USER MOD reduce.3.24.130724 H: found=0, std=0, add=1037, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 1034 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 5 LYS NZ :NH3+ -140:sc= -0.195 (180deg=-0.254) USER MOD Set 1.2: A 29 GLN : amide:sc= -0.0204 X(o=-0.22,f=-0.16) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 3 ASN : amide:sc= -1.35 K(o=-1.4,f=0.66) USER MOD Single : A 12 GLN : amide:sc= -0.132 X(o=-0.13,f=-0.016) USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 ASN : amide:sc= -0.0944 K(o=-0.094,f=-1.9) USER MOD Single : A 24 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot 46:sc= 1.08 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 GLN : amide:sc= -6.78! C(o=-6.8!,f=-9.9!) USER MOD Single : A 35 ASN : amide:sc= -1.15 K(o=-1.2,f=-3.7!) USER MOD Single : A 38 GLN : amide:sc= -0.0426 K(o=-0.043,f=-1) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.205 USER MOD Single : A 45 LYS NZ :NH3+ -160:sc= 0 (180deg=-0.352) USER MOD Single : A 55 MET CE :methyl 147:sc= -12.9! (180deg=-16.5!) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 MET CE :methyl -108:sc= -1.96 (180deg=-3.89!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= -0.122 K(o=-0.12,f=-2.1!) USER MOD Single : A 81 MET CE :methyl -136:sc= -8.85! (180deg=-16.1!) USER MOD Single : A 82 THR OG1 : rot -162:sc= 0.368 USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 MET CE :methyl 172:sc= -6.25! (180deg=-6.49!) USER MOD Single : A 91 GLN : amide:sc= -0.353 K(o=-0.35,f=-2.8!) USER MOD Single : A 93 SER OG : rot -67:sc= -0.86 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 THR OG1 : rot 48:sc= 0.214! USER MOD Single : A 101 HIS : no HD1:sc= -8.33! C(o=-8.3!,f=-7.5!) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ -158:sc= -0.0411 (180deg=-0.328) USER MOD Single : A 118 TYR OH : rot -145:sc= -3.75! USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 SER OG : rot 32:sc= 0.211 USER MOD Single : A 124 ASN : amide:sc= 0 X(o=0,f=-0.0007) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -9.363 -16.498 15.102 1.00 0.00 N ATOM 2 CA MET A 1 -8.288 -15.879 14.346 1.00 0.00 C ATOM 3 C MET A 1 -8.189 -14.383 14.656 1.00 0.00 C ATOM 4 O MET A 1 -7.288 -13.953 15.373 1.00 0.00 O ATOM 5 CB MET A 1 -8.538 -16.074 12.849 1.00 0.00 C ATOM 6 CG MET A 1 -7.722 -17.249 12.306 1.00 0.00 C ATOM 7 SD MET A 1 -7.693 -17.199 10.522 1.00 0.00 S ATOM 8 CE MET A 1 -6.020 -17.746 10.224 1.00 0.00 C ATOM 0 H1 MET A 1 -9.409 -17.512 14.874 1.00 0.00 H new ATOM 0 H2 MET A 1 -9.184 -16.380 16.120 1.00 0.00 H new ATOM 0 H3 MET A 1 -10.266 -16.046 14.854 1.00 0.00 H new ATOM 0 HA MET A 1 -7.349 -16.353 14.632 1.00 0.00 H new ATOM 0 HB2 MET A 1 -9.599 -16.252 12.674 1.00 0.00 H new ATOM 0 HB3 MET A 1 -8.274 -15.164 12.311 1.00 0.00 H new ATOM 0 HG2 MET A 1 -6.705 -17.207 12.696 1.00 0.00 H new ATOM 0 HG3 MET A 1 -8.155 -18.190 12.645 1.00 0.00 H new ATOM 0 HE1 MET A 1 -5.832 -17.773 9.151 1.00 0.00 H new ATOM 0 HE2 MET A 1 -5.322 -17.056 10.698 1.00 0.00 H new ATOM 0 HE3 MET A 1 -5.884 -18.744 10.641 1.00 0.00 H new ATOM 18 N MET A 2 -9.129 -13.633 14.100 1.00 0.00 N ATOM 19 CA MET A 2 -9.160 -12.196 14.308 1.00 0.00 C ATOM 20 C MET A 2 -7.745 -11.613 14.320 1.00 0.00 C ATOM 21 O MET A 2 -7.093 -11.578 15.362 1.00 0.00 O ATOM 22 CB MET A 2 -9.850 -11.887 15.638 1.00 0.00 C ATOM 23 CG MET A 2 -11.372 -11.958 15.496 1.00 0.00 C ATOM 24 SD MET A 2 -12.154 -11.257 16.939 1.00 0.00 S ATOM 25 CE MET A 2 -13.626 -10.576 16.194 1.00 0.00 C ATOM 0 H MET A 2 -9.875 -13.994 13.505 1.00 0.00 H new ATOM 0 HA MET A 2 -9.714 -11.741 13.487 1.00 0.00 H new ATOM 0 HB2 MET A 2 -9.519 -12.596 16.397 1.00 0.00 H new ATOM 0 HB3 MET A 2 -9.559 -10.894 15.981 1.00 0.00 H new ATOM 0 HG2 MET A 2 -11.688 -11.418 14.603 1.00 0.00 H new ATOM 0 HG3 MET A 2 -11.686 -12.994 15.370 1.00 0.00 H new ATOM 0 HE1 MET A 2 -14.234 -10.097 16.961 1.00 0.00 H new ATOM 0 HE2 MET A 2 -13.345 -9.840 15.441 1.00 0.00 H new ATOM 0 HE3 MET A 2 -14.199 -11.375 15.724 1.00 0.00 H new ATOM 35 N ASN A 3 -7.312 -11.170 13.149 1.00 0.00 N ATOM 36 CA ASN A 3 -5.987 -10.591 13.011 1.00 0.00 C ATOM 37 C ASN A 3 -5.894 -9.852 11.675 1.00 0.00 C ATOM 38 O ASN A 3 -6.750 -10.020 10.807 1.00 0.00 O ATOM 39 CB ASN A 3 -4.907 -11.675 13.027 1.00 0.00 C ATOM 40 CG ASN A 3 -4.122 -11.648 14.340 1.00 0.00 C ATOM 41 OD1 ASN A 3 -4.671 -11.762 15.424 1.00 0.00 O ATOM 42 ND2 ASN A 3 -2.811 -11.491 14.182 1.00 0.00 N ATOM 0 H ASN A 3 -7.856 -11.200 12.287 1.00 0.00 H new ATOM 0 HA ASN A 3 -5.828 -9.911 13.848 1.00 0.00 H new ATOM 0 HB2 ASN A 3 -5.367 -12.654 12.895 1.00 0.00 H new ATOM 0 HB3 ASN A 3 -4.226 -11.527 12.189 1.00 0.00 H new ATOM 0 HD21 ASN A 3 -2.199 -11.460 14.998 1.00 0.00 H new ATOM 0 HD22 ASN A 3 -2.417 -11.402 13.245 1.00 0.00 H new ATOM 49 N GLU A 4 -4.848 -9.048 11.551 1.00 0.00 N ATOM 50 CA GLU A 4 -4.633 -8.282 10.335 1.00 0.00 C ATOM 51 C GLU A 4 -3.333 -7.482 10.434 1.00 0.00 C ATOM 52 O GLU A 4 -2.898 -7.131 11.530 1.00 0.00 O ATOM 53 CB GLU A 4 -5.822 -7.362 10.048 1.00 0.00 C ATOM 54 CG GLU A 4 -6.076 -7.248 8.544 1.00 0.00 C ATOM 55 CD GLU A 4 -7.499 -7.689 8.193 1.00 0.00 C ATOM 56 OE1 GLU A 4 -7.850 -8.827 8.574 1.00 0.00 O ATOM 57 OE2 GLU A 4 -8.203 -6.878 7.553 1.00 0.00 O ATOM 0 H GLU A 4 -4.140 -8.910 12.273 1.00 0.00 H new ATOM 0 HA GLU A 4 -4.546 -8.979 9.501 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -6.713 -7.748 10.543 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -5.630 -6.373 10.464 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -5.921 -6.218 8.222 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -5.357 -7.863 8.003 1.00 0.00 H new ATOM 64 N LYS A 5 -2.748 -7.217 9.275 1.00 0.00 N ATOM 65 CA LYS A 5 -1.506 -6.465 9.218 1.00 0.00 C ATOM 66 C LYS A 5 -1.541 -5.521 8.015 1.00 0.00 C ATOM 67 O LYS A 5 -2.155 -5.832 6.995 1.00 0.00 O ATOM 68 CB LYS A 5 -0.305 -7.413 9.221 1.00 0.00 C ATOM 69 CG LYS A 5 -0.042 -7.962 10.625 1.00 0.00 C ATOM 70 CD LYS A 5 -0.156 -9.487 10.648 1.00 0.00 C ATOM 71 CE LYS A 5 1.139 -10.142 10.165 1.00 0.00 C ATOM 72 NZ LYS A 5 2.035 -10.425 11.309 1.00 0.00 N ATOM 0 H LYS A 5 -3.111 -7.510 8.368 1.00 0.00 H new ATOM 0 HA LYS A 5 -1.395 -5.845 10.107 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -0.487 -8.238 8.532 1.00 0.00 H new ATOM 0 HB3 LYS A 5 0.579 -6.887 8.861 1.00 0.00 H new ATOM 0 HG2 LYS A 5 0.953 -7.663 10.956 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -0.755 -7.530 11.328 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -0.382 -9.823 11.660 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -0.985 -9.803 10.015 1.00 0.00 H new ATOM 0 HE2 LYS A 5 0.910 -11.068 9.637 1.00 0.00 H new ATOM 0 HE3 LYS A 5 1.642 -9.486 9.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 3.017 -10.212 11.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 1.761 -9.833 12.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 1.957 -11.428 11.571 1.00 0.00 H new ATOM 86 N ILE A 6 -0.875 -4.387 8.174 1.00 0.00 N ATOM 87 CA ILE A 6 -0.823 -3.395 7.113 1.00 0.00 C ATOM 88 C ILE A 6 0.429 -2.532 7.289 1.00 0.00 C ATOM 89 O ILE A 6 0.695 -2.033 8.381 1.00 0.00 O ATOM 90 CB ILE A 6 -2.123 -2.590 7.067 1.00 0.00 C ATOM 91 CG1 ILE A 6 -3.048 -3.106 5.963 1.00 0.00 C ATOM 92 CG2 ILE A 6 -1.837 -1.094 6.923 1.00 0.00 C ATOM 93 CD1 ILE A 6 -4.515 -3.016 6.391 1.00 0.00 C ATOM 0 H ILE A 6 -0.367 -4.133 9.021 1.00 0.00 H new ATOM 0 HA ILE A 6 -0.742 -3.881 6.141 1.00 0.00 H new ATOM 0 HB ILE A 6 -2.644 -2.728 8.014 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -2.894 -2.525 5.054 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -2.797 -4.140 5.727 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -2.778 -0.545 6.893 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -1.245 -0.753 7.773 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -1.284 -0.916 6.001 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -5.152 -3.389 5.589 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -4.670 -3.617 7.287 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -4.769 -1.977 6.603 1.00 0.00 H new ATOM 105 N LEU A 7 1.164 -2.383 6.197 1.00 0.00 N ATOM 106 CA LEU A 7 2.381 -1.589 6.216 1.00 0.00 C ATOM 107 C LEU A 7 2.141 -0.278 5.466 1.00 0.00 C ATOM 108 O LEU A 7 1.445 -0.257 4.452 1.00 0.00 O ATOM 109 CB LEU A 7 3.559 -2.401 5.675 1.00 0.00 C ATOM 110 CG LEU A 7 4.813 -2.429 6.551 1.00 0.00 C ATOM 111 CD1 LEU A 7 4.829 -3.669 7.447 1.00 0.00 C ATOM 112 CD2 LEU A 7 6.080 -2.321 5.699 1.00 0.00 C ATOM 0 H LEU A 7 0.940 -2.799 5.293 1.00 0.00 H new ATOM 0 HA LEU A 7 2.649 -1.326 7.239 1.00 0.00 H new ATOM 0 HB2 LEU A 7 3.226 -3.427 5.519 1.00 0.00 H new ATOM 0 HB3 LEU A 7 3.831 -2.002 4.698 1.00 0.00 H new ATOM 0 HG LEU A 7 4.791 -1.559 7.207 1.00 0.00 H new ATOM 0 HD11 LEU A 7 5.731 -3.664 8.059 1.00 0.00 H new ATOM 0 HD12 LEU A 7 3.952 -3.662 8.094 1.00 0.00 H new ATOM 0 HD13 LEU A 7 4.816 -4.566 6.827 1.00 0.00 H new ATOM 0 HD21 LEU A 7 6.957 -2.343 6.346 1.00 0.00 H new ATOM 0 HD22 LEU A 7 6.122 -3.158 5.002 1.00 0.00 H new ATOM 0 HD23 LEU A 7 6.065 -1.385 5.141 1.00 0.00 H new ATOM 124 N ILE A 8 2.732 0.785 5.992 1.00 0.00 N ATOM 125 CA ILE A 8 2.591 2.097 5.385 1.00 0.00 C ATOM 126 C ILE A 8 3.970 2.611 4.966 1.00 0.00 C ATOM 127 O ILE A 8 4.768 3.016 5.809 1.00 0.00 O ATOM 128 CB ILE A 8 1.841 3.045 6.323 1.00 0.00 C ATOM 129 CG1 ILE A 8 0.398 2.583 6.530 1.00 0.00 C ATOM 130 CG2 ILE A 8 1.915 4.488 5.819 1.00 0.00 C ATOM 131 CD1 ILE A 8 -0.109 2.970 7.921 1.00 0.00 C ATOM 0 H ILE A 8 3.310 0.764 6.832 1.00 0.00 H new ATOM 0 HA ILE A 8 1.985 2.035 4.481 1.00 0.00 H new ATOM 0 HB ILE A 8 2.330 3.019 7.297 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -0.243 3.028 5.769 1.00 0.00 H new ATOM 0 HG13 ILE A 8 0.337 1.502 6.405 1.00 0.00 H new ATOM 0 HG21 ILE A 8 1.374 5.141 6.504 1.00 0.00 H new ATOM 0 HG22 ILE A 8 2.957 4.802 5.766 1.00 0.00 H new ATOM 0 HG23 ILE A 8 1.466 4.551 4.828 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -1.137 2.629 8.041 1.00 0.00 H new ATOM 0 HD12 ILE A 8 0.519 2.503 8.680 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -0.070 4.053 8.034 1.00 0.00 H new ATOM 143 N VAL A 9 4.209 2.576 3.663 1.00 0.00 N ATOM 144 CA VAL A 9 5.477 3.033 3.122 1.00 0.00 C ATOM 145 C VAL A 9 5.293 4.420 2.503 1.00 0.00 C ATOM 146 O VAL A 9 4.386 4.630 1.699 1.00 0.00 O ATOM 147 CB VAL A 9 6.024 2.004 2.130 1.00 0.00 C ATOM 148 CG1 VAL A 9 7.413 2.408 1.631 1.00 0.00 C ATOM 149 CG2 VAL A 9 6.049 0.605 2.749 1.00 0.00 C ATOM 0 H VAL A 9 3.545 2.238 2.966 1.00 0.00 H new ATOM 0 HA VAL A 9 6.219 3.127 3.915 1.00 0.00 H new ATOM 0 HB VAL A 9 5.354 1.978 1.271 1.00 0.00 H new ATOM 0 HG11 VAL A 9 7.779 1.660 0.928 1.00 0.00 H new ATOM 0 HG12 VAL A 9 7.353 3.376 1.133 1.00 0.00 H new ATOM 0 HG13 VAL A 9 8.098 2.476 2.476 1.00 0.00 H new ATOM 0 HG21 VAL A 9 6.442 -0.107 2.023 1.00 0.00 H new ATOM 0 HG22 VAL A 9 6.686 0.610 3.634 1.00 0.00 H new ATOM 0 HG23 VAL A 9 5.037 0.314 3.032 1.00 0.00 H new ATOM 159 N ASP A 10 6.168 5.332 2.902 1.00 0.00 N ATOM 160 CA ASP A 10 6.114 6.693 2.397 1.00 0.00 C ATOM 161 C ASP A 10 4.659 7.166 2.374 1.00 0.00 C ATOM 162 O ASP A 10 3.790 6.542 2.982 1.00 0.00 O ATOM 163 CB ASP A 10 6.659 6.773 0.970 1.00 0.00 C ATOM 164 CG ASP A 10 7.436 8.051 0.645 1.00 0.00 C ATOM 165 OD1 ASP A 10 8.666 8.038 0.866 1.00 0.00 O ATOM 166 OD2 ASP A 10 6.782 9.011 0.184 1.00 0.00 O ATOM 0 H ASP A 10 6.919 5.154 3.570 1.00 0.00 H new ATOM 0 HA ASP A 10 6.721 7.320 3.051 1.00 0.00 H new ATOM 0 HB2 ASP A 10 7.310 5.916 0.797 1.00 0.00 H new ATOM 0 HB3 ASP A 10 5.825 6.685 0.273 1.00 0.00 H new ATOM 171 N ASP A 11 4.438 8.265 1.668 1.00 0.00 N ATOM 172 CA ASP A 11 3.103 8.829 1.558 1.00 0.00 C ATOM 173 C ASP A 11 2.628 9.275 2.942 1.00 0.00 C ATOM 174 O ASP A 11 1.463 9.628 3.118 1.00 0.00 O ATOM 175 CB ASP A 11 2.110 7.793 1.028 1.00 0.00 C ATOM 176 CG ASP A 11 0.681 8.306 0.838 1.00 0.00 C ATOM 177 OD1 ASP A 11 0.547 9.428 0.304 1.00 0.00 O ATOM 178 OD2 ASP A 11 -0.245 7.564 1.231 1.00 0.00 O ATOM 0 H ASP A 11 5.161 8.780 1.166 1.00 0.00 H new ATOM 0 HA ASP A 11 3.148 9.671 0.868 1.00 0.00 H new ATOM 0 HB2 ASP A 11 2.475 7.417 0.072 1.00 0.00 H new ATOM 0 HB3 ASP A 11 2.088 6.948 1.716 1.00 0.00 H new ATOM 183 N GLN A 12 3.554 9.245 3.889 1.00 0.00 N ATOM 184 CA GLN A 12 3.244 9.642 5.252 1.00 0.00 C ATOM 185 C GLN A 12 3.170 11.167 5.357 1.00 0.00 C ATOM 186 O GLN A 12 4.179 11.852 5.198 1.00 0.00 O ATOM 187 CB GLN A 12 4.268 9.073 6.235 1.00 0.00 C ATOM 188 CG GLN A 12 5.693 9.245 5.704 1.00 0.00 C ATOM 189 CD GLN A 12 6.688 9.425 6.852 1.00 0.00 C ATOM 190 OE1 GLN A 12 7.591 8.630 7.055 1.00 0.00 O ATOM 191 NE2 GLN A 12 6.473 10.511 7.589 1.00 0.00 N ATOM 0 H GLN A 12 4.519 8.952 3.739 1.00 0.00 H new ATOM 0 HA GLN A 12 2.269 9.232 5.517 1.00 0.00 H new ATOM 0 HB2 GLN A 12 4.172 9.576 7.197 1.00 0.00 H new ATOM 0 HB3 GLN A 12 4.065 8.016 6.406 1.00 0.00 H new ATOM 0 HG2 GLN A 12 5.971 8.374 5.110 1.00 0.00 H new ATOM 0 HG3 GLN A 12 5.736 10.110 5.042 1.00 0.00 H new ATOM 0 HE21 GLN A 12 5.698 11.135 7.364 1.00 0.00 H new ATOM 0 HE22 GLN A 12 7.083 10.720 8.379 1.00 0.00 H new ATOM 200 N TYR A 13 1.967 11.652 5.623 1.00 0.00 N ATOM 201 CA TYR A 13 1.749 13.083 5.751 1.00 0.00 C ATOM 202 C TYR A 13 0.453 13.375 6.511 1.00 0.00 C ATOM 203 O TYR A 13 -0.180 14.407 6.292 1.00 0.00 O ATOM 204 CB TYR A 13 1.622 13.620 4.324 1.00 0.00 C ATOM 205 CG TYR A 13 2.589 14.759 3.999 1.00 0.00 C ATOM 206 CD1 TYR A 13 2.329 16.036 4.454 1.00 0.00 C ATOM 207 CD2 TYR A 13 3.722 14.511 3.251 1.00 0.00 C ATOM 208 CE1 TYR A 13 3.240 17.109 4.148 1.00 0.00 C ATOM 209 CE2 TYR A 13 4.632 15.583 2.944 1.00 0.00 C ATOM 210 CZ TYR A 13 4.347 16.829 3.408 1.00 0.00 C ATOM 211 OH TYR A 13 5.207 17.843 3.119 1.00 0.00 O ATOM 0 H TYR A 13 1.133 11.080 5.754 1.00 0.00 H new ATOM 0 HA TYR A 13 2.567 13.548 6.301 1.00 0.00 H new ATOM 0 HB2 TYR A 13 1.791 12.803 3.623 1.00 0.00 H new ATOM 0 HB3 TYR A 13 0.601 13.968 4.167 1.00 0.00 H new ATOM 0 HD1 TYR A 13 1.443 16.231 5.039 1.00 0.00 H new ATOM 0 HD2 TYR A 13 3.926 13.512 2.896 1.00 0.00 H new ATOM 0 HE1 TYR A 13 3.049 18.113 4.498 1.00 0.00 H new ATOM 0 HE2 TYR A 13 5.521 15.402 2.358 1.00 0.00 H new ATOM 0 HH TYR A 13 5.953 17.497 2.585 1.00 0.00 H new ATOM 221 N GLY A 14 0.097 12.447 7.387 1.00 0.00 N ATOM 222 CA GLY A 14 -1.112 12.592 8.181 1.00 0.00 C ATOM 223 C GLY A 14 -2.205 11.640 7.692 1.00 0.00 C ATOM 224 O GLY A 14 -3.256 11.521 8.320 1.00 0.00 O ATOM 0 H GLY A 14 0.624 11.592 7.565 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -0.890 12.389 9.229 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -1.468 13.621 8.124 1.00 0.00 H new ATOM 228 N ILE A 15 -1.921 10.987 6.574 1.00 0.00 N ATOM 229 CA ILE A 15 -2.867 10.050 5.994 1.00 0.00 C ATOM 230 C ILE A 15 -2.598 8.650 6.550 1.00 0.00 C ATOM 231 O ILE A 15 -3.532 7.909 6.854 1.00 0.00 O ATOM 232 CB ILE A 15 -2.824 10.122 4.466 1.00 0.00 C ATOM 233 CG1 ILE A 15 -3.517 11.389 3.958 1.00 0.00 C ATOM 234 CG2 ILE A 15 -3.413 8.856 3.840 1.00 0.00 C ATOM 235 CD1 ILE A 15 -2.504 12.512 3.728 1.00 0.00 C ATOM 0 H ILE A 15 -1.049 11.089 6.055 1.00 0.00 H new ATOM 0 HA ILE A 15 -3.886 10.315 6.275 1.00 0.00 H new ATOM 0 HB ILE A 15 -1.781 10.178 4.156 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.043 11.172 3.028 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -4.267 11.713 4.680 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -3.370 8.933 2.754 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -2.839 7.988 4.165 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -4.450 8.743 4.155 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -3.022 13.401 3.367 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -1.997 12.742 4.665 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -1.770 12.194 2.987 1.00 0.00 H new ATOM 247 N ARG A 16 -1.318 8.330 6.668 1.00 0.00 N ATOM 248 CA ARG A 16 -0.915 7.033 7.183 1.00 0.00 C ATOM 249 C ARG A 16 -1.645 6.732 8.493 1.00 0.00 C ATOM 250 O ARG A 16 -2.031 5.591 8.745 1.00 0.00 O ATOM 251 CB ARG A 16 0.595 6.981 7.425 1.00 0.00 C ATOM 252 CG ARG A 16 1.078 8.241 8.145 1.00 0.00 C ATOM 253 CD ARG A 16 2.492 8.049 8.698 1.00 0.00 C ATOM 254 NE ARG A 16 2.428 7.494 10.069 1.00 0.00 N ATOM 255 CZ ARG A 16 3.422 7.583 10.963 1.00 0.00 C ATOM 256 NH1 ARG A 16 4.563 8.205 10.636 1.00 0.00 N ATOM 257 NH2 ARG A 16 3.276 7.050 12.183 1.00 0.00 N ATOM 0 H ARG A 16 -0.546 8.947 6.416 1.00 0.00 H new ATOM 0 HA ARG A 16 -1.178 6.284 6.436 1.00 0.00 H new ATOM 0 HB2 ARG A 16 0.842 6.101 8.019 1.00 0.00 H new ATOM 0 HB3 ARG A 16 1.116 6.879 6.473 1.00 0.00 H new ATOM 0 HG2 ARG A 16 1.065 9.085 7.456 1.00 0.00 H new ATOM 0 HG3 ARG A 16 0.395 8.483 8.959 1.00 0.00 H new ATOM 0 HD2 ARG A 16 3.056 7.378 8.051 1.00 0.00 H new ATOM 0 HD3 ARG A 16 3.021 9.002 8.707 1.00 0.00 H new ATOM 0 HE ARG A 16 1.573 7.014 10.351 1.00 0.00 H new ATOM 0 HH11 ARG A 16 4.675 8.611 9.707 1.00 0.00 H new ATOM 0 HH12 ARG A 16 5.320 8.273 11.316 1.00 0.00 H new ATOM 0 HH21 ARG A 16 2.408 6.576 12.432 1.00 0.00 H new ATOM 0 HH22 ARG A 16 4.033 7.118 12.863 1.00 0.00 H new ATOM 271 N ILE A 17 -1.812 7.774 9.294 1.00 0.00 N ATOM 272 CA ILE A 17 -2.489 7.635 10.572 1.00 0.00 C ATOM 273 C ILE A 17 -3.966 7.320 10.330 1.00 0.00 C ATOM 274 O ILE A 17 -4.513 6.396 10.930 1.00 0.00 O ATOM 275 CB ILE A 17 -2.258 8.876 11.438 1.00 0.00 C ATOM 276 CG1 ILE A 17 -0.766 9.096 11.695 1.00 0.00 C ATOM 277 CG2 ILE A 17 -3.058 8.792 12.739 1.00 0.00 C ATOM 278 CD1 ILE A 17 -0.457 10.581 11.893 1.00 0.00 C ATOM 0 H ILE A 17 -1.490 8.718 9.083 1.00 0.00 H new ATOM 0 HA ILE A 17 -2.073 6.800 11.135 1.00 0.00 H new ATOM 0 HB ILE A 17 -2.621 9.747 10.892 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -0.459 8.536 12.578 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -0.188 8.709 10.856 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -2.876 9.686 13.336 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -4.121 8.719 12.509 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -2.748 7.911 13.301 1.00 0.00 H new ATOM 0 HD11 ILE A 17 0.610 10.710 12.074 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -0.743 11.135 10.999 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -1.018 10.959 12.748 1.00 0.00 H new ATOM 290 N LEU A 18 -4.570 8.105 9.451 1.00 0.00 N ATOM 291 CA LEU A 18 -5.973 7.921 9.122 1.00 0.00 C ATOM 292 C LEU A 18 -6.261 6.429 8.950 1.00 0.00 C ATOM 293 O LEU A 18 -7.155 5.886 9.596 1.00 0.00 O ATOM 294 CB LEU A 18 -6.354 8.766 7.904 1.00 0.00 C ATOM 295 CG LEU A 18 -7.833 9.138 7.782 1.00 0.00 C ATOM 296 CD1 LEU A 18 -8.063 10.602 8.162 1.00 0.00 C ATOM 297 CD2 LEU A 18 -8.364 8.818 6.383 1.00 0.00 C ATOM 0 H LEU A 18 -4.113 8.871 8.956 1.00 0.00 H new ATOM 0 HA LEU A 18 -6.604 8.276 9.937 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -5.769 9.686 7.927 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -6.061 8.224 7.005 1.00 0.00 H new ATOM 0 HG LEU A 18 -8.398 8.530 8.488 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -9.122 10.841 8.067 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -7.746 10.765 9.192 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -7.485 11.245 7.498 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -9.417 9.092 6.322 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -7.799 9.383 5.641 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -8.254 7.751 6.187 1.00 0.00 H new ATOM 309 N LEU A 19 -5.485 5.806 8.074 1.00 0.00 N ATOM 310 CA LEU A 19 -5.645 4.387 7.808 1.00 0.00 C ATOM 311 C LEU A 19 -5.079 3.586 8.982 1.00 0.00 C ATOM 312 O LEU A 19 -5.481 2.446 9.212 1.00 0.00 O ATOM 313 CB LEU A 19 -5.025 4.021 6.458 1.00 0.00 C ATOM 314 CG LEU A 19 -3.667 4.655 6.150 1.00 0.00 C ATOM 315 CD1 LEU A 19 -2.656 3.596 5.704 1.00 0.00 C ATOM 316 CD2 LEU A 19 -3.807 5.781 5.124 1.00 0.00 C ATOM 0 H LEU A 19 -4.744 6.259 7.540 1.00 0.00 H new ATOM 0 HA LEU A 19 -6.702 4.132 7.727 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -4.917 2.937 6.412 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -5.723 4.305 5.671 1.00 0.00 H new ATOM 0 HG LEU A 19 -3.283 5.101 7.067 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -1.699 4.073 5.491 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -2.526 2.860 6.497 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -3.022 3.100 4.805 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -2.827 6.214 4.923 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -4.223 5.381 4.199 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -4.471 6.551 5.517 1.00 0.00 H new ATOM 328 N ASN A 20 -4.154 4.213 9.694 1.00 0.00 N ATOM 329 CA ASN A 20 -3.529 3.573 10.839 1.00 0.00 C ATOM 330 C ASN A 20 -4.598 3.250 11.885 1.00 0.00 C ATOM 331 O ASN A 20 -4.717 2.107 12.323 1.00 0.00 O ATOM 332 CB ASN A 20 -2.495 4.495 11.489 1.00 0.00 C ATOM 333 CG ASN A 20 -1.670 3.742 12.535 1.00 0.00 C ATOM 334 OD1 ASN A 20 -1.789 2.541 12.710 1.00 0.00 O ATOM 335 ND2 ASN A 20 -0.829 4.514 13.218 1.00 0.00 N ATOM 0 H ASN A 20 -3.822 5.158 9.500 1.00 0.00 H new ATOM 0 HA ASN A 20 -3.035 2.666 10.490 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -1.834 4.903 10.724 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -2.999 5.340 11.958 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -0.234 4.106 13.939 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -0.780 5.514 13.021 1.00 0.00 H new ATOM 342 N GLU A 21 -5.348 4.278 12.254 1.00 0.00 N ATOM 343 CA GLU A 21 -6.404 4.117 13.240 1.00 0.00 C ATOM 344 C GLU A 21 -7.406 3.058 12.777 1.00 0.00 C ATOM 345 O GLU A 21 -7.941 2.307 13.591 1.00 0.00 O ATOM 346 CB GLU A 21 -7.103 5.450 13.516 1.00 0.00 C ATOM 347 CG GLU A 21 -8.117 5.311 14.653 1.00 0.00 C ATOM 348 CD GLU A 21 -8.496 6.681 15.220 1.00 0.00 C ATOM 349 OE1 GLU A 21 -7.559 7.419 15.593 1.00 0.00 O ATOM 350 OE2 GLU A 21 -9.714 6.959 15.267 1.00 0.00 O ATOM 0 H GLU A 21 -5.246 5.225 11.889 1.00 0.00 H new ATOM 0 HA GLU A 21 -5.954 3.779 14.174 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -6.362 6.207 13.775 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -7.608 5.794 12.613 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -9.011 4.804 14.288 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -7.699 4.689 15.444 1.00 0.00 H new ATOM 357 N VAL A 22 -7.630 3.031 11.472 1.00 0.00 N ATOM 358 CA VAL A 22 -8.559 2.077 10.891 1.00 0.00 C ATOM 359 C VAL A 22 -8.141 0.659 11.289 1.00 0.00 C ATOM 360 O VAL A 22 -8.968 -0.131 11.741 1.00 0.00 O ATOM 361 CB VAL A 22 -8.634 2.275 9.376 1.00 0.00 C ATOM 362 CG1 VAL A 22 -9.110 0.999 8.679 1.00 0.00 C ATOM 363 CG2 VAL A 22 -9.532 3.461 9.022 1.00 0.00 C ATOM 0 H VAL A 22 -7.184 3.655 10.800 1.00 0.00 H new ATOM 0 HA VAL A 22 -9.565 2.240 11.276 1.00 0.00 H new ATOM 0 HB VAL A 22 -7.629 2.497 9.017 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -9.154 1.167 7.603 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -8.414 0.187 8.891 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -10.101 0.732 9.046 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -9.568 3.580 7.939 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -10.538 3.281 9.401 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -9.131 4.369 9.473 1.00 0.00 H new ATOM 373 N PHE A 23 -6.859 0.381 11.106 1.00 0.00 N ATOM 374 CA PHE A 23 -6.322 -0.927 11.440 1.00 0.00 C ATOM 375 C PHE A 23 -5.975 -1.014 12.928 1.00 0.00 C ATOM 376 O PHE A 23 -6.411 -1.934 13.618 1.00 0.00 O ATOM 377 CB PHE A 23 -5.044 -1.109 10.619 1.00 0.00 C ATOM 378 CG PHE A 23 -5.108 -0.487 9.222 1.00 0.00 C ATOM 379 CD1 PHE A 23 -6.148 -0.777 8.396 1.00 0.00 C ATOM 380 CD2 PHE A 23 -4.124 0.354 8.807 1.00 0.00 C ATOM 381 CE1 PHE A 23 -6.207 -0.200 7.100 1.00 0.00 C ATOM 382 CE2 PHE A 23 -4.183 0.931 7.511 1.00 0.00 C ATOM 383 CZ PHE A 23 -5.223 0.642 6.685 1.00 0.00 C ATOM 0 H PHE A 23 -6.176 1.039 10.731 1.00 0.00 H new ATOM 0 HA PHE A 23 -7.060 -1.699 11.221 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -4.209 -0.669 11.164 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -4.835 -2.174 10.522 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -6.929 -1.446 8.725 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -3.297 0.583 9.463 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -7.033 -0.430 6.444 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -3.401 1.600 7.182 1.00 0.00 H new ATOM 0 HZ PHE A 23 -5.268 1.081 5.699 1.00 0.00 H new ATOM 393 N ASN A 24 -5.194 -0.042 13.378 1.00 0.00 N ATOM 394 CA ASN A 24 -4.784 0.003 14.771 1.00 0.00 C ATOM 395 C ASN A 24 -6.024 -0.062 15.666 1.00 0.00 C ATOM 396 O ASN A 24 -5.927 -0.408 16.842 1.00 0.00 O ATOM 397 CB ASN A 24 -4.042 1.303 15.085 1.00 0.00 C ATOM 398 CG ASN A 24 -2.915 1.062 16.091 1.00 0.00 C ATOM 399 OD1 ASN A 24 -1.830 0.619 15.753 1.00 0.00 O ATOM 400 ND2 ASN A 24 -3.231 1.378 17.344 1.00 0.00 N ATOM 0 H ASN A 24 -4.835 0.720 12.803 1.00 0.00 H new ATOM 0 HA ASN A 24 -4.122 -0.843 14.955 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -3.631 1.722 14.167 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -4.741 2.037 15.486 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -2.546 1.254 18.090 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -4.158 1.745 17.559 1.00 0.00 H new ATOM 407 N LYS A 25 -7.159 0.277 15.074 1.00 0.00 N ATOM 408 CA LYS A 25 -8.416 0.263 15.803 1.00 0.00 C ATOM 409 C LYS A 25 -8.528 -1.043 16.592 1.00 0.00 C ATOM 410 O LYS A 25 -9.201 -1.095 17.621 1.00 0.00 O ATOM 411 CB LYS A 25 -9.590 0.508 14.852 1.00 0.00 C ATOM 412 CG LYS A 25 -10.307 1.817 15.192 1.00 0.00 C ATOM 413 CD LYS A 25 -11.337 2.172 14.119 1.00 0.00 C ATOM 414 CE LYS A 25 -12.762 1.999 14.648 1.00 0.00 C ATOM 415 NZ LYS A 25 -13.624 1.372 13.621 1.00 0.00 N ATOM 0 H LYS A 25 -7.235 0.563 14.098 1.00 0.00 H new ATOM 0 HA LYS A 25 -8.446 1.078 16.526 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.229 0.543 13.824 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -10.293 -0.323 14.915 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -10.801 1.725 16.159 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -9.578 2.622 15.282 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.189 3.202 13.794 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -11.190 1.538 13.245 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -12.750 1.383 15.547 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -13.171 2.969 14.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -14.588 1.262 13.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -13.649 1.975 12.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -13.242 0.438 13.370 1.00 0.00 H new ATOM 429 N GLU A 26 -7.857 -2.065 16.082 1.00 0.00 N ATOM 430 CA GLU A 26 -7.873 -3.367 16.726 1.00 0.00 C ATOM 431 C GLU A 26 -6.491 -3.694 17.296 1.00 0.00 C ATOM 432 O GLU A 26 -6.371 -4.492 18.224 1.00 0.00 O ATOM 433 CB GLU A 26 -8.336 -4.455 15.755 1.00 0.00 C ATOM 434 CG GLU A 26 -7.287 -5.561 15.630 1.00 0.00 C ATOM 435 CD GLU A 26 -7.906 -6.843 15.068 1.00 0.00 C ATOM 436 OE1 GLU A 26 -8.994 -6.730 14.463 1.00 0.00 O ATOM 437 OE2 GLU A 26 -7.276 -7.906 15.255 1.00 0.00 O ATOM 0 H GLU A 26 -7.299 -2.018 15.230 1.00 0.00 H new ATOM 0 HA GLU A 26 -8.587 -3.334 17.549 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -9.278 -4.880 16.102 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -8.526 -4.016 14.775 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -6.478 -5.228 14.980 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -6.848 -5.763 16.607 1.00 0.00 H new ATOM 444 N GLY A 27 -5.482 -3.059 16.717 1.00 0.00 N ATOM 445 CA GLY A 27 -4.113 -3.272 17.155 1.00 0.00 C ATOM 446 C GLY A 27 -3.360 -4.180 16.181 1.00 0.00 C ATOM 447 O GLY A 27 -2.496 -4.954 16.590 1.00 0.00 O ATOM 0 H GLY A 27 -5.586 -2.397 15.948 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -3.600 -2.314 17.235 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -4.111 -3.718 18.149 1.00 0.00 H new ATOM 451 N TYR A 28 -3.715 -4.054 14.911 1.00 0.00 N ATOM 452 CA TYR A 28 -3.083 -4.854 13.875 1.00 0.00 C ATOM 453 C TYR A 28 -1.596 -4.517 13.752 1.00 0.00 C ATOM 454 O TYR A 28 -1.189 -3.385 14.012 1.00 0.00 O ATOM 455 CB TYR A 28 -3.788 -4.483 12.568 1.00 0.00 C ATOM 456 CG TYR A 28 -5.187 -5.086 12.423 1.00 0.00 C ATOM 457 CD1 TYR A 28 -5.418 -6.392 12.802 1.00 0.00 C ATOM 458 CD2 TYR A 28 -6.217 -4.322 11.913 1.00 0.00 C ATOM 459 CE1 TYR A 28 -6.735 -6.959 12.665 1.00 0.00 C ATOM 460 CE2 TYR A 28 -7.534 -4.889 11.776 1.00 0.00 C ATOM 461 CZ TYR A 28 -7.728 -6.179 12.159 1.00 0.00 C ATOM 462 OH TYR A 28 -8.971 -6.715 12.030 1.00 0.00 O ATOM 0 H TYR A 28 -4.432 -3.410 14.576 1.00 0.00 H new ATOM 0 HA TYR A 28 -3.163 -5.916 14.107 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -3.863 -3.398 12.503 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -3.173 -4.811 11.730 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -4.612 -6.989 13.201 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -6.036 -3.299 11.617 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -6.930 -7.980 12.957 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -8.349 -4.303 11.378 1.00 0.00 H new ATOM 0 HH TYR A 28 -9.206 -7.196 12.851 1.00 0.00 H new ATOM 472 N GLN A 29 -0.825 -5.519 13.356 1.00 0.00 N ATOM 473 CA GLN A 29 0.608 -5.343 13.195 1.00 0.00 C ATOM 474 C GLN A 29 0.903 -4.489 11.960 1.00 0.00 C ATOM 475 O GLN A 29 0.874 -4.987 10.836 1.00 0.00 O ATOM 476 CB GLN A 29 1.320 -6.694 13.111 1.00 0.00 C ATOM 477 CG GLN A 29 2.034 -7.021 14.424 1.00 0.00 C ATOM 478 CD GLN A 29 2.243 -8.529 14.574 1.00 0.00 C ATOM 479 OE1 GLN A 29 1.500 -9.221 15.251 1.00 0.00 O ATOM 480 NE2 GLN A 29 3.293 -8.998 13.906 1.00 0.00 N ATOM 0 H GLN A 29 -1.166 -6.456 13.142 1.00 0.00 H new ATOM 0 HA GLN A 29 0.991 -4.822 14.072 1.00 0.00 H new ATOM 0 HB2 GLN A 29 0.597 -7.476 12.882 1.00 0.00 H new ATOM 0 HB3 GLN A 29 2.042 -6.678 12.295 1.00 0.00 H new ATOM 0 HG2 GLN A 29 2.997 -6.512 14.455 1.00 0.00 H new ATOM 0 HG3 GLN A 29 1.449 -6.646 15.264 1.00 0.00 H new ATOM 0 HE21 GLN A 29 3.874 -8.363 13.358 1.00 0.00 H new ATOM 0 HE22 GLN A 29 3.517 -9.992 13.942 1.00 0.00 H new ATOM 489 N THR A 30 1.180 -3.218 12.211 1.00 0.00 N ATOM 490 CA THR A 30 1.479 -2.290 11.134 1.00 0.00 C ATOM 491 C THR A 30 2.846 -1.639 11.356 1.00 0.00 C ATOM 492 O THR A 30 3.292 -1.495 12.493 1.00 0.00 O ATOM 493 CB THR A 30 0.333 -1.281 11.046 1.00 0.00 C ATOM 494 OG1 THR A 30 0.334 -0.642 12.319 1.00 0.00 O ATOM 495 CG2 THR A 30 -1.038 -1.957 10.969 1.00 0.00 C ATOM 0 H THR A 30 1.204 -2.809 13.145 1.00 0.00 H new ATOM 0 HA THR A 30 1.550 -2.806 10.176 1.00 0.00 H new ATOM 0 HB THR A 30 0.475 -0.647 10.171 1.00 0.00 H new ATOM 0 HG1 THR A 30 -0.379 0.030 12.348 1.00 0.00 H new ATOM 0 HG21 THR A 30 -1.816 -1.196 10.908 1.00 0.00 H new ATOM 0 HG22 THR A 30 -1.081 -2.592 10.084 1.00 0.00 H new ATOM 0 HG23 THR A 30 -1.194 -2.565 11.860 1.00 0.00 H new ATOM 503 N PHE A 31 3.473 -1.263 10.251 1.00 0.00 N ATOM 504 CA PHE A 31 4.780 -0.630 10.310 1.00 0.00 C ATOM 505 C PHE A 31 4.926 0.429 9.216 1.00 0.00 C ATOM 506 O PHE A 31 4.155 0.448 8.258 1.00 0.00 O ATOM 507 CB PHE A 31 5.819 -1.729 10.081 1.00 0.00 C ATOM 508 CG PHE A 31 7.016 -1.662 11.033 1.00 0.00 C ATOM 509 CD1 PHE A 31 8.004 -0.752 10.819 1.00 0.00 C ATOM 510 CD2 PHE A 31 7.091 -2.511 12.093 1.00 0.00 C ATOM 511 CE1 PHE A 31 9.114 -0.690 11.701 1.00 0.00 C ATOM 512 CE2 PHE A 31 8.201 -2.448 12.975 1.00 0.00 C ATOM 513 CZ PHE A 31 9.189 -1.539 12.761 1.00 0.00 C ATOM 0 H PHE A 31 3.100 -1.385 9.309 1.00 0.00 H new ATOM 0 HA PHE A 31 4.913 -0.139 11.274 1.00 0.00 H new ATOM 0 HB2 PHE A 31 5.336 -2.700 10.189 1.00 0.00 H new ATOM 0 HB3 PHE A 31 6.180 -1.665 9.055 1.00 0.00 H new ATOM 0 HD1 PHE A 31 7.944 -0.077 9.978 1.00 0.00 H new ATOM 0 HD2 PHE A 31 6.306 -3.233 12.263 1.00 0.00 H new ATOM 0 HE1 PHE A 31 9.899 0.031 11.531 1.00 0.00 H new ATOM 0 HE2 PHE A 31 8.261 -3.122 13.816 1.00 0.00 H new ATOM 0 HZ PHE A 31 10.033 -1.491 13.433 1.00 0.00 H new ATOM 523 N GLN A 32 5.921 1.285 9.395 1.00 0.00 N ATOM 524 CA GLN A 32 6.179 2.345 8.435 1.00 0.00 C ATOM 525 C GLN A 32 7.589 2.208 7.858 1.00 0.00 C ATOM 526 O GLN A 32 8.472 1.635 8.496 1.00 0.00 O ATOM 527 CB GLN A 32 5.979 3.722 9.072 1.00 0.00 C ATOM 528 CG GLN A 32 4.633 4.324 8.663 1.00 0.00 C ATOM 529 CD GLN A 32 4.830 5.615 7.865 1.00 0.00 C ATOM 530 OE1 GLN A 32 5.111 6.672 8.406 1.00 0.00 O ATOM 531 NE2 GLN A 32 4.666 5.471 6.553 1.00 0.00 N ATOM 0 H GLN A 32 6.559 1.266 10.191 1.00 0.00 H new ATOM 0 HA GLN A 32 5.463 2.251 7.619 1.00 0.00 H new ATOM 0 HB2 GLN A 32 6.028 3.635 10.157 1.00 0.00 H new ATOM 0 HB3 GLN A 32 6.787 4.388 8.769 1.00 0.00 H new ATOM 0 HG2 GLN A 32 4.075 3.604 8.065 1.00 0.00 H new ATOM 0 HG3 GLN A 32 4.037 4.529 9.552 1.00 0.00 H new ATOM 0 HE21 GLN A 32 4.431 4.557 6.166 1.00 0.00 H new ATOM 0 HE22 GLN A 32 4.775 6.274 5.934 1.00 0.00 H new ATOM 540 N ALA A 33 7.758 2.742 6.658 1.00 0.00 N ATOM 541 CA ALA A 33 9.046 2.686 5.988 1.00 0.00 C ATOM 542 C ALA A 33 9.305 4.017 5.278 1.00 0.00 C ATOM 543 O ALA A 33 8.397 4.835 5.134 1.00 0.00 O ATOM 544 CB ALA A 33 9.070 1.497 5.025 1.00 0.00 C ATOM 0 H ALA A 33 7.024 3.216 6.132 1.00 0.00 H new ATOM 0 HA ALA A 33 9.848 2.536 6.711 1.00 0.00 H new ATOM 0 HB1 ALA A 33 10.036 1.455 4.522 1.00 0.00 H new ATOM 0 HB2 ALA A 33 8.911 0.574 5.582 1.00 0.00 H new ATOM 0 HB3 ALA A 33 8.280 1.614 4.283 1.00 0.00 H new ATOM 550 N ALA A 34 10.547 4.192 4.853 1.00 0.00 N ATOM 551 CA ALA A 34 10.937 5.409 4.161 1.00 0.00 C ATOM 552 C ALA A 34 11.591 5.045 2.827 1.00 0.00 C ATOM 553 O ALA A 34 12.617 5.616 2.458 1.00 0.00 O ATOM 554 CB ALA A 34 11.862 6.233 5.059 1.00 0.00 C ATOM 0 H ALA A 34 11.297 3.511 4.974 1.00 0.00 H new ATOM 0 HA ALA A 34 10.063 6.023 3.943 1.00 0.00 H new ATOM 0 HB1 ALA A 34 12.155 7.146 4.540 1.00 0.00 H new ATOM 0 HB2 ALA A 34 11.340 6.491 5.980 1.00 0.00 H new ATOM 0 HB3 ALA A 34 12.752 5.650 5.297 1.00 0.00 H new ATOM 560 N ASN A 35 10.972 4.097 2.139 1.00 0.00 N ATOM 561 CA ASN A 35 11.481 3.651 0.854 1.00 0.00 C ATOM 562 C ASN A 35 10.804 2.333 0.472 1.00 0.00 C ATOM 563 O ASN A 35 9.902 1.869 1.169 1.00 0.00 O ATOM 564 CB ASN A 35 12.990 3.406 0.914 1.00 0.00 C ATOM 565 CG ASN A 35 13.753 4.496 0.158 1.00 0.00 C ATOM 566 OD1 ASN A 35 13.182 5.434 -0.375 1.00 0.00 O ATOM 567 ND2 ASN A 35 15.071 4.321 0.140 1.00 0.00 N ATOM 0 H ASN A 35 10.122 3.625 2.448 1.00 0.00 H new ATOM 0 HA ASN A 35 11.270 4.429 0.120 1.00 0.00 H new ATOM 0 HB2 ASN A 35 13.317 3.382 1.953 1.00 0.00 H new ATOM 0 HB3 ASN A 35 13.221 2.431 0.485 1.00 0.00 H new ATOM 0 HD21 ASN A 35 15.668 4.994 -0.340 1.00 0.00 H new ATOM 0 HD22 ASN A 35 15.485 3.514 0.606 1.00 0.00 H new ATOM 574 N GLY A 36 11.264 1.767 -0.635 1.00 0.00 N ATOM 575 CA GLY A 36 10.713 0.512 -1.118 1.00 0.00 C ATOM 576 C GLY A 36 11.490 -0.680 -0.555 1.00 0.00 C ATOM 577 O GLY A 36 10.900 -1.699 -0.201 1.00 0.00 O ATOM 0 H GLY A 36 12.012 2.154 -1.211 1.00 0.00 H new ATOM 0 HA2 GLY A 36 9.664 0.436 -0.830 1.00 0.00 H new ATOM 0 HA3 GLY A 36 10.747 0.491 -2.207 1.00 0.00 H new ATOM 581 N LEU A 37 12.803 -0.512 -0.491 1.00 0.00 N ATOM 582 CA LEU A 37 13.667 -1.561 0.023 1.00 0.00 C ATOM 583 C LEU A 37 13.339 -1.811 1.496 1.00 0.00 C ATOM 584 O LEU A 37 13.023 -2.935 1.883 1.00 0.00 O ATOM 585 CB LEU A 37 15.136 -1.217 -0.230 1.00 0.00 C ATOM 586 CG LEU A 37 15.965 -2.291 -0.938 1.00 0.00 C ATOM 587 CD1 LEU A 37 17.214 -1.685 -1.580 1.00 0.00 C ATOM 588 CD2 LEU A 37 16.308 -3.437 0.016 1.00 0.00 C ATOM 0 H LEU A 37 13.289 0.335 -0.787 1.00 0.00 H new ATOM 0 HA LEU A 37 13.487 -2.496 -0.507 1.00 0.00 H new ATOM 0 HB2 LEU A 37 15.178 -0.304 -0.824 1.00 0.00 H new ATOM 0 HB3 LEU A 37 15.607 -0.996 0.728 1.00 0.00 H new ATOM 0 HG LEU A 37 15.362 -2.712 -1.743 1.00 0.00 H new ATOM 0 HD11 LEU A 37 17.785 -2.470 -2.076 1.00 0.00 H new ATOM 0 HD12 LEU A 37 16.919 -0.933 -2.312 1.00 0.00 H new ATOM 0 HD13 LEU A 37 17.830 -1.220 -0.810 1.00 0.00 H new ATOM 0 HD21 LEU A 37 16.897 -4.186 -0.512 1.00 0.00 H new ATOM 0 HD22 LEU A 37 16.883 -3.050 0.857 1.00 0.00 H new ATOM 0 HD23 LEU A 37 15.388 -3.892 0.384 1.00 0.00 H new ATOM 600 N GLN A 38 13.425 -0.745 2.277 1.00 0.00 N ATOM 601 CA GLN A 38 13.141 -0.835 3.700 1.00 0.00 C ATOM 602 C GLN A 38 11.781 -1.499 3.928 1.00 0.00 C ATOM 603 O GLN A 38 11.546 -2.093 4.980 1.00 0.00 O ATOM 604 CB GLN A 38 13.194 0.545 4.358 1.00 0.00 C ATOM 605 CG GLN A 38 14.578 0.816 4.951 1.00 0.00 C ATOM 606 CD GLN A 38 14.897 2.313 4.938 1.00 0.00 C ATOM 607 OE1 GLN A 38 14.842 2.976 3.915 1.00 0.00 O ATOM 608 NE2 GLN A 38 15.233 2.805 6.127 1.00 0.00 N ATOM 0 H GLN A 38 13.687 0.186 1.952 1.00 0.00 H new ATOM 0 HA GLN A 38 13.909 -1.453 4.166 1.00 0.00 H new ATOM 0 HB2 GLN A 38 12.953 1.312 3.622 1.00 0.00 H new ATOM 0 HB3 GLN A 38 12.440 0.607 5.142 1.00 0.00 H new ATOM 0 HG2 GLN A 38 14.619 0.441 5.974 1.00 0.00 H new ATOM 0 HG3 GLN A 38 15.334 0.275 4.382 1.00 0.00 H new ATOM 0 HE21 GLN A 38 15.259 2.194 6.943 1.00 0.00 H new ATOM 0 HE22 GLN A 38 15.465 3.794 6.223 1.00 0.00 H new ATOM 617 N ALA A 39 10.922 -1.376 2.927 1.00 0.00 N ATOM 618 CA ALA A 39 9.593 -1.957 3.006 1.00 0.00 C ATOM 619 C ALA A 39 9.655 -3.422 2.569 1.00 0.00 C ATOM 620 O ALA A 39 8.847 -4.239 3.010 1.00 0.00 O ATOM 621 CB ALA A 39 8.625 -1.135 2.153 1.00 0.00 C ATOM 0 H ALA A 39 11.121 -0.882 2.057 1.00 0.00 H new ATOM 0 HA ALA A 39 9.224 -1.934 4.032 1.00 0.00 H new ATOM 0 HB1 ALA A 39 7.628 -1.571 2.212 1.00 0.00 H new ATOM 0 HB2 ALA A 39 8.595 -0.110 2.522 1.00 0.00 H new ATOM 0 HB3 ALA A 39 8.961 -1.138 1.116 1.00 0.00 H new ATOM 627 N LEU A 40 10.620 -3.710 1.709 1.00 0.00 N ATOM 628 CA LEU A 40 10.798 -5.062 1.208 1.00 0.00 C ATOM 629 C LEU A 40 11.154 -5.990 2.371 1.00 0.00 C ATOM 630 O LEU A 40 10.670 -7.118 2.441 1.00 0.00 O ATOM 631 CB LEU A 40 11.820 -5.082 0.070 1.00 0.00 C ATOM 632 CG LEU A 40 11.274 -4.782 -1.327 1.00 0.00 C ATOM 633 CD1 LEU A 40 12.334 -5.045 -2.399 1.00 0.00 C ATOM 634 CD2 LEU A 40 9.986 -5.563 -1.592 1.00 0.00 C ATOM 0 H LEU A 40 11.288 -3.030 1.346 1.00 0.00 H new ATOM 0 HA LEU A 40 9.868 -5.433 0.777 1.00 0.00 H new ATOM 0 HB2 LEU A 40 12.601 -4.356 0.297 1.00 0.00 H new ATOM 0 HB3 LEU A 40 12.293 -6.064 0.050 1.00 0.00 H new ATOM 0 HG LEU A 40 11.024 -3.722 -1.375 1.00 0.00 H new ATOM 0 HD11 LEU A 40 11.920 -4.824 -3.383 1.00 0.00 H new ATOM 0 HD12 LEU A 40 13.200 -4.408 -2.218 1.00 0.00 H new ATOM 0 HD13 LEU A 40 12.639 -6.091 -2.361 1.00 0.00 H new ATOM 0 HD21 LEU A 40 9.619 -5.331 -2.592 1.00 0.00 H new ATOM 0 HD22 LEU A 40 10.187 -6.632 -1.518 1.00 0.00 H new ATOM 0 HD23 LEU A 40 9.233 -5.283 -0.855 1.00 0.00 H new ATOM 646 N ASP A 41 11.998 -5.479 3.256 1.00 0.00 N ATOM 647 CA ASP A 41 12.425 -6.248 4.413 1.00 0.00 C ATOM 648 C ASP A 41 11.279 -6.317 5.425 1.00 0.00 C ATOM 649 O ASP A 41 10.892 -7.402 5.856 1.00 0.00 O ATOM 650 CB ASP A 41 13.623 -5.589 5.100 1.00 0.00 C ATOM 651 CG ASP A 41 14.174 -6.350 6.307 1.00 0.00 C ATOM 652 OD1 ASP A 41 13.352 -6.983 7.004 1.00 0.00 O ATOM 653 OD2 ASP A 41 15.407 -6.282 6.506 1.00 0.00 O ATOM 0 H ASP A 41 12.397 -4.542 3.195 1.00 0.00 H new ATOM 0 HA ASP A 41 12.708 -7.244 4.071 1.00 0.00 H new ATOM 0 HB2 ASP A 41 14.422 -5.470 4.368 1.00 0.00 H new ATOM 0 HB3 ASP A 41 13.334 -4.588 5.421 1.00 0.00 H new ATOM 658 N ILE A 42 10.768 -5.146 5.774 1.00 0.00 N ATOM 659 CA ILE A 42 9.674 -5.060 6.726 1.00 0.00 C ATOM 660 C ILE A 42 8.457 -5.800 6.167 1.00 0.00 C ATOM 661 O ILE A 42 7.594 -6.243 6.923 1.00 0.00 O ATOM 662 CB ILE A 42 9.393 -3.601 7.090 1.00 0.00 C ATOM 663 CG1 ILE A 42 10.545 -3.008 7.905 1.00 0.00 C ATOM 664 CG2 ILE A 42 8.051 -3.464 7.812 1.00 0.00 C ATOM 665 CD1 ILE A 42 10.118 -2.753 9.352 1.00 0.00 C ATOM 0 H ILE A 42 11.092 -4.248 5.414 1.00 0.00 H new ATOM 0 HA ILE A 42 9.944 -5.551 7.661 1.00 0.00 H new ATOM 0 HB ILE A 42 9.322 -3.026 6.166 1.00 0.00 H new ATOM 0 HG12 ILE A 42 11.396 -3.689 7.888 1.00 0.00 H new ATOM 0 HG13 ILE A 42 10.875 -2.074 7.449 1.00 0.00 H new ATOM 0 HG21 ILE A 42 7.876 -2.417 8.059 1.00 0.00 H new ATOM 0 HG22 ILE A 42 7.251 -3.822 7.164 1.00 0.00 H new ATOM 0 HG23 ILE A 42 8.068 -4.055 8.728 1.00 0.00 H new ATOM 0 HD11 ILE A 42 10.955 -2.332 9.909 1.00 0.00 H new ATOM 0 HD12 ILE A 42 9.283 -2.053 9.367 1.00 0.00 H new ATOM 0 HD13 ILE A 42 9.812 -3.693 9.812 1.00 0.00 H new ATOM 677 N VAL A 43 8.427 -5.910 4.847 1.00 0.00 N ATOM 678 CA VAL A 43 7.330 -6.588 4.177 1.00 0.00 C ATOM 679 C VAL A 43 7.157 -7.984 4.778 1.00 0.00 C ATOM 680 O VAL A 43 6.078 -8.327 5.261 1.00 0.00 O ATOM 681 CB VAL A 43 7.574 -6.613 2.667 1.00 0.00 C ATOM 682 CG1 VAL A 43 7.337 -8.012 2.096 1.00 0.00 C ATOM 683 CG2 VAL A 43 6.705 -5.575 1.954 1.00 0.00 C ATOM 0 H VAL A 43 9.145 -5.541 4.223 1.00 0.00 H new ATOM 0 HA VAL A 43 6.396 -6.049 4.332 1.00 0.00 H new ATOM 0 HB VAL A 43 8.618 -6.353 2.492 1.00 0.00 H new ATOM 0 HG11 VAL A 43 7.517 -8.002 1.021 1.00 0.00 H new ATOM 0 HG12 VAL A 43 8.017 -8.719 2.571 1.00 0.00 H new ATOM 0 HG13 VAL A 43 6.307 -8.314 2.288 1.00 0.00 H new ATOM 0 HG21 VAL A 43 6.898 -5.614 0.882 1.00 0.00 H new ATOM 0 HG22 VAL A 43 5.653 -5.791 2.141 1.00 0.00 H new ATOM 0 HG23 VAL A 43 6.944 -4.580 2.330 1.00 0.00 H new ATOM 693 N THR A 44 8.234 -8.753 4.728 1.00 0.00 N ATOM 694 CA THR A 44 8.215 -10.105 5.261 1.00 0.00 C ATOM 695 C THR A 44 8.305 -10.077 6.788 1.00 0.00 C ATOM 696 O THR A 44 7.692 -10.901 7.465 1.00 0.00 O ATOM 697 CB THR A 44 9.349 -10.890 4.600 1.00 0.00 C ATOM 698 OG1 THR A 44 9.059 -10.812 3.207 1.00 0.00 O ATOM 699 CG2 THR A 44 9.284 -12.387 4.911 1.00 0.00 C ATOM 0 H THR A 44 9.126 -8.466 4.326 1.00 0.00 H new ATOM 0 HA THR A 44 7.276 -10.608 5.031 1.00 0.00 H new ATOM 0 HB THR A 44 10.308 -10.492 4.932 1.00 0.00 H new ATOM 0 HG1 THR A 44 9.747 -11.294 2.702 1.00 0.00 H new ATOM 0 HG21 THR A 44 10.111 -12.897 4.418 1.00 0.00 H new ATOM 0 HG22 THR A 44 9.355 -12.538 5.988 1.00 0.00 H new ATOM 0 HG23 THR A 44 8.340 -12.793 4.549 1.00 0.00 H new ATOM 707 N LYS A 45 9.074 -9.120 7.286 1.00 0.00 N ATOM 708 CA LYS A 45 9.252 -8.974 8.721 1.00 0.00 C ATOM 709 C LYS A 45 7.887 -8.778 9.383 1.00 0.00 C ATOM 710 O LYS A 45 7.623 -9.337 10.447 1.00 0.00 O ATOM 711 CB LYS A 45 10.250 -7.855 9.026 1.00 0.00 C ATOM 712 CG LYS A 45 11.400 -8.367 9.896 1.00 0.00 C ATOM 713 CD LYS A 45 11.696 -7.396 11.041 1.00 0.00 C ATOM 714 CE LYS A 45 13.200 -7.296 11.300 1.00 0.00 C ATOM 715 NZ LYS A 45 13.786 -8.644 11.474 1.00 0.00 N ATOM 0 H LYS A 45 9.581 -8.438 6.722 1.00 0.00 H new ATOM 0 HA LYS A 45 9.685 -9.880 9.145 1.00 0.00 H new ATOM 0 HB2 LYS A 45 10.646 -7.452 8.094 1.00 0.00 H new ATOM 0 HB3 LYS A 45 9.740 -7.037 9.535 1.00 0.00 H new ATOM 0 HG2 LYS A 45 11.146 -9.346 10.302 1.00 0.00 H new ATOM 0 HG3 LYS A 45 12.293 -8.497 9.285 1.00 0.00 H new ATOM 0 HD2 LYS A 45 11.299 -6.410 10.798 1.00 0.00 H new ATOM 0 HD3 LYS A 45 11.189 -7.730 11.946 1.00 0.00 H new ATOM 0 HE2 LYS A 45 13.685 -6.787 10.468 1.00 0.00 H new ATOM 0 HE3 LYS A 45 13.383 -6.696 12.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 14.696 -8.565 11.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 13.137 -9.235 12.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 13.937 -9.080 10.542 1.00 0.00 H new ATOM 729 N GLU A 46 7.055 -7.983 8.726 1.00 0.00 N ATOM 730 CA GLU A 46 5.723 -7.707 9.237 1.00 0.00 C ATOM 731 C GLU A 46 4.680 -8.521 8.469 1.00 0.00 C ATOM 732 O GLU A 46 3.499 -8.502 8.810 1.00 0.00 O ATOM 733 CB GLU A 46 5.410 -6.211 9.170 1.00 0.00 C ATOM 734 CG GLU A 46 5.849 -5.501 10.452 1.00 0.00 C ATOM 735 CD GLU A 46 4.686 -5.381 11.439 1.00 0.00 C ATOM 736 OE1 GLU A 46 4.400 -6.400 12.105 1.00 0.00 O ATOM 737 OE2 GLU A 46 4.109 -4.274 11.505 1.00 0.00 O ATOM 0 H GLU A 46 7.278 -7.521 7.844 1.00 0.00 H new ATOM 0 HA GLU A 46 5.688 -8.006 10.285 1.00 0.00 H new ATOM 0 HB2 GLU A 46 5.917 -5.768 8.313 1.00 0.00 H new ATOM 0 HB3 GLU A 46 4.340 -6.066 9.018 1.00 0.00 H new ATOM 0 HG2 GLU A 46 6.668 -6.052 10.915 1.00 0.00 H new ATOM 0 HG3 GLU A 46 6.229 -4.508 10.210 1.00 0.00 H new ATOM 744 N ARG A 47 5.155 -9.215 7.445 1.00 0.00 N ATOM 745 CA ARG A 47 4.278 -10.034 6.626 1.00 0.00 C ATOM 746 C ARG A 47 2.840 -9.518 6.708 1.00 0.00 C ATOM 747 O ARG A 47 1.943 -10.237 7.146 1.00 0.00 O ATOM 748 CB ARG A 47 4.314 -11.497 7.072 1.00 0.00 C ATOM 749 CG ARG A 47 3.988 -11.624 8.561 1.00 0.00 C ATOM 750 CD ARG A 47 2.815 -12.582 8.786 1.00 0.00 C ATOM 751 NE ARG A 47 3.240 -13.974 8.517 1.00 0.00 N ATOM 752 CZ ARG A 47 2.411 -15.026 8.520 1.00 0.00 C ATOM 753 NH1 ARG A 47 1.108 -14.851 8.778 1.00 0.00 N ATOM 754 NH2 ARG A 47 2.885 -16.253 8.266 1.00 0.00 N ATOM 0 H ARG A 47 6.135 -9.227 7.164 1.00 0.00 H new ATOM 0 HA ARG A 47 4.632 -9.971 5.597 1.00 0.00 H new ATOM 0 HB2 ARG A 47 3.598 -12.076 6.489 1.00 0.00 H new ATOM 0 HB3 ARG A 47 5.300 -11.917 6.875 1.00 0.00 H new ATOM 0 HG2 ARG A 47 4.865 -11.984 9.099 1.00 0.00 H new ATOM 0 HG3 ARG A 47 3.744 -10.643 8.969 1.00 0.00 H new ATOM 0 HD2 ARG A 47 2.455 -12.495 9.811 1.00 0.00 H new ATOM 0 HD3 ARG A 47 1.985 -12.314 8.132 1.00 0.00 H new ATOM 0 HE ARG A 47 4.226 -14.143 8.317 1.00 0.00 H new ATOM 0 HH11 ARG A 47 0.748 -13.917 8.972 1.00 0.00 H new ATOM 0 HH12 ARG A 47 0.476 -15.652 8.780 1.00 0.00 H new ATOM 0 HH21 ARG A 47 3.877 -16.386 8.070 1.00 0.00 H new ATOM 0 HH22 ARG A 47 2.254 -17.054 8.268 1.00 0.00 H new ATOM 768 N PRO A 48 2.660 -8.244 6.269 1.00 0.00 N ATOM 769 CA PRO A 48 1.346 -7.624 6.289 1.00 0.00 C ATOM 770 C PRO A 48 0.464 -8.172 5.166 1.00 0.00 C ATOM 771 O PRO A 48 0.970 -8.679 4.166 1.00 0.00 O ATOM 772 CB PRO A 48 1.613 -6.133 6.161 1.00 0.00 C ATOM 773 CG PRO A 48 3.024 -6.008 5.609 1.00 0.00 C ATOM 774 CD PRO A 48 3.699 -7.363 5.744 1.00 0.00 C ATOM 0 HA PRO A 48 0.793 -7.839 7.203 1.00 0.00 H new ATOM 0 HB2 PRO A 48 0.890 -5.663 5.495 1.00 0.00 H new ATOM 0 HB3 PRO A 48 1.526 -5.636 7.127 1.00 0.00 H new ATOM 0 HG2 PRO A 48 2.999 -5.696 4.565 1.00 0.00 H new ATOM 0 HG3 PRO A 48 3.582 -5.248 6.156 1.00 0.00 H new ATOM 0 HD2 PRO A 48 4.071 -7.718 4.783 1.00 0.00 H new ATOM 0 HD3 PRO A 48 4.554 -7.314 6.418 1.00 0.00 H new ATOM 782 N ASP A 49 -0.840 -8.051 5.368 1.00 0.00 N ATOM 783 CA ASP A 49 -1.797 -8.528 4.385 1.00 0.00 C ATOM 784 C ASP A 49 -2.067 -7.422 3.363 1.00 0.00 C ATOM 785 O ASP A 49 -2.821 -7.620 2.412 1.00 0.00 O ATOM 786 CB ASP A 49 -3.127 -8.897 5.045 1.00 0.00 C ATOM 787 CG ASP A 49 -3.772 -10.184 4.526 1.00 0.00 C ATOM 788 OD1 ASP A 49 -3.007 -11.048 4.045 1.00 0.00 O ATOM 789 OD2 ASP A 49 -5.015 -10.274 4.621 1.00 0.00 O ATOM 0 H ASP A 49 -1.256 -7.629 6.198 1.00 0.00 H new ATOM 0 HA ASP A 49 -1.375 -9.411 3.905 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -2.967 -8.996 6.119 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -3.827 -8.074 4.901 1.00 0.00 H new ATOM 794 N LEU A 50 -1.436 -6.280 3.595 1.00 0.00 N ATOM 795 CA LEU A 50 -1.599 -5.141 2.707 1.00 0.00 C ATOM 796 C LEU A 50 -0.507 -4.111 3.001 1.00 0.00 C ATOM 797 O LEU A 50 -0.151 -3.890 4.157 1.00 0.00 O ATOM 798 CB LEU A 50 -3.018 -4.579 2.810 1.00 0.00 C ATOM 799 CG LEU A 50 -3.622 -4.041 1.512 1.00 0.00 C ATOM 800 CD1 LEU A 50 -3.104 -2.634 1.208 1.00 0.00 C ATOM 801 CD2 LEU A 50 -3.376 -5.006 0.351 1.00 0.00 C ATOM 0 H LEU A 50 -0.811 -6.119 4.385 1.00 0.00 H new ATOM 0 HA LEU A 50 -1.478 -5.448 1.668 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -3.671 -5.363 3.194 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -3.017 -3.776 3.547 1.00 0.00 H new ATOM 0 HG LEU A 50 -4.701 -3.965 1.644 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -3.549 -2.275 0.280 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -3.374 -1.963 2.023 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -2.019 -2.660 1.104 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -3.816 -4.599 -0.560 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -2.303 -5.138 0.209 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -3.833 -5.970 0.576 1.00 0.00 H new ATOM 813 N VAL A 51 -0.004 -3.507 1.933 1.00 0.00 N ATOM 814 CA VAL A 51 1.040 -2.506 2.062 1.00 0.00 C ATOM 815 C VAL A 51 0.725 -1.325 1.141 1.00 0.00 C ATOM 816 O VAL A 51 0.179 -1.509 0.054 1.00 0.00 O ATOM 817 CB VAL A 51 2.406 -3.135 1.781 1.00 0.00 C ATOM 818 CG1 VAL A 51 3.536 -2.143 2.066 1.00 0.00 C ATOM 819 CG2 VAL A 51 2.592 -4.423 2.584 1.00 0.00 C ATOM 0 H VAL A 51 -0.301 -3.692 0.975 1.00 0.00 H new ATOM 0 HA VAL A 51 1.077 -2.123 3.082 1.00 0.00 H new ATOM 0 HB VAL A 51 2.445 -3.392 0.722 1.00 0.00 H new ATOM 0 HG11 VAL A 51 4.496 -2.616 1.858 1.00 0.00 H new ATOM 0 HG12 VAL A 51 3.418 -1.265 1.431 1.00 0.00 H new ATOM 0 HG13 VAL A 51 3.499 -1.841 3.113 1.00 0.00 H new ATOM 0 HG21 VAL A 51 3.571 -4.850 2.366 1.00 0.00 H new ATOM 0 HG22 VAL A 51 2.522 -4.201 3.649 1.00 0.00 H new ATOM 0 HG23 VAL A 51 1.816 -5.138 2.311 1.00 0.00 H new ATOM 829 N LEU A 52 1.081 -0.138 1.610 1.00 0.00 N ATOM 830 CA LEU A 52 0.843 1.072 0.843 1.00 0.00 C ATOM 831 C LEU A 52 2.182 1.744 0.530 1.00 0.00 C ATOM 832 O LEU A 52 2.891 2.175 1.438 1.00 0.00 O ATOM 833 CB LEU A 52 -0.147 1.983 1.572 1.00 0.00 C ATOM 834 CG LEU A 52 0.032 3.485 1.345 1.00 0.00 C ATOM 835 CD1 LEU A 52 -1.321 4.176 1.157 1.00 0.00 C ATOM 836 CD2 LEU A 52 0.846 4.118 2.476 1.00 0.00 C ATOM 0 H LEU A 52 1.533 0.011 2.512 1.00 0.00 H new ATOM 0 HA LEU A 52 0.375 0.832 -0.112 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -1.156 1.707 1.267 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -0.072 1.786 2.641 1.00 0.00 H new ATOM 0 HG LEU A 52 0.597 3.626 0.424 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -1.166 5.243 0.997 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -1.830 3.750 0.292 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -1.932 4.028 2.047 1.00 0.00 H new ATOM 0 HD21 LEU A 52 0.958 5.186 2.290 1.00 0.00 H new ATOM 0 HD22 LEU A 52 0.330 3.967 3.424 1.00 0.00 H new ATOM 0 HD23 LEU A 52 1.830 3.652 2.521 1.00 0.00 H new ATOM 848 N LEU A 53 2.486 1.813 -0.757 1.00 0.00 N ATOM 849 CA LEU A 53 3.727 2.425 -1.201 1.00 0.00 C ATOM 850 C LEU A 53 3.415 3.506 -2.239 1.00 0.00 C ATOM 851 O LEU A 53 2.560 3.314 -3.101 1.00 0.00 O ATOM 852 CB LEU A 53 4.704 1.358 -1.699 1.00 0.00 C ATOM 853 CG LEU A 53 6.040 1.871 -2.239 1.00 0.00 C ATOM 854 CD1 LEU A 53 5.881 2.435 -3.652 1.00 0.00 C ATOM 855 CD2 LEU A 53 6.663 2.889 -1.282 1.00 0.00 C ATOM 0 H LEU A 53 1.895 1.455 -1.507 1.00 0.00 H new ATOM 0 HA LEU A 53 4.228 2.917 -0.367 1.00 0.00 H new ATOM 0 HB2 LEU A 53 4.907 0.669 -0.879 1.00 0.00 H new ATOM 0 HB3 LEU A 53 4.214 0.783 -2.485 1.00 0.00 H new ATOM 0 HG LEU A 53 6.728 1.028 -2.305 1.00 0.00 H new ATOM 0 HD11 LEU A 53 6.846 2.793 -4.012 1.00 0.00 H new ATOM 0 HD12 LEU A 53 5.513 1.653 -4.317 1.00 0.00 H new ATOM 0 HD13 LEU A 53 5.171 3.262 -3.636 1.00 0.00 H new ATOM 0 HD21 LEU A 53 7.612 3.238 -1.689 1.00 0.00 H new ATOM 0 HD22 LEU A 53 5.987 3.735 -1.161 1.00 0.00 H new ATOM 0 HD23 LEU A 53 6.835 2.420 -0.313 1.00 0.00 H new ATOM 867 N ASP A 54 4.126 4.617 -2.121 1.00 0.00 N ATOM 868 CA ASP A 54 3.936 5.728 -3.038 1.00 0.00 C ATOM 869 C ASP A 54 5.007 5.672 -4.129 1.00 0.00 C ATOM 870 O ASP A 54 6.176 5.417 -3.844 1.00 0.00 O ATOM 871 CB ASP A 54 4.069 7.069 -2.314 1.00 0.00 C ATOM 872 CG ASP A 54 4.495 8.242 -3.199 1.00 0.00 C ATOM 873 OD1 ASP A 54 4.141 8.207 -4.397 1.00 0.00 O ATOM 874 OD2 ASP A 54 5.165 9.148 -2.657 1.00 0.00 O ATOM 0 H ASP A 54 4.835 4.772 -1.404 1.00 0.00 H new ATOM 0 HA ASP A 54 2.936 5.646 -3.464 1.00 0.00 H new ATOM 0 HB2 ASP A 54 3.112 7.311 -1.851 1.00 0.00 H new ATOM 0 HB3 ASP A 54 4.794 6.959 -1.508 1.00 0.00 H new ATOM 879 N MET A 55 4.569 5.914 -5.356 1.00 0.00 N ATOM 880 CA MET A 55 5.476 5.894 -6.492 1.00 0.00 C ATOM 881 C MET A 55 6.602 6.914 -6.312 1.00 0.00 C ATOM 882 O MET A 55 7.764 6.541 -6.161 1.00 0.00 O ATOM 883 CB MET A 55 4.699 6.212 -7.771 1.00 0.00 C ATOM 884 CG MET A 55 3.449 5.336 -7.885 1.00 0.00 C ATOM 885 SD MET A 55 3.854 3.641 -7.495 1.00 0.00 S ATOM 886 CE MET A 55 3.356 3.591 -5.781 1.00 0.00 C ATOM 0 H MET A 55 3.599 6.125 -5.589 1.00 0.00 H new ATOM 0 HA MET A 55 5.919 4.900 -6.563 1.00 0.00 H new ATOM 0 HB2 MET A 55 4.412 7.264 -7.775 1.00 0.00 H new ATOM 0 HB3 MET A 55 5.339 6.053 -8.639 1.00 0.00 H new ATOM 0 HG2 MET A 55 2.677 5.699 -7.207 1.00 0.00 H new ATOM 0 HG3 MET A 55 3.042 5.398 -8.894 1.00 0.00 H new ATOM 0 HE1 MET A 55 2.981 2.596 -5.540 1.00 0.00 H new ATOM 0 HE2 MET A 55 4.212 3.820 -5.146 1.00 0.00 H new ATOM 0 HE3 MET A 55 2.570 4.327 -5.609 1.00 0.00 H new ATOM 896 N LYS A 56 6.218 8.182 -6.335 1.00 0.00 N ATOM 897 CA LYS A 56 7.181 9.259 -6.176 1.00 0.00 C ATOM 898 C LYS A 56 7.901 9.100 -4.836 1.00 0.00 C ATOM 899 O LYS A 56 7.278 9.188 -3.779 1.00 0.00 O ATOM 900 CB LYS A 56 6.499 10.617 -6.351 1.00 0.00 C ATOM 901 CG LYS A 56 7.480 11.656 -6.899 1.00 0.00 C ATOM 902 CD LYS A 56 7.065 13.071 -6.491 1.00 0.00 C ATOM 903 CE LYS A 56 8.289 13.967 -6.297 1.00 0.00 C ATOM 904 NZ LYS A 56 7.887 15.283 -5.751 1.00 0.00 N ATOM 0 H LYS A 56 5.253 8.488 -6.461 1.00 0.00 H new ATOM 0 HA LYS A 56 7.942 9.208 -6.955 1.00 0.00 H new ATOM 0 HB2 LYS A 56 5.652 10.518 -7.030 1.00 0.00 H new ATOM 0 HB3 LYS A 56 6.103 10.955 -5.394 1.00 0.00 H new ATOM 0 HG2 LYS A 56 8.483 11.446 -6.527 1.00 0.00 H new ATOM 0 HG3 LYS A 56 7.521 11.585 -7.986 1.00 0.00 H new ATOM 0 HD2 LYS A 56 6.415 13.498 -7.255 1.00 0.00 H new ATOM 0 HD3 LYS A 56 6.488 13.032 -5.567 1.00 0.00 H new ATOM 0 HE2 LYS A 56 8.995 13.486 -5.620 1.00 0.00 H new ATOM 0 HE3 LYS A 56 8.802 14.103 -7.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 8.730 15.879 -5.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 7.230 15.747 -6.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 7.418 15.149 -4.833 1.00 0.00 H new ATOM 918 N ILE A 57 9.202 8.869 -4.923 1.00 0.00 N ATOM 919 CA ILE A 57 10.014 8.697 -3.730 1.00 0.00 C ATOM 920 C ILE A 57 11.411 9.267 -3.982 1.00 0.00 C ATOM 921 O ILE A 57 11.863 9.329 -5.125 1.00 0.00 O ATOM 922 CB ILE A 57 10.017 7.231 -3.291 1.00 0.00 C ATOM 923 CG1 ILE A 57 9.261 7.052 -1.973 1.00 0.00 C ATOM 924 CG2 ILE A 57 11.445 6.686 -3.212 1.00 0.00 C ATOM 925 CD1 ILE A 57 9.100 5.569 -1.631 1.00 0.00 C ATOM 0 H ILE A 57 9.715 8.797 -5.802 1.00 0.00 H new ATOM 0 HA ILE A 57 9.588 9.255 -2.896 1.00 0.00 H new ATOM 0 HB ILE A 57 9.490 6.647 -4.046 1.00 0.00 H new ATOM 0 HG12 ILE A 57 9.797 7.558 -1.170 1.00 0.00 H new ATOM 0 HG13 ILE A 57 8.280 7.521 -2.046 1.00 0.00 H new ATOM 0 HG21 ILE A 57 11.419 5.643 -2.898 1.00 0.00 H new ATOM 0 HG22 ILE A 57 11.917 6.758 -4.192 1.00 0.00 H new ATOM 0 HG23 ILE A 57 12.017 7.268 -2.490 1.00 0.00 H new ATOM 0 HD11 ILE A 57 8.559 5.469 -0.690 1.00 0.00 H new ATOM 0 HD12 ILE A 57 8.542 5.071 -2.424 1.00 0.00 H new ATOM 0 HD13 ILE A 57 10.083 5.109 -1.535 1.00 0.00 H new ATOM 937 N PRO A 58 12.074 9.679 -2.868 1.00 0.00 N ATOM 938 CA PRO A 58 13.410 10.241 -2.958 1.00 0.00 C ATOM 939 C PRO A 58 14.449 9.148 -3.213 1.00 0.00 C ATOM 940 O PRO A 58 14.522 8.170 -2.470 1.00 0.00 O ATOM 941 CB PRO A 58 13.622 10.965 -1.638 1.00 0.00 C ATOM 942 CG PRO A 58 12.589 10.394 -0.679 1.00 0.00 C ATOM 943 CD PRO A 58 11.569 9.621 -1.499 1.00 0.00 C ATOM 0 HA PRO A 58 13.521 10.928 -3.797 1.00 0.00 H new ATOM 0 HB2 PRO A 58 14.633 10.806 -1.263 1.00 0.00 H new ATOM 0 HB3 PRO A 58 13.492 12.041 -1.757 1.00 0.00 H new ATOM 0 HG2 PRO A 58 13.066 9.740 0.051 1.00 0.00 H new ATOM 0 HG3 PRO A 58 12.103 11.194 -0.121 1.00 0.00 H new ATOM 0 HD2 PRO A 58 11.481 8.591 -1.153 1.00 0.00 H new ATOM 0 HD3 PRO A 58 10.578 10.069 -1.423 1.00 0.00 H new ATOM 951 N GLY A 59 15.227 9.349 -4.266 1.00 0.00 N ATOM 952 CA GLY A 59 16.259 8.393 -4.629 1.00 0.00 C ATOM 953 C GLY A 59 15.645 7.120 -5.215 1.00 0.00 C ATOM 954 O GLY A 59 15.060 6.318 -4.489 1.00 0.00 O ATOM 0 H GLY A 59 15.163 10.161 -4.880 1.00 0.00 H new ATOM 0 HA2 GLY A 59 16.936 8.842 -5.355 1.00 0.00 H new ATOM 0 HA3 GLY A 59 16.854 8.143 -3.750 1.00 0.00 H new ATOM 958 N MET A 60 15.800 6.975 -6.523 1.00 0.00 N ATOM 959 CA MET A 60 15.267 5.813 -7.215 1.00 0.00 C ATOM 960 C MET A 60 13.780 5.627 -6.910 1.00 0.00 C ATOM 961 O MET A 60 13.420 5.060 -5.880 1.00 0.00 O ATOM 962 CB MET A 60 16.037 4.564 -6.782 1.00 0.00 C ATOM 963 CG MET A 60 16.304 3.643 -7.975 1.00 0.00 C ATOM 964 SD MET A 60 16.486 1.958 -7.416 1.00 0.00 S ATOM 965 CE MET A 60 14.857 1.676 -6.742 1.00 0.00 C ATOM 0 H MET A 60 16.287 7.642 -7.122 1.00 0.00 H new ATOM 0 HA MET A 60 15.382 5.968 -8.288 1.00 0.00 H new ATOM 0 HB2 MET A 60 16.982 4.856 -6.325 1.00 0.00 H new ATOM 0 HB3 MET A 60 15.468 4.027 -6.023 1.00 0.00 H new ATOM 0 HG2 MET A 60 15.483 3.711 -8.689 1.00 0.00 H new ATOM 0 HG3 MET A 60 17.207 3.962 -8.496 1.00 0.00 H new ATOM 0 HE1 MET A 60 14.914 1.645 -5.654 1.00 0.00 H new ATOM 0 HE2 MET A 60 14.192 2.484 -7.048 1.00 0.00 H new ATOM 0 HE3 MET A 60 14.469 0.727 -7.112 1.00 0.00 H new ATOM 975 N ASP A 61 12.956 6.116 -7.825 1.00 0.00 N ATOM 976 CA ASP A 61 11.515 6.010 -7.668 1.00 0.00 C ATOM 977 C ASP A 61 11.137 4.545 -7.440 1.00 0.00 C ATOM 978 O ASP A 61 12.004 3.673 -7.417 1.00 0.00 O ATOM 979 CB ASP A 61 10.786 6.497 -8.922 1.00 0.00 C ATOM 980 CG ASP A 61 11.582 6.369 -10.222 1.00 0.00 C ATOM 981 OD1 ASP A 61 12.066 5.247 -10.484 1.00 0.00 O ATOM 982 OD2 ASP A 61 11.689 7.397 -10.925 1.00 0.00 O ATOM 0 H ASP A 61 13.259 6.587 -8.678 1.00 0.00 H new ATOM 0 HA ASP A 61 11.223 6.628 -6.819 1.00 0.00 H new ATOM 0 HB2 ASP A 61 9.857 5.936 -9.025 1.00 0.00 H new ATOM 0 HB3 ASP A 61 10.513 7.543 -8.782 1.00 0.00 H new ATOM 987 N GLY A 62 9.841 4.321 -7.276 1.00 0.00 N ATOM 988 CA GLY A 62 9.338 2.976 -7.050 1.00 0.00 C ATOM 989 C GLY A 62 9.084 2.256 -8.376 1.00 0.00 C ATOM 990 O GLY A 62 8.745 1.074 -8.390 1.00 0.00 O ATOM 0 H GLY A 62 9.125 5.047 -7.295 1.00 0.00 H new ATOM 0 HA2 GLY A 62 10.056 2.410 -6.457 1.00 0.00 H new ATOM 0 HA3 GLY A 62 8.414 3.021 -6.474 1.00 0.00 H new ATOM 994 N ILE A 63 9.257 3.000 -9.459 1.00 0.00 N ATOM 995 CA ILE A 63 9.051 2.447 -10.787 1.00 0.00 C ATOM 996 C ILE A 63 9.702 1.065 -10.866 1.00 0.00 C ATOM 997 O ILE A 63 9.123 0.133 -11.423 1.00 0.00 O ATOM 998 CB ILE A 63 9.546 3.423 -11.856 1.00 0.00 C ATOM 999 CG1 ILE A 63 8.482 4.475 -12.174 1.00 0.00 C ATOM 1000 CG2 ILE A 63 10.006 2.675 -13.110 1.00 0.00 C ATOM 1001 CD1 ILE A 63 7.537 3.985 -13.273 1.00 0.00 C ATOM 0 H ILE A 63 9.537 3.981 -9.444 1.00 0.00 H new ATOM 0 HA ILE A 63 7.987 2.310 -10.982 1.00 0.00 H new ATOM 0 HB ILE A 63 10.413 3.952 -11.460 1.00 0.00 H new ATOM 0 HG12 ILE A 63 7.911 4.704 -11.274 1.00 0.00 H new ATOM 0 HG13 ILE A 63 8.964 5.401 -12.490 1.00 0.00 H new ATOM 0 HG21 ILE A 63 10.353 3.392 -13.854 1.00 0.00 H new ATOM 0 HG22 ILE A 63 10.820 1.997 -12.852 1.00 0.00 H new ATOM 0 HG23 ILE A 63 9.173 2.103 -13.518 1.00 0.00 H new ATOM 0 HD11 ILE A 63 6.790 4.752 -13.480 1.00 0.00 H new ATOM 0 HD12 ILE A 63 8.108 3.781 -14.179 1.00 0.00 H new ATOM 0 HD13 ILE A 63 7.039 3.073 -12.944 1.00 0.00 H new ATOM 1013 N GLU A 64 10.897 0.976 -10.301 1.00 0.00 N ATOM 1014 CA GLU A 64 11.633 -0.277 -10.301 1.00 0.00 C ATOM 1015 C GLU A 64 11.258 -1.113 -9.076 1.00 0.00 C ATOM 1016 O GLU A 64 10.953 -2.298 -9.197 1.00 0.00 O ATOM 1017 CB GLU A 64 13.141 -0.027 -10.354 1.00 0.00 C ATOM 1018 CG GLU A 64 13.502 0.907 -11.511 1.00 0.00 C ATOM 1019 CD GLU A 64 13.222 0.242 -12.860 1.00 0.00 C ATOM 1020 OE1 GLU A 64 12.024 0.132 -13.200 1.00 0.00 O ATOM 1021 OE2 GLU A 64 14.212 -0.140 -13.521 1.00 0.00 O ATOM 0 H GLU A 64 11.374 1.751 -9.840 1.00 0.00 H new ATOM 0 HA GLU A 64 11.359 -0.837 -11.196 1.00 0.00 H new ATOM 0 HB2 GLU A 64 13.474 0.409 -9.412 1.00 0.00 H new ATOM 0 HB3 GLU A 64 13.666 -0.975 -10.470 1.00 0.00 H new ATOM 0 HG2 GLU A 64 12.928 1.830 -11.430 1.00 0.00 H new ATOM 0 HG3 GLU A 64 14.555 1.180 -11.448 1.00 0.00 H new ATOM 1028 N ILE A 65 11.293 -0.462 -7.922 1.00 0.00 N ATOM 1029 CA ILE A 65 10.961 -1.130 -6.675 1.00 0.00 C ATOM 1030 C ILE A 65 9.670 -1.930 -6.859 1.00 0.00 C ATOM 1031 O ILE A 65 9.677 -3.157 -6.770 1.00 0.00 O ATOM 1032 CB ILE A 65 10.902 -0.121 -5.526 1.00 0.00 C ATOM 1033 CG1 ILE A 65 12.188 0.705 -5.455 1.00 0.00 C ATOM 1034 CG2 ILE A 65 10.594 -0.819 -4.200 1.00 0.00 C ATOM 1035 CD1 ILE A 65 12.315 1.406 -4.101 1.00 0.00 C ATOM 0 H ILE A 65 11.546 0.521 -7.825 1.00 0.00 H new ATOM 0 HA ILE A 65 11.741 -1.841 -6.403 1.00 0.00 H new ATOM 0 HB ILE A 65 10.085 0.573 -5.722 1.00 0.00 H new ATOM 0 HG12 ILE A 65 13.050 0.057 -5.615 1.00 0.00 H new ATOM 0 HG13 ILE A 65 12.193 1.446 -6.254 1.00 0.00 H new ATOM 0 HG21 ILE A 65 10.558 -0.080 -3.400 1.00 0.00 H new ATOM 0 HG22 ILE A 65 9.631 -1.325 -4.270 1.00 0.00 H new ATOM 0 HG23 ILE A 65 11.373 -1.550 -3.984 1.00 0.00 H new ATOM 0 HD11 ILE A 65 13.237 1.986 -4.077 1.00 0.00 H new ATOM 0 HD12 ILE A 65 11.464 2.071 -3.954 1.00 0.00 H new ATOM 0 HD13 ILE A 65 12.334 0.661 -3.306 1.00 0.00 H new ATOM 1047 N LEU A 66 8.591 -1.202 -7.111 1.00 0.00 N ATOM 1048 CA LEU A 66 7.295 -1.829 -7.307 1.00 0.00 C ATOM 1049 C LEU A 66 7.412 -2.903 -8.390 1.00 0.00 C ATOM 1050 O LEU A 66 6.731 -3.926 -8.331 1.00 0.00 O ATOM 1051 CB LEU A 66 6.229 -0.772 -7.601 1.00 0.00 C ATOM 1052 CG LEU A 66 5.766 0.065 -6.406 1.00 0.00 C ATOM 1053 CD1 LEU A 66 5.821 -0.750 -5.113 1.00 0.00 C ATOM 1054 CD2 LEU A 66 6.571 1.362 -6.301 1.00 0.00 C ATOM 0 H LEU A 66 8.588 -0.185 -7.184 1.00 0.00 H new ATOM 0 HA LEU A 66 6.971 -2.330 -6.395 1.00 0.00 H new ATOM 0 HB2 LEU A 66 6.616 -0.097 -8.364 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.359 -1.271 -8.029 1.00 0.00 H new ATOM 0 HG LEU A 66 4.725 0.344 -6.567 1.00 0.00 H new ATOM 0 HD11 LEU A 66 5.487 -0.132 -4.279 1.00 0.00 H new ATOM 0 HD12 LEU A 66 5.171 -1.620 -5.203 1.00 0.00 H new ATOM 0 HD13 LEU A 66 6.845 -1.079 -4.934 1.00 0.00 H new ATOM 0 HD21 LEU A 66 6.222 1.938 -5.444 1.00 0.00 H new ATOM 0 HD22 LEU A 66 7.627 1.125 -6.174 1.00 0.00 H new ATOM 0 HD23 LEU A 66 6.438 1.948 -7.211 1.00 0.00 H new ATOM 1066 N LYS A 67 8.280 -2.634 -9.355 1.00 0.00 N ATOM 1067 CA LYS A 67 8.494 -3.564 -10.450 1.00 0.00 C ATOM 1068 C LYS A 67 9.133 -4.845 -9.908 1.00 0.00 C ATOM 1069 O LYS A 67 8.533 -5.917 -9.971 1.00 0.00 O ATOM 1070 CB LYS A 67 9.300 -2.900 -11.568 1.00 0.00 C ATOM 1071 CG LYS A 67 8.427 -2.648 -12.798 1.00 0.00 C ATOM 1072 CD LYS A 67 9.278 -2.217 -13.995 1.00 0.00 C ATOM 1073 CE LYS A 67 8.398 -1.894 -15.205 1.00 0.00 C ATOM 1074 NZ LYS A 67 8.708 -2.805 -16.329 1.00 0.00 N ATOM 0 H LYS A 67 8.843 -1.785 -9.401 1.00 0.00 H new ATOM 0 HA LYS A 67 7.543 -3.847 -10.900 1.00 0.00 H new ATOM 0 HB2 LYS A 67 9.714 -1.957 -11.212 1.00 0.00 H new ATOM 0 HB3 LYS A 67 10.143 -3.535 -11.840 1.00 0.00 H new ATOM 0 HG2 LYS A 67 7.874 -3.553 -13.048 1.00 0.00 H new ATOM 0 HG3 LYS A 67 7.691 -1.876 -12.574 1.00 0.00 H new ATOM 0 HD2 LYS A 67 9.871 -1.342 -13.728 1.00 0.00 H new ATOM 0 HD3 LYS A 67 9.979 -3.011 -14.252 1.00 0.00 H new ATOM 0 HE2 LYS A 67 7.347 -1.987 -14.933 1.00 0.00 H new ATOM 0 HE3 LYS A 67 8.557 -0.860 -15.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 8.102 -2.572 -17.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 9.706 -2.696 -16.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 8.534 -3.788 -16.037 1.00 0.00 H new ATOM 1088 N ARG A 68 10.342 -4.690 -9.387 1.00 0.00 N ATOM 1089 CA ARG A 68 11.068 -5.820 -8.835 1.00 0.00 C ATOM 1090 C ARG A 68 10.216 -6.538 -7.786 1.00 0.00 C ATOM 1091 O ARG A 68 10.302 -7.757 -7.640 1.00 0.00 O ATOM 1092 CB ARG A 68 12.382 -5.369 -8.192 1.00 0.00 C ATOM 1093 CG ARG A 68 13.547 -5.504 -9.174 1.00 0.00 C ATOM 1094 CD ARG A 68 14.818 -4.867 -8.608 1.00 0.00 C ATOM 1095 NE ARG A 68 15.710 -5.915 -8.063 1.00 0.00 N ATOM 1096 CZ ARG A 68 16.334 -6.834 -8.812 1.00 0.00 C ATOM 1097 NH1 ARG A 68 16.168 -6.840 -10.141 1.00 0.00 N ATOM 1098 NH2 ARG A 68 17.125 -7.747 -8.231 1.00 0.00 N ATOM 0 H ARG A 68 10.836 -3.799 -9.336 1.00 0.00 H new ATOM 0 HA ARG A 68 11.292 -6.502 -9.655 1.00 0.00 H new ATOM 0 HB2 ARG A 68 12.295 -4.333 -7.866 1.00 0.00 H new ATOM 0 HB3 ARG A 68 12.580 -5.967 -7.303 1.00 0.00 H new ATOM 0 HG2 ARG A 68 13.728 -6.558 -9.387 1.00 0.00 H new ATOM 0 HG3 ARG A 68 13.287 -5.028 -10.120 1.00 0.00 H new ATOM 0 HD2 ARG A 68 15.334 -4.309 -9.389 1.00 0.00 H new ATOM 0 HD3 ARG A 68 14.560 -4.154 -7.825 1.00 0.00 H new ATOM 0 HE ARG A 68 15.859 -5.939 -7.054 1.00 0.00 H new ATOM 0 HH11 ARG A 68 15.566 -6.145 -10.583 1.00 0.00 H new ATOM 0 HH12 ARG A 68 16.643 -7.540 -10.711 1.00 0.00 H new ATOM 0 HH21 ARG A 68 17.252 -7.742 -7.219 1.00 0.00 H new ATOM 0 HH22 ARG A 68 17.600 -8.447 -8.801 1.00 0.00 H new ATOM 1112 N MET A 69 9.412 -5.753 -7.085 1.00 0.00 N ATOM 1113 CA MET A 69 8.545 -6.299 -6.054 1.00 0.00 C ATOM 1114 C MET A 69 7.652 -7.405 -6.619 1.00 0.00 C ATOM 1115 O MET A 69 7.666 -8.532 -6.127 1.00 0.00 O ATOM 1116 CB MET A 69 7.672 -5.182 -5.477 1.00 0.00 C ATOM 1117 CG MET A 69 7.805 -5.114 -3.955 1.00 0.00 C ATOM 1118 SD MET A 69 6.420 -4.228 -3.260 1.00 0.00 S ATOM 1119 CE MET A 69 7.288 -2.968 -2.339 1.00 0.00 C ATOM 0 H MET A 69 9.342 -4.743 -7.210 1.00 0.00 H new ATOM 0 HA MET A 69 9.169 -6.727 -5.269 1.00 0.00 H new ATOM 0 HB2 MET A 69 7.962 -4.226 -5.914 1.00 0.00 H new ATOM 0 HB3 MET A 69 6.630 -5.353 -5.747 1.00 0.00 H new ATOM 0 HG2 MET A 69 7.848 -6.121 -3.540 1.00 0.00 H new ATOM 0 HG3 MET A 69 8.737 -4.618 -3.685 1.00 0.00 H new ATOM 0 HE1 MET A 69 6.567 -2.321 -1.839 1.00 0.00 H new ATOM 0 HE2 MET A 69 7.931 -3.439 -1.595 1.00 0.00 H new ATOM 0 HE3 MET A 69 7.897 -2.374 -3.020 1.00 0.00 H new ATOM 1129 N LYS A 70 6.895 -7.044 -7.645 1.00 0.00 N ATOM 1130 CA LYS A 70 5.997 -7.992 -8.282 1.00 0.00 C ATOM 1131 C LYS A 70 6.816 -9.001 -9.090 1.00 0.00 C ATOM 1132 O LYS A 70 6.518 -10.195 -9.083 1.00 0.00 O ATOM 1133 CB LYS A 70 4.940 -7.256 -9.109 1.00 0.00 C ATOM 1134 CG LYS A 70 5.469 -6.925 -10.506 1.00 0.00 C ATOM 1135 CD LYS A 70 5.498 -8.173 -11.391 1.00 0.00 C ATOM 1136 CE LYS A 70 4.702 -7.950 -12.679 1.00 0.00 C ATOM 1137 NZ LYS A 70 5.589 -8.049 -13.860 1.00 0.00 N ATOM 0 H LYS A 70 6.885 -6.108 -8.051 1.00 0.00 H new ATOM 0 HA LYS A 70 5.445 -8.557 -7.531 1.00 0.00 H new ATOM 0 HB2 LYS A 70 4.044 -7.872 -9.192 1.00 0.00 H new ATOM 0 HB3 LYS A 70 4.649 -6.337 -8.599 1.00 0.00 H new ATOM 0 HG2 LYS A 70 4.840 -6.163 -10.966 1.00 0.00 H new ATOM 0 HG3 LYS A 70 6.472 -6.506 -10.429 1.00 0.00 H new ATOM 0 HD2 LYS A 70 6.530 -8.426 -11.636 1.00 0.00 H new ATOM 0 HD3 LYS A 70 5.083 -9.020 -10.845 1.00 0.00 H new ATOM 0 HE2 LYS A 70 3.904 -8.689 -12.753 1.00 0.00 H new ATOM 0 HE3 LYS A 70 4.227 -6.969 -12.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 5.033 -7.895 -14.725 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 6.335 -7.328 -13.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 6.023 -8.994 -13.890 1.00 0.00 H new ATOM 1151 N VAL A 71 7.832 -8.485 -9.765 1.00 0.00 N ATOM 1152 CA VAL A 71 8.696 -9.326 -10.576 1.00 0.00 C ATOM 1153 C VAL A 71 9.357 -10.379 -9.684 1.00 0.00 C ATOM 1154 O VAL A 71 9.665 -11.479 -10.141 1.00 0.00 O ATOM 1155 CB VAL A 71 9.708 -8.462 -11.331 1.00 0.00 C ATOM 1156 CG1 VAL A 71 10.576 -9.317 -12.257 1.00 0.00 C ATOM 1157 CG2 VAL A 71 9.005 -7.349 -12.112 1.00 0.00 C ATOM 0 H VAL A 71 8.077 -7.495 -9.767 1.00 0.00 H new ATOM 0 HA VAL A 71 8.115 -9.856 -11.330 1.00 0.00 H new ATOM 0 HB VAL A 71 10.362 -7.994 -10.596 1.00 0.00 H new ATOM 0 HG11 VAL A 71 11.287 -8.678 -12.782 1.00 0.00 H new ATOM 0 HG12 VAL A 71 11.119 -10.056 -11.667 1.00 0.00 H new ATOM 0 HG13 VAL A 71 9.942 -9.826 -12.982 1.00 0.00 H new ATOM 0 HG21 VAL A 71 9.747 -6.750 -12.639 1.00 0.00 H new ATOM 0 HG22 VAL A 71 8.316 -7.789 -12.832 1.00 0.00 H new ATOM 0 HG23 VAL A 71 8.451 -6.714 -11.421 1.00 0.00 H new ATOM 1167 N ILE A 72 9.557 -10.005 -8.429 1.00 0.00 N ATOM 1168 CA ILE A 72 10.175 -10.904 -7.470 1.00 0.00 C ATOM 1169 C ILE A 72 9.228 -12.071 -7.186 1.00 0.00 C ATOM 1170 O ILE A 72 9.639 -13.230 -7.211 1.00 0.00 O ATOM 1171 CB ILE A 72 10.601 -10.138 -6.215 1.00 0.00 C ATOM 1172 CG1 ILE A 72 12.010 -9.562 -6.376 1.00 0.00 C ATOM 1173 CG2 ILE A 72 10.481 -11.017 -4.969 1.00 0.00 C ATOM 1174 CD1 ILE A 72 13.061 -10.674 -6.373 1.00 0.00 C ATOM 0 H ILE A 72 9.302 -9.091 -8.054 1.00 0.00 H new ATOM 0 HA ILE A 72 11.090 -11.329 -7.882 1.00 0.00 H new ATOM 0 HB ILE A 72 9.922 -9.296 -6.082 1.00 0.00 H new ATOM 0 HG12 ILE A 72 12.073 -9.000 -7.308 1.00 0.00 H new ATOM 0 HG13 ILE A 72 12.215 -8.861 -5.567 1.00 0.00 H new ATOM 0 HG21 ILE A 72 10.790 -10.449 -4.092 1.00 0.00 H new ATOM 0 HG22 ILE A 72 9.446 -11.337 -4.848 1.00 0.00 H new ATOM 0 HG23 ILE A 72 11.121 -11.892 -5.078 1.00 0.00 H new ATOM 0 HD11 ILE A 72 14.053 -10.237 -6.489 1.00 0.00 H new ATOM 0 HD12 ILE A 72 13.012 -11.218 -5.430 1.00 0.00 H new ATOM 0 HD13 ILE A 72 12.868 -11.360 -7.198 1.00 0.00 H new ATOM 1186 N ASP A 73 7.976 -11.724 -6.921 1.00 0.00 N ATOM 1187 CA ASP A 73 6.967 -12.728 -6.632 1.00 0.00 C ATOM 1188 C ASP A 73 5.592 -12.194 -7.038 1.00 0.00 C ATOM 1189 O ASP A 73 5.395 -10.984 -7.133 1.00 0.00 O ATOM 1190 CB ASP A 73 6.925 -13.054 -5.138 1.00 0.00 C ATOM 1191 CG ASP A 73 7.562 -14.389 -4.749 1.00 0.00 C ATOM 1192 OD1 ASP A 73 7.287 -15.378 -5.462 1.00 0.00 O ATOM 1193 OD2 ASP A 73 8.310 -14.391 -3.747 1.00 0.00 O ATOM 0 H ASP A 73 7.638 -10.762 -6.901 1.00 0.00 H new ATOM 0 HA ASP A 73 7.219 -13.630 -7.190 1.00 0.00 H new ATOM 0 HB2 ASP A 73 7.429 -12.256 -4.593 1.00 0.00 H new ATOM 0 HB3 ASP A 73 5.885 -13.056 -4.811 1.00 0.00 H new ATOM 1198 N GLU A 74 4.675 -13.123 -7.267 1.00 0.00 N ATOM 1199 CA GLU A 74 3.324 -12.761 -7.661 1.00 0.00 C ATOM 1200 C GLU A 74 2.361 -12.952 -6.488 1.00 0.00 C ATOM 1201 O GLU A 74 1.145 -12.888 -6.662 1.00 0.00 O ATOM 1202 CB GLU A 74 2.873 -13.570 -8.878 1.00 0.00 C ATOM 1203 CG GLU A 74 2.302 -14.925 -8.456 1.00 0.00 C ATOM 1204 CD GLU A 74 1.940 -15.773 -9.677 1.00 0.00 C ATOM 1205 OE1 GLU A 74 2.864 -16.426 -10.208 1.00 0.00 O ATOM 1206 OE2 GLU A 74 0.748 -15.749 -10.051 1.00 0.00 O ATOM 0 H GLU A 74 4.841 -14.126 -7.187 1.00 0.00 H new ATOM 0 HA GLU A 74 3.318 -11.708 -7.943 1.00 0.00 H new ATOM 0 HB2 GLU A 74 2.119 -13.010 -9.432 1.00 0.00 H new ATOM 0 HB3 GLU A 74 3.717 -13.721 -9.552 1.00 0.00 H new ATOM 0 HG2 GLU A 74 3.031 -15.456 -7.844 1.00 0.00 H new ATOM 0 HG3 GLU A 74 1.417 -14.774 -7.839 1.00 0.00 H new ATOM 1213 N ASN A 75 2.940 -13.181 -5.319 1.00 0.00 N ATOM 1214 CA ASN A 75 2.148 -13.381 -4.117 1.00 0.00 C ATOM 1215 C ASN A 75 2.148 -12.094 -3.291 1.00 0.00 C ATOM 1216 O ASN A 75 1.372 -11.958 -2.347 1.00 0.00 O ATOM 1217 CB ASN A 75 2.732 -14.499 -3.252 1.00 0.00 C ATOM 1218 CG ASN A 75 1.635 -15.204 -2.452 1.00 0.00 C ATOM 1219 OD1 ASN A 75 0.456 -14.923 -2.586 1.00 0.00 O ATOM 1220 ND2 ASN A 75 2.088 -16.134 -1.615 1.00 0.00 N ATOM 0 H ASN A 75 3.949 -13.233 -5.178 1.00 0.00 H new ATOM 0 HA ASN A 75 1.137 -13.652 -4.421 1.00 0.00 H new ATOM 0 HB2 ASN A 75 3.247 -15.222 -3.885 1.00 0.00 H new ATOM 0 HB3 ASN A 75 3.475 -14.086 -2.570 1.00 0.00 H new ATOM 0 HD21 ASN A 75 1.434 -16.661 -1.036 1.00 0.00 H new ATOM 0 HD22 ASN A 75 3.089 -16.319 -1.552 1.00 0.00 H new ATOM 1227 N ILE A 76 3.029 -11.182 -3.676 1.00 0.00 N ATOM 1228 CA ILE A 76 3.141 -9.910 -2.982 1.00 0.00 C ATOM 1229 C ILE A 76 1.940 -9.032 -3.339 1.00 0.00 C ATOM 1230 O ILE A 76 1.607 -8.877 -4.513 1.00 0.00 O ATOM 1231 CB ILE A 76 4.492 -9.255 -3.278 1.00 0.00 C ATOM 1232 CG1 ILE A 76 4.789 -8.135 -2.279 1.00 0.00 C ATOM 1233 CG2 ILE A 76 4.557 -8.764 -4.726 1.00 0.00 C ATOM 1234 CD1 ILE A 76 5.810 -7.148 -2.850 1.00 0.00 C ATOM 0 H ILE A 76 3.672 -11.299 -4.459 1.00 0.00 H new ATOM 0 HA ILE A 76 3.116 -10.061 -1.903 1.00 0.00 H new ATOM 0 HB ILE A 76 5.271 -10.008 -3.158 1.00 0.00 H new ATOM 0 HG12 ILE A 76 3.867 -7.608 -2.033 1.00 0.00 H new ATOM 0 HG13 ILE A 76 5.170 -8.562 -1.351 1.00 0.00 H new ATOM 0 HG21 ILE A 76 5.527 -8.303 -4.911 1.00 0.00 H new ATOM 0 HG22 ILE A 76 4.422 -9.608 -5.403 1.00 0.00 H new ATOM 0 HG23 ILE A 76 3.768 -8.031 -4.898 1.00 0.00 H new ATOM 0 HD11 ILE A 76 6.004 -6.362 -2.120 1.00 0.00 H new ATOM 0 HD12 ILE A 76 6.739 -7.673 -3.072 1.00 0.00 H new ATOM 0 HD13 ILE A 76 5.416 -6.705 -3.765 1.00 0.00 H new ATOM 1246 N ARG A 77 1.323 -8.480 -2.304 1.00 0.00 N ATOM 1247 CA ARG A 77 0.166 -7.622 -2.494 1.00 0.00 C ATOM 1248 C ARG A 77 0.462 -6.211 -1.982 1.00 0.00 C ATOM 1249 O ARG A 77 0.597 -5.999 -0.777 1.00 0.00 O ATOM 1250 CB ARG A 77 -1.058 -8.176 -1.762 1.00 0.00 C ATOM 1251 CG ARG A 77 -2.042 -7.058 -1.415 1.00 0.00 C ATOM 1252 CD ARG A 77 -3.470 -7.597 -1.311 1.00 0.00 C ATOM 1253 NE ARG A 77 -3.533 -8.672 -0.296 1.00 0.00 N ATOM 1254 CZ ARG A 77 -3.469 -9.980 -0.581 1.00 0.00 C ATOM 1255 NH1 ARG A 77 -3.341 -10.382 -1.853 1.00 0.00 N ATOM 1256 NH2 ARG A 77 -3.534 -10.885 0.405 1.00 0.00 N ATOM 0 H ARG A 77 1.603 -8.610 -1.332 1.00 0.00 H new ATOM 0 HA ARG A 77 -0.049 -7.588 -3.562 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -1.553 -8.920 -2.386 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -0.742 -8.683 -0.850 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -1.754 -6.596 -0.471 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -1.998 -6.280 -2.177 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -4.153 -6.791 -1.042 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -3.794 -7.980 -2.279 1.00 0.00 H new ATOM 0 HE ARG A 77 -3.631 -8.400 0.682 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -3.292 -9.693 -2.603 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -3.292 -11.377 -2.071 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -3.632 -10.579 1.373 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -3.485 -11.880 0.188 1.00 0.00 H new ATOM 1270 N VAL A 78 0.556 -5.282 -2.922 1.00 0.00 N ATOM 1271 CA VAL A 78 0.834 -3.897 -2.580 1.00 0.00 C ATOM 1272 C VAL A 78 -0.008 -2.978 -3.468 1.00 0.00 C ATOM 1273 O VAL A 78 -0.247 -3.285 -4.635 1.00 0.00 O ATOM 1274 CB VAL A 78 2.335 -3.622 -2.690 1.00 0.00 C ATOM 1275 CG1 VAL A 78 2.685 -3.028 -4.056 1.00 0.00 C ATOM 1276 CG2 VAL A 78 2.810 -2.710 -1.557 1.00 0.00 C ATOM 0 H VAL A 78 0.445 -5.461 -3.920 1.00 0.00 H new ATOM 0 HA VAL A 78 0.555 -3.696 -1.546 1.00 0.00 H new ATOM 0 HB VAL A 78 2.858 -4.574 -2.595 1.00 0.00 H new ATOM 0 HG11 VAL A 78 3.758 -2.842 -4.108 1.00 0.00 H new ATOM 0 HG12 VAL A 78 2.400 -3.728 -4.841 1.00 0.00 H new ATOM 0 HG13 VAL A 78 2.147 -2.090 -4.193 1.00 0.00 H new ATOM 0 HG21 VAL A 78 3.880 -2.530 -1.659 1.00 0.00 H new ATOM 0 HG22 VAL A 78 2.277 -1.761 -1.606 1.00 0.00 H new ATOM 0 HG23 VAL A 78 2.612 -3.188 -0.598 1.00 0.00 H new ATOM 1286 N ILE A 79 -0.435 -1.870 -2.881 1.00 0.00 N ATOM 1287 CA ILE A 79 -1.246 -0.905 -3.604 1.00 0.00 C ATOM 1288 C ILE A 79 -0.406 0.339 -3.901 1.00 0.00 C ATOM 1289 O ILE A 79 0.390 0.769 -3.067 1.00 0.00 O ATOM 1290 CB ILE A 79 -2.535 -0.606 -2.836 1.00 0.00 C ATOM 1291 CG1 ILE A 79 -3.667 -1.533 -3.285 1.00 0.00 C ATOM 1292 CG2 ILE A 79 -2.919 0.870 -2.962 1.00 0.00 C ATOM 1293 CD1 ILE A 79 -5.025 -1.008 -2.814 1.00 0.00 C ATOM 0 H ILE A 79 -0.235 -1.619 -1.913 1.00 0.00 H new ATOM 0 HA ILE A 79 -1.561 -1.315 -4.563 1.00 0.00 H new ATOM 0 HB ILE A 79 -2.357 -0.803 -1.779 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -3.663 -1.618 -4.372 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -3.502 -2.534 -2.886 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -3.839 1.055 -2.407 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -2.119 1.490 -2.557 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -3.073 1.118 -4.012 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -5.812 -1.685 -3.146 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -5.034 -0.947 -1.726 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -5.198 -0.017 -3.234 1.00 0.00 H new ATOM 1305 N ILE A 80 -0.611 0.882 -5.092 1.00 0.00 N ATOM 1306 CA ILE A 80 0.117 2.068 -5.510 1.00 0.00 C ATOM 1307 C ILE A 80 -0.799 3.288 -5.403 1.00 0.00 C ATOM 1308 O ILE A 80 -2.021 3.159 -5.461 1.00 0.00 O ATOM 1309 CB ILE A 80 0.713 1.867 -6.905 1.00 0.00 C ATOM 1310 CG1 ILE A 80 -0.345 2.081 -7.989 1.00 0.00 C ATOM 1311 CG2 ILE A 80 1.385 0.497 -7.022 1.00 0.00 C ATOM 1312 CD1 ILE A 80 -0.718 3.560 -8.107 1.00 0.00 C ATOM 0 H ILE A 80 -1.271 0.522 -5.781 1.00 0.00 H new ATOM 0 HA ILE A 80 0.965 2.247 -4.849 1.00 0.00 H new ATOM 0 HB ILE A 80 1.487 2.619 -7.058 1.00 0.00 H new ATOM 0 HG12 ILE A 80 0.032 1.720 -8.946 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -1.234 1.496 -7.755 1.00 0.00 H new ATOM 0 HG21 ILE A 80 1.800 0.380 -8.023 1.00 0.00 H new ATOM 0 HG22 ILE A 80 2.185 0.420 -6.286 1.00 0.00 H new ATOM 0 HG23 ILE A 80 0.649 -0.286 -6.841 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -1.472 3.684 -8.885 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -1.117 3.912 -7.156 1.00 0.00 H new ATOM 0 HD13 ILE A 80 0.168 4.139 -8.365 1.00 0.00 H new ATOM 1324 N MET A 81 -0.173 4.446 -5.247 1.00 0.00 N ATOM 1325 CA MET A 81 -0.917 5.689 -5.131 1.00 0.00 C ATOM 1326 C MET A 81 -0.228 6.815 -5.904 1.00 0.00 C ATOM 1327 O MET A 81 0.957 7.075 -5.703 1.00 0.00 O ATOM 1328 CB MET A 81 -1.034 6.078 -3.656 1.00 0.00 C ATOM 1329 CG MET A 81 0.029 5.368 -2.816 1.00 0.00 C ATOM 1330 SD MET A 81 0.302 6.261 -1.295 1.00 0.00 S ATOM 1331 CE MET A 81 0.656 7.884 -1.947 1.00 0.00 C ATOM 0 H MET A 81 0.841 4.549 -5.198 1.00 0.00 H new ATOM 0 HA MET A 81 -1.909 5.538 -5.556 1.00 0.00 H new ATOM 0 HB2 MET A 81 -0.924 7.157 -3.551 1.00 0.00 H new ATOM 0 HB3 MET A 81 -2.027 5.821 -3.286 1.00 0.00 H new ATOM 0 HG2 MET A 81 -0.290 4.349 -2.597 1.00 0.00 H new ATOM 0 HG3 MET A 81 0.960 5.297 -3.378 1.00 0.00 H new ATOM 0 HE1 MET A 81 1.511 8.309 -1.422 1.00 0.00 H new ATOM 0 HE2 MET A 81 0.885 7.807 -3.010 1.00 0.00 H new ATOM 0 HE3 MET A 81 -0.212 8.529 -1.808 1.00 0.00 H new ATOM 1341 N THR A 82 -0.999 7.452 -6.772 1.00 0.00 N ATOM 1342 CA THR A 82 -0.478 8.544 -7.576 1.00 0.00 C ATOM 1343 C THR A 82 -1.605 9.207 -8.370 1.00 0.00 C ATOM 1344 O THR A 82 -2.520 8.532 -8.837 1.00 0.00 O ATOM 1345 CB THR A 82 0.642 7.989 -8.457 1.00 0.00 C ATOM 1346 OG1 THR A 82 0.592 8.796 -9.631 1.00 0.00 O ATOM 1347 CG2 THR A 82 0.344 6.576 -8.963 1.00 0.00 C ATOM 0 H THR A 82 -1.981 7.233 -6.936 1.00 0.00 H new ATOM 0 HA THR A 82 -0.058 9.331 -6.950 1.00 0.00 H new ATOM 0 HB THR A 82 1.576 7.984 -7.896 1.00 0.00 H new ATOM 0 HG1 THR A 82 1.074 8.348 -10.357 1.00 0.00 H new ATOM 0 HG21 THR A 82 1.171 6.230 -9.583 1.00 0.00 H new ATOM 0 HG22 THR A 82 0.221 5.904 -8.114 1.00 0.00 H new ATOM 0 HG23 THR A 82 -0.573 6.587 -9.553 1.00 0.00 H new ATOM 1355 N ALA A 83 -1.500 10.522 -8.499 1.00 0.00 N ATOM 1356 CA ALA A 83 -2.499 11.284 -9.229 1.00 0.00 C ATOM 1357 C ALA A 83 -2.632 10.718 -10.645 1.00 0.00 C ATOM 1358 O ALA A 83 -1.718 10.064 -11.143 1.00 0.00 O ATOM 1359 CB ALA A 83 -2.115 12.765 -9.227 1.00 0.00 C ATOM 0 H ALA A 83 -0.739 11.079 -8.110 1.00 0.00 H new ATOM 0 HA ALA A 83 -3.473 11.200 -8.747 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -2.865 13.336 -9.775 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -2.063 13.126 -8.200 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -1.143 12.890 -9.705 1.00 0.00 H new ATOM 1365 N TYR A 84 -3.778 10.991 -11.251 1.00 0.00 N ATOM 1366 CA TYR A 84 -4.042 10.517 -12.599 1.00 0.00 C ATOM 1367 C TYR A 84 -3.256 11.330 -13.630 1.00 0.00 C ATOM 1368 O TYR A 84 -3.832 11.859 -14.579 1.00 0.00 O ATOM 1369 CB TYR A 84 -5.539 10.728 -12.835 1.00 0.00 C ATOM 1370 CG TYR A 84 -6.021 12.149 -12.537 1.00 0.00 C ATOM 1371 CD1 TYR A 84 -6.428 12.487 -11.262 1.00 0.00 C ATOM 1372 CD2 TYR A 84 -6.050 13.093 -13.543 1.00 0.00 C ATOM 1373 CE1 TYR A 84 -6.882 13.824 -10.982 1.00 0.00 C ATOM 1374 CE2 TYR A 84 -6.504 14.431 -13.263 1.00 0.00 C ATOM 1375 CZ TYR A 84 -6.898 14.730 -11.996 1.00 0.00 C ATOM 1376 OH TYR A 84 -7.327 15.993 -11.731 1.00 0.00 O ATOM 0 H TYR A 84 -4.534 11.534 -10.834 1.00 0.00 H new ATOM 0 HA TYR A 84 -3.745 9.473 -12.704 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -5.770 10.487 -13.872 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -6.097 10.028 -12.213 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -6.406 11.748 -10.474 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -5.732 12.829 -14.541 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -7.203 14.101 -9.989 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -6.531 15.179 -14.041 1.00 0.00 H new ATOM 0 HH TYR A 84 -7.283 16.532 -12.549 1.00 0.00 H new ATOM 1386 N GLY A 85 -1.952 11.405 -13.408 1.00 0.00 N ATOM 1387 CA GLY A 85 -1.081 12.144 -14.306 1.00 0.00 C ATOM 1388 C GLY A 85 -0.105 11.207 -15.019 1.00 0.00 C ATOM 1389 O GLY A 85 0.280 11.457 -16.160 1.00 0.00 O ATOM 0 H GLY A 85 -1.477 10.966 -12.619 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -1.681 12.678 -15.042 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -0.525 12.894 -13.743 1.00 0.00 H new ATOM 1393 N GLU A 86 0.268 10.147 -14.317 1.00 0.00 N ATOM 1394 CA GLU A 86 1.192 9.171 -14.868 1.00 0.00 C ATOM 1395 C GLU A 86 0.486 7.829 -15.075 1.00 0.00 C ATOM 1396 O GLU A 86 1.005 6.784 -14.686 1.00 0.00 O ATOM 1397 CB GLU A 86 2.421 9.011 -13.971 1.00 0.00 C ATOM 1398 CG GLU A 86 2.048 9.173 -12.496 1.00 0.00 C ATOM 1399 CD GLU A 86 3.091 8.513 -11.592 1.00 0.00 C ATOM 1400 OE1 GLU A 86 4.281 8.860 -11.750 1.00 0.00 O ATOM 1401 OE2 GLU A 86 2.675 7.676 -10.762 1.00 0.00 O ATOM 0 H GLU A 86 -0.053 9.943 -13.371 1.00 0.00 H new ATOM 0 HA GLU A 86 1.535 9.532 -15.837 1.00 0.00 H new ATOM 0 HB2 GLU A 86 2.867 8.030 -14.131 1.00 0.00 H new ATOM 0 HB3 GLU A 86 3.173 9.752 -14.243 1.00 0.00 H new ATOM 0 HG2 GLU A 86 1.968 10.232 -12.252 1.00 0.00 H new ATOM 0 HG3 GLU A 86 1.070 8.729 -12.313 1.00 0.00 H new ATOM 1408 N LEU A 87 -0.687 7.902 -15.686 1.00 0.00 N ATOM 1409 CA LEU A 87 -1.470 6.706 -15.949 1.00 0.00 C ATOM 1410 C LEU A 87 -0.552 5.612 -16.497 1.00 0.00 C ATOM 1411 O LEU A 87 -0.713 4.438 -16.166 1.00 0.00 O ATOM 1412 CB LEU A 87 -2.654 7.031 -16.862 1.00 0.00 C ATOM 1413 CG LEU A 87 -3.613 8.111 -16.358 1.00 0.00 C ATOM 1414 CD1 LEU A 87 -4.145 8.956 -17.517 1.00 0.00 C ATOM 1415 CD2 LEU A 87 -4.744 7.497 -15.530 1.00 0.00 C ATOM 0 H LEU A 87 -1.115 8.771 -16.007 1.00 0.00 H new ATOM 0 HA LEU A 87 -1.905 6.324 -15.026 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -2.265 7.342 -17.831 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -3.223 6.116 -17.026 1.00 0.00 H new ATOM 0 HG LEU A 87 -3.059 8.780 -15.700 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -4.824 9.716 -17.131 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -3.312 9.439 -18.027 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -4.678 8.316 -18.219 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -5.411 8.286 -15.184 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -5.304 6.792 -16.145 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.324 6.975 -14.671 1.00 0.00 H new ATOM 1427 N ASP A 88 0.391 6.035 -17.327 1.00 0.00 N ATOM 1428 CA ASP A 88 1.334 5.105 -17.924 1.00 0.00 C ATOM 1429 C ASP A 88 1.890 4.181 -16.839 1.00 0.00 C ATOM 1430 O ASP A 88 1.815 2.959 -16.961 1.00 0.00 O ATOM 1431 CB ASP A 88 2.510 5.848 -18.561 1.00 0.00 C ATOM 1432 CG ASP A 88 2.482 5.915 -20.089 1.00 0.00 C ATOM 1433 OD1 ASP A 88 1.708 5.129 -20.678 1.00 0.00 O ATOM 1434 OD2 ASP A 88 3.234 6.752 -20.634 1.00 0.00 O ATOM 0 H ASP A 88 0.522 7.009 -17.600 1.00 0.00 H new ATOM 0 HA ASP A 88 0.808 4.537 -18.691 1.00 0.00 H new ATOM 0 HB2 ASP A 88 2.533 6.865 -18.168 1.00 0.00 H new ATOM 0 HB3 ASP A 88 3.436 5.365 -18.251 1.00 0.00 H new ATOM 1439 N MET A 89 2.434 4.800 -15.802 1.00 0.00 N ATOM 1440 CA MET A 89 3.002 4.048 -14.695 1.00 0.00 C ATOM 1441 C MET A 89 1.918 3.268 -13.948 1.00 0.00 C ATOM 1442 O MET A 89 2.080 2.081 -13.673 1.00 0.00 O ATOM 1443 CB MET A 89 3.698 5.008 -13.729 1.00 0.00 C ATOM 1444 CG MET A 89 3.916 4.351 -12.365 1.00 0.00 C ATOM 1445 SD MET A 89 4.932 5.399 -11.337 1.00 0.00 S ATOM 1446 CE MET A 89 5.750 4.161 -10.345 1.00 0.00 C ATOM 0 H MET A 89 2.494 5.814 -15.704 1.00 0.00 H new ATOM 0 HA MET A 89 3.724 3.336 -15.096 1.00 0.00 H new ATOM 0 HB2 MET A 89 4.657 5.317 -14.145 1.00 0.00 H new ATOM 0 HB3 MET A 89 3.097 5.910 -13.610 1.00 0.00 H new ATOM 0 HG2 MET A 89 2.956 4.173 -11.880 1.00 0.00 H new ATOM 0 HG3 MET A 89 4.394 3.380 -12.492 1.00 0.00 H new ATOM 0 HE1 MET A 89 6.528 4.632 -9.744 1.00 0.00 H new ATOM 0 HE2 MET A 89 5.023 3.683 -9.688 1.00 0.00 H new ATOM 0 HE3 MET A 89 6.199 3.411 -10.996 1.00 0.00 H new ATOM 1456 N ILE A 90 0.836 3.969 -13.641 1.00 0.00 N ATOM 1457 CA ILE A 90 -0.275 3.357 -12.931 1.00 0.00 C ATOM 1458 C ILE A 90 -0.721 2.099 -13.679 1.00 0.00 C ATOM 1459 O ILE A 90 -0.776 1.015 -13.099 1.00 0.00 O ATOM 1460 CB ILE A 90 -1.397 4.374 -12.714 1.00 0.00 C ATOM 1461 CG1 ILE A 90 -0.944 5.500 -11.783 1.00 0.00 C ATOM 1462 CG2 ILE A 90 -2.668 3.689 -12.209 1.00 0.00 C ATOM 1463 CD1 ILE A 90 -1.317 6.869 -12.355 1.00 0.00 C ATOM 0 H ILE A 90 0.705 4.954 -13.871 1.00 0.00 H new ATOM 0 HA ILE A 90 0.036 3.043 -11.935 1.00 0.00 H new ATOM 0 HB ILE A 90 -1.637 4.828 -13.675 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -1.405 5.374 -10.803 1.00 0.00 H new ATOM 0 HG13 ILE A 90 0.135 5.444 -11.638 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -3.450 4.435 -12.063 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -3.000 2.953 -12.941 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -2.461 3.190 -11.262 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -0.983 7.651 -11.673 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -0.835 7.002 -13.324 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -2.399 6.930 -12.476 1.00 0.00 H new ATOM 1475 N GLN A 91 -1.030 2.285 -14.954 1.00 0.00 N ATOM 1476 CA GLN A 91 -1.470 1.178 -15.786 1.00 0.00 C ATOM 1477 C GLN A 91 -0.535 -0.021 -15.613 1.00 0.00 C ATOM 1478 O GLN A 91 -0.989 -1.135 -15.358 1.00 0.00 O ATOM 1479 CB GLN A 91 -1.557 1.598 -17.255 1.00 0.00 C ATOM 1480 CG GLN A 91 -2.984 2.008 -17.624 1.00 0.00 C ATOM 1481 CD GLN A 91 -3.551 1.097 -18.715 1.00 0.00 C ATOM 1482 OE1 GLN A 91 -2.979 0.080 -19.070 1.00 0.00 O ATOM 1483 NE2 GLN A 91 -4.704 1.519 -19.226 1.00 0.00 N ATOM 0 H GLN A 91 -0.984 3.185 -15.431 1.00 0.00 H new ATOM 0 HA GLN A 91 -2.469 0.883 -15.466 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -0.877 2.429 -17.440 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -1.235 0.774 -17.892 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -3.620 1.962 -16.740 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -2.992 3.042 -17.968 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -5.129 2.380 -18.883 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -5.163 0.981 -19.961 1.00 0.00 H new ATOM 1492 N GLU A 92 0.754 0.249 -15.758 1.00 0.00 N ATOM 1493 CA GLU A 92 1.757 -0.794 -15.621 1.00 0.00 C ATOM 1494 C GLU A 92 1.641 -1.464 -14.250 1.00 0.00 C ATOM 1495 O GLU A 92 1.565 -2.689 -14.159 1.00 0.00 O ATOM 1496 CB GLU A 92 3.164 -0.234 -15.841 1.00 0.00 C ATOM 1497 CG GLU A 92 3.768 -0.765 -17.142 1.00 0.00 C ATOM 1498 CD GLU A 92 4.634 0.300 -17.819 1.00 0.00 C ATOM 1499 OE1 GLU A 92 5.801 0.437 -17.393 1.00 0.00 O ATOM 1500 OE2 GLU A 92 4.109 0.953 -18.747 1.00 0.00 O ATOM 0 H GLU A 92 1.127 1.175 -15.969 1.00 0.00 H new ATOM 0 HA GLU A 92 1.578 -1.547 -16.388 1.00 0.00 H new ATOM 0 HB2 GLU A 92 3.125 0.855 -15.872 1.00 0.00 H new ATOM 0 HB3 GLU A 92 3.803 -0.507 -15.001 1.00 0.00 H new ATOM 0 HG2 GLU A 92 4.370 -1.650 -16.933 1.00 0.00 H new ATOM 0 HG3 GLU A 92 2.971 -1.074 -17.818 1.00 0.00 H new ATOM 1507 N SER A 93 1.632 -0.633 -13.219 1.00 0.00 N ATOM 1508 CA SER A 93 1.527 -1.130 -11.858 1.00 0.00 C ATOM 1509 C SER A 93 0.309 -2.047 -11.728 1.00 0.00 C ATOM 1510 O SER A 93 0.339 -3.022 -10.978 1.00 0.00 O ATOM 1511 CB SER A 93 1.431 0.023 -10.856 1.00 0.00 C ATOM 1512 OG SER A 93 1.305 1.285 -11.506 1.00 0.00 O ATOM 0 H SER A 93 1.696 0.382 -13.299 1.00 0.00 H new ATOM 0 HA SER A 93 2.429 -1.699 -11.632 1.00 0.00 H new ATOM 0 HB2 SER A 93 0.574 -0.135 -10.202 1.00 0.00 H new ATOM 0 HB3 SER A 93 2.318 0.028 -10.223 1.00 0.00 H new ATOM 0 HG SER A 93 2.133 1.488 -11.989 1.00 0.00 H new ATOM 1518 N LYS A 94 -0.733 -1.703 -12.471 1.00 0.00 N ATOM 1519 CA LYS A 94 -1.958 -2.484 -12.448 1.00 0.00 C ATOM 1520 C LYS A 94 -1.719 -3.821 -13.153 1.00 0.00 C ATOM 1521 O LYS A 94 -2.067 -4.876 -12.625 1.00 0.00 O ATOM 1522 CB LYS A 94 -3.118 -1.678 -13.036 1.00 0.00 C ATOM 1523 CG LYS A 94 -4.291 -1.610 -12.055 1.00 0.00 C ATOM 1524 CD LYS A 94 -5.599 -1.299 -12.785 1.00 0.00 C ATOM 1525 CE LYS A 94 -6.799 -1.454 -11.850 1.00 0.00 C ATOM 1526 NZ LYS A 94 -8.024 -1.755 -12.624 1.00 0.00 N ATOM 0 H LYS A 94 -0.754 -0.894 -13.092 1.00 0.00 H new ATOM 0 HA LYS A 94 -2.246 -2.711 -11.421 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -2.780 -0.670 -13.275 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -3.446 -2.134 -13.970 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -4.382 -2.558 -11.526 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -4.098 -0.843 -11.305 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -5.568 -0.282 -13.177 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -5.710 -1.967 -13.639 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -6.609 -2.253 -11.134 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -6.940 -0.539 -11.276 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -8.829 -1.857 -11.974 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -8.213 -0.979 -13.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -7.892 -2.641 -13.153 1.00 0.00 H new ATOM 1540 N GLU A 95 -1.127 -3.732 -14.335 1.00 0.00 N ATOM 1541 CA GLU A 95 -0.837 -4.922 -15.118 1.00 0.00 C ATOM 1542 C GLU A 95 0.341 -5.684 -14.509 1.00 0.00 C ATOM 1543 O GLU A 95 0.615 -6.821 -14.892 1.00 0.00 O ATOM 1544 CB GLU A 95 -0.562 -4.563 -16.579 1.00 0.00 C ATOM 1545 CG GLU A 95 -1.694 -3.711 -17.157 1.00 0.00 C ATOM 1546 CD GLU A 95 -2.953 -4.551 -17.381 1.00 0.00 C ATOM 1547 OE1 GLU A 95 -3.706 -4.718 -16.397 1.00 0.00 O ATOM 1548 OE2 GLU A 95 -3.134 -5.007 -18.530 1.00 0.00 O ATOM 0 H GLU A 95 -0.840 -2.855 -14.770 1.00 0.00 H new ATOM 0 HA GLU A 95 -1.713 -5.570 -15.096 1.00 0.00 H new ATOM 0 HB2 GLU A 95 0.380 -4.020 -16.653 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -0.452 -5.474 -17.167 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -1.918 -2.888 -16.478 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -1.375 -3.268 -18.101 1.00 0.00 H new ATOM 1555 N LEU A 96 1.008 -5.027 -13.571 1.00 0.00 N ATOM 1556 CA LEU A 96 2.151 -5.629 -12.905 1.00 0.00 C ATOM 1557 C LEU A 96 1.661 -6.701 -11.929 1.00 0.00 C ATOM 1558 O LEU A 96 2.437 -7.550 -11.494 1.00 0.00 O ATOM 1559 CB LEU A 96 3.018 -4.552 -12.251 1.00 0.00 C ATOM 1560 CG LEU A 96 4.390 -4.318 -12.887 1.00 0.00 C ATOM 1561 CD1 LEU A 96 4.290 -4.292 -14.413 1.00 0.00 C ATOM 1562 CD2 LEU A 96 5.042 -3.049 -12.333 1.00 0.00 C ATOM 0 H LEU A 96 0.779 -4.084 -13.257 1.00 0.00 H new ATOM 0 HA LEU A 96 2.795 -6.128 -13.629 1.00 0.00 H new ATOM 0 HB2 LEU A 96 2.467 -3.611 -12.266 1.00 0.00 H new ATOM 0 HB3 LEU A 96 3.165 -4.818 -11.204 1.00 0.00 H new ATOM 0 HG LEU A 96 5.037 -5.154 -12.621 1.00 0.00 H new ATOM 0 HD11 LEU A 96 5.279 -4.124 -14.840 1.00 0.00 H new ATOM 0 HD12 LEU A 96 3.899 -5.245 -14.768 1.00 0.00 H new ATOM 0 HD13 LEU A 96 3.621 -3.488 -14.720 1.00 0.00 H new ATOM 0 HD21 LEU A 96 6.016 -2.906 -12.801 1.00 0.00 H new ATOM 0 HD22 LEU A 96 4.406 -2.190 -12.548 1.00 0.00 H new ATOM 0 HD23 LEU A 96 5.169 -3.146 -11.255 1.00 0.00 H new ATOM 1574 N GLY A 97 0.377 -6.626 -11.613 1.00 0.00 N ATOM 1575 CA GLY A 97 -0.225 -7.578 -10.696 1.00 0.00 C ATOM 1576 C GLY A 97 -0.585 -6.910 -9.368 1.00 0.00 C ATOM 1577 O GLY A 97 -0.639 -7.569 -8.331 1.00 0.00 O ATOM 0 H GLY A 97 -0.264 -5.920 -11.976 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -1.121 -8.005 -11.147 1.00 0.00 H new ATOM 0 HA3 GLY A 97 0.466 -8.402 -10.517 1.00 0.00 H new ATOM 1581 N ALA A 98 -0.823 -5.608 -9.443 1.00 0.00 N ATOM 1582 CA ALA A 98 -1.176 -4.843 -8.260 1.00 0.00 C ATOM 1583 C ALA A 98 -2.683 -4.951 -8.018 1.00 0.00 C ATOM 1584 O ALA A 98 -3.450 -5.181 -8.952 1.00 0.00 O ATOM 1585 CB ALA A 98 -0.716 -3.394 -8.433 1.00 0.00 C ATOM 0 H ALA A 98 -0.778 -5.064 -10.305 1.00 0.00 H new ATOM 0 HA ALA A 98 -0.672 -5.243 -7.380 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -0.981 -2.820 -7.545 1.00 0.00 H new ATOM 0 HB2 ALA A 98 0.365 -3.370 -8.572 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -1.204 -2.959 -9.305 1.00 0.00 H new ATOM 1591 N LEU A 99 -3.062 -4.782 -6.760 1.00 0.00 N ATOM 1592 CA LEU A 99 -4.463 -4.858 -6.384 1.00 0.00 C ATOM 1593 C LEU A 99 -5.247 -3.778 -7.132 1.00 0.00 C ATOM 1594 O LEU A 99 -6.250 -4.071 -7.781 1.00 0.00 O ATOM 1595 CB LEU A 99 -4.615 -4.785 -4.863 1.00 0.00 C ATOM 1596 CG LEU A 99 -3.525 -5.482 -4.047 1.00 0.00 C ATOM 1597 CD1 LEU A 99 -3.034 -6.747 -4.754 1.00 0.00 C ATOM 1598 CD2 LEU A 99 -2.377 -4.521 -3.731 1.00 0.00 C ATOM 0 H LEU A 99 -2.423 -4.593 -5.988 1.00 0.00 H new ATOM 0 HA LEU A 99 -4.884 -5.820 -6.678 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -4.645 -3.735 -4.571 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -5.578 -5.219 -4.592 1.00 0.00 H new ATOM 0 HG LEU A 99 -3.957 -5.792 -3.096 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -2.260 -7.223 -4.152 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -3.867 -7.437 -4.885 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -2.625 -6.483 -5.729 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -1.616 -5.042 -3.150 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -1.939 -4.159 -4.661 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -2.757 -3.677 -3.156 1.00 0.00 H new ATOM 1610 N THR A 100 -4.760 -2.551 -7.016 1.00 0.00 N ATOM 1611 CA THR A 100 -5.403 -1.426 -7.674 1.00 0.00 C ATOM 1612 C THR A 100 -4.459 -0.222 -7.713 1.00 0.00 C ATOM 1613 O THR A 100 -3.264 -0.356 -7.454 1.00 0.00 O ATOM 1614 CB THR A 100 -6.719 -1.142 -6.947 1.00 0.00 C ATOM 1615 OG1 THR A 100 -7.286 -0.052 -7.669 1.00 0.00 O ATOM 1616 CG2 THR A 100 -6.502 -0.585 -5.539 1.00 0.00 C ATOM 0 H THR A 100 -3.928 -2.311 -6.477 1.00 0.00 H new ATOM 0 HA THR A 100 -5.633 -1.655 -8.715 1.00 0.00 H new ATOM 0 HB THR A 100 -7.306 -2.059 -6.887 1.00 0.00 H new ATOM 0 HG1 THR A 100 -7.252 -0.243 -8.630 1.00 0.00 H new ATOM 0 HG21 THR A 100 -7.467 -0.401 -5.068 1.00 0.00 H new ATOM 0 HG22 THR A 100 -5.940 -1.306 -4.945 1.00 0.00 H new ATOM 0 HG23 THR A 100 -5.944 0.349 -5.599 1.00 0.00 H new ATOM 1624 N HIS A 101 -5.032 0.928 -8.040 1.00 0.00 N ATOM 1625 CA HIS A 101 -4.257 2.155 -8.117 1.00 0.00 C ATOM 1626 C HIS A 101 -5.116 3.334 -7.658 1.00 0.00 C ATOM 1627 O HIS A 101 -6.169 3.602 -8.236 1.00 0.00 O ATOM 1628 CB HIS A 101 -3.685 2.349 -9.522 1.00 0.00 C ATOM 1629 CG HIS A 101 -4.715 2.736 -10.556 1.00 0.00 C ATOM 1630 ND1 HIS A 101 -5.175 1.857 -11.522 1.00 0.00 N ATOM 1631 CD2 HIS A 101 -5.369 3.914 -10.765 1.00 0.00 C ATOM 1632 CE1 HIS A 101 -6.065 2.489 -12.273 1.00 0.00 C ATOM 1633 NE2 HIS A 101 -6.184 3.764 -11.802 1.00 0.00 N ATOM 0 H HIS A 101 -6.023 1.035 -8.254 1.00 0.00 H new ATOM 0 HA HIS A 101 -3.401 2.091 -7.445 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -2.914 3.119 -9.486 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -3.199 1.425 -9.836 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -5.245 4.817 -10.185 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -6.602 2.069 -13.111 1.00 0.00 H new ATOM 0 HE2 HIS A 101 -6.798 4.483 -12.184 1.00 0.00 H new ATOM 1641 N PHE A 102 -4.636 4.008 -6.624 1.00 0.00 N ATOM 1642 CA PHE A 102 -5.347 5.153 -6.081 1.00 0.00 C ATOM 1643 C PHE A 102 -4.651 6.462 -6.461 1.00 0.00 C ATOM 1644 O PHE A 102 -3.456 6.472 -6.751 1.00 0.00 O ATOM 1645 CB PHE A 102 -5.335 5.006 -4.558 1.00 0.00 C ATOM 1646 CG PHE A 102 -5.997 3.723 -4.051 1.00 0.00 C ATOM 1647 CD1 PHE A 102 -7.087 3.221 -4.692 1.00 0.00 C ATOM 1648 CD2 PHE A 102 -5.495 3.085 -2.960 1.00 0.00 C ATOM 1649 CE1 PHE A 102 -7.701 2.031 -4.221 1.00 0.00 C ATOM 1650 CE2 PHE A 102 -6.110 1.894 -2.490 1.00 0.00 C ATOM 1651 CZ PHE A 102 -7.199 1.392 -3.130 1.00 0.00 C ATOM 0 H PHE A 102 -3.763 3.783 -6.147 1.00 0.00 H new ATOM 0 HA PHE A 102 -6.361 5.184 -6.479 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -4.303 5.032 -4.209 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -5.843 5.864 -4.117 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -7.485 3.728 -5.559 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -4.630 3.483 -2.451 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -8.567 1.633 -4.729 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -5.712 1.387 -1.623 1.00 0.00 H new ATOM 0 HZ PHE A 102 -7.666 0.486 -2.772 1.00 0.00 H new ATOM 1661 N ALA A 103 -5.429 7.534 -6.447 1.00 0.00 N ATOM 1662 CA ALA A 103 -4.902 8.845 -6.786 1.00 0.00 C ATOM 1663 C ALA A 103 -4.845 9.709 -5.525 1.00 0.00 C ATOM 1664 O ALA A 103 -5.675 9.563 -4.630 1.00 0.00 O ATOM 1665 CB ALA A 103 -5.764 9.473 -7.884 1.00 0.00 C ATOM 0 H ALA A 103 -6.420 7.522 -6.206 1.00 0.00 H new ATOM 0 HA ALA A 103 -3.887 8.762 -7.175 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -5.369 10.457 -8.139 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -5.748 8.836 -8.768 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -6.789 9.575 -7.528 1.00 0.00 H new ATOM 1671 N LYS A 104 -3.856 10.590 -5.495 1.00 0.00 N ATOM 1672 CA LYS A 104 -3.679 11.478 -4.358 1.00 0.00 C ATOM 1673 C LYS A 104 -5.037 11.738 -3.704 1.00 0.00 C ATOM 1674 O LYS A 104 -5.233 11.432 -2.529 1.00 0.00 O ATOM 1675 CB LYS A 104 -2.946 12.752 -4.782 1.00 0.00 C ATOM 1676 CG LYS A 104 -1.516 12.770 -4.236 1.00 0.00 C ATOM 1677 CD LYS A 104 -0.538 13.314 -5.279 1.00 0.00 C ATOM 1678 CE LYS A 104 -0.072 14.724 -4.910 1.00 0.00 C ATOM 1679 NZ LYS A 104 -0.160 15.623 -6.082 1.00 0.00 N ATOM 0 H LYS A 104 -3.169 10.708 -6.240 1.00 0.00 H new ATOM 0 HA LYS A 104 -3.046 11.010 -3.604 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -2.925 12.818 -5.870 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -3.488 13.625 -4.420 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -1.474 13.385 -3.337 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -1.221 11.762 -3.946 1.00 0.00 H new ATOM 0 HD2 LYS A 104 0.324 12.651 -5.356 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -1.016 13.330 -6.258 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -0.685 15.115 -4.098 1.00 0.00 H new ATOM 0 HE3 LYS A 104 0.955 14.690 -4.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 0.160 16.575 -5.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 0.443 15.257 -6.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -1.145 15.669 -6.411 1.00 0.00 H new ATOM 1693 N PRO A 105 -5.964 12.317 -4.514 1.00 0.00 N ATOM 1694 CA PRO A 105 -7.298 12.622 -4.026 1.00 0.00 C ATOM 1695 C PRO A 105 -8.143 11.352 -3.908 1.00 0.00 C ATOM 1696 O PRO A 105 -8.743 10.908 -4.886 1.00 0.00 O ATOM 1697 CB PRO A 105 -7.863 13.620 -5.023 1.00 0.00 C ATOM 1698 CG PRO A 105 -7.012 13.484 -6.276 1.00 0.00 C ATOM 1699 CD PRO A 105 -5.767 12.694 -5.911 1.00 0.00 C ATOM 0 HA PRO A 105 -7.292 13.043 -3.021 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -8.910 13.408 -5.237 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -7.818 14.635 -4.628 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -7.570 12.976 -7.063 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -6.741 14.467 -6.662 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -5.655 11.815 -6.546 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -4.866 13.295 -6.036 1.00 0.00 H new ATOM 1707 N PHE A 106 -8.163 10.802 -2.703 1.00 0.00 N ATOM 1708 CA PHE A 106 -8.924 9.592 -2.445 1.00 0.00 C ATOM 1709 C PHE A 106 -9.838 9.768 -1.231 1.00 0.00 C ATOM 1710 O PHE A 106 -9.563 10.588 -0.356 1.00 0.00 O ATOM 1711 CB PHE A 106 -7.913 8.482 -2.151 1.00 0.00 C ATOM 1712 CG PHE A 106 -6.578 8.986 -1.599 1.00 0.00 C ATOM 1713 CD1 PHE A 106 -6.554 9.772 -0.490 1.00 0.00 C ATOM 1714 CD2 PHE A 106 -5.415 8.648 -2.218 1.00 0.00 C ATOM 1715 CE1 PHE A 106 -5.315 10.240 0.022 1.00 0.00 C ATOM 1716 CE2 PHE A 106 -4.176 9.115 -1.706 1.00 0.00 C ATOM 1717 CZ PHE A 106 -4.152 9.902 -0.597 1.00 0.00 C ATOM 0 H PHE A 106 -7.664 11.172 -1.894 1.00 0.00 H new ATOM 0 HA PHE A 106 -9.549 9.355 -3.306 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -8.351 7.786 -1.435 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -7.727 7.922 -3.067 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -7.477 10.040 0.002 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -5.434 8.024 -3.099 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -5.296 10.864 0.903 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -3.253 8.845 -2.197 1.00 0.00 H new ATOM 0 HZ PHE A 106 -3.210 10.258 -0.208 1.00 0.00 H new ATOM 1727 N ASP A 107 -10.906 8.984 -1.216 1.00 0.00 N ATOM 1728 CA ASP A 107 -11.862 9.042 -0.123 1.00 0.00 C ATOM 1729 C ASP A 107 -11.824 7.724 0.653 1.00 0.00 C ATOM 1730 O ASP A 107 -11.605 6.663 0.072 1.00 0.00 O ATOM 1731 CB ASP A 107 -13.286 9.242 -0.647 1.00 0.00 C ATOM 1732 CG ASP A 107 -14.214 10.022 0.285 1.00 0.00 C ATOM 1733 OD1 ASP A 107 -14.169 11.270 0.217 1.00 0.00 O ATOM 1734 OD2 ASP A 107 -14.949 9.354 1.044 1.00 0.00 O ATOM 0 H ASP A 107 -11.131 8.305 -1.943 1.00 0.00 H new ATOM 0 HA ASP A 107 -11.592 9.882 0.517 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -13.235 9.762 -1.603 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -13.727 8.264 -0.839 1.00 0.00 H new ATOM 1739 N ILE A 108 -12.041 7.836 1.956 1.00 0.00 N ATOM 1740 CA ILE A 108 -12.034 6.666 2.818 1.00 0.00 C ATOM 1741 C ILE A 108 -13.256 5.800 2.505 1.00 0.00 C ATOM 1742 O ILE A 108 -13.205 4.578 2.632 1.00 0.00 O ATOM 1743 CB ILE A 108 -11.936 7.083 4.287 1.00 0.00 C ATOM 1744 CG1 ILE A 108 -10.613 6.621 4.900 1.00 0.00 C ATOM 1745 CG2 ILE A 108 -13.143 6.581 5.081 1.00 0.00 C ATOM 1746 CD1 ILE A 108 -10.406 5.120 4.692 1.00 0.00 C ATOM 0 H ILE A 108 -12.223 8.718 2.435 1.00 0.00 H new ATOM 0 HA ILE A 108 -11.152 6.056 2.624 1.00 0.00 H new ATOM 0 HB ILE A 108 -11.950 8.172 4.335 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -9.787 7.171 4.449 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -10.603 6.849 5.966 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -13.048 6.891 6.122 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -14.056 7.001 4.659 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -13.186 5.493 5.029 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -9.458 4.818 5.137 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -11.220 4.571 5.165 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -10.392 4.899 3.625 1.00 0.00 H new ATOM 1758 N ASP A 109 -14.327 6.468 2.102 1.00 0.00 N ATOM 1759 CA ASP A 109 -15.561 5.775 1.771 1.00 0.00 C ATOM 1760 C ASP A 109 -15.357 4.966 0.488 1.00 0.00 C ATOM 1761 O ASP A 109 -15.733 3.797 0.421 1.00 0.00 O ATOM 1762 CB ASP A 109 -16.701 6.766 1.529 1.00 0.00 C ATOM 1763 CG ASP A 109 -18.103 6.219 1.807 1.00 0.00 C ATOM 1764 OD1 ASP A 109 -18.306 5.728 2.939 1.00 0.00 O ATOM 1765 OD2 ASP A 109 -18.939 6.304 0.882 1.00 0.00 O ATOM 0 H ASP A 109 -14.366 7.482 1.997 1.00 0.00 H new ATOM 0 HA ASP A 109 -15.819 5.126 2.608 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -16.539 7.643 2.155 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -16.657 7.101 0.493 1.00 0.00 H new ATOM 1770 N GLU A 110 -14.761 5.621 -0.498 1.00 0.00 N ATOM 1771 CA GLU A 110 -14.503 4.977 -1.775 1.00 0.00 C ATOM 1772 C GLU A 110 -13.401 3.927 -1.626 1.00 0.00 C ATOM 1773 O GLU A 110 -13.398 2.920 -2.333 1.00 0.00 O ATOM 1774 CB GLU A 110 -14.138 6.008 -2.845 1.00 0.00 C ATOM 1775 CG GLU A 110 -12.675 6.436 -2.716 1.00 0.00 C ATOM 1776 CD GLU A 110 -12.231 7.246 -3.937 1.00 0.00 C ATOM 1777 OE1 GLU A 110 -12.690 8.403 -4.047 1.00 0.00 O ATOM 1778 OE2 GLU A 110 -11.444 6.689 -4.732 1.00 0.00 O ATOM 0 H GLU A 110 -14.450 6.590 -0.438 1.00 0.00 H new ATOM 0 HA GLU A 110 -15.415 4.475 -2.098 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -14.312 5.587 -3.835 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -14.786 6.880 -2.751 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -12.545 7.032 -1.813 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -12.042 5.555 -2.610 1.00 0.00 H new ATOM 1785 N ILE A 111 -12.491 4.197 -0.702 1.00 0.00 N ATOM 1786 CA ILE A 111 -11.385 3.288 -0.452 1.00 0.00 C ATOM 1787 C ILE A 111 -11.924 1.991 0.155 1.00 0.00 C ATOM 1788 O ILE A 111 -11.309 0.935 0.019 1.00 0.00 O ATOM 1789 CB ILE A 111 -10.315 3.969 0.404 1.00 0.00 C ATOM 1790 CG1 ILE A 111 -9.342 4.767 -0.467 1.00 0.00 C ATOM 1791 CG2 ILE A 111 -9.590 2.952 1.287 1.00 0.00 C ATOM 1792 CD1 ILE A 111 -8.098 5.169 0.327 1.00 0.00 C ATOM 0 H ILE A 111 -12.497 5.033 -0.117 1.00 0.00 H new ATOM 0 HA ILE A 111 -10.891 3.022 -1.387 1.00 0.00 H new ATOM 0 HB ILE A 111 -10.809 4.678 1.068 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -9.049 4.171 -1.331 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -9.838 5.659 -0.849 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -8.835 3.462 1.885 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -10.308 2.466 1.947 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -9.109 2.202 0.659 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -7.423 5.735 -0.316 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -8.392 5.785 1.177 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -7.591 4.274 0.687 1.00 0.00 H new ATOM 1804 N ARG A 112 -13.068 2.114 0.813 1.00 0.00 N ATOM 1805 CA ARG A 112 -13.697 0.965 1.441 1.00 0.00 C ATOM 1806 C ARG A 112 -14.042 -0.092 0.390 1.00 0.00 C ATOM 1807 O ARG A 112 -14.157 -1.275 0.708 1.00 0.00 O ATOM 1808 CB ARG A 112 -14.972 1.372 2.182 1.00 0.00 C ATOM 1809 CG ARG A 112 -14.658 2.341 3.323 1.00 0.00 C ATOM 1810 CD ARG A 112 -15.182 1.807 4.657 1.00 0.00 C ATOM 1811 NE ARG A 112 -14.234 0.816 5.213 1.00 0.00 N ATOM 1812 CZ ARG A 112 -13.069 1.134 5.794 1.00 0.00 C ATOM 1813 NH1 ARG A 112 -12.701 2.419 5.897 1.00 0.00 N ATOM 1814 NH2 ARG A 112 -12.271 0.168 6.270 1.00 0.00 N ATOM 0 H ARG A 112 -13.575 2.992 0.925 1.00 0.00 H new ATOM 0 HA ARG A 112 -12.989 0.551 2.159 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -15.668 1.839 1.485 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -15.465 0.485 2.579 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -13.581 2.496 3.387 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -15.108 3.312 3.114 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -15.315 2.629 5.360 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -16.160 1.347 4.515 1.00 0.00 H new ATOM 0 HE ARG A 112 -14.483 -0.171 5.150 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -13.308 3.154 5.533 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -11.814 2.662 6.339 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -12.550 -0.810 6.190 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -11.384 0.411 6.712 1.00 0.00 H new ATOM 1828 N ASP A 113 -14.197 0.372 -0.841 1.00 0.00 N ATOM 1829 CA ASP A 113 -14.526 -0.519 -1.941 1.00 0.00 C ATOM 1830 C ASP A 113 -13.276 -1.303 -2.348 1.00 0.00 C ATOM 1831 O ASP A 113 -13.281 -2.533 -2.338 1.00 0.00 O ATOM 1832 CB ASP A 113 -15.008 0.267 -3.161 1.00 0.00 C ATOM 1833 CG ASP A 113 -16.378 -0.151 -3.700 1.00 0.00 C ATOM 1834 OD1 ASP A 113 -16.424 -1.200 -4.379 1.00 0.00 O ATOM 1835 OD2 ASP A 113 -17.347 0.587 -3.421 1.00 0.00 O ATOM 0 H ASP A 113 -14.101 1.354 -1.101 1.00 0.00 H new ATOM 0 HA ASP A 113 -15.319 -1.189 -1.607 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -15.044 1.325 -2.902 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -14.272 0.159 -3.958 1.00 0.00 H new ATOM 1840 N ALA A 114 -12.237 -0.559 -2.695 1.00 0.00 N ATOM 1841 CA ALA A 114 -10.983 -1.169 -3.105 1.00 0.00 C ATOM 1842 C ALA A 114 -10.495 -2.111 -2.002 1.00 0.00 C ATOM 1843 O ALA A 114 -9.901 -3.149 -2.286 1.00 0.00 O ATOM 1844 CB ALA A 114 -9.965 -0.075 -3.429 1.00 0.00 C ATOM 0 H ALA A 114 -12.237 0.461 -2.701 1.00 0.00 H new ATOM 0 HA ALA A 114 -11.122 -1.763 -4.009 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -9.025 -0.533 -3.736 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -10.346 0.549 -4.237 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -9.797 0.540 -2.544 1.00 0.00 H new ATOM 1850 N VAL A 115 -10.765 -1.714 -0.767 1.00 0.00 N ATOM 1851 CA VAL A 115 -10.361 -2.510 0.380 1.00 0.00 C ATOM 1852 C VAL A 115 -10.885 -3.938 0.214 1.00 0.00 C ATOM 1853 O VAL A 115 -10.171 -4.901 0.492 1.00 0.00 O ATOM 1854 CB VAL A 115 -10.839 -1.845 1.672 1.00 0.00 C ATOM 1855 CG1 VAL A 115 -10.928 -2.863 2.812 1.00 0.00 C ATOM 1856 CG2 VAL A 115 -9.932 -0.673 2.053 1.00 0.00 C ATOM 0 H VAL A 115 -11.258 -0.852 -0.535 1.00 0.00 H new ATOM 0 HA VAL A 115 -9.274 -2.567 0.442 1.00 0.00 H new ATOM 0 HB VAL A 115 -11.840 -1.451 1.496 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -11.270 -2.365 3.719 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -11.632 -3.650 2.543 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -9.945 -3.300 2.987 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -10.294 -0.218 2.975 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -8.914 -1.034 2.202 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -9.941 0.069 1.254 1.00 0.00 H new ATOM 1866 N LYS A 116 -12.126 -4.031 -0.239 1.00 0.00 N ATOM 1867 CA LYS A 116 -12.753 -5.325 -0.445 1.00 0.00 C ATOM 1868 C LYS A 116 -11.791 -6.237 -1.209 1.00 0.00 C ATOM 1869 O LYS A 116 -11.879 -7.460 -1.111 1.00 0.00 O ATOM 1870 CB LYS A 116 -14.114 -5.159 -1.125 1.00 0.00 C ATOM 1871 CG LYS A 116 -14.869 -6.489 -1.172 1.00 0.00 C ATOM 1872 CD LYS A 116 -15.974 -6.455 -2.230 1.00 0.00 C ATOM 1873 CE LYS A 116 -17.122 -5.542 -1.795 1.00 0.00 C ATOM 1874 NZ LYS A 116 -18.365 -5.891 -2.517 1.00 0.00 N ATOM 0 H LYS A 116 -12.715 -3.231 -0.469 1.00 0.00 H new ATOM 0 HA LYS A 116 -12.957 -5.806 0.512 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -14.706 -4.419 -0.586 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -13.975 -4.780 -2.137 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -14.173 -7.299 -1.393 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -15.303 -6.700 -0.195 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -15.565 -6.104 -3.177 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -16.351 -7.464 -2.400 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -17.281 -5.634 -0.721 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -16.861 -4.502 -1.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -19.134 -5.261 -2.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -18.215 -5.780 -3.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -18.622 -6.877 -2.310 1.00 0.00 H new ATOM 1888 N LYS A 117 -10.894 -5.607 -1.953 1.00 0.00 N ATOM 1889 CA LYS A 117 -9.916 -6.346 -2.733 1.00 0.00 C ATOM 1890 C LYS A 117 -8.532 -6.171 -2.105 1.00 0.00 C ATOM 1891 O LYS A 117 -7.696 -7.071 -2.177 1.00 0.00 O ATOM 1892 CB LYS A 117 -9.981 -5.932 -4.204 1.00 0.00 C ATOM 1893 CG LYS A 117 -11.340 -6.282 -4.813 1.00 0.00 C ATOM 1894 CD LYS A 117 -11.391 -5.904 -6.295 1.00 0.00 C ATOM 1895 CE LYS A 117 -11.762 -4.430 -6.472 1.00 0.00 C ATOM 1896 NZ LYS A 117 -13.185 -4.209 -6.129 1.00 0.00 N ATOM 0 H LYS A 117 -10.824 -4.592 -2.032 1.00 0.00 H new ATOM 0 HA LYS A 117 -10.142 -7.412 -2.716 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -9.804 -4.860 -4.292 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -9.189 -6.432 -4.762 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -11.529 -7.349 -4.700 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -12.130 -5.759 -4.273 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -10.423 -6.097 -6.757 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -12.120 -6.531 -6.809 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -11.128 -3.811 -5.837 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -11.578 -4.124 -7.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -13.522 -3.339 -6.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -13.751 -5.016 -6.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -13.283 -4.116 -5.098 1.00 0.00 H new ATOM 1910 N TYR A 118 -8.332 -5.008 -1.505 1.00 0.00 N ATOM 1911 CA TYR A 118 -7.063 -4.703 -0.865 1.00 0.00 C ATOM 1912 C TYR A 118 -6.903 -5.492 0.437 1.00 0.00 C ATOM 1913 O TYR A 118 -5.785 -5.705 0.903 1.00 0.00 O ATOM 1914 CB TYR A 118 -7.102 -3.209 -0.541 1.00 0.00 C ATOM 1915 CG TYR A 118 -6.932 -2.890 0.946 1.00 0.00 C ATOM 1916 CD1 TYR A 118 -7.821 -3.404 1.868 1.00 0.00 C ATOM 1917 CD2 TYR A 118 -5.890 -2.088 1.365 1.00 0.00 C ATOM 1918 CE1 TYR A 118 -7.661 -3.104 3.267 1.00 0.00 C ATOM 1919 CE2 TYR A 118 -5.730 -1.788 2.764 1.00 0.00 C ATOM 1920 CZ TYR A 118 -6.623 -2.311 3.646 1.00 0.00 C ATOM 1921 OH TYR A 118 -6.472 -2.027 4.968 1.00 0.00 O ATOM 0 H TYR A 118 -9.028 -4.264 -1.448 1.00 0.00 H new ATOM 0 HA TYR A 118 -6.231 -4.967 -1.517 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -6.315 -2.705 -1.102 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -8.051 -2.798 -0.884 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -8.637 -4.031 1.540 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -5.195 -1.685 0.643 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -8.350 -3.500 3.999 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -4.919 -1.162 3.105 1.00 0.00 H new ATOM 0 HH TYR A 118 -6.124 -1.117 5.069 1.00 0.00 H new ATOM 1931 N LEU A 119 -8.036 -5.903 0.986 1.00 0.00 N ATOM 1932 CA LEU A 119 -8.036 -6.662 2.224 1.00 0.00 C ATOM 1933 C LEU A 119 -9.475 -6.831 2.715 1.00 0.00 C ATOM 1934 O LEU A 119 -10.299 -5.933 2.553 1.00 0.00 O ATOM 1935 CB LEU A 119 -7.108 -6.011 3.252 1.00 0.00 C ATOM 1936 CG LEU A 119 -6.041 -6.921 3.864 1.00 0.00 C ATOM 1937 CD1 LEU A 119 -6.482 -7.436 5.236 1.00 0.00 C ATOM 1938 CD2 LEU A 119 -5.682 -8.064 2.912 1.00 0.00 C ATOM 0 H LEU A 119 -8.961 -5.724 0.596 1.00 0.00 H new ATOM 0 HA LEU A 119 -7.637 -7.662 2.057 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -6.608 -5.167 2.777 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -7.719 -5.607 4.059 1.00 0.00 H new ATOM 0 HG LEU A 119 -5.136 -6.332 4.015 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -5.706 -8.080 5.649 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -6.647 -6.592 5.906 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -7.407 -8.003 5.132 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -4.922 -8.695 3.372 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -6.572 -8.659 2.706 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -5.297 -7.653 1.979 1.00 0.00 H new ATOM 1950 N PRO A 120 -9.740 -8.019 3.322 1.00 0.00 N ATOM 1951 CA PRO A 120 -11.065 -8.317 3.837 1.00 0.00 C ATOM 1952 C PRO A 120 -11.332 -7.554 5.137 1.00 0.00 C ATOM 1953 O PRO A 120 -11.630 -8.159 6.165 1.00 0.00 O ATOM 1954 CB PRO A 120 -11.087 -9.826 4.019 1.00 0.00 C ATOM 1955 CG PRO A 120 -9.632 -10.264 4.041 1.00 0.00 C ATOM 1956 CD PRO A 120 -8.789 -9.106 3.532 1.00 0.00 C ATOM 0 HA PRO A 120 -11.860 -7.999 3.162 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -11.592 -10.100 4.945 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -11.628 -10.310 3.206 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -9.332 -10.540 5.052 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -9.489 -11.145 3.415 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -8.022 -8.827 4.255 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -8.275 -9.367 2.607 1.00 0.00 H new ATOM 1964 N LEU A 121 -11.215 -6.238 5.047 1.00 0.00 N ATOM 1965 CA LEU A 121 -11.440 -5.386 6.203 1.00 0.00 C ATOM 1966 C LEU A 121 -12.886 -4.886 6.189 1.00 0.00 C ATOM 1967 O LEU A 121 -13.576 -5.000 5.178 1.00 0.00 O ATOM 1968 CB LEU A 121 -10.402 -4.264 6.252 1.00 0.00 C ATOM 1969 CG LEU A 121 -10.650 -3.165 7.288 1.00 0.00 C ATOM 1970 CD1 LEU A 121 -10.554 -3.721 8.710 1.00 0.00 C ATOM 1971 CD2 LEU A 121 -9.704 -1.983 7.070 1.00 0.00 C ATOM 0 H LEU A 121 -10.967 -5.740 4.192 1.00 0.00 H new ATOM 0 HA LEU A 121 -11.307 -5.952 7.125 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -9.426 -4.707 6.449 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -10.349 -3.801 5.266 1.00 0.00 H new ATOM 0 HG LEU A 121 -11.666 -2.793 7.155 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -10.734 -2.920 9.427 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -11.300 -4.504 8.846 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -9.559 -4.136 8.872 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -9.901 -1.216 7.819 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -8.672 -2.322 7.160 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -9.864 -1.568 6.075 1.00 0.00 H new ATOM 1983 N LYS A 122 -13.302 -4.343 7.324 1.00 0.00 N ATOM 1984 CA LYS A 122 -14.653 -3.826 7.455 1.00 0.00 C ATOM 1985 C LYS A 122 -15.049 -3.112 6.161 1.00 0.00 C ATOM 1986 O LYS A 122 -14.530 -2.040 5.855 1.00 0.00 O ATOM 1987 CB LYS A 122 -14.772 -2.947 8.703 1.00 0.00 C ATOM 1988 CG LYS A 122 -16.230 -2.568 8.969 1.00 0.00 C ATOM 1989 CD LYS A 122 -16.472 -1.085 8.681 1.00 0.00 C ATOM 1990 CE LYS A 122 -16.291 -0.244 9.946 1.00 0.00 C ATOM 1991 NZ LYS A 122 -17.068 1.012 9.849 1.00 0.00 N ATOM 0 H LYS A 122 -12.727 -4.250 8.161 1.00 0.00 H new ATOM 0 HA LYS A 122 -15.361 -4.642 7.599 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -14.367 -3.477 9.565 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -14.175 -2.044 8.574 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -16.887 -3.175 8.346 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -16.483 -2.787 10.006 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -15.781 -0.743 7.911 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -17.480 -0.947 8.289 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -16.615 -0.813 10.817 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -15.235 -0.015 10.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -16.934 1.571 10.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -16.740 1.561 9.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -18.077 0.788 9.734 1.00 0.00 H new ATOM 2005 N SER A 123 -15.966 -3.736 5.436 1.00 0.00 N ATOM 2006 CA SER A 123 -16.437 -3.174 4.181 1.00 0.00 C ATOM 2007 C SER A 123 -17.681 -2.318 4.427 1.00 0.00 C ATOM 2008 O SER A 123 -18.685 -2.808 4.942 1.00 0.00 O ATOM 2009 CB SER A 123 -16.743 -4.276 3.165 1.00 0.00 C ATOM 2010 OG SER A 123 -15.568 -4.979 2.770 1.00 0.00 O ATOM 0 H SER A 123 -16.395 -4.625 5.693 1.00 0.00 H new ATOM 0 HA SER A 123 -15.647 -2.546 3.768 1.00 0.00 H new ATOM 0 HB2 SER A 123 -17.458 -4.977 3.595 1.00 0.00 H new ATOM 0 HB3 SER A 123 -17.216 -3.838 2.286 1.00 0.00 H new ATOM 0 HG SER A 123 -14.937 -5.008 3.519 1.00 0.00 H new ATOM 2016 N ASN A 124 -17.574 -1.054 4.046 1.00 0.00 N ATOM 2017 CA ASN A 124 -18.678 -0.124 4.218 1.00 0.00 C ATOM 2018 C ASN A 124 -18.641 0.918 3.099 1.00 0.00 C ATOM 2019 O ASN A 124 -19.669 1.497 2.750 1.00 0.00 O ATOM 2020 CB ASN A 124 -18.575 0.612 5.555 1.00 0.00 C ATOM 2021 CG ASN A 124 -19.959 1.011 6.070 1.00 0.00 C ATOM 2022 OD1 ASN A 124 -20.763 0.185 6.469 1.00 0.00 O ATOM 2023 ND2 ASN A 124 -20.192 2.321 6.038 1.00 0.00 N ATOM 0 H ASN A 124 -16.740 -0.651 3.619 1.00 0.00 H new ATOM 0 HA ASN A 124 -19.607 -0.694 4.192 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -18.080 -0.026 6.288 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -17.956 1.502 5.438 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -21.088 2.688 6.360 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -19.475 2.958 5.692 1.00 0.00 H new TER 2030 ASN A 124