 2025 C HIS A 136 -25.511 4.342 -1.875 1.00 0.00 C ATOM 2026 O HIS A 136 -26.652 4.250 -1.421 1.00 0.00 O ATOM 2027 CB HIS A 136 -23.796 2.527 -1.733 1.00 0.00 C ATOM 2028 CG HIS A 136 -24.349 1.558 -0.734 1.00 0.00 C ATOM 2029 ND1 HIS A 136 -24.079 0.206 -0.768 1.00 0.00 N ATOM 2030 CD2 HIS A 136 -25.160 1.751 0.332 1.00 0.00 C ATOM 2031 CE1 HIS A 136 -24.701 -0.390 0.234 1.00 0.00 C ATOM 2032 NE2 HIS A 136 -25.364 0.525 0.917 1.00 0.00 N ATOM 0 H HIS A 136 -23.278 3.788 -3.840 1.00 0.00 H new ATOM 0 HA HIS A 136 -25.638 2.437 -2.837 1.00 0.00 H new ATOM 0 HB2 HIS A 136 -23.077 2.010 -2.369 1.00 0.00 H new ATOM 0 HB3 HIS A 136 -23.250 3.309 -1.205 1.00 0.00 H new ATOM 0 HD2 HIS A 136 -25.571 2.694 0.662 1.00 0.00 H new ATOM 0 HE1 HIS A 136 -24.672 -1.446 0.457 1.00 0.00 H new ATOM 0 HE2 HIS A 136 -25.935 0.350 1.744 1.00 0.00 H new ATOM 2041 N LYS A 137 -24.773 5.441 -1.756 1.00 0.00 N ATOM 2042 CA LYS A 137 -25.272 6.629 -1.073 1.00 0.00 C ATOM 2043 C LYS A 137 -25.911 7.598 -2.063 1.00 0.00 C ATOM 2044 O LYS A 137 -25.308 7.990 -3.062 1.00 0.00 O ATOM 2045 CB LYS A 137 -24.136 7.326 -0.322 1.00 0.00 C ATOM 2046 CG LYS A 137 -24.588 8.532 0.483 1.00 0.00 C ATOM 2047 CD LYS A 137 -23.433 9.478 0.767 1.00 0.00 C ATOM 2048 CE LYS A 137 -23.862 10.625 1.669 1.00 0.00 C ATOM 2049 NZ LYS A 137 -22.868 11.734 1.667 1.00 0.00 N ATOM 0 H LYS A 137 -23.826 5.533 -2.124 1.00 0.00 H new ATOM 0 HA LYS A 137 -26.032 6.314 -0.358 1.00 0.00 H new ATOM 0 HB2 LYS A 137 -23.662 6.609 0.349 1.00 0.00 H new ATOM 0 HB3 LYS A 137 -23.378 7.642 -1.039 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -25.368 9.063 -0.062 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -25.026 8.199 1.424 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -22.618 8.928 1.238 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -23.048 9.876 -0.172 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -24.829 11.004 1.339 1.00 0.00 H new ATOM 0 HE3 LYS A 137 -23.994 10.257 2.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 -23.197 12.496 2.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 -21.951 11.379 2.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -22.761 12.103 0.700 1.00 0.00 H new ATOM 2063 N PRO A 138 -27.161 7.995 -1.781 1.00 0.00 N ATOM 2064 CA PRO A 138 -27.908 8.925 -2.633 1.00 0.00 C ATOM 2065 C PRO A 138 -27.341 10.340 -2.583 1.00 0.00 C ATOM 2066 O PRO A 138 -27.088 10.879 -1.507 1.00 0.00 O ATOM 2067 CB PRO A 138 -29.319 8.892 -2.042 1.00 0.00 C ATOM 2068 CG PRO A 138 -29.125 8.494 -0.619 1.00 0.00 C ATOM 2069 CD PRO A 138 -27.941 7.568 -0.607 1.00 0.00 C ATOM 0 HA PRO A 138 -27.865 8.639 -3.684 1.00 0.00 H new ATOM 0 HB2 PRO A 138 -29.803 9.866 -2.118 1.00 0.00 H new ATOM 0 HB3 PRO A 138 -29.953 8.179 -2.570 1.00 0.00 H new ATOM 0 HG2 PRO A 138 -28.945 9.366 0.009 1.00 0.00 H new ATOM 0 HG3 PRO A 138 -30.013 7.997 -0.228 1.00 0.00 H new ATOM 0 HD2 PRO A 138 -27.366 7.663 0.314 1.00 0.00 H new ATOM 0 HD3 PRO A 138 -28.246 6.525 -0.685 1.00 0.00 H new ATOM 2077 N ASN A 139 -27.146 10.936 -3.755 1.00 0.00 N ATOM 2078 CA ASN A 139 -26.610 12.289 -3.844 1.00 0.00 C ATOM 2079 C ASN A 139 -27.727 13.304 -4.064 1.00 0.00 C ATOM 2080 O ASN A 139 -27.958 13.758 -5.185 1.00 0.00 O ATOM 2081 CB ASN A 139 -25.590 12.382 -4.980 1.00 0.00 C ATOM 2082 CG ASN A 139 -26.060 11.676 -6.238 1.00 0.00 C ATOM 2083 OD1 ASN A 139 -26.249 10.460 -6.246 1.00 0.00 O ATOM 2084 ND2 ASN A 139 -26.250 12.439 -7.308 1.00 0.00 N ATOM 0 H ASN A 139 -27.351 10.503 -4.656 1.00 0.00 H new ATOM 0 HA ASN A 139 -26.115 12.519 -2.900 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -25.396 13.431 -5.206 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -24.646 11.947 -4.653 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -26.565 12.021 -8.183 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -26.081 13.443 -7.255 1.00 0.00 H new ATOM 2091 N THR A 140 -28.419 13.657 -2.985 1.00 0.00 N ATOM 2092 CA THR A 140 -29.513 14.618 -3.059 1.00 0.00 C ATOM 2093 C THR A 140 -29.705 15.336 -1.729 1.00 0.00 C ATOM 2094 O THR A 140 -29.496 14.755 -0.663 1.00 0.00 O ATOM 2095 CB THR A 140 -30.835 13.934 -3.457 1.00 0.00 C ATOM 2096 OG1 THR A 140 -31.167 12.918 -2.504 1.00 0.00 O ATOM 2097 CG2 THR A 140 -30.731 13.321 -4.845 1.00 0.00 C ATOM 0 H THR A 140 -28.241 13.292 -2.049 1.00 0.00 H new ATOM 0 HA THR A 140 -29.244 15.345 -3.825 1.00 0.00 H new ATOM 0 HB THR A 140 -31.620 14.690 -3.470 1.00 0.00 H new ATOM 0 HG1 THR A 140 -32.009 12.489 -2.763 1.00 0.00 H new ATOM 0 HG21 THR A 140 -31.676 12.844 -5.104 1.00 0.00 H new ATOM 0 HG22 THR A 140 -30.508 14.102 -5.572 1.00 0.00 H new ATOM 0 HG23 THR A 140 -29.934 12.577 -4.855 1.00 0.00 H new ATOM 2105 N ILE A 141 -30.106 16.601 -1.797 1.00 0.00 N ATOM 2106 CA ILE A 141 -30.328 17.397 -0.596 1.00 0.00 C ATOM 2107 C ILE A 141 -31.790 17.815 -0.476 1.00 0.00 C ATOM 2108 O ILE A 141 -32.279 18.630 -1.257 1.00 0.00 O ATOM 2109 CB ILE A 141 -29.443 18.658 -0.585 1.00 0.00 C ATOM 2110 CG1 ILE A 141 -27.964 18.270 -0.653 1.00 0.00 C ATOM 2111 CG2 ILE A 141 -29.721 19.489 0.658 1.00 0.00 C ATOM 2112 CD1 ILE A 141 -27.046 19.438 -0.937 1.00 0.00 C ATOM 0 H ILE A 141 -30.284 17.097 -2.671 1.00 0.00 H new ATOM 0 HA ILE A 141 -30.061 16.768 0.253 1.00 0.00 H new ATOM 0 HB ILE A 141 -29.682 19.260 -1.462 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -27.673 17.811 0.292 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -27.830 17.516 -1.428 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -29.088 20.376 0.651 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -30.768 19.790 0.667 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -29.506 18.897 1.547 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -26.014 19.090 -0.971 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -27.310 19.884 -1.896 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -27.151 20.184 -0.149 1.00 0.00 H new ATOM 2124 N GLY A 142 -32.482 17.252 0.509 1.00 0.00 N ATOM 2125 CA GLY A 142 -33.880 17.579 0.715 1.00 0.00 C ATOM 2126 C GLY A 142 -34.135 18.212 2.069 1.00 0.00 C ATOM 2127 O GLY A 142 -34.213 17.517 3.082 1.00 0.00 O ATOM 0 H GLY A 142 -32.099 16.575 1.168 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -34.210 18.261 -0.069 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -34.479 16.673 0.622 1.00 0.00 H new ATOM 2131 N ASP A 143 -34.262 19.535 2.087 1.00 0.00 N ATOM 2132 CA ASP A 143 -34.508 20.262 3.326 1.00 0.00 C ATOM 2133 C ASP A 143 -35.717 21.182 3.186 1.00 0.00 C ATOM 2134 O ASP A 143 -36.578 21.230 4.063 1.00 0.00 O ATOM 2135 CB ASP A 143 -33.274 21.077 3.718 1.00 0.00 C ATOM 2136 CG ASP A 143 -32.129 20.203 4.189 1.00 0.00 C ATOM 2137 OD1 ASP A 143 -32.068 19.908 5.401 1.00 0.00 O ATOM 2138 OD2 ASP A 143 -31.293 19.814 3.346 1.00 0.00 O ATOM 0 H ASP A 143 -34.199 20.125 1.257 1.00 0.00 H new ATOM 0 HA ASP A 143 -34.717 19.534 4.110 1.00 0.00 H new ATOM 0 HB2 ASP A 143 -32.947 21.670 2.864 1.00 0.00 H new ATOM 0 HB3 ASP A 143 -33.541 21.778 4.509 1.00 0.00 H new ATOM 2143 N ALA A 144 -35.773 21.911 2.076 1.00 0.00 N ATOM 2144 CA ALA A 144 -36.876 22.829 1.820 1.00 0.00 C ATOM 2145 C ALA A 144 -37.206 23.650 3.062 1.00 0.00 C ATOM 2146 O ALA A 144 -38.375 23.865 3.383 1.00 0.00 O ATOM 2147 CB ALA A 144 -38.103 22.061 1.351 1.00 0.00 C ATOM 0 H ALA A 144 -35.067 21.884 1.340 1.00 0.00 H new ATOM 0 HA ALA A 144 -36.569 23.517 1.033 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -38.919 22.759 1.163 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -37.867 21.524 0.433 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -38.403 21.350 2.121 1.00 0.00 H new ATOM 2153 N SER A 145 -36.169 24.107 3.757 1.00 0.00 N ATOM 2154 CA SER A 145 -36.350 24.901 4.966 1.00 0.00 C ATOM 2155 C SER A 145 -35.656 26.254 4.837 1.00 0.00 C ATOM 2156 O SER A 145 -34.624 26.374 4.178 1.00 0.00 O ATOM 2157 CB SER A 145 -35.804 24.149 6.182 1.00 0.00 C ATOM 2158 OG SER A 145 -36.459 22.904 6.348 1.00 0.00 O ATOM 0 H SER A 145 -35.195 23.941 3.503 1.00 0.00 H new ATOM 0 HA SER A 145 -37.418 25.072 5.102 1.00 0.00 H new ATOM 0 HB2 SER A 145 -34.733 23.987 6.062 1.00 0.00 H new ATOM 0 HB3 SER A 145 -35.936 24.755 7.078 1.00 0.00 H new ATOM 0 HG SER A 145 -36.347 22.365 5.537 1.00 0.00 H new ATOM 2164 N GLY A 146 -36.232 27.271 5.471 1.00 0.00 N ATOM 2165 CA GLY A 146 -35.657 28.602 5.415 1.00 0.00 C ATOM 2166 C GLY A 146 -36.647 29.679 5.812 1.00 0.00 C ATOM 2167 O GLY A 146 -36.990 30.559 5.022 1.00 0.00 O ATOM 0 H GLY A 146 -37.087 27.197 6.022 1.00 0.00 H new ATOM 0 HA2 GLY A 146 -34.791 28.648 6.075 1.00 0.00 H new ATOM 0 HA3 GLY A 146 -35.298 28.797 4.404 1.00 0.00 H new ATOM 2171 N PRO A 147 -37.125 29.616 7.063 1.00 0.00 N ATOM 2172 CA PRO A 147 -38.090 30.585 7.592 1.00 0.00 C ATOM 2173 C PRO A 147 -37.474 31.965 7.792 1.00 0.00 C ATOM 2174 O PRO A 147 -36.272 32.153 7.601 1.00 0.00 O ATOM 2175 CB PRO A 147 -38.498 29.981 8.938 1.00 0.00 C ATOM 2176 CG PRO A 147 -37.342 29.131 9.338 1.00 0.00 C ATOM 2177 CD PRO A 147 -36.761 28.594 8.059 1.00 0.00 C ATOM 0 HA PRO A 147 -38.925 30.743 6.910 1.00 0.00 H new ATOM 0 HB2 PRO A 147 -38.693 30.758 9.678 1.00 0.00 H new ATOM 0 HB3 PRO A 147 -39.410 29.391 8.847 1.00 0.00 H new ATOM 0 HG2 PRO A 147 -36.602 29.712 9.889 1.00 0.00 H new ATOM 0 HG3 PRO A 147 -37.662 28.320 9.992 1.00 0.00 H new ATOM 0 HD2 PRO A 147 -35.681 28.469 8.130 1.00 0.00 H new ATOM 0 HD3 PRO A 147 -37.179 27.620 7.806 1.00 0.00 H new ATOM 2185 N SER A 148 -38.305 32.929 8.178 1.00 0.00 N ATOM 2186 CA SER A 148 -37.842 34.293 8.401 1.00 0.00 C ATOM 2187 C SER A 148 -38.898 35.112 9.137 1.00 0.00 C ATOM 2188 O SER A 148 -40.035 35.232 8.681 1.00 0.00 O ATOM 2189 CB SER A 148 -37.499 34.962 7.068 1.00 0.00 C ATOM 2190 OG SER A 148 -36.157 34.699 6.696 1.00 0.00 O ATOM 0 H SER A 148 -39.302 32.790 8.343 1.00 0.00 H new ATOM 0 HA SER A 148 -36.945 34.249 9.019 1.00 0.00 H new ATOM 0 HB2 SER A 148 -38.173 34.599 6.292 1.00 0.00 H new ATOM 0 HB3 SER A 148 -37.654 36.038 7.147 1.00 0.00 H new ATOM 0 HG SER A 148 -35.922 33.781 6.947 1.00 0.00 H new ATOM 2196 N SER A 149 -38.513 35.673 10.279 1.00 0.00 N ATOM 2197 CA SER A 149 -39.427 36.477 11.081 1.00 0.00 C ATOM 2198 C SER A 149 -39.023 37.948 11.054 1.00 0.00 C ATOM 2199 O SER A 149 -37.910 38.305 11.438 1.00 0.00 O ATOM 2200 CB SER A 149 -39.454 35.970 12.524 1.00 0.00 C ATOM 2201 OG SER A 149 -40.594 36.453 13.214 1.00 0.00 O ATOM 0 H SER A 149 -37.575 35.585 10.669 1.00 0.00 H new ATOM 0 HA SER A 149 -40.425 36.384 10.652 1.00 0.00 H new ATOM 0 HB2 SER A 149 -39.457 34.880 12.530 1.00 0.00 H new ATOM 0 HB3 SER A 149 -38.550 36.289 13.042 1.00 0.00 H new ATOM 0 HG SER A 149 -40.588 36.113 14.133 1.00 0.00 H new ATOM 2207 N GLY A 150 -39.938 38.799 10.598 1.00 0.00 N ATOM 2208 CA GLY A 150 -39.659 40.221 10.529 1.00 0.00 C ATOM 2209 C GLY A 150 -40.819 41.013 9.959 1.00 0.00 C ATOM 2210 O GLY A 150 -41.905 40.471 9.749 1.00 0.00 O ATOM 0 H GLY A 150 -40.867 38.528 10.275 1.00 0.00 H new ATOM 0 HA2 GLY A 150 -39.426 40.591 11.527 1.00 0.00 H new ATOM 0 HA3 GLY A 150 -38.774 40.385 9.914 1.00 0.00 H new TER 2214 GLY A 150