USER MOD reduce.3.24.130724 H: found=0, std=0, add=783, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 778 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 47 MET CE :methyl -171:sc= -0.598 (180deg=-0.2) USER MOD Set 1.2: A 56 HIS : no HE2:sc= -2.36! C(o=-3!,f=-7.7!) USER MOD Set 2.1: A 38 GLN : amide:sc= -0.726 K(o=-5.8,f=-8.5) USER MOD Set 2.2: A 77 MET CE :methyl 154:sc= -5.11! (180deg=-5.95!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot -13:sc= 0.551 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= -0.161 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -0.654 K(o=-0.65,f=-1.6!) USER MOD Single : A 14 GLN : amide:sc= -0.387 X(o=-0.39,f=-0.83) USER MOD Single : A 17 THR OG1 : rot 42:sc= -0.356 USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 52:sc= 0.308 USER MOD Single : A 44 ASN : amide:sc= -1.16 X(o=-1.2,f=-0.99) USER MOD Single : A 45 THR OG1 : rot 160:sc= 0.0298 USER MOD Single : A 46 HIS : no HD1:sc= -1.55 K(o=-1.5,f=-3.5!) USER MOD Single : A 49 LYS NZ :NH3+ -142:sc= 1.22 (180deg=0.542) USER MOD Single : A 53 THR OG1 : rot -72:sc= 0.282 USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0186) USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 30:sc= -0.415 USER MOD Single : A 85 LYS NZ :NH3+ 161:sc= -0.0519 (180deg=-0.357) USER MOD Single : A 90 ASN : amide:sc= -5.67! C(o=-5.7!,f=-4.2!) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 SER OG : rot -171:sc= 0.195 USER MOD Single : A 95 HIS : no HD1:sc= -0.496 K(o=-0.5,f=0.076) USER MOD Single : A 96 ASN : amide:sc= -0.985 K(o=-0.99,f=0.016) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 ASN : amide:sc= -0.614 K(o=-0.61,f=-0.048) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 19.742 14.987 -3.156 1.00 0.00 N ATOM 2 CA GLY A 1 20.904 14.123 -3.254 1.00 0.00 C ATOM 3 C GLY A 1 21.966 14.682 -4.179 1.00 0.00 C ATOM 4 O GLY A 1 22.419 14.001 -5.098 1.00 0.00 O ATOM 0 H1 GLY A 1 19.046 14.560 -2.512 1.00 0.00 H new ATOM 0 H2 GLY A 1 20.030 15.916 -2.788 1.00 0.00 H new ATOM 0 H3 GLY A 1 19.316 15.105 -4.098 1.00 0.00 H new ATOM 0 HA2 GLY A 1 21.331 13.979 -2.261 1.00 0.00 H new ATOM 0 HA3 GLY A 1 20.594 13.142 -3.613 1.00 0.00 H new ATOM 8 N SER A 2 22.364 15.927 -3.937 1.00 0.00 N ATOM 9 CA SER A 2 23.376 16.580 -4.760 1.00 0.00 C ATOM 10 C SER A 2 23.163 16.263 -6.237 1.00 0.00 C ATOM 11 O SER A 2 24.112 15.969 -6.963 1.00 0.00 O ATOM 12 CB SER A 2 24.776 16.139 -4.329 1.00 0.00 C ATOM 13 OG SER A 2 25.033 14.802 -4.723 1.00 0.00 O ATOM 0 H SER A 2 22.001 16.504 -3.178 1.00 0.00 H new ATOM 0 HA SER A 2 23.283 17.657 -4.621 1.00 0.00 H new ATOM 0 HB2 SER A 2 25.521 16.801 -4.770 1.00 0.00 H new ATOM 0 HB3 SER A 2 24.872 16.227 -3.247 1.00 0.00 H new ATOM 0 HG SER A 2 24.194 14.374 -4.995 1.00 0.00 H new ATOM 19 N SER A 3 21.909 16.325 -6.674 1.00 0.00 N ATOM 20 CA SER A 3 21.569 16.040 -8.063 1.00 0.00 C ATOM 21 C SER A 3 21.445 17.331 -8.867 1.00 0.00 C ATOM 22 O SER A 3 21.998 17.451 -9.959 1.00 0.00 O ATOM 23 CB SER A 3 20.260 15.252 -8.139 1.00 0.00 C ATOM 24 OG SER A 3 20.496 13.860 -8.017 1.00 0.00 O ATOM 0 H SER A 3 21.112 16.570 -6.086 1.00 0.00 H new ATOM 0 HA SER A 3 22.371 15.440 -8.492 1.00 0.00 H new ATOM 0 HB2 SER A 3 19.587 15.581 -7.347 1.00 0.00 H new ATOM 0 HB3 SER A 3 19.762 15.458 -9.086 1.00 0.00 H new ATOM 0 HG SER A 3 19.644 13.378 -8.067 1.00 0.00 H new ATOM 30 N GLY A 4 20.714 18.296 -8.317 1.00 0.00 N ATOM 31 CA GLY A 4 20.530 19.566 -8.995 1.00 0.00 C ATOM 32 C GLY A 4 19.968 20.636 -8.080 1.00 0.00 C ATOM 33 O GLY A 4 19.901 20.451 -6.865 1.00 0.00 O ATOM 0 H GLY A 4 20.246 18.221 -7.414 1.00 0.00 H new ATOM 0 HA2 GLY A 4 21.486 19.902 -9.397 1.00 0.00 H new ATOM 0 HA3 GLY A 4 19.859 19.428 -9.843 1.00 0.00 H new ATOM 37 N SER A 5 19.566 21.760 -8.664 1.00 0.00 N ATOM 38 CA SER A 5 19.012 22.867 -7.892 1.00 0.00 C ATOM 39 C SER A 5 17.643 22.503 -7.327 1.00 0.00 C ATOM 40 O SER A 5 17.376 22.700 -6.142 1.00 0.00 O ATOM 41 CB SER A 5 18.901 24.119 -8.764 1.00 0.00 C ATOM 42 OG SER A 5 17.969 23.928 -9.814 1.00 0.00 O ATOM 0 H SER A 5 19.613 21.929 -9.669 1.00 0.00 H new ATOM 0 HA SER A 5 19.686 23.071 -7.060 1.00 0.00 H new ATOM 0 HB2 SER A 5 18.595 24.967 -8.151 1.00 0.00 H new ATOM 0 HB3 SER A 5 19.878 24.364 -9.181 1.00 0.00 H new ATOM 0 HG SER A 5 17.915 24.743 -10.356 1.00 0.00 H new ATOM 48 N SER A 6 16.778 21.972 -8.185 1.00 0.00 N ATOM 49 CA SER A 6 15.433 21.584 -7.773 1.00 0.00 C ATOM 50 C SER A 6 15.482 20.424 -6.783 1.00 0.00 C ATOM 51 O SER A 6 14.743 20.401 -5.800 1.00 0.00 O ATOM 52 CB SER A 6 14.597 21.194 -8.993 1.00 0.00 C ATOM 53 OG SER A 6 14.002 22.333 -9.589 1.00 0.00 O ATOM 0 H SER A 6 16.984 21.800 -9.169 1.00 0.00 H new ATOM 0 HA SER A 6 14.968 22.439 -7.281 1.00 0.00 H new ATOM 0 HB2 SER A 6 15.228 20.686 -9.722 1.00 0.00 H new ATOM 0 HB3 SER A 6 13.821 20.488 -8.696 1.00 0.00 H new ATOM 0 HG SER A 6 13.475 22.057 -10.367 1.00 0.00 H new ATOM 59 N GLY A 7 16.359 19.462 -7.051 1.00 0.00 N ATOM 60 CA GLY A 7 16.488 18.311 -6.176 1.00 0.00 C ATOM 61 C GLY A 7 15.172 17.589 -5.970 1.00 0.00 C ATOM 62 O GLY A 7 14.658 17.497 -4.855 1.00 0.00 O ATOM 0 H GLY A 7 16.983 19.459 -7.858 1.00 0.00 H new ATOM 0 HA2 GLY A 7 17.217 17.618 -6.597 1.00 0.00 H new ATOM 0 HA3 GLY A 7 16.876 18.634 -5.210 1.00 0.00 H new ATOM 66 N PRO A 8 14.604 17.061 -7.064 1.00 0.00 N ATOM 67 CA PRO A 8 13.332 16.334 -7.024 1.00 0.00 C ATOM 68 C PRO A 8 13.455 14.988 -6.319 1.00 0.00 C ATOM 69 O PRO A 8 13.597 13.949 -6.965 1.00 0.00 O ATOM 70 CB PRO A 8 12.991 16.135 -8.503 1.00 0.00 C ATOM 71 CG PRO A 8 14.305 16.172 -9.203 1.00 0.00 C ATOM 72 CD PRO A 8 15.162 17.132 -8.426 1.00 0.00 C ATOM 0 HA PRO A 8 12.569 16.877 -6.466 1.00 0.00 H new ATOM 0 HB2 PRO A 8 12.481 15.186 -8.667 1.00 0.00 H new ATOM 0 HB3 PRO A 8 12.327 16.920 -8.865 1.00 0.00 H new ATOM 0 HG2 PRO A 8 14.759 15.181 -9.234 1.00 0.00 H new ATOM 0 HG3 PRO A 8 14.188 16.501 -10.235 1.00 0.00 H new ATOM 0 HD2 PRO A 8 16.212 16.840 -8.446 1.00 0.00 H new ATOM 0 HD3 PRO A 8 15.104 18.142 -8.832 1.00 0.00 H new ATOM 80 N ILE A 9 13.399 15.013 -4.992 1.00 0.00 N ATOM 81 CA ILE A 9 13.503 13.793 -4.200 1.00 0.00 C ATOM 82 C ILE A 9 12.129 13.317 -3.742 1.00 0.00 C ATOM 83 O ILE A 9 11.956 12.896 -2.598 1.00 0.00 O ATOM 84 CB ILE A 9 14.401 13.998 -2.966 1.00 0.00 C ATOM 85 CG1 ILE A 9 13.744 14.973 -1.986 1.00 0.00 C ATOM 86 CG2 ILE A 9 15.772 14.505 -3.387 1.00 0.00 C ATOM 87 CD1 ILE A 9 14.083 14.694 -0.539 1.00 0.00 C ATOM 0 H ILE A 9 13.282 15.864 -4.442 1.00 0.00 H new ATOM 0 HA ILE A 9 13.951 13.036 -4.843 1.00 0.00 H new ATOM 0 HB ILE A 9 14.528 13.039 -2.464 1.00 0.00 H new ATOM 0 HG12 ILE A 9 14.053 15.988 -2.234 1.00 0.00 H new ATOM 0 HG13 ILE A 9 12.662 14.929 -2.112 1.00 0.00 H new ATOM 0 HG21 ILE A 9 16.395 14.645 -2.504 1.00 0.00 H new ATOM 0 HG22 ILE A 9 16.241 13.778 -4.050 1.00 0.00 H new ATOM 0 HG23 ILE A 9 15.664 15.456 -3.909 1.00 0.00 H new ATOM 0 HD11 ILE A 9 13.583 15.423 0.099 1.00 0.00 H new ATOM 0 HD12 ILE A 9 13.749 13.691 -0.274 1.00 0.00 H new ATOM 0 HD13 ILE A 9 15.161 14.767 -0.397 1.00 0.00 H new ATOM 99 N SER A 10 11.154 13.385 -4.643 1.00 0.00 N ATOM 100 CA SER A 10 9.794 12.962 -4.331 1.00 0.00 C ATOM 101 C SER A 10 9.628 11.461 -4.547 1.00 0.00 C ATOM 102 O SER A 10 8.586 11.001 -5.012 1.00 0.00 O ATOM 103 CB SER A 10 8.789 13.727 -5.195 1.00 0.00 C ATOM 104 OG SER A 10 8.684 15.078 -4.780 1.00 0.00 O ATOM 0 H SER A 10 11.281 13.729 -5.595 1.00 0.00 H new ATOM 0 HA SER A 10 9.603 13.183 -3.281 1.00 0.00 H new ATOM 0 HB2 SER A 10 9.098 13.687 -6.239 1.00 0.00 H new ATOM 0 HB3 SER A 10 7.812 13.247 -5.133 1.00 0.00 H new ATOM 0 HG SER A 10 8.037 15.546 -5.349 1.00 0.00 H new ATOM 110 N GLU A 11 10.665 10.702 -4.206 1.00 0.00 N ATOM 111 CA GLU A 11 10.636 9.253 -4.363 1.00 0.00 C ATOM 112 C GLU A 11 10.268 8.571 -3.048 1.00 0.00 C ATOM 113 O GLU A 11 9.389 7.710 -3.008 1.00 0.00 O ATOM 114 CB GLU A 11 11.992 8.743 -4.853 1.00 0.00 C ATOM 115 CG GLU A 11 12.170 8.837 -6.359 1.00 0.00 C ATOM 116 CD GLU A 11 12.751 10.167 -6.796 1.00 0.00 C ATOM 117 OE1 GLU A 11 13.658 10.675 -6.105 1.00 0.00 O ATOM 118 OE2 GLU A 11 12.297 10.701 -7.831 1.00 0.00 O ATOM 0 H GLU A 11 11.535 11.067 -3.819 1.00 0.00 H new ATOM 0 HA GLU A 11 9.875 9.009 -5.105 1.00 0.00 H new ATOM 0 HB2 GLU A 11 12.783 9.314 -4.366 1.00 0.00 H new ATOM 0 HB3 GLU A 11 12.113 7.704 -4.546 1.00 0.00 H new ATOM 0 HG2 GLU A 11 12.823 8.032 -6.695 1.00 0.00 H new ATOM 0 HG3 GLU A 11 11.206 8.689 -6.845 1.00 0.00 H new ATOM 125 N ARG A 12 10.949 8.961 -1.975 1.00 0.00 N ATOM 126 CA ARG A 12 10.696 8.386 -0.660 1.00 0.00 C ATOM 127 C ARG A 12 9.484 9.042 -0.004 1.00 0.00 C ATOM 128 O ARG A 12 9.458 10.254 0.204 1.00 0.00 O ATOM 129 CB ARG A 12 11.925 8.550 0.237 1.00 0.00 C ATOM 130 CG ARG A 12 11.907 7.654 1.464 1.00 0.00 C ATOM 131 CD ARG A 12 12.880 8.143 2.525 1.00 0.00 C ATOM 132 NE ARG A 12 14.252 7.725 2.244 1.00 0.00 N ATOM 133 CZ ARG A 12 15.191 7.614 3.176 1.00 0.00 C ATOM 134 NH1 ARG A 12 14.909 7.887 4.443 1.00 0.00 N ATOM 135 NH2 ARG A 12 16.416 7.228 2.842 1.00 0.00 N ATOM 0 H ARG A 12 11.680 9.672 -1.991 1.00 0.00 H new ATOM 0 HA ARG A 12 10.488 7.324 -0.790 1.00 0.00 H new ATOM 0 HB2 ARG A 12 12.821 8.336 -0.346 1.00 0.00 H new ATOM 0 HB3 ARG A 12 11.994 9.589 0.558 1.00 0.00 H new ATOM 0 HG2 ARG A 12 10.900 7.624 1.879 1.00 0.00 H new ATOM 0 HG3 ARG A 12 12.164 6.635 1.175 1.00 0.00 H new ATOM 0 HD2 ARG A 12 12.837 9.231 2.583 1.00 0.00 H new ATOM 0 HD3 ARG A 12 12.577 7.760 3.499 1.00 0.00 H new ATOM 0 HE ARG A 12 14.502 7.507 1.279 1.00 0.00 H new ATOM 0 HH11 ARG A 12 13.968 8.183 4.704 1.00 0.00 H new ATOM 0 HH12 ARG A 12 15.633 7.801 5.157 1.00 0.00 H new ATOM 0 HH21 ARG A 12 16.637 7.016 1.869 1.00 0.00 H new ATOM 0 HH22 ARG A 12 17.137 7.143 3.558 1.00 0.00 H new ATOM 149 N ASN A 13 8.481 8.231 0.318 1.00 0.00 N ATOM 150 CA ASN A 13 7.265 8.732 0.949 1.00 0.00 C ATOM 151 C ASN A 13 6.890 7.881 2.159 1.00 0.00 C ATOM 152 O ASN A 13 7.517 6.857 2.428 1.00 0.00 O ATOM 153 CB ASN A 13 6.112 8.745 -0.056 1.00 0.00 C ATOM 154 CG ASN A 13 6.329 9.750 -1.171 1.00 0.00 C ATOM 155 OD1 ASN A 13 7.239 10.577 -1.108 1.00 0.00 O ATOM 156 ND2 ASN A 13 5.490 9.683 -2.199 1.00 0.00 N ATOM 0 H ASN A 13 8.486 7.225 0.152 1.00 0.00 H new ATOM 0 HA ASN A 13 7.454 9.751 1.288 1.00 0.00 H new ATOM 0 HB2 ASN A 13 5.996 7.750 -0.485 1.00 0.00 H new ATOM 0 HB3 ASN A 13 5.183 8.978 0.464 1.00 0.00 H new ATOM 0 HD21 ASN A 13 5.586 10.334 -2.979 1.00 0.00 H new ATOM 0 HD22 ASN A 13 4.750 8.981 -2.209 1.00 0.00 H new ATOM 163 N GLN A 14 5.863 8.314 2.884 1.00 0.00 N ATOM 164 CA GLN A 14 5.405 7.592 4.065 1.00 0.00 C ATOM 165 C GLN A 14 4.042 6.954 3.818 1.00 0.00 C ATOM 166 O GLN A 14 3.900 5.732 3.863 1.00 0.00 O ATOM 167 CB GLN A 14 5.330 8.534 5.267 1.00 0.00 C ATOM 168 CG GLN A 14 5.362 7.816 6.606 1.00 0.00 C ATOM 169 CD GLN A 14 5.415 8.772 7.781 1.00 0.00 C ATOM 170 OE1 GLN A 14 4.911 9.893 7.707 1.00 0.00 O ATOM 171 NE2 GLN A 14 6.028 8.334 8.875 1.00 0.00 N ATOM 0 H GLN A 14 5.333 9.160 2.674 1.00 0.00 H new ATOM 0 HA GLN A 14 6.123 6.800 4.277 1.00 0.00 H new ATOM 0 HB2 GLN A 14 6.163 9.236 5.221 1.00 0.00 H new ATOM 0 HB3 GLN A 14 4.414 9.121 5.201 1.00 0.00 H new ATOM 0 HG2 GLN A 14 4.478 7.184 6.696 1.00 0.00 H new ATOM 0 HG3 GLN A 14 6.230 7.157 6.640 1.00 0.00 H new ATOM 0 HE21 GLN A 14 6.432 7.398 8.893 1.00 0.00 H new ATOM 0 HE22 GLN A 14 6.095 8.934 9.697 1.00 0.00 H new ATOM 180 N ASP A 15 3.042 7.789 3.557 1.00 0.00 N ATOM 181 CA ASP A 15 1.690 7.307 3.303 1.00 0.00 C ATOM 182 C ASP A 15 1.692 6.227 2.225 1.00 0.00 C ATOM 183 O ASP A 15 1.245 5.104 2.457 1.00 0.00 O ATOM 184 CB ASP A 15 0.783 8.464 2.881 1.00 0.00 C ATOM 185 CG ASP A 15 1.021 9.715 3.703 1.00 0.00 C ATOM 186 OD1 ASP A 15 2.146 10.254 3.652 1.00 0.00 O ATOM 187 OD2 ASP A 15 0.082 10.155 4.400 1.00 0.00 O ATOM 0 H ASP A 15 3.143 8.803 3.516 1.00 0.00 H new ATOM 0 HA ASP A 15 1.306 6.873 4.227 1.00 0.00 H new ATOM 0 HB2 ASP A 15 0.951 8.688 1.827 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -0.259 8.160 2.981 1.00 0.00 H new ATOM 192 N ALA A 16 2.196 6.576 1.046 1.00 0.00 N ATOM 193 CA ALA A 16 2.257 5.637 -0.067 1.00 0.00 C ATOM 194 C ALA A 16 2.808 4.288 0.382 1.00 0.00 C ATOM 195 O ALA A 16 2.489 3.250 -0.199 1.00 0.00 O ATOM 196 CB ALA A 16 3.106 6.208 -1.193 1.00 0.00 C ATOM 0 H ALA A 16 2.568 7.502 0.837 1.00 0.00 H new ATOM 0 HA ALA A 16 1.243 5.481 -0.435 1.00 0.00 H new ATOM 0 HB1 ALA A 16 3.143 5.496 -2.018 1.00 0.00 H new ATOM 0 HB2 ALA A 16 2.668 7.144 -1.541 1.00 0.00 H new ATOM 0 HB3 ALA A 16 4.116 6.394 -0.829 1.00 0.00 H new ATOM 202 N THR A 17 3.638 4.309 1.420 1.00 0.00 N ATOM 203 CA THR A 17 4.235 3.088 1.947 1.00 0.00 C ATOM 204 C THR A 17 3.312 2.416 2.957 1.00 0.00 C ATOM 205 O THR A 17 2.539 3.082 3.646 1.00 0.00 O ATOM 206 CB THR A 17 5.593 3.371 2.617 1.00 0.00 C ATOM 207 OG1 THR A 17 6.485 3.981 1.678 1.00 0.00 O ATOM 208 CG2 THR A 17 6.210 2.087 3.151 1.00 0.00 C ATOM 0 H THR A 17 3.912 5.159 1.913 1.00 0.00 H new ATOM 0 HA THR A 17 4.389 2.420 1.100 1.00 0.00 H new ATOM 0 HB THR A 17 5.427 4.051 3.453 1.00 0.00 H new ATOM 0 HG1 THR A 17 5.999 4.650 1.152 1.00 0.00 H new ATOM 0 HG21 THR A 17 7.168 2.311 3.620 1.00 0.00 H new ATOM 0 HG22 THR A 17 5.541 1.641 3.887 1.00 0.00 H new ATOM 0 HG23 THR A 17 6.363 1.388 2.329 1.00 0.00 H new ATOM 216 N VAL A 18 3.399 1.092 3.041 1.00 0.00 N ATOM 217 CA VAL A 18 2.572 0.329 3.968 1.00 0.00 C ATOM 218 C VAL A 18 3.416 -0.277 5.084 1.00 0.00 C ATOM 219 O VAL A 18 4.596 -0.571 4.895 1.00 0.00 O ATOM 220 CB VAL A 18 1.810 -0.797 3.246 1.00 0.00 C ATOM 221 CG1 VAL A 18 1.274 -0.307 1.909 1.00 0.00 C ATOM 222 CG2 VAL A 18 2.707 -2.011 3.057 1.00 0.00 C ATOM 0 H VAL A 18 4.034 0.526 2.478 1.00 0.00 H new ATOM 0 HA VAL A 18 1.852 1.026 4.397 1.00 0.00 H new ATOM 0 HB VAL A 18 0.962 -1.093 3.864 1.00 0.00 H new ATOM 0 HG11 VAL A 18 0.738 -1.116 1.413 1.00 0.00 H new ATOM 0 HG12 VAL A 18 0.595 0.530 2.074 1.00 0.00 H new ATOM 0 HG13 VAL A 18 2.104 0.017 1.281 1.00 0.00 H new ATOM 0 HG21 VAL A 18 2.152 -2.797 2.545 1.00 0.00 H new ATOM 0 HG22 VAL A 18 3.576 -1.732 2.460 1.00 0.00 H new ATOM 0 HG23 VAL A 18 3.037 -2.375 4.030 1.00 0.00 H new ATOM 232 N TYR A 19 2.802 -0.463 6.248 1.00 0.00 N ATOM 233 CA TYR A 19 3.497 -1.033 7.396 1.00 0.00 C ATOM 234 C TYR A 19 3.145 -2.508 7.568 1.00 0.00 C ATOM 235 O TYR A 19 2.069 -2.848 8.062 1.00 0.00 O ATOM 236 CB TYR A 19 3.143 -0.261 8.668 1.00 0.00 C ATOM 237 CG TYR A 19 3.970 -0.661 9.869 1.00 0.00 C ATOM 238 CD1 TYR A 19 3.895 -1.946 10.391 1.00 0.00 C ATOM 239 CD2 TYR A 19 4.825 0.247 10.481 1.00 0.00 C ATOM 240 CE1 TYR A 19 4.649 -2.316 11.489 1.00 0.00 C ATOM 241 CE2 TYR A 19 5.583 -0.114 11.578 1.00 0.00 C ATOM 242 CZ TYR A 19 5.491 -1.397 12.078 1.00 0.00 C ATOM 243 OH TYR A 19 6.243 -1.760 13.172 1.00 0.00 O ATOM 0 H TYR A 19 1.825 -0.227 6.421 1.00 0.00 H new ATOM 0 HA TYR A 19 4.569 -0.952 7.217 1.00 0.00 H new ATOM 0 HB2 TYR A 19 3.276 0.805 8.485 1.00 0.00 H new ATOM 0 HB3 TYR A 19 2.088 -0.416 8.896 1.00 0.00 H new ATOM 0 HD1 TYR A 19 3.237 -2.668 9.931 1.00 0.00 H new ATOM 0 HD2 TYR A 19 4.898 1.252 10.093 1.00 0.00 H new ATOM 0 HE1 TYR A 19 4.579 -3.319 11.883 1.00 0.00 H new ATOM 0 HE2 TYR A 19 6.244 0.604 12.042 1.00 0.00 H new ATOM 0 HH TYR A 19 6.783 -0.997 13.465 1.00 0.00 H new ATOM 253 N VAL A 20 4.060 -3.380 7.157 1.00 0.00 N ATOM 254 CA VAL A 20 3.849 -4.818 7.267 1.00 0.00 C ATOM 255 C VAL A 20 4.386 -5.353 8.589 1.00 0.00 C ATOM 256 O VAL A 20 5.590 -5.317 8.843 1.00 0.00 O ATOM 257 CB VAL A 20 4.524 -5.575 6.107 1.00 0.00 C ATOM 258 CG1 VAL A 20 4.192 -7.058 6.172 1.00 0.00 C ATOM 259 CG2 VAL A 20 4.103 -4.984 4.770 1.00 0.00 C ATOM 0 H VAL A 20 4.955 -3.115 6.745 1.00 0.00 H new ATOM 0 HA VAL A 20 2.773 -4.984 7.222 1.00 0.00 H new ATOM 0 HB VAL A 20 5.604 -5.465 6.203 1.00 0.00 H new ATOM 0 HG11 VAL A 20 4.677 -7.576 5.345 1.00 0.00 H new ATOM 0 HG12 VAL A 20 4.548 -7.469 7.117 1.00 0.00 H new ATOM 0 HG13 VAL A 20 3.113 -7.193 6.101 1.00 0.00 H new ATOM 0 HG21 VAL A 20 4.589 -5.530 3.962 1.00 0.00 H new ATOM 0 HG22 VAL A 20 3.021 -5.062 4.662 1.00 0.00 H new ATOM 0 HG23 VAL A 20 4.397 -3.935 4.727 1.00 0.00 H new ATOM 269 N GLY A 21 3.485 -5.851 9.431 1.00 0.00 N ATOM 270 CA GLY A 21 3.888 -6.387 10.718 1.00 0.00 C ATOM 271 C GLY A 21 3.356 -7.787 10.955 1.00 0.00 C ATOM 272 O GLY A 21 2.145 -7.997 11.010 1.00 0.00 O ATOM 0 H GLY A 21 2.483 -5.893 9.244 1.00 0.00 H new ATOM 0 HA2 GLY A 21 4.976 -6.400 10.778 1.00 0.00 H new ATOM 0 HA3 GLY A 21 3.533 -5.728 11.510 1.00 0.00 H new ATOM 276 N GLY A 22 4.263 -8.748 11.094 1.00 0.00 N ATOM 277 CA GLY A 22 3.859 -10.123 11.324 1.00 0.00 C ATOM 278 C GLY A 22 4.155 -11.020 10.138 1.00 0.00 C ATOM 279 O GLY A 22 3.276 -11.735 9.656 1.00 0.00 O ATOM 0 H GLY A 22 5.271 -8.599 11.051 1.00 0.00 H new ATOM 0 HA2 GLY A 22 4.374 -10.508 12.204 1.00 0.00 H new ATOM 0 HA3 GLY A 22 2.791 -10.153 11.541 1.00 0.00 H new ATOM 283 N LEU A 23 5.396 -10.981 9.665 1.00 0.00 N ATOM 284 CA LEU A 23 5.807 -11.796 8.527 1.00 0.00 C ATOM 285 C LEU A 23 6.570 -13.033 8.990 1.00 0.00 C ATOM 286 O LEU A 23 7.260 -13.004 10.009 1.00 0.00 O ATOM 287 CB LEU A 23 6.675 -10.974 7.573 1.00 0.00 C ATOM 288 CG LEU A 23 6.007 -9.752 6.942 1.00 0.00 C ATOM 289 CD1 LEU A 23 7.041 -8.873 6.255 1.00 0.00 C ATOM 290 CD2 LEU A 23 4.930 -10.182 5.956 1.00 0.00 C ATOM 0 H LEU A 23 6.135 -10.394 10.052 1.00 0.00 H new ATOM 0 HA LEU A 23 4.909 -12.122 8.002 1.00 0.00 H new ATOM 0 HB2 LEU A 23 7.560 -10.640 8.115 1.00 0.00 H new ATOM 0 HB3 LEU A 23 7.020 -11.628 6.772 1.00 0.00 H new ATOM 0 HG LEU A 23 5.535 -9.171 7.734 1.00 0.00 H new ATOM 0 HD11 LEU A 23 6.547 -8.008 5.812 1.00 0.00 H new ATOM 0 HD12 LEU A 23 7.776 -8.536 6.986 1.00 0.00 H new ATOM 0 HD13 LEU A 23 7.543 -9.444 5.474 1.00 0.00 H new ATOM 0 HD21 LEU A 23 4.465 -9.299 5.517 1.00 0.00 H new ATOM 0 HD22 LEU A 23 5.379 -10.786 5.168 1.00 0.00 H new ATOM 0 HD23 LEU A 23 4.173 -10.769 6.477 1.00 0.00 H new ATOM 302 N ASP A 24 6.445 -14.117 8.232 1.00 0.00 N ATOM 303 CA ASP A 24 7.126 -15.363 8.562 1.00 0.00 C ATOM 304 C ASP A 24 8.534 -15.386 7.975 1.00 0.00 C ATOM 305 O ASP A 24 8.846 -14.625 7.060 1.00 0.00 O ATOM 306 CB ASP A 24 6.325 -16.559 8.045 1.00 0.00 C ATOM 307 CG ASP A 24 6.656 -17.841 8.784 1.00 0.00 C ATOM 308 OD1 ASP A 24 6.388 -17.911 10.002 1.00 0.00 O ATOM 309 OD2 ASP A 24 7.182 -18.775 8.144 1.00 0.00 O ATOM 0 H ASP A 24 5.878 -14.158 7.385 1.00 0.00 H new ATOM 0 HA ASP A 24 7.204 -15.429 9.647 1.00 0.00 H new ATOM 0 HB2 ASP A 24 5.260 -16.350 8.145 1.00 0.00 H new ATOM 0 HB3 ASP A 24 6.525 -16.694 6.982 1.00 0.00 H new ATOM 314 N GLU A 25 9.378 -16.262 8.510 1.00 0.00 N ATOM 315 CA GLU A 25 10.754 -16.381 8.040 1.00 0.00 C ATOM 316 C GLU A 25 10.804 -16.438 6.516 1.00 0.00 C ATOM 317 O GLU A 25 11.656 -15.810 5.887 1.00 0.00 O ATOM 318 CB GLU A 25 11.412 -17.629 8.630 1.00 0.00 C ATOM 319 CG GLU A 25 10.755 -18.928 8.193 1.00 0.00 C ATOM 320 CD GLU A 25 10.881 -20.024 9.234 1.00 0.00 C ATOM 321 OE1 GLU A 25 12.005 -20.532 9.427 1.00 0.00 O ATOM 322 OE2 GLU A 25 9.856 -20.374 9.855 1.00 0.00 O ATOM 0 H GLU A 25 9.134 -16.899 9.268 1.00 0.00 H new ATOM 0 HA GLU A 25 11.302 -15.499 8.372 1.00 0.00 H new ATOM 0 HB2 GLU A 25 12.462 -17.647 8.340 1.00 0.00 H new ATOM 0 HB3 GLU A 25 11.383 -17.565 9.718 1.00 0.00 H new ATOM 0 HG2 GLU A 25 9.700 -18.746 7.988 1.00 0.00 H new ATOM 0 HG3 GLU A 25 11.208 -19.264 7.260 1.00 0.00 H new ATOM 329 N LYS A 26 9.886 -17.197 5.927 1.00 0.00 N ATOM 330 CA LYS A 26 9.823 -17.338 4.477 1.00 0.00 C ATOM 331 C LYS A 26 9.788 -15.972 3.799 1.00 0.00 C ATOM 332 O LYS A 26 10.627 -15.667 2.951 1.00 0.00 O ATOM 333 CB LYS A 26 8.590 -18.150 4.076 1.00 0.00 C ATOM 334 CG LYS A 26 8.721 -19.636 4.363 1.00 0.00 C ATOM 335 CD LYS A 26 7.936 -20.468 3.363 1.00 0.00 C ATOM 336 CE LYS A 26 6.449 -20.467 3.681 1.00 0.00 C ATOM 337 NZ LYS A 26 5.785 -21.723 3.236 1.00 0.00 N ATOM 0 H LYS A 26 9.174 -17.725 6.432 1.00 0.00 H new ATOM 0 HA LYS A 26 10.719 -17.864 4.149 1.00 0.00 H new ATOM 0 HB2 LYS A 26 7.721 -17.761 4.607 1.00 0.00 H new ATOM 0 HB3 LYS A 26 8.403 -18.009 3.011 1.00 0.00 H new ATOM 0 HG2 LYS A 26 9.772 -19.923 4.330 1.00 0.00 H new ATOM 0 HG3 LYS A 26 8.365 -19.846 5.372 1.00 0.00 H new ATOM 0 HD2 LYS A 26 8.094 -20.076 2.358 1.00 0.00 H new ATOM 0 HD3 LYS A 26 8.309 -21.492 3.368 1.00 0.00 H new ATOM 0 HE2 LYS A 26 6.307 -20.342 4.755 1.00 0.00 H new ATOM 0 HE3 LYS A 26 5.975 -19.614 3.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 4.773 -21.683 3.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 5.898 -21.830 2.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 6.220 -22.535 3.718 1.00 0.00 H new ATOM 351 N VAL A 27 8.813 -15.152 4.179 1.00 0.00 N ATOM 352 CA VAL A 27 8.671 -13.818 3.609 1.00 0.00 C ATOM 353 C VAL A 27 10.030 -13.216 3.272 1.00 0.00 C ATOM 354 O VAL A 27 10.988 -13.355 4.033 1.00 0.00 O ATOM 355 CB VAL A 27 7.928 -12.873 4.572 1.00 0.00 C ATOM 356 CG1 VAL A 27 7.969 -11.443 4.056 1.00 0.00 C ATOM 357 CG2 VAL A 27 6.492 -13.336 4.770 1.00 0.00 C ATOM 0 H VAL A 27 8.110 -15.388 4.879 1.00 0.00 H new ATOM 0 HA VAL A 27 8.088 -13.925 2.694 1.00 0.00 H new ATOM 0 HB VAL A 27 8.431 -12.899 5.539 1.00 0.00 H new ATOM 0 HG11 VAL A 27 7.439 -10.791 4.750 1.00 0.00 H new ATOM 0 HG12 VAL A 27 9.005 -11.117 3.971 1.00 0.00 H new ATOM 0 HG13 VAL A 27 7.492 -11.396 3.077 1.00 0.00 H new ATOM 0 HG21 VAL A 27 5.982 -12.657 5.453 1.00 0.00 H new ATOM 0 HG22 VAL A 27 5.976 -13.341 3.810 1.00 0.00 H new ATOM 0 HG23 VAL A 27 6.489 -14.342 5.189 1.00 0.00 H new ATOM 367 N SER A 28 10.108 -12.546 2.127 1.00 0.00 N ATOM 368 CA SER A 28 11.351 -11.925 1.687 1.00 0.00 C ATOM 369 C SER A 28 11.089 -10.545 1.092 1.00 0.00 C ATOM 370 O SER A 28 9.942 -10.110 0.991 1.00 0.00 O ATOM 371 CB SER A 28 12.052 -12.812 0.656 1.00 0.00 C ATOM 372 OG SER A 28 12.386 -14.073 1.211 1.00 0.00 O ATOM 0 H SER A 28 9.324 -12.419 1.487 1.00 0.00 H new ATOM 0 HA SER A 28 11.998 -11.810 2.557 1.00 0.00 H new ATOM 0 HB2 SER A 28 11.403 -12.952 -0.209 1.00 0.00 H new ATOM 0 HB3 SER A 28 12.956 -12.317 0.300 1.00 0.00 H new ATOM 0 HG SER A 28 11.589 -14.472 1.619 1.00 0.00 H new ATOM 378 N GLU A 29 12.160 -9.863 0.700 1.00 0.00 N ATOM 379 CA GLU A 29 12.046 -8.532 0.116 1.00 0.00 C ATOM 380 C GLU A 29 11.386 -8.596 -1.259 1.00 0.00 C ATOM 381 O GLU A 29 10.372 -7.947 -1.519 1.00 0.00 O ATOM 382 CB GLU A 29 13.425 -7.880 0.001 1.00 0.00 C ATOM 383 CG GLU A 29 13.789 -7.010 1.193 1.00 0.00 C ATOM 384 CD GLU A 29 15.279 -6.991 1.469 1.00 0.00 C ATOM 385 OE1 GLU A 29 15.787 -7.969 2.056 1.00 0.00 O ATOM 386 OE2 GLU A 29 15.938 -5.998 1.097 1.00 0.00 O ATOM 0 H GLU A 29 13.116 -10.210 0.776 1.00 0.00 H new ATOM 0 HA GLU A 29 11.421 -7.928 0.773 1.00 0.00 H new ATOM 0 HB2 GLU A 29 14.178 -8.660 -0.112 1.00 0.00 H new ATOM 0 HB3 GLU A 29 13.456 -7.273 -0.904 1.00 0.00 H new ATOM 0 HG2 GLU A 29 13.444 -5.992 1.014 1.00 0.00 H new ATOM 0 HG3 GLU A 29 13.264 -7.373 2.077 1.00 0.00 H new ATOM 393 N PRO A 30 11.974 -9.395 -2.160 1.00 0.00 N ATOM 394 CA PRO A 30 11.461 -9.564 -3.523 1.00 0.00 C ATOM 395 C PRO A 30 10.144 -10.331 -3.556 1.00 0.00 C ATOM 396 O PRO A 30 9.607 -10.617 -4.627 1.00 0.00 O ATOM 397 CB PRO A 30 12.564 -10.363 -4.221 1.00 0.00 C ATOM 398 CG PRO A 30 13.254 -11.096 -3.122 1.00 0.00 C ATOM 399 CD PRO A 30 13.185 -10.198 -1.919 1.00 0.00 C ATOM 0 HA PRO A 30 11.244 -8.607 -3.998 1.00 0.00 H new ATOM 0 HB2 PRO A 30 12.149 -11.052 -4.957 1.00 0.00 H new ATOM 0 HB3 PRO A 30 13.253 -9.706 -4.752 1.00 0.00 H new ATOM 0 HG2 PRO A 30 12.768 -12.051 -2.924 1.00 0.00 H new ATOM 0 HG3 PRO A 30 14.288 -11.314 -3.388 1.00 0.00 H new ATOM 0 HD2 PRO A 30 13.110 -10.770 -0.994 1.00 0.00 H new ATOM 0 HD3 PRO A 30 14.073 -9.571 -1.835 1.00 0.00 H new ATOM 407 N LEU A 31 9.628 -10.663 -2.378 1.00 0.00 N ATOM 408 CA LEU A 31 8.373 -11.398 -2.272 1.00 0.00 C ATOM 409 C LEU A 31 7.192 -10.442 -2.134 1.00 0.00 C ATOM 410 O LEU A 31 6.198 -10.560 -2.852 1.00 0.00 O ATOM 411 CB LEU A 31 8.416 -12.350 -1.075 1.00 0.00 C ATOM 412 CG LEU A 31 7.153 -13.176 -0.829 1.00 0.00 C ATOM 413 CD1 LEU A 31 6.878 -14.095 -2.008 1.00 0.00 C ATOM 414 CD2 LEU A 31 7.283 -13.979 0.457 1.00 0.00 C ATOM 0 H LEU A 31 10.060 -10.435 -1.482 1.00 0.00 H new ATOM 0 HA LEU A 31 8.242 -11.978 -3.185 1.00 0.00 H new ATOM 0 HB2 LEU A 31 9.253 -13.035 -1.211 1.00 0.00 H new ATOM 0 HB3 LEU A 31 8.624 -11.766 -0.179 1.00 0.00 H new ATOM 0 HG LEU A 31 6.310 -12.493 -0.723 1.00 0.00 H new ATOM 0 HD11 LEU A 31 5.975 -14.675 -1.815 1.00 0.00 H new ATOM 0 HD12 LEU A 31 6.740 -13.499 -2.910 1.00 0.00 H new ATOM 0 HD13 LEU A 31 7.721 -14.772 -2.146 1.00 0.00 H new ATOM 0 HD21 LEU A 31 6.375 -14.561 0.616 1.00 0.00 H new ATOM 0 HD22 LEU A 31 8.137 -14.652 0.381 1.00 0.00 H new ATOM 0 HD23 LEU A 31 7.431 -13.300 1.297 1.00 0.00 H new ATOM 426 N LEU A 32 7.309 -9.495 -1.211 1.00 0.00 N ATOM 427 CA LEU A 32 6.253 -8.516 -0.980 1.00 0.00 C ATOM 428 C LEU A 32 6.020 -7.663 -2.223 1.00 0.00 C ATOM 429 O LEU A 32 4.880 -7.442 -2.632 1.00 0.00 O ATOM 430 CB LEU A 32 6.610 -7.620 0.207 1.00 0.00 C ATOM 431 CG LEU A 32 7.270 -8.316 1.398 1.00 0.00 C ATOM 432 CD1 LEU A 32 7.563 -7.316 2.505 1.00 0.00 C ATOM 433 CD2 LEU A 32 6.385 -9.442 1.915 1.00 0.00 C ATOM 0 H LEU A 32 8.125 -9.384 -0.610 1.00 0.00 H new ATOM 0 HA LEU A 32 5.334 -9.057 -0.755 1.00 0.00 H new ATOM 0 HB2 LEU A 32 7.278 -6.834 -0.145 1.00 0.00 H new ATOM 0 HB3 LEU A 32 5.700 -7.132 0.555 1.00 0.00 H new ATOM 0 HG LEU A 32 8.215 -8.746 1.065 1.00 0.00 H new ATOM 0 HD11 LEU A 32 8.032 -7.829 3.344 1.00 0.00 H new ATOM 0 HD12 LEU A 32 8.235 -6.544 2.130 1.00 0.00 H new ATOM 0 HD13 LEU A 32 6.632 -6.856 2.836 1.00 0.00 H new ATOM 0 HD21 LEU A 32 6.870 -9.926 2.762 1.00 0.00 H new ATOM 0 HD22 LEU A 32 5.425 -9.034 2.231 1.00 0.00 H new ATOM 0 HD23 LEU A 32 6.226 -10.173 1.122 1.00 0.00 H new ATOM 445 N TRP A 33 7.107 -7.189 -2.820 1.00 0.00 N ATOM 446 CA TRP A 33 7.022 -6.362 -4.019 1.00 0.00 C ATOM 447 C TRP A 33 5.933 -6.873 -4.956 1.00 0.00 C ATOM 448 O TRP A 33 4.907 -6.219 -5.144 1.00 0.00 O ATOM 449 CB TRP A 33 8.368 -6.339 -4.745 1.00 0.00 C ATOM 450 CG TRP A 33 8.502 -5.201 -5.712 1.00 0.00 C ATOM 451 CD1 TRP A 33 7.552 -4.750 -6.583 1.00 0.00 C ATOM 452 CD2 TRP A 33 9.653 -4.373 -5.906 1.00 0.00 C ATOM 453 NE1 TRP A 33 8.044 -3.691 -7.307 1.00 0.00 N ATOM 454 CE2 TRP A 33 9.330 -3.440 -6.910 1.00 0.00 C ATOM 455 CE3 TRP A 33 10.925 -4.328 -5.328 1.00 0.00 C ATOM 456 CZ2 TRP A 33 10.234 -2.475 -7.348 1.00 0.00 C ATOM 457 CZ3 TRP A 33 11.820 -3.370 -5.763 1.00 0.00 C ATOM 458 CH2 TRP A 33 11.472 -2.453 -6.765 1.00 0.00 C ATOM 0 H TRP A 33 8.058 -7.363 -2.494 1.00 0.00 H new ATOM 0 HA TRP A 33 6.766 -5.348 -3.713 1.00 0.00 H new ATOM 0 HB2 TRP A 33 9.169 -6.277 -4.008 1.00 0.00 H new ATOM 0 HB3 TRP A 33 8.500 -7.279 -5.281 1.00 0.00 H new ATOM 0 HD1 TRP A 33 6.560 -5.165 -6.687 1.00 0.00 H new ATOM 0 HE1 TRP A 33 7.534 -3.175 -8.024 1.00 0.00 H new ATOM 0 HE3 TRP A 33 11.203 -5.030 -4.555 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 9.967 -1.769 -8.121 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 12.806 -3.327 -5.323 1.00 0.00 H new ATOM 0 HH2 TRP A 33 12.194 -1.716 -7.083 1.00 0.00 H new ATOM 469 N GLU A 34 6.163 -8.044 -5.541 1.00 0.00 N ATOM 470 CA GLU A 34 5.201 -8.641 -6.460 1.00 0.00 C ATOM 471 C GLU A 34 3.880 -8.929 -5.752 1.00 0.00 C ATOM 472 O GLU A 34 2.814 -8.514 -6.209 1.00 0.00 O ATOM 473 CB GLU A 34 5.765 -9.932 -7.056 1.00 0.00 C ATOM 474 CG GLU A 34 4.772 -10.685 -7.925 1.00 0.00 C ATOM 475 CD GLU A 34 5.048 -12.176 -7.969 1.00 0.00 C ATOM 476 OE1 GLU A 34 5.957 -12.589 -8.719 1.00 0.00 O ATOM 477 OE2 GLU A 34 4.355 -12.928 -7.253 1.00 0.00 O ATOM 0 H GLU A 34 7.007 -8.598 -5.395 1.00 0.00 H new ATOM 0 HA GLU A 34 5.015 -7.929 -7.264 1.00 0.00 H new ATOM 0 HB2 GLU A 34 6.647 -9.693 -7.650 1.00 0.00 H new ATOM 0 HB3 GLU A 34 6.093 -10.583 -6.246 1.00 0.00 H new ATOM 0 HG2 GLU A 34 3.764 -10.517 -7.547 1.00 0.00 H new ATOM 0 HG3 GLU A 34 4.804 -10.283 -8.938 1.00 0.00 H new ATOM 484 N LEU A 35 3.958 -9.643 -4.634 1.00 0.00 N ATOM 485 CA LEU A 35 2.770 -9.988 -3.862 1.00 0.00 C ATOM 486 C LEU A 35 1.891 -8.762 -3.637 1.00 0.00 C ATOM 487 O LEU A 35 0.688 -8.881 -3.404 1.00 0.00 O ATOM 488 CB LEU A 35 3.170 -10.597 -2.517 1.00 0.00 C ATOM 489 CG LEU A 35 2.063 -10.688 -1.466 1.00 0.00 C ATOM 490 CD1 LEU A 35 0.985 -11.665 -1.909 1.00 0.00 C ATOM 491 CD2 LEU A 35 2.640 -11.102 -0.120 1.00 0.00 C ATOM 0 H LEU A 35 4.832 -9.994 -4.242 1.00 0.00 H new ATOM 0 HA LEU A 35 2.199 -10.722 -4.430 1.00 0.00 H new ATOM 0 HB2 LEU A 35 3.557 -11.600 -2.696 1.00 0.00 H new ATOM 0 HB3 LEU A 35 3.989 -10.008 -2.103 1.00 0.00 H new ATOM 0 HG LEU A 35 1.609 -9.703 -1.358 1.00 0.00 H new ATOM 0 HD11 LEU A 35 0.206 -11.717 -1.148 1.00 0.00 H new ATOM 0 HD12 LEU A 35 0.552 -11.326 -2.850 1.00 0.00 H new ATOM 0 HD13 LEU A 35 1.424 -12.653 -2.046 1.00 0.00 H new ATOM 0 HD21 LEU A 35 1.839 -11.162 0.616 1.00 0.00 H new ATOM 0 HD22 LEU A 35 3.120 -12.076 -0.214 1.00 0.00 H new ATOM 0 HD23 LEU A 35 3.375 -10.365 0.203 1.00 0.00 H new ATOM 503 N PHE A 36 2.500 -7.583 -3.711 1.00 0.00 N ATOM 504 CA PHE A 36 1.773 -6.334 -3.517 1.00 0.00 C ATOM 505 C PHE A 36 1.344 -5.740 -4.856 1.00 0.00 C ATOM 506 O PHE A 36 0.309 -5.080 -4.952 1.00 0.00 O ATOM 507 CB PHE A 36 2.639 -5.328 -2.755 1.00 0.00 C ATOM 508 CG PHE A 36 2.463 -5.394 -1.265 1.00 0.00 C ATOM 509 CD1 PHE A 36 2.890 -6.503 -0.552 1.00 0.00 C ATOM 510 CD2 PHE A 36 1.871 -4.347 -0.577 1.00 0.00 C ATOM 511 CE1 PHE A 36 2.728 -6.566 0.819 1.00 0.00 C ATOM 512 CE2 PHE A 36 1.707 -4.405 0.794 1.00 0.00 C ATOM 513 CZ PHE A 36 2.138 -5.516 1.493 1.00 0.00 C ATOM 0 H PHE A 36 3.495 -7.466 -3.904 1.00 0.00 H new ATOM 0 HA PHE A 36 0.879 -6.551 -2.932 1.00 0.00 H new ATOM 0 HB2 PHE A 36 3.687 -5.506 -2.997 1.00 0.00 H new ATOM 0 HB3 PHE A 36 2.399 -4.321 -3.097 1.00 0.00 H new ATOM 0 HD1 PHE A 36 3.354 -7.327 -1.073 1.00 0.00 H new ATOM 0 HD2 PHE A 36 1.534 -3.475 -1.118 1.00 0.00 H new ATOM 0 HE1 PHE A 36 3.063 -7.437 1.363 1.00 0.00 H new ATOM 0 HE2 PHE A 36 1.243 -3.583 1.318 1.00 0.00 H new ATOM 0 HZ PHE A 36 2.013 -5.563 2.565 1.00 0.00 H new ATOM 523 N LEU A 37 2.147 -5.979 -5.887 1.00 0.00 N ATOM 524 CA LEU A 37 1.852 -5.469 -7.221 1.00 0.00 C ATOM 525 C LEU A 37 0.353 -5.511 -7.501 1.00 0.00 C ATOM 526 O LEU A 37 -0.185 -4.635 -8.177 1.00 0.00 O ATOM 527 CB LEU A 37 2.603 -6.282 -8.277 1.00 0.00 C ATOM 528 CG LEU A 37 4.072 -5.915 -8.487 1.00 0.00 C ATOM 529 CD1 LEU A 37 4.714 -6.845 -9.505 1.00 0.00 C ATOM 530 CD2 LEU A 37 4.202 -4.465 -8.931 1.00 0.00 C ATOM 0 H LEU A 37 3.008 -6.523 -5.825 1.00 0.00 H new ATOM 0 HA LEU A 37 2.182 -4.431 -7.268 1.00 0.00 H new ATOM 0 HB2 LEU A 37 2.548 -7.335 -8.002 1.00 0.00 H new ATOM 0 HB3 LEU A 37 2.082 -6.173 -9.228 1.00 0.00 H new ATOM 0 HG LEU A 37 4.595 -6.032 -7.538 1.00 0.00 H new ATOM 0 HD11 LEU A 37 5.760 -6.569 -9.642 1.00 0.00 H new ATOM 0 HD12 LEU A 37 4.654 -7.873 -9.147 1.00 0.00 H new ATOM 0 HD13 LEU A 37 4.189 -6.761 -10.457 1.00 0.00 H new ATOM 0 HD21 LEU A 37 5.255 -4.222 -9.076 1.00 0.00 H new ATOM 0 HD22 LEU A 37 3.664 -4.322 -9.868 1.00 0.00 H new ATOM 0 HD23 LEU A 37 3.780 -3.811 -8.167 1.00 0.00 H new ATOM 542 N GLN A 38 -0.314 -6.533 -6.975 1.00 0.00 N ATOM 543 CA GLN A 38 -1.751 -6.687 -7.167 1.00 0.00 C ATOM 544 C GLN A 38 -2.492 -5.414 -6.774 1.00 0.00 C ATOM 545 O GLN A 38 -3.340 -4.923 -7.519 1.00 0.00 O ATOM 546 CB GLN A 38 -2.272 -7.869 -6.347 1.00 0.00 C ATOM 547 CG GLN A 38 -1.743 -7.902 -4.923 1.00 0.00 C ATOM 548 CD GLN A 38 -2.238 -9.105 -4.144 1.00 0.00 C ATOM 549 OE1 GLN A 38 -2.901 -8.964 -3.117 1.00 0.00 O ATOM 550 NE2 GLN A 38 -1.917 -10.298 -4.631 1.00 0.00 N ATOM 0 H GLN A 38 0.118 -7.266 -6.413 1.00 0.00 H new ATOM 0 HA GLN A 38 -1.933 -6.879 -8.224 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -3.361 -7.830 -6.320 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -1.999 -8.797 -6.849 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -0.653 -7.911 -4.944 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -2.044 -6.991 -4.406 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -1.365 -10.368 -5.486 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -2.222 -11.144 -4.150 1.00 0.00 H new ATOM 559 N ALA A 39 -2.167 -4.884 -5.600 1.00 0.00 N ATOM 560 CA ALA A 39 -2.801 -3.666 -5.109 1.00 0.00 C ATOM 561 C ALA A 39 -2.433 -2.467 -5.976 1.00 0.00 C ATOM 562 O ALA A 39 -3.291 -1.663 -6.337 1.00 0.00 O ATOM 563 CB ALA A 39 -2.408 -3.414 -3.661 1.00 0.00 C ATOM 0 H ALA A 39 -1.468 -5.279 -4.971 1.00 0.00 H new ATOM 0 HA ALA A 39 -3.881 -3.801 -5.163 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -2.888 -2.502 -3.307 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -2.728 -4.255 -3.046 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -1.326 -3.305 -3.591 1.00 0.00 H new ATOM 569 N GLY A 40 -1.150 -2.354 -6.307 1.00 0.00 N ATOM 570 CA GLY A 40 -0.690 -1.249 -7.128 1.00 0.00 C ATOM 571 C GLY A 40 0.747 -1.420 -7.579 1.00 0.00 C ATOM 572 O GLY A 40 1.416 -2.394 -7.235 1.00 0.00 O ATOM 0 H GLY A 40 -0.421 -3.008 -6.021 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -1.334 -1.158 -8.003 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -0.783 -0.320 -6.566 1.00 0.00 H new ATOM 576 N PRO A 41 1.242 -0.456 -8.370 1.00 0.00 N ATOM 577 CA PRO A 41 2.613 -0.483 -8.886 1.00 0.00 C ATOM 578 C PRO A 41 3.649 -0.252 -7.792 1.00 0.00 C ATOM 579 O PRO A 41 4.116 0.869 -7.590 1.00 0.00 O ATOM 580 CB PRO A 41 2.635 0.669 -9.894 1.00 0.00 C ATOM 581 CG PRO A 41 1.568 1.600 -9.429 1.00 0.00 C ATOM 582 CD PRO A 41 0.500 0.734 -8.820 1.00 0.00 C ATOM 0 HA PRO A 41 2.867 -1.451 -9.318 1.00 0.00 H new ATOM 0 HB2 PRO A 41 3.608 1.160 -9.913 1.00 0.00 H new ATOM 0 HB3 PRO A 41 2.437 0.314 -10.905 1.00 0.00 H new ATOM 0 HG2 PRO A 41 1.959 2.309 -8.699 1.00 0.00 H new ATOM 0 HG3 PRO A 41 1.171 2.184 -10.259 1.00 0.00 H new ATOM 0 HD2 PRO A 41 0.002 1.235 -7.990 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -0.271 0.476 -9.546 1.00 0.00 H new ATOM 590 N VAL A 42 4.007 -1.322 -7.087 1.00 0.00 N ATOM 591 CA VAL A 42 4.989 -1.236 -6.014 1.00 0.00 C ATOM 592 C VAL A 42 6.303 -0.649 -6.517 1.00 0.00 C ATOM 593 O VAL A 42 6.887 -1.142 -7.482 1.00 0.00 O ATOM 594 CB VAL A 42 5.263 -2.618 -5.391 1.00 0.00 C ATOM 595 CG1 VAL A 42 6.360 -2.524 -4.342 1.00 0.00 C ATOM 596 CG2 VAL A 42 3.988 -3.193 -4.792 1.00 0.00 C ATOM 0 H VAL A 42 3.631 -2.258 -7.241 1.00 0.00 H new ATOM 0 HA VAL A 42 4.568 -0.579 -5.253 1.00 0.00 H new ATOM 0 HB VAL A 42 5.604 -3.291 -6.178 1.00 0.00 H new ATOM 0 HG11 VAL A 42 6.539 -3.510 -3.913 1.00 0.00 H new ATOM 0 HG12 VAL A 42 7.276 -2.158 -4.805 1.00 0.00 H new ATOM 0 HG13 VAL A 42 6.052 -1.837 -3.554 1.00 0.00 H new ATOM 0 HG21 VAL A 42 4.199 -4.170 -4.356 1.00 0.00 H new ATOM 0 HG22 VAL A 42 3.615 -2.523 -4.017 1.00 0.00 H new ATOM 0 HG23 VAL A 42 3.235 -3.299 -5.573 1.00 0.00 H new ATOM 606 N VAL A 43 6.764 0.409 -5.856 1.00 0.00 N ATOM 607 CA VAL A 43 8.011 1.063 -6.235 1.00 0.00 C ATOM 608 C VAL A 43 9.217 0.297 -5.704 1.00 0.00 C ATOM 609 O VAL A 43 10.119 -0.061 -6.460 1.00 0.00 O ATOM 610 CB VAL A 43 8.065 2.511 -5.713 1.00 0.00 C ATOM 611 CG1 VAL A 43 9.104 3.317 -6.478 1.00 0.00 C ATOM 612 CG2 VAL A 43 6.695 3.164 -5.810 1.00 0.00 C ATOM 0 H VAL A 43 6.293 0.831 -5.056 1.00 0.00 H new ATOM 0 HA VAL A 43 8.044 1.076 -7.324 1.00 0.00 H new ATOM 0 HB VAL A 43 8.358 2.489 -4.663 1.00 0.00 H new ATOM 0 HG11 VAL A 43 9.127 4.337 -6.095 1.00 0.00 H new ATOM 0 HG12 VAL A 43 10.085 2.859 -6.351 1.00 0.00 H new ATOM 0 HG13 VAL A 43 8.845 3.333 -7.537 1.00 0.00 H new ATOM 0 HG21 VAL A 43 6.752 4.187 -5.437 1.00 0.00 H new ATOM 0 HG22 VAL A 43 6.370 3.175 -6.850 1.00 0.00 H new ATOM 0 HG23 VAL A 43 5.980 2.599 -5.212 1.00 0.00 H new ATOM 622 N ASN A 44 9.226 0.049 -4.398 1.00 0.00 N ATOM 623 CA ASN A 44 10.322 -0.675 -3.765 1.00 0.00 C ATOM 624 C ASN A 44 9.886 -1.259 -2.425 1.00 0.00 C ATOM 625 O ASN A 44 8.890 -0.830 -1.842 1.00 0.00 O ATOM 626 CB ASN A 44 11.524 0.251 -3.564 1.00 0.00 C ATOM 627 CG ASN A 44 12.483 -0.268 -2.511 1.00 0.00 C ATOM 628 OD1 ASN A 44 13.384 -1.053 -2.808 1.00 0.00 O ATOM 629 ND2 ASN A 44 12.294 0.170 -1.272 1.00 0.00 N ATOM 0 H ASN A 44 8.487 0.339 -3.758 1.00 0.00 H new ATOM 0 HA ASN A 44 10.610 -1.496 -4.422 1.00 0.00 H new ATOM 0 HB2 ASN A 44 12.054 0.365 -4.510 1.00 0.00 H new ATOM 0 HB3 ASN A 44 11.172 1.241 -3.275 1.00 0.00 H new ATOM 0 HD21 ASN A 44 12.909 -0.144 -0.521 1.00 0.00 H new ATOM 0 HD22 ASN A 44 11.534 0.820 -1.071 1.00 0.00 H new ATOM 636 N THR A 45 10.640 -2.241 -1.940 1.00 0.00 N ATOM 637 CA THR A 45 10.332 -2.884 -0.669 1.00 0.00 C ATOM 638 C THR A 45 11.415 -2.603 0.366 1.00 0.00 C ATOM 639 O THR A 45 12.595 -2.495 0.031 1.00 0.00 O ATOM 640 CB THR A 45 10.178 -4.408 -0.833 1.00 0.00 C ATOM 641 OG1 THR A 45 11.381 -4.966 -1.373 1.00 0.00 O ATOM 642 CG2 THR A 45 9.006 -4.738 -1.745 1.00 0.00 C ATOM 0 H THR A 45 11.468 -2.608 -2.409 1.00 0.00 H new ATOM 0 HA THR A 45 9.386 -2.466 -0.324 1.00 0.00 H new ATOM 0 HB THR A 45 9.986 -4.840 0.149 1.00 0.00 H new ATOM 0 HG1 THR A 45 11.411 -5.927 -1.182 1.00 0.00 H new ATOM 0 HG21 THR A 45 8.917 -5.820 -1.846 1.00 0.00 H new ATOM 0 HG22 THR A 45 8.088 -4.337 -1.317 1.00 0.00 H new ATOM 0 HG23 THR A 45 9.173 -4.295 -2.727 1.00 0.00 H new ATOM 650 N HIS A 46 11.007 -2.486 1.626 1.00 0.00 N ATOM 651 CA HIS A 46 11.944 -2.219 2.712 1.00 0.00 C ATOM 652 C HIS A 46 11.732 -3.194 3.865 1.00 0.00 C ATOM 653 O HIS A 46 10.643 -3.270 4.434 1.00 0.00 O ATOM 654 CB HIS A 46 11.786 -0.782 3.208 1.00 0.00 C ATOM 655 CG HIS A 46 12.782 -0.397 4.258 1.00 0.00 C ATOM 656 ND1 HIS A 46 13.045 -1.174 5.366 1.00 0.00 N ATOM 657 CD2 HIS A 46 13.583 0.689 4.363 1.00 0.00 C ATOM 658 CE1 HIS A 46 13.964 -0.582 6.109 1.00 0.00 C ATOM 659 NE2 HIS A 46 14.307 0.551 5.522 1.00 0.00 N ATOM 0 H HIS A 46 10.034 -2.572 1.920 1.00 0.00 H new ATOM 0 HA HIS A 46 12.955 -2.354 2.328 1.00 0.00 H new ATOM 0 HB2 HIS A 46 11.882 -0.102 2.362 1.00 0.00 H new ATOM 0 HB3 HIS A 46 10.780 -0.653 3.608 1.00 0.00 H new ATOM 0 HD2 HIS A 46 13.642 1.511 3.665 1.00 0.00 H new ATOM 0 HE1 HIS A 46 14.366 -0.960 7.037 1.00 0.00 H new ATOM 0 HE2 HIS A 46 14.997 1.215 5.873 1.00 0.00 H new ATOM 667 N MET A 47 12.779 -3.939 4.205 1.00 0.00 N ATOM 668 CA MET A 47 12.706 -4.909 5.291 1.00 0.00 C ATOM 669 C MET A 47 13.987 -4.895 6.120 1.00 0.00 C ATOM 670 O MET A 47 15.070 -5.229 5.639 1.00 0.00 O ATOM 671 CB MET A 47 12.462 -6.313 4.734 1.00 0.00 C ATOM 672 CG MET A 47 10.989 -6.671 4.614 1.00 0.00 C ATOM 673 SD MET A 47 10.346 -7.470 6.097 1.00 0.00 S ATOM 674 CE MET A 47 11.018 -9.119 5.913 1.00 0.00 C ATOM 0 H MET A 47 13.688 -3.889 3.744 1.00 0.00 H new ATOM 0 HA MET A 47 11.873 -4.632 5.937 1.00 0.00 H new ATOM 0 HB2 MET A 47 12.928 -6.391 3.752 1.00 0.00 H new ATOM 0 HB3 MET A 47 12.953 -7.041 5.379 1.00 0.00 H new ATOM 0 HG2 MET A 47 10.414 -5.767 4.415 1.00 0.00 H new ATOM 0 HG3 MET A 47 10.848 -7.333 3.759 1.00 0.00 H new ATOM 0 HE1 MET A 47 10.581 -9.776 6.665 1.00 0.00 H new ATOM 0 HE2 MET A 47 10.783 -9.499 4.919 1.00 0.00 H new ATOM 0 HE3 MET A 47 12.100 -9.088 6.043 1.00 0.00 H new ATOM 684 N PRO A 48 13.863 -4.498 7.395 1.00 0.00 N ATOM 685 CA PRO A 48 15.001 -4.431 8.317 1.00 0.00 C ATOM 686 C PRO A 48 15.524 -5.812 8.695 1.00 0.00 C ATOM 687 O PRO A 48 14.783 -6.796 8.673 1.00 0.00 O ATOM 688 CB PRO A 48 14.421 -3.725 9.545 1.00 0.00 C ATOM 689 CG PRO A 48 12.960 -4.015 9.494 1.00 0.00 C ATOM 690 CD PRO A 48 12.603 -4.086 8.035 1.00 0.00 C ATOM 0 HA PRO A 48 15.854 -3.916 7.874 1.00 0.00 H new ATOM 0 HB2 PRO A 48 14.867 -4.101 10.466 1.00 0.00 H new ATOM 0 HB3 PRO A 48 14.613 -2.653 9.513 1.00 0.00 H new ATOM 0 HG2 PRO A 48 12.731 -4.954 9.998 1.00 0.00 H new ATOM 0 HG3 PRO A 48 12.389 -3.235 9.998 1.00 0.00 H new ATOM 0 HD2 PRO A 48 11.805 -4.805 7.851 1.00 0.00 H new ATOM 0 HD3 PRO A 48 12.257 -3.123 7.659 1.00 0.00 H new ATOM 698 N LYS A 49 16.804 -5.881 9.041 1.00 0.00 N ATOM 699 CA LYS A 49 17.427 -7.142 9.426 1.00 0.00 C ATOM 700 C LYS A 49 18.238 -6.980 10.708 1.00 0.00 C ATOM 701 O LYS A 49 18.956 -5.994 10.879 1.00 0.00 O ATOM 702 CB LYS A 49 18.330 -7.653 8.301 1.00 0.00 C ATOM 703 CG LYS A 49 17.643 -7.705 6.947 1.00 0.00 C ATOM 704 CD LYS A 49 16.760 -8.935 6.817 1.00 0.00 C ATOM 705 CE LYS A 49 15.920 -8.886 5.549 1.00 0.00 C ATOM 706 NZ LYS A 49 16.694 -9.321 4.354 1.00 0.00 N ATOM 0 H LYS A 49 17.432 -5.077 9.063 1.00 0.00 H new ATOM 0 HA LYS A 49 16.635 -7.869 9.607 1.00 0.00 H new ATOM 0 HB2 LYS A 49 19.207 -7.010 8.230 1.00 0.00 H new ATOM 0 HB3 LYS A 49 18.686 -8.651 8.557 1.00 0.00 H new ATOM 0 HG2 LYS A 49 17.041 -6.807 6.809 1.00 0.00 H new ATOM 0 HG3 LYS A 49 18.394 -7.710 6.157 1.00 0.00 H new ATOM 0 HD2 LYS A 49 17.381 -9.831 6.809 1.00 0.00 H new ATOM 0 HD3 LYS A 49 16.106 -9.008 7.686 1.00 0.00 H new ATOM 0 HE2 LYS A 49 15.045 -9.526 5.668 1.00 0.00 H new ATOM 0 HE3 LYS A 49 15.554 -7.871 5.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 16.429 -8.735 3.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 17.711 -9.214 4.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 16.483 -10.318 4.148 1.00 0.00 H new ATOM 720 N ASP A 50 18.119 -7.952 11.605 1.00 0.00 N ATOM 721 CA ASP A 50 18.842 -7.918 12.870 1.00 0.00 C ATOM 722 C ASP A 50 20.338 -7.733 12.636 1.00 0.00 C ATOM 723 O ASP A 50 20.789 -7.622 11.496 1.00 0.00 O ATOM 724 CB ASP A 50 18.593 -9.204 13.660 1.00 0.00 C ATOM 725 CG ASP A 50 18.874 -9.039 15.140 1.00 0.00 C ATOM 726 OD1 ASP A 50 19.089 -7.889 15.579 1.00 0.00 O ATOM 727 OD2 ASP A 50 18.878 -10.059 15.861 1.00 0.00 O ATOM 0 H ASP A 50 17.528 -8.774 11.479 1.00 0.00 H new ATOM 0 HA ASP A 50 18.474 -7.069 13.447 1.00 0.00 H new ATOM 0 HB2 ASP A 50 17.558 -9.516 13.523 1.00 0.00 H new ATOM 0 HB3 ASP A 50 19.222 -10.000 13.260 1.00 0.00 H new ATOM 732 N ARG A 51 21.103 -7.700 13.723 1.00 0.00 N ATOM 733 CA ARG A 51 22.548 -7.525 13.635 1.00 0.00 C ATOM 734 C ARG A 51 23.276 -8.794 14.071 1.00 0.00 C ATOM 735 O ARG A 51 24.304 -9.158 13.502 1.00 0.00 O ATOM 736 CB ARG A 51 22.994 -6.346 14.501 1.00 0.00 C ATOM 737 CG ARG A 51 22.745 -6.552 15.986 1.00 0.00 C ATOM 738 CD ARG A 51 23.546 -5.570 16.827 1.00 0.00 C ATOM 739 NE ARG A 51 24.889 -6.066 17.116 1.00 0.00 N ATOM 740 CZ ARG A 51 25.740 -5.451 17.930 1.00 0.00 C ATOM 741 NH1 ARG A 51 25.389 -4.324 18.533 1.00 0.00 N ATOM 742 NH2 ARG A 51 26.945 -5.965 18.142 1.00 0.00 N ATOM 0 H ARG A 51 20.746 -7.792 14.674 1.00 0.00 H new ATOM 0 HA ARG A 51 22.802 -7.319 12.595 1.00 0.00 H new ATOM 0 HB2 ARG A 51 24.058 -6.170 14.341 1.00 0.00 H new ATOM 0 HB3 ARG A 51 22.470 -5.448 14.175 1.00 0.00 H new ATOM 0 HG2 ARG A 51 21.683 -6.432 16.198 1.00 0.00 H new ATOM 0 HG3 ARG A 51 23.012 -7.572 16.263 1.00 0.00 H new ATOM 0 HD2 ARG A 51 23.616 -4.617 16.303 1.00 0.00 H new ATOM 0 HD3 ARG A 51 23.020 -5.381 17.763 1.00 0.00 H new ATOM 0 HE ARG A 51 25.190 -6.932 16.668 1.00 0.00 H new ATOM 0 HH11 ARG A 51 24.463 -3.927 18.373 1.00 0.00 H new ATOM 0 HH12 ARG A 51 26.045 -3.854 19.157 1.00 0.00 H new ATOM 0 HH21 ARG A 51 27.218 -6.832 17.680 1.00 0.00 H new ATOM 0 HH22 ARG A 51 27.598 -5.493 18.767 1.00 0.00 H new ATOM 756 N VAL A 52 22.735 -9.462 15.085 1.00 0.00 N ATOM 757 CA VAL A 52 23.332 -10.689 15.597 1.00 0.00 C ATOM 758 C VAL A 52 22.948 -11.888 14.737 1.00 0.00 C ATOM 759 O VAL A 52 23.782 -12.740 14.432 1.00 0.00 O ATOM 760 CB VAL A 52 22.903 -10.957 17.052 1.00 0.00 C ATOM 761 CG1 VAL A 52 23.398 -9.848 17.968 1.00 0.00 C ATOM 762 CG2 VAL A 52 21.391 -11.101 17.144 1.00 0.00 C ATOM 0 H VAL A 52 21.884 -9.174 15.568 1.00 0.00 H new ATOM 0 HA VAL A 52 24.413 -10.553 15.563 1.00 0.00 H new ATOM 0 HB VAL A 52 23.355 -11.894 17.379 1.00 0.00 H new ATOM 0 HG11 VAL A 52 23.085 -10.055 18.992 1.00 0.00 H new ATOM 0 HG12 VAL A 52 24.486 -9.798 17.924 1.00 0.00 H new ATOM 0 HG13 VAL A 52 22.978 -8.895 17.646 1.00 0.00 H new ATOM 0 HG21 VAL A 52 21.106 -11.290 18.179 1.00 0.00 H new ATOM 0 HG22 VAL A 52 20.916 -10.183 16.799 1.00 0.00 H new ATOM 0 HG23 VAL A 52 21.066 -11.934 16.520 1.00 0.00 H new ATOM 772 N THR A 53 21.678 -11.947 14.347 1.00 0.00 N ATOM 773 CA THR A 53 21.183 -13.041 13.521 1.00 0.00 C ATOM 774 C THR A 53 21.025 -12.606 12.069 1.00 0.00 C ATOM 775 O THR A 53 21.016 -13.436 11.160 1.00 0.00 O ATOM 776 CB THR A 53 19.830 -13.566 14.038 1.00 0.00 C ATOM 777 OG1 THR A 53 18.890 -12.490 14.130 1.00 0.00 O ATOM 778 CG2 THR A 53 19.989 -14.224 15.400 1.00 0.00 C ATOM 0 H THR A 53 20.974 -11.250 14.590 1.00 0.00 H new ATOM 0 HA THR A 53 21.922 -13.841 13.579 1.00 0.00 H new ATOM 0 HB THR A 53 19.462 -14.311 13.333 1.00 0.00 H new ATOM 0 HG1 THR A 53 19.130 -11.909 14.882 1.00 0.00 H new ATOM 0 HG21 THR A 53 19.020 -14.587 15.744 1.00 0.00 H new ATOM 0 HG22 THR A 53 20.683 -15.061 15.321 1.00 0.00 H new ATOM 0 HG23 THR A 53 20.378 -13.496 16.112 1.00 0.00 H new ATOM 786 N GLY A 54 20.903 -11.299 11.857 1.00 0.00 N ATOM 787 CA GLY A 54 20.748 -10.778 10.511 1.00 0.00 C ATOM 788 C GLY A 54 19.499 -11.297 9.828 1.00 0.00 C ATOM 789 O GLY A 54 19.496 -11.529 8.619 1.00 0.00 O ATOM 0 H GLY A 54 20.909 -10.592 12.592 1.00 0.00 H new ATOM 0 HA2 GLY A 54 20.712 -9.689 10.548 1.00 0.00 H new ATOM 0 HA3 GLY A 54 21.622 -11.048 9.918 1.00 0.00 H new ATOM 793 N GLN A 55 18.435 -11.482 10.604 1.00 0.00 N ATOM 794 CA GLN A 55 17.175 -11.981 10.065 1.00 0.00 C ATOM 795 C GLN A 55 16.033 -11.019 10.374 1.00 0.00 C ATOM 796 O GLN A 55 15.881 -10.562 11.507 1.00 0.00 O ATOM 797 CB GLN A 55 16.862 -13.364 10.639 1.00 0.00 C ATOM 798 CG GLN A 55 17.978 -14.375 10.433 1.00 0.00 C ATOM 799 CD GLN A 55 17.499 -15.808 10.560 1.00 0.00 C ATOM 800 OE1 GLN A 55 17.309 -16.502 9.562 1.00 0.00 O ATOM 801 NE2 GLN A 55 17.301 -16.258 11.794 1.00 0.00 N ATOM 0 H GLN A 55 18.421 -11.294 11.606 1.00 0.00 H new ATOM 0 HA GLN A 55 17.277 -12.060 8.983 1.00 0.00 H new ATOM 0 HB2 GLN A 55 16.662 -13.268 11.706 1.00 0.00 H new ATOM 0 HB3 GLN A 55 15.950 -13.742 10.177 1.00 0.00 H new ATOM 0 HG2 GLN A 55 18.418 -14.229 9.446 1.00 0.00 H new ATOM 0 HG3 GLN A 55 18.767 -14.194 11.163 1.00 0.00 H new ATOM 0 HE21 GLN A 55 17.471 -15.647 12.593 1.00 0.00 H new ATOM 0 HE22 GLN A 55 16.979 -17.214 11.943 1.00 0.00 H new ATOM 810 N HIS A 56 15.231 -10.714 9.358 1.00 0.00 N ATOM 811 CA HIS A 56 14.102 -9.806 9.521 1.00 0.00 C ATOM 812 C HIS A 56 13.353 -10.097 10.818 1.00 0.00 C ATOM 813 O HIS A 56 12.822 -11.191 11.007 1.00 0.00 O ATOM 814 CB HIS A 56 13.148 -9.925 8.331 1.00 0.00 C ATOM 815 CG HIS A 56 12.382 -11.212 8.304 1.00 0.00 C ATOM 816 ND1 HIS A 56 11.092 -11.330 8.776 1.00 0.00 N ATOM 817 CD2 HIS A 56 12.731 -12.441 7.856 1.00 0.00 C ATOM 818 CE1 HIS A 56 10.681 -12.576 8.621 1.00 0.00 C ATOM 819 NE2 HIS A 56 11.657 -13.270 8.064 1.00 0.00 N ATOM 0 H HIS A 56 15.343 -11.083 8.414 1.00 0.00 H new ATOM 0 HA HIS A 56 14.490 -8.789 9.566 1.00 0.00 H new ATOM 0 HB2 HIS A 56 12.444 -9.093 8.356 1.00 0.00 H new ATOM 0 HB3 HIS A 56 13.719 -9.832 7.407 1.00 0.00 H new ATOM 0 HD1 HIS A 56 10.541 -10.573 9.182 1.00 0.00 H new ATOM 0 HD2 HIS A 56 13.678 -12.718 7.417 1.00 0.00 H new ATOM 0 HE1 HIS A 56 9.712 -12.961 8.902 1.00 0.00 H new ATOM 827 N GLN A 57 13.317 -9.111 11.709 1.00 0.00 N ATOM 828 CA GLN A 57 12.636 -9.263 12.989 1.00 0.00 C ATOM 829 C GLN A 57 11.249 -9.867 12.798 1.00 0.00 C ATOM 830 O GLN A 57 10.903 -10.865 13.430 1.00 0.00 O ATOM 831 CB GLN A 57 12.523 -7.910 13.694 1.00 0.00 C ATOM 832 CG GLN A 57 13.791 -7.499 14.426 1.00 0.00 C ATOM 833 CD GLN A 57 13.513 -6.588 15.606 1.00 0.00 C ATOM 834 OE1 GLN A 57 13.107 -7.044 16.675 1.00 0.00 O ATOM 835 NE2 GLN A 57 13.732 -5.292 15.418 1.00 0.00 N ATOM 0 H GLN A 57 13.751 -8.199 11.568 1.00 0.00 H new ATOM 0 HA GLN A 57 13.225 -9.939 13.608 1.00 0.00 H new ATOM 0 HB2 GLN A 57 12.274 -7.146 12.958 1.00 0.00 H new ATOM 0 HB3 GLN A 57 11.698 -7.948 14.406 1.00 0.00 H new ATOM 0 HG2 GLN A 57 14.310 -8.392 14.775 1.00 0.00 H new ATOM 0 HG3 GLN A 57 14.460 -6.993 13.730 1.00 0.00 H new ATOM 0 HE21 GLN A 57 14.069 -4.957 14.515 1.00 0.00 H new ATOM 0 HE22 GLN A 57 13.564 -4.631 16.176 1.00 0.00 H new ATOM 844 N GLY A 58 10.456 -9.255 11.924 1.00 0.00 N ATOM 845 CA GLY A 58 9.115 -9.746 11.666 1.00 0.00 C ATOM 846 C GLY A 58 8.187 -8.660 11.161 1.00 0.00 C ATOM 847 O GLY A 58 7.002 -8.642 11.495 1.00 0.00 O ATOM 0 H GLY A 58 10.719 -8.427 11.389 1.00 0.00 H new ATOM 0 HA2 GLY A 58 9.161 -10.550 10.932 1.00 0.00 H new ATOM 0 HA3 GLY A 58 8.705 -10.173 12.581 1.00 0.00 H new ATOM 851 N TYR A 59 8.725 -7.752 10.355 1.00 0.00 N ATOM 852 CA TYR A 59 7.937 -6.655 9.805 1.00 0.00 C ATOM 853 C TYR A 59 8.647 -6.018 8.614 1.00 0.00 C ATOM 854 O TYR A 59 9.866 -5.855 8.617 1.00 0.00 O ATOM 855 CB TYR A 59 7.675 -5.599 10.881 1.00 0.00 C ATOM 856 CG TYR A 59 8.912 -4.834 11.292 1.00 0.00 C ATOM 857 CD1 TYR A 59 9.769 -5.331 12.266 1.00 0.00 C ATOM 858 CD2 TYR A 59 9.224 -3.613 10.706 1.00 0.00 C ATOM 859 CE1 TYR A 59 10.900 -4.634 12.645 1.00 0.00 C ATOM 860 CE2 TYR A 59 10.354 -2.910 11.079 1.00 0.00 C ATOM 861 CZ TYR A 59 11.188 -3.424 12.049 1.00 0.00 C ATOM 862 OH TYR A 59 12.314 -2.728 12.423 1.00 0.00 O ATOM 0 H TYR A 59 9.704 -7.754 10.068 1.00 0.00 H new ATOM 0 HA TYR A 59 6.985 -7.061 9.463 1.00 0.00 H new ATOM 0 HB2 TYR A 59 6.928 -4.895 10.513 1.00 0.00 H new ATOM 0 HB3 TYR A 59 7.250 -6.085 11.759 1.00 0.00 H new ATOM 0 HD1 TYR A 59 9.547 -6.278 12.735 1.00 0.00 H new ATOM 0 HD2 TYR A 59 8.573 -3.207 9.946 1.00 0.00 H new ATOM 0 HE1 TYR A 59 11.555 -5.035 13.404 1.00 0.00 H new ATOM 0 HE2 TYR A 59 10.582 -1.963 10.613 1.00 0.00 H new ATOM 0 HH TYR A 59 12.371 -1.897 11.907 1.00 0.00 H new ATOM 872 N GLY A 60 7.872 -5.658 7.595 1.00 0.00 N ATOM 873 CA GLY A 60 8.442 -5.043 6.411 1.00 0.00 C ATOM 874 C GLY A 60 7.668 -3.818 5.965 1.00 0.00 C ATOM 875 O GLY A 60 6.854 -3.281 6.716 1.00 0.00 O ATOM 0 H GLY A 60 6.860 -5.781 7.569 1.00 0.00 H new ATOM 0 HA2 GLY A 60 9.476 -4.762 6.613 1.00 0.00 H new ATOM 0 HA3 GLY A 60 8.462 -5.772 5.601 1.00 0.00 H new ATOM 879 N PHE A 61 7.923 -3.373 4.739 1.00 0.00 N ATOM 880 CA PHE A 61 7.246 -2.202 4.194 1.00 0.00 C ATOM 881 C PHE A 61 7.231 -2.242 2.669 1.00 0.00 C ATOM 882 O PHE A 61 8.160 -2.751 2.041 1.00 0.00 O ATOM 883 CB PHE A 61 7.931 -0.921 4.675 1.00 0.00 C ATOM 884 CG PHE A 61 8.142 -0.876 6.162 1.00 0.00 C ATOM 885 CD1 PHE A 61 9.278 -1.430 6.730 1.00 0.00 C ATOM 886 CD2 PHE A 61 7.205 -0.282 6.991 1.00 0.00 C ATOM 887 CE1 PHE A 61 9.476 -1.390 8.097 1.00 0.00 C ATOM 888 CE2 PHE A 61 7.398 -0.238 8.359 1.00 0.00 C ATOM 889 CZ PHE A 61 8.534 -0.794 8.913 1.00 0.00 C ATOM 0 H PHE A 61 8.594 -3.806 4.104 1.00 0.00 H new ATOM 0 HA PHE A 61 6.216 -2.211 4.550 1.00 0.00 H new ATOM 0 HB2 PHE A 61 8.895 -0.825 4.176 1.00 0.00 H new ATOM 0 HB3 PHE A 61 7.330 -0.062 4.375 1.00 0.00 H new ATOM 0 HD1 PHE A 61 10.017 -1.898 6.097 1.00 0.00 H new ATOM 0 HD2 PHE A 61 6.313 0.152 6.564 1.00 0.00 H new ATOM 0 HE1 PHE A 61 10.366 -1.824 8.527 1.00 0.00 H new ATOM 0 HE2 PHE A 61 6.661 0.231 8.994 1.00 0.00 H new ATOM 0 HZ PHE A 61 8.686 -0.763 9.982 1.00 0.00 H new ATOM 899 N VAL A 62 6.170 -1.702 2.079 1.00 0.00 N ATOM 900 CA VAL A 62 6.033 -1.675 0.627 1.00 0.00 C ATOM 901 C VAL A 62 5.674 -0.278 0.135 1.00 0.00 C ATOM 902 O VAL A 62 4.545 0.181 0.308 1.00 0.00 O ATOM 903 CB VAL A 62 4.959 -2.669 0.146 1.00 0.00 C ATOM 904 CG1 VAL A 62 4.811 -2.605 -1.366 1.00 0.00 C ATOM 905 CG2 VAL A 62 5.300 -4.081 0.597 1.00 0.00 C ATOM 0 H VAL A 62 5.392 -1.277 2.584 1.00 0.00 H new ATOM 0 HA VAL A 62 6.998 -1.966 0.212 1.00 0.00 H new ATOM 0 HB VAL A 62 4.005 -2.390 0.593 1.00 0.00 H new ATOM 0 HG11 VAL A 62 4.048 -3.314 -1.687 1.00 0.00 H new ATOM 0 HG12 VAL A 62 4.517 -1.598 -1.660 1.00 0.00 H new ATOM 0 HG13 VAL A 62 5.762 -2.858 -1.836 1.00 0.00 H new ATOM 0 HG21 VAL A 62 4.531 -4.770 0.249 1.00 0.00 H new ATOM 0 HG22 VAL A 62 6.264 -4.373 0.181 1.00 0.00 H new ATOM 0 HG23 VAL A 62 5.350 -4.113 1.685 1.00 0.00 H new ATOM 915 N GLU A 63 6.642 0.394 -0.480 1.00 0.00 N ATOM 916 CA GLU A 63 6.427 1.740 -0.997 1.00 0.00 C ATOM 917 C GLU A 63 5.747 1.696 -2.363 1.00 0.00 C ATOM 918 O GLU A 63 6.297 1.162 -3.326 1.00 0.00 O ATOM 919 CB GLU A 63 7.758 2.489 -1.102 1.00 0.00 C ATOM 920 CG GLU A 63 7.647 3.832 -1.804 1.00 0.00 C ATOM 921 CD GLU A 63 6.825 4.835 -1.018 1.00 0.00 C ATOM 922 OE1 GLU A 63 5.704 4.481 -0.596 1.00 0.00 O ATOM 923 OE2 GLU A 63 7.302 5.973 -0.826 1.00 0.00 O ATOM 0 H GLU A 63 7.582 0.028 -0.632 1.00 0.00 H new ATOM 0 HA GLU A 63 5.775 2.268 -0.302 1.00 0.00 H new ATOM 0 HB2 GLU A 63 8.158 2.644 -0.100 1.00 0.00 H new ATOM 0 HB3 GLU A 63 8.474 1.866 -1.638 1.00 0.00 H new ATOM 0 HG2 GLU A 63 8.646 4.236 -1.968 1.00 0.00 H new ATOM 0 HG3 GLU A 63 7.196 3.688 -2.786 1.00 0.00 H new ATOM 930 N PHE A 64 4.546 2.261 -2.437 1.00 0.00 N ATOM 931 CA PHE A 64 3.789 2.285 -3.683 1.00 0.00 C ATOM 932 C PHE A 64 4.063 3.568 -4.462 1.00 0.00 C ATOM 933 O PHE A 64 4.523 4.563 -3.899 1.00 0.00 O ATOM 934 CB PHE A 64 2.291 2.160 -3.397 1.00 0.00 C ATOM 935 CG PHE A 64 1.827 0.739 -3.245 1.00 0.00 C ATOM 936 CD1 PHE A 64 1.583 -0.047 -4.359 1.00 0.00 C ATOM 937 CD2 PHE A 64 1.634 0.191 -1.987 1.00 0.00 C ATOM 938 CE1 PHE A 64 1.156 -1.354 -4.223 1.00 0.00 C ATOM 939 CE2 PHE A 64 1.207 -1.116 -1.845 1.00 0.00 C ATOM 940 CZ PHE A 64 0.967 -1.889 -2.964 1.00 0.00 C ATOM 0 H PHE A 64 4.077 2.708 -1.649 1.00 0.00 H new ATOM 0 HA PHE A 64 4.109 1.437 -4.289 1.00 0.00 H new ATOM 0 HB2 PHE A 64 2.056 2.710 -2.486 1.00 0.00 H new ATOM 0 HB3 PHE A 64 1.734 2.631 -4.207 1.00 0.00 H new ATOM 0 HD1 PHE A 64 1.728 0.367 -5.346 1.00 0.00 H new ATOM 0 HD2 PHE A 64 1.819 0.791 -1.108 1.00 0.00 H new ATOM 0 HE1 PHE A 64 0.970 -1.956 -5.100 1.00 0.00 H new ATOM 0 HE2 PHE A 64 1.061 -1.533 -0.859 1.00 0.00 H new ATOM 0 HZ PHE A 64 0.632 -2.910 -2.855 1.00 0.00 H new ATOM 950 N LEU A 65 3.779 3.539 -5.759 1.00 0.00 N ATOM 951 CA LEU A 65 3.996 4.699 -6.617 1.00 0.00 C ATOM 952 C LEU A 65 3.074 5.848 -6.220 1.00 0.00 C ATOM 953 O LEU A 65 3.512 6.991 -6.093 1.00 0.00 O ATOM 954 CB LEU A 65 3.763 4.325 -8.081 1.00 0.00 C ATOM 955 CG LEU A 65 4.145 5.386 -9.114 1.00 0.00 C ATOM 956 CD1 LEU A 65 5.650 5.398 -9.334 1.00 0.00 C ATOM 957 CD2 LEU A 65 3.414 5.142 -10.426 1.00 0.00 C ATOM 0 H LEU A 65 3.398 2.725 -6.240 1.00 0.00 H new ATOM 0 HA LEU A 65 5.028 5.026 -6.492 1.00 0.00 H new ATOM 0 HB2 LEU A 65 4.326 3.417 -8.297 1.00 0.00 H new ATOM 0 HB3 LEU A 65 2.708 4.084 -8.210 1.00 0.00 H new ATOM 0 HG LEU A 65 3.846 6.362 -8.732 1.00 0.00 H new ATOM 0 HD11 LEU A 65 5.904 6.159 -10.072 1.00 0.00 H new ATOM 0 HD12 LEU A 65 6.153 5.622 -8.394 1.00 0.00 H new ATOM 0 HD13 LEU A 65 5.973 4.421 -9.694 1.00 0.00 H new ATOM 0 HD21 LEU A 65 3.698 5.907 -11.149 1.00 0.00 H new ATOM 0 HD22 LEU A 65 3.681 4.159 -10.814 1.00 0.00 H new ATOM 0 HD23 LEU A 65 2.338 5.185 -10.257 1.00 0.00 H new ATOM 969 N SER A 66 1.797 5.536 -6.026 1.00 0.00 N ATOM 970 CA SER A 66 0.813 6.543 -5.645 1.00 0.00 C ATOM 971 C SER A 66 0.177 6.200 -4.302 1.00 0.00 C ATOM 972 O SER A 66 -0.023 5.030 -3.979 1.00 0.00 O ATOM 973 CB SER A 66 -0.269 6.660 -6.720 1.00 0.00 C ATOM 974 OG SER A 66 0.304 6.864 -8.000 1.00 0.00 O ATOM 0 H SER A 66 1.419 4.594 -6.126 1.00 0.00 H new ATOM 0 HA SER A 66 1.326 7.500 -5.550 1.00 0.00 H new ATOM 0 HB2 SER A 66 -0.876 5.755 -6.730 1.00 0.00 H new ATOM 0 HB3 SER A 66 -0.936 7.488 -6.480 1.00 0.00 H new ATOM 0 HG SER A 66 -0.408 6.934 -8.670 1.00 0.00 H new ATOM 980 N GLU A 67 -0.139 7.231 -3.524 1.00 0.00 N ATOM 981 CA GLU A 67 -0.752 7.039 -2.215 1.00 0.00 C ATOM 982 C GLU A 67 -1.969 6.123 -2.313 1.00 0.00 C ATOM 983 O GLU A 67 -2.107 5.173 -1.542 1.00 0.00 O ATOM 984 CB GLU A 67 -1.162 8.386 -1.616 1.00 0.00 C ATOM 985 CG GLU A 67 -1.655 8.290 -0.182 1.00 0.00 C ATOM 986 CD GLU A 67 -2.625 9.400 0.177 1.00 0.00 C ATOM 987 OE1 GLU A 67 -2.549 10.479 -0.446 1.00 0.00 O ATOM 988 OE2 GLU A 67 -3.460 9.188 1.081 1.00 0.00 O ATOM 0 H GLU A 67 0.019 8.206 -3.777 1.00 0.00 H new ATOM 0 HA GLU A 67 -0.016 6.569 -1.563 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -0.310 9.065 -1.654 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -1.947 8.824 -2.232 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -2.141 7.326 -0.032 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -0.801 8.325 0.495 1.00 0.00 H new ATOM 995 N GLU A 68 -2.848 6.416 -3.266 1.00 0.00 N ATOM 996 CA GLU A 68 -4.054 5.620 -3.463 1.00 0.00 C ATOM 997 C GLU A 68 -3.719 4.132 -3.526 1.00 0.00 C ATOM 998 O GLU A 68 -4.411 3.304 -2.934 1.00 0.00 O ATOM 999 CB GLU A 68 -4.769 6.047 -4.747 1.00 0.00 C ATOM 1000 CG GLU A 68 -3.958 5.799 -6.007 1.00 0.00 C ATOM 1001 CD GLU A 68 -4.668 6.271 -7.261 1.00 0.00 C ATOM 1002 OE1 GLU A 68 -4.776 7.499 -7.456 1.00 0.00 O ATOM 1003 OE2 GLU A 68 -5.117 5.410 -8.047 1.00 0.00 O ATOM 0 H GLU A 68 -2.748 7.198 -3.913 1.00 0.00 H new ATOM 0 HA GLU A 68 -4.715 5.791 -2.613 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -5.714 5.510 -4.822 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -5.010 7.108 -4.683 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -2.999 6.310 -5.923 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -3.745 4.733 -6.094 1.00 0.00 H new ATOM 1010 N ASP A 69 -2.653 3.801 -4.247 1.00 0.00 N ATOM 1011 CA ASP A 69 -2.226 2.414 -4.387 1.00 0.00 C ATOM 1012 C ASP A 69 -2.029 1.766 -3.020 1.00 0.00 C ATOM 1013 O ASP A 69 -2.332 0.588 -2.831 1.00 0.00 O ATOM 1014 CB ASP A 69 -0.928 2.337 -5.193 1.00 0.00 C ATOM 1015 CG ASP A 69 -1.103 2.824 -6.618 1.00 0.00 C ATOM 1016 OD1 ASP A 69 -2.228 2.716 -7.148 1.00 0.00 O ATOM 1017 OD2 ASP A 69 -0.114 3.313 -7.203 1.00 0.00 O ATOM 0 H ASP A 69 -2.069 4.474 -4.743 1.00 0.00 H new ATOM 0 HA ASP A 69 -3.007 1.870 -4.918 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -0.161 2.934 -4.699 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -0.572 1.307 -5.205 1.00 0.00 H new ATOM 1022 N ALA A 70 -1.519 2.543 -2.070 1.00 0.00 N ATOM 1023 CA ALA A 70 -1.282 2.044 -0.721 1.00 0.00 C ATOM 1024 C ALA A 70 -2.588 1.625 -0.054 1.00 0.00 C ATOM 1025 O ALA A 70 -2.780 0.455 0.277 1.00 0.00 O ATOM 1026 CB ALA A 70 -0.575 3.100 0.116 1.00 0.00 C ATOM 0 H ALA A 70 -1.262 3.520 -2.210 1.00 0.00 H new ATOM 0 HA ALA A 70 -0.642 1.165 -0.793 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -0.404 2.714 1.121 1.00 0.00 H new ATOM 0 HB2 ALA A 70 0.381 3.349 -0.344 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -1.195 3.995 0.172 1.00 0.00 H new ATOM 1032 N ASP A 71 -3.482 2.588 0.142 1.00 0.00 N ATOM 1033 CA ASP A 71 -4.770 2.319 0.770 1.00 0.00 C ATOM 1034 C ASP A 71 -5.388 1.039 0.216 1.00 0.00 C ATOM 1035 O ASP A 71 -5.945 0.233 0.962 1.00 0.00 O ATOM 1036 CB ASP A 71 -5.724 3.495 0.553 1.00 0.00 C ATOM 1037 CG ASP A 71 -7.108 3.229 1.109 1.00 0.00 C ATOM 1038 OD1 ASP A 71 -7.216 2.464 2.090 1.00 0.00 O ATOM 1039 OD2 ASP A 71 -8.085 3.784 0.563 1.00 0.00 O ATOM 0 H ASP A 71 -3.338 3.562 -0.125 1.00 0.00 H new ATOM 0 HA ASP A 71 -4.604 2.189 1.839 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -5.311 4.386 1.026 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -5.799 3.706 -0.514 1.00 0.00 H new ATOM 1044 N TYR A 72 -5.286 0.859 -1.096 1.00 0.00 N ATOM 1045 CA TYR A 72 -5.838 -0.322 -1.750 1.00 0.00 C ATOM 1046 C TYR A 72 -5.198 -1.595 -1.206 1.00 0.00 C ATOM 1047 O TYR A 72 -5.865 -2.616 -1.040 1.00 0.00 O ATOM 1048 CB TYR A 72 -5.625 -0.238 -3.263 1.00 0.00 C ATOM 1049 CG TYR A 72 -6.439 -1.244 -4.045 1.00 0.00 C ATOM 1050 CD1 TYR A 72 -5.983 -2.544 -4.228 1.00 0.00 C ATOM 1051 CD2 TYR A 72 -7.663 -0.896 -4.602 1.00 0.00 C ATOM 1052 CE1 TYR A 72 -6.722 -3.467 -4.943 1.00 0.00 C ATOM 1053 CE2 TYR A 72 -8.410 -1.812 -5.317 1.00 0.00 C ATOM 1054 CZ TYR A 72 -7.935 -3.096 -5.484 1.00 0.00 C ATOM 1055 OH TYR A 72 -8.675 -4.012 -6.197 1.00 0.00 O ATOM 0 H TYR A 72 -4.827 1.515 -1.727 1.00 0.00 H new ATOM 0 HA TYR A 72 -6.907 -0.356 -1.541 1.00 0.00 H new ATOM 0 HB2 TYR A 72 -5.880 0.766 -3.602 1.00 0.00 H new ATOM 0 HB3 TYR A 72 -4.568 -0.389 -3.482 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -5.034 -2.838 -3.804 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -8.037 0.109 -4.474 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -6.352 -4.473 -5.077 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -9.360 -1.524 -5.743 1.00 0.00 H new ATOM 0 HH TYR A 72 -9.503 -3.591 -6.509 1.00 0.00 H new ATOM 1065 N ALA A 73 -3.901 -1.526 -0.928 1.00 0.00 N ATOM 1066 CA ALA A 73 -3.170 -2.672 -0.399 1.00 0.00 C ATOM 1067 C ALA A 73 -3.458 -2.868 1.085 1.00 0.00 C ATOM 1068 O ALA A 73 -3.412 -3.989 1.593 1.00 0.00 O ATOM 1069 CB ALA A 73 -1.677 -2.498 -0.631 1.00 0.00 C ATOM 0 H ALA A 73 -3.334 -0.689 -1.060 1.00 0.00 H new ATOM 0 HA ALA A 73 -3.507 -3.563 -0.928 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -1.144 -3.360 -0.231 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -1.482 -2.415 -1.700 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -1.334 -1.594 -0.128 1.00 0.00 H new ATOM 1075 N ILE A 74 -3.753 -1.772 1.776 1.00 0.00 N ATOM 1076 CA ILE A 74 -4.048 -1.825 3.202 1.00 0.00 C ATOM 1077 C ILE A 74 -5.433 -2.412 3.456 1.00 0.00 C ATOM 1078 O ILE A 74 -5.774 -2.762 4.586 1.00 0.00 O ATOM 1079 CB ILE A 74 -3.969 -0.429 3.846 1.00 0.00 C ATOM 1080 CG1 ILE A 74 -2.603 0.206 3.574 1.00 0.00 C ATOM 1081 CG2 ILE A 74 -4.227 -0.520 5.343 1.00 0.00 C ATOM 1082 CD1 ILE A 74 -2.594 1.710 3.733 1.00 0.00 C ATOM 0 H ILE A 74 -3.794 -0.837 1.371 1.00 0.00 H new ATOM 0 HA ILE A 74 -3.294 -2.468 3.656 1.00 0.00 H new ATOM 0 HB ILE A 74 -4.738 0.203 3.402 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -1.868 -0.227 4.252 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -2.289 -0.046 2.561 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -4.168 0.475 5.784 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -5.220 -0.935 5.517 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -3.479 -1.165 5.803 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -1.594 2.092 3.525 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -3.304 2.154 3.036 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -2.877 1.970 4.753 1.00 0.00 H new ATOM 1094 N LYS A 75 -6.227 -2.519 2.396 1.00 0.00 N ATOM 1095 CA LYS A 75 -7.574 -3.066 2.501 1.00 0.00 C ATOM 1096 C LYS A 75 -7.575 -4.566 2.227 1.00 0.00 C ATOM 1097 O LYS A 75 -8.343 -5.317 2.830 1.00 0.00 O ATOM 1098 CB LYS A 75 -8.513 -2.357 1.522 1.00 0.00 C ATOM 1099 CG LYS A 75 -8.627 -3.053 0.177 1.00 0.00 C ATOM 1100 CD LYS A 75 -9.096 -2.098 -0.907 1.00 0.00 C ATOM 1101 CE LYS A 75 -10.613 -2.077 -1.014 1.00 0.00 C ATOM 1102 NZ LYS A 75 -11.136 -3.283 -1.714 1.00 0.00 N ATOM 0 H LYS A 75 -5.960 -2.234 1.454 1.00 0.00 H new ATOM 0 HA LYS A 75 -7.928 -2.900 3.519 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -9.504 -2.285 1.970 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -8.159 -1.338 1.366 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -7.660 -3.472 -0.100 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -9.325 -3.887 0.256 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -8.732 -1.094 -0.691 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -8.667 -2.394 -1.864 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -11.047 -2.020 -0.016 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -10.927 -1.181 -1.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -12.161 -3.184 -1.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -10.665 -3.380 -2.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -10.947 -4.128 -1.138 1.00 0.00 H new ATOM 1116 N ILE A 76 -6.710 -4.997 1.315 1.00 0.00 N ATOM 1117 CA ILE A 76 -6.609 -6.408 0.963 1.00 0.00 C ATOM 1118 C ILE A 76 -5.458 -7.079 1.705 1.00 0.00 C ATOM 1119 O ILE A 76 -5.599 -8.189 2.217 1.00 0.00 O ATOM 1120 CB ILE A 76 -6.410 -6.598 -0.552 1.00 0.00 C ATOM 1121 CG1 ILE A 76 -5.186 -5.813 -1.029 1.00 0.00 C ATOM 1122 CG2 ILE A 76 -7.655 -6.161 -1.309 1.00 0.00 C ATOM 1123 CD1 ILE A 76 -4.914 -5.960 -2.510 1.00 0.00 C ATOM 0 H ILE A 76 -6.069 -4.389 0.806 1.00 0.00 H new ATOM 0 HA ILE A 76 -7.549 -6.875 1.258 1.00 0.00 H new ATOM 0 HB ILE A 76 -6.241 -7.656 -0.752 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -5.328 -4.758 -0.797 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -4.311 -6.147 -0.472 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -7.499 -6.301 -2.379 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -8.507 -6.759 -0.985 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -7.853 -5.108 -1.106 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -4.033 -5.377 -2.778 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -4.740 -7.010 -2.745 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -5.773 -5.599 -3.075 1.00 0.00 H new ATOM 1135 N MET A 77 -4.319 -6.396 1.760 1.00 0.00 N ATOM 1136 CA MET A 77 -3.144 -6.925 2.442 1.00 0.00 C ATOM 1137 C MET A 77 -3.246 -6.710 3.948 1.00 0.00 C ATOM 1138 O MET A 77 -2.243 -6.754 4.661 1.00 0.00 O ATOM 1139 CB MET A 77 -1.874 -6.261 1.905 1.00 0.00 C ATOM 1140 CG MET A 77 -1.856 -6.119 0.391 1.00 0.00 C ATOM 1141 SD MET A 77 -2.213 -7.670 -0.456 1.00 0.00 S ATOM 1142 CE MET A 77 -0.740 -7.854 -1.459 1.00 0.00 C ATOM 0 H MET A 77 -4.185 -5.476 1.341 1.00 0.00 H new ATOM 0 HA MET A 77 -3.095 -7.997 2.249 1.00 0.00 H new ATOM 0 HB2 MET A 77 -1.772 -5.274 2.356 1.00 0.00 H new ATOM 0 HB3 MET A 77 -1.008 -6.845 2.217 1.00 0.00 H new ATOM 0 HG2 MET A 77 -2.588 -5.369 0.092 1.00 0.00 H new ATOM 0 HG3 MET A 77 -0.879 -5.754 0.076 1.00 0.00 H new ATOM 0 HE1 MET A 77 -0.574 -8.910 -1.671 1.00 0.00 H new ATOM 0 HE2 MET A 77 -0.867 -7.311 -2.396 1.00 0.00 H new ATOM 0 HE3 MET A 77 0.119 -7.453 -0.921 1.00 0.00 H new ATOM 1152 N ASP A 78 -4.463 -6.476 4.426 1.00 0.00 N ATOM 1153 CA ASP A 78 -4.697 -6.254 5.849 1.00 0.00 C ATOM 1154 C ASP A 78 -5.211 -7.524 6.519 1.00 0.00 C ATOM 1155 O ASP A 78 -6.145 -8.161 6.031 1.00 0.00 O ATOM 1156 CB ASP A 78 -5.696 -5.115 6.052 1.00 0.00 C ATOM 1157 CG ASP A 78 -6.539 -5.299 7.298 1.00 0.00 C ATOM 1158 OD1 ASP A 78 -7.511 -6.080 7.248 1.00 0.00 O ATOM 1159 OD2 ASP A 78 -6.225 -4.662 8.325 1.00 0.00 O ATOM 0 H ASP A 78 -5.303 -6.435 3.849 1.00 0.00 H new ATOM 0 HA ASP A 78 -3.748 -5.980 6.310 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -5.157 -4.170 6.118 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -6.349 -5.049 5.182 1.00 0.00 H new ATOM 1164 N MET A 79 -4.595 -7.887 7.639 1.00 0.00 N ATOM 1165 CA MET A 79 -4.991 -9.081 8.377 1.00 0.00 C ATOM 1166 C MET A 79 -5.004 -10.304 7.465 1.00 0.00 C ATOM 1167 O MET A 79 -5.875 -11.167 7.581 1.00 0.00 O ATOM 1168 CB MET A 79 -6.372 -8.884 9.005 1.00 0.00 C ATOM 1169 CG MET A 79 -6.333 -8.177 10.350 1.00 0.00 C ATOM 1170 SD MET A 79 -7.864 -8.372 11.282 1.00 0.00 S ATOM 1171 CE MET A 79 -7.288 -9.330 12.682 1.00 0.00 C ATOM 0 H MET A 79 -3.820 -7.372 8.056 1.00 0.00 H new ATOM 0 HA MET A 79 -4.260 -9.248 9.169 1.00 0.00 H new ATOM 0 HB2 MET A 79 -6.995 -8.309 8.320 1.00 0.00 H new ATOM 0 HB3 MET A 79 -6.848 -9.857 9.129 1.00 0.00 H new ATOM 0 HG2 MET A 79 -5.502 -8.568 10.938 1.00 0.00 H new ATOM 0 HG3 MET A 79 -6.141 -7.116 10.193 1.00 0.00 H new ATOM 0 HE1 MET A 79 -8.123 -9.532 13.353 1.00 0.00 H new ATOM 0 HE2 MET A 79 -6.869 -10.273 12.330 1.00 0.00 H new ATOM 0 HE3 MET A 79 -6.521 -8.769 13.216 1.00 0.00 H new ATOM 1181 N ILE A 80 -4.035 -10.371 6.558 1.00 0.00 N ATOM 1182 CA ILE A 80 -3.936 -11.488 5.628 1.00 0.00 C ATOM 1183 C ILE A 80 -3.257 -12.688 6.280 1.00 0.00 C ATOM 1184 O ILE A 80 -2.481 -12.539 7.224 1.00 0.00 O ATOM 1185 CB ILE A 80 -3.155 -11.097 4.360 1.00 0.00 C ATOM 1186 CG1 ILE A 80 -4.054 -10.312 3.402 1.00 0.00 C ATOM 1187 CG2 ILE A 80 -2.600 -12.338 3.676 1.00 0.00 C ATOM 1188 CD1 ILE A 80 -3.560 -10.310 1.973 1.00 0.00 C ATOM 0 H ILE A 80 -3.308 -9.665 6.448 1.00 0.00 H new ATOM 0 HA ILE A 80 -4.955 -11.757 5.349 1.00 0.00 H new ATOM 0 HB ILE A 80 -2.319 -10.460 4.648 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -5.058 -10.736 3.430 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -4.132 -9.283 3.752 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -2.051 -12.045 2.781 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -1.930 -12.861 4.359 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -3.421 -12.998 3.398 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -4.246 -9.735 1.352 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -2.568 -9.859 1.931 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -3.508 -11.334 1.604 1.00 0.00 H new ATOM 1200 N LYS A 81 -3.553 -13.878 5.769 1.00 0.00 N ATOM 1201 CA LYS A 81 -2.969 -15.105 6.298 1.00 0.00 C ATOM 1202 C LYS A 81 -1.900 -15.649 5.356 1.00 0.00 C ATOM 1203 O LYS A 81 -2.186 -16.473 4.486 1.00 0.00 O ATOM 1204 CB LYS A 81 -4.057 -16.159 6.516 1.00 0.00 C ATOM 1205 CG LYS A 81 -4.687 -16.108 7.897 1.00 0.00 C ATOM 1206 CD LYS A 81 -5.161 -17.480 8.345 1.00 0.00 C ATOM 1207 CE LYS A 81 -5.273 -17.564 9.860 1.00 0.00 C ATOM 1208 NZ LYS A 81 -3.971 -17.908 10.494 1.00 0.00 N ATOM 0 H LYS A 81 -4.194 -14.019 4.989 1.00 0.00 H new ATOM 0 HA LYS A 81 -2.501 -14.872 7.254 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -4.836 -16.025 5.766 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -3.629 -17.149 6.358 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -3.963 -15.720 8.614 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -5.529 -15.416 7.888 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -6.130 -17.696 7.895 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -4.467 -18.241 7.988 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -5.627 -16.610 10.251 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -6.017 -18.314 10.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -4.089 -17.956 11.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -3.645 -18.830 10.140 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -3.267 -17.179 10.260 1.00 0.00 H new ATOM 1222 N LEU A 82 -0.668 -15.185 5.536 1.00 0.00 N ATOM 1223 CA LEU A 82 0.445 -15.627 4.703 1.00 0.00 C ATOM 1224 C LEU A 82 1.284 -16.675 5.427 1.00 0.00 C ATOM 1225 O LEU A 82 1.476 -16.602 6.641 1.00 0.00 O ATOM 1226 CB LEU A 82 1.321 -14.435 4.314 1.00 0.00 C ATOM 1227 CG LEU A 82 2.580 -14.761 3.510 1.00 0.00 C ATOM 1228 CD1 LEU A 82 2.211 -15.348 2.156 1.00 0.00 C ATOM 1229 CD2 LEU A 82 3.440 -13.518 3.338 1.00 0.00 C ATOM 0 H LEU A 82 -0.415 -14.503 6.251 1.00 0.00 H new ATOM 0 HA LEU A 82 0.034 -16.078 3.800 1.00 0.00 H new ATOM 0 HB2 LEU A 82 0.715 -13.738 3.735 1.00 0.00 H new ATOM 0 HB3 LEU A 82 1.620 -13.917 5.225 1.00 0.00 H new ATOM 0 HG LEU A 82 3.157 -15.504 4.060 1.00 0.00 H new ATOM 0 HD11 LEU A 82 3.119 -15.574 1.598 1.00 0.00 H new ATOM 0 HD12 LEU A 82 1.637 -16.263 2.300 1.00 0.00 H new ATOM 0 HD13 LEU A 82 1.612 -14.628 1.598 1.00 0.00 H new ATOM 0 HD21 LEU A 82 4.332 -13.769 2.763 1.00 0.00 H new ATOM 0 HD22 LEU A 82 2.872 -12.753 2.810 1.00 0.00 H new ATOM 0 HD23 LEU A 82 3.734 -13.141 4.317 1.00 0.00 H new ATOM 1241 N TYR A 83 1.783 -17.649 4.673 1.00 0.00 N ATOM 1242 CA TYR A 83 2.602 -18.712 5.242 1.00 0.00 C ATOM 1243 C TYR A 83 2.323 -18.876 6.733 1.00 0.00 C ATOM 1244 O TYR A 83 3.234 -18.819 7.557 1.00 0.00 O ATOM 1245 CB TYR A 83 4.086 -18.417 5.020 1.00 0.00 C ATOM 1246 CG TYR A 83 4.400 -17.900 3.634 1.00 0.00 C ATOM 1247 CD1 TYR A 83 3.991 -18.595 2.503 1.00 0.00 C ATOM 1248 CD2 TYR A 83 5.104 -16.716 3.456 1.00 0.00 C ATOM 1249 CE1 TYR A 83 4.276 -18.127 1.235 1.00 0.00 C ATOM 1250 CE2 TYR A 83 5.392 -16.239 2.191 1.00 0.00 C ATOM 1251 CZ TYR A 83 4.976 -16.949 1.084 1.00 0.00 C ATOM 1252 OH TYR A 83 5.261 -16.478 -0.177 1.00 0.00 O ATOM 0 H TYR A 83 1.634 -17.724 3.667 1.00 0.00 H new ATOM 0 HA TYR A 83 2.344 -19.643 4.737 1.00 0.00 H new ATOM 0 HB2 TYR A 83 4.416 -17.683 5.756 1.00 0.00 H new ATOM 0 HB3 TYR A 83 4.659 -19.327 5.198 1.00 0.00 H new ATOM 0 HD1 TYR A 83 3.441 -19.517 2.617 1.00 0.00 H new ATOM 0 HD2 TYR A 83 5.432 -16.158 4.321 1.00 0.00 H new ATOM 0 HE1 TYR A 83 3.952 -18.681 0.366 1.00 0.00 H new ATOM 0 HE2 TYR A 83 5.939 -15.316 2.070 1.00 0.00 H new ATOM 0 HH TYR A 83 4.559 -16.762 -0.799 1.00 0.00 H new ATOM 1262 N GLY A 84 1.053 -19.082 7.072 1.00 0.00 N ATOM 1263 CA GLY A 84 0.675 -19.252 8.462 1.00 0.00 C ATOM 1264 C GLY A 84 1.133 -18.099 9.333 1.00 0.00 C ATOM 1265 O GLY A 84 1.944 -18.281 10.242 1.00 0.00 O ATOM 0 H GLY A 84 0.280 -19.134 6.408 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -0.409 -19.348 8.531 1.00 0.00 H new ATOM 0 HA3 GLY A 84 1.102 -20.181 8.840 1.00 0.00 H new ATOM 1269 N LYS A 85 0.614 -16.908 9.056 1.00 0.00 N ATOM 1270 CA LYS A 85 0.974 -15.719 9.820 1.00 0.00 C ATOM 1271 C LYS A 85 0.072 -14.544 9.455 1.00 0.00 C ATOM 1272 O LYS A 85 0.115 -14.020 8.342 1.00 0.00 O ATOM 1273 CB LYS A 85 2.438 -15.350 9.567 1.00 0.00 C ATOM 1274 CG LYS A 85 3.412 -16.058 10.492 1.00 0.00 C ATOM 1275 CD LYS A 85 4.649 -15.214 10.751 1.00 0.00 C ATOM 1276 CE LYS A 85 4.358 -14.082 11.724 1.00 0.00 C ATOM 1277 NZ LYS A 85 4.040 -14.590 13.087 1.00 0.00 N ATOM 0 H LYS A 85 -0.058 -16.740 8.307 1.00 0.00 H new ATOM 0 HA LYS A 85 0.839 -15.942 10.878 1.00 0.00 H new ATOM 0 HB2 LYS A 85 2.691 -15.590 8.534 1.00 0.00 H new ATOM 0 HB3 LYS A 85 2.558 -14.273 9.683 1.00 0.00 H new ATOM 0 HG2 LYS A 85 2.919 -16.283 11.438 1.00 0.00 H new ATOM 0 HG3 LYS A 85 3.706 -17.011 10.052 1.00 0.00 H new ATOM 0 HD2 LYS A 85 5.443 -15.844 11.151 1.00 0.00 H new ATOM 0 HD3 LYS A 85 5.013 -14.802 9.810 1.00 0.00 H new ATOM 0 HE2 LYS A 85 5.220 -13.417 11.776 1.00 0.00 H new ATOM 0 HE3 LYS A 85 3.521 -13.490 11.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 4.164 -13.825 13.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 3.055 -14.924 13.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 4.679 -15.377 13.322 1.00 0.00 H new ATOM 1291 N PRO A 86 -0.764 -14.119 10.414 1.00 0.00 N ATOM 1292 CA PRO A 86 -1.690 -13.000 10.218 1.00 0.00 C ATOM 1293 C PRO A 86 -0.969 -11.661 10.117 1.00 0.00 C ATOM 1294 O PRO A 86 -0.825 -10.946 11.110 1.00 0.00 O ATOM 1295 CB PRO A 86 -2.567 -13.042 11.472 1.00 0.00 C ATOM 1296 CG PRO A 86 -1.722 -13.705 12.504 1.00 0.00 C ATOM 1297 CD PRO A 86 -0.868 -14.698 11.764 1.00 0.00 C ATOM 0 HA PRO A 86 -2.249 -13.092 9.287 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -2.859 -12.039 11.784 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -3.486 -13.601 11.294 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -1.106 -12.976 13.031 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -2.339 -14.202 13.253 1.00 0.00 H new ATOM 0 HD2 PRO A 86 0.111 -14.811 12.229 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -1.327 -15.686 11.743 1.00 0.00 H new ATOM 1305 N ILE A 87 -0.517 -11.327 8.913 1.00 0.00 N ATOM 1306 CA ILE A 87 0.189 -10.072 8.684 1.00 0.00 C ATOM 1307 C ILE A 87 -0.719 -8.875 8.945 1.00 0.00 C ATOM 1308 O ILE A 87 -1.935 -8.955 8.768 1.00 0.00 O ATOM 1309 CB ILE A 87 0.731 -9.987 7.245 1.00 0.00 C ATOM 1310 CG1 ILE A 87 -0.424 -9.935 6.243 1.00 0.00 C ATOM 1311 CG2 ILE A 87 1.642 -11.169 6.951 1.00 0.00 C ATOM 1312 CD1 ILE A 87 0.005 -9.549 4.845 1.00 0.00 C ATOM 0 H ILE A 87 -0.627 -11.907 8.081 1.00 0.00 H new ATOM 0 HA ILE A 87 1.026 -10.048 9.381 1.00 0.00 H new ATOM 0 HB ILE A 87 1.314 -9.071 7.146 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -0.909 -10.911 6.209 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -1.168 -9.221 6.596 1.00 0.00 H new ATOM 0 HG21 ILE A 87 2.017 -11.094 5.930 1.00 0.00 H new ATOM 0 HG22 ILE A 87 2.481 -11.164 7.647 1.00 0.00 H new ATOM 0 HG23 ILE A 87 1.082 -12.097 7.065 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -0.865 -9.532 4.189 1.00 0.00 H new ATOM 0 HD12 ILE A 87 0.463 -8.560 4.865 1.00 0.00 H new ATOM 0 HD13 ILE A 87 0.727 -10.276 4.472 1.00 0.00 H new ATOM 1324 N ARG A 88 -0.120 -7.766 9.365 1.00 0.00 N ATOM 1325 CA ARG A 88 -0.875 -6.551 9.650 1.00 0.00 C ATOM 1326 C ARG A 88 -0.382 -5.391 8.790 1.00 0.00 C ATOM 1327 O ARG A 88 0.806 -5.067 8.788 1.00 0.00 O ATOM 1328 CB ARG A 88 -0.758 -6.189 11.131 1.00 0.00 C ATOM 1329 CG ARG A 88 -1.878 -6.756 11.988 1.00 0.00 C ATOM 1330 CD ARG A 88 -1.770 -8.267 12.116 1.00 0.00 C ATOM 1331 NE ARG A 88 -0.956 -8.662 13.263 1.00 0.00 N ATOM 1332 CZ ARG A 88 -1.349 -8.525 14.525 1.00 0.00 C ATOM 1333 NH1 ARG A 88 -2.537 -8.006 14.800 1.00 0.00 N ATOM 1334 NH2 ARG A 88 -0.551 -8.908 15.514 1.00 0.00 N ATOM 0 H ARG A 88 0.885 -7.683 9.516 1.00 0.00 H new ATOM 0 HA ARG A 88 -1.922 -6.738 9.411 1.00 0.00 H new ATOM 0 HB2 ARG A 88 0.197 -6.552 11.510 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -0.749 -5.104 11.231 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -1.845 -6.302 12.979 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -2.841 -6.495 11.550 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -2.768 -8.695 12.215 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -1.336 -8.678 11.205 1.00 0.00 H new ATOM 0 HE ARG A 88 -0.036 -9.065 13.085 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -3.152 -7.711 14.042 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -2.836 -7.902 15.770 1.00 0.00 H new ATOM 0 HH21 ARG A 88 0.364 -9.308 15.305 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -0.853 -8.803 16.483 1.00 0.00 H new ATOM 1348 N VAL A 89 -1.303 -4.769 8.061 1.00 0.00 N ATOM 1349 CA VAL A 89 -0.963 -3.644 7.198 1.00 0.00 C ATOM 1350 C VAL A 89 -1.779 -2.408 7.558 1.00 0.00 C ATOM 1351 O VAL A 89 -2.981 -2.495 7.803 1.00 0.00 O ATOM 1352 CB VAL A 89 -1.196 -3.985 5.714 1.00 0.00 C ATOM 1353 CG1 VAL A 89 -0.937 -2.767 4.839 1.00 0.00 C ATOM 1354 CG2 VAL A 89 -0.316 -5.152 5.291 1.00 0.00 C ATOM 0 H VAL A 89 -2.290 -5.025 8.051 1.00 0.00 H new ATOM 0 HA VAL A 89 0.095 -3.435 7.354 1.00 0.00 H new ATOM 0 HB VAL A 89 -2.238 -4.280 5.586 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -1.107 -3.027 3.794 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -1.613 -1.962 5.127 1.00 0.00 H new ATOM 0 HG13 VAL A 89 0.094 -2.439 4.968 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -0.494 -5.379 4.240 1.00 0.00 H new ATOM 0 HG22 VAL A 89 0.732 -4.888 5.433 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -0.555 -6.026 5.897 1.00 0.00 H new ATOM 1364 N ASN A 90 -1.116 -1.256 7.588 1.00 0.00 N ATOM 1365 CA ASN A 90 -1.781 -0.001 7.919 1.00 0.00 C ATOM 1366 C ASN A 90 -0.946 1.193 7.464 1.00 0.00 C ATOM 1367 O ASN A 90 0.283 1.129 7.430 1.00 0.00 O ATOM 1368 CB ASN A 90 -2.034 0.085 9.425 1.00 0.00 C ATOM 1369 CG ASN A 90 -2.417 -1.255 10.024 1.00 0.00 C ATOM 1370 OD1 ASN A 90 -3.590 -1.517 10.289 1.00 0.00 O ATOM 1371 ND2 ASN A 90 -1.424 -2.111 10.241 1.00 0.00 N ATOM 0 H ASN A 90 -0.120 -1.166 7.387 1.00 0.00 H new ATOM 0 HA ASN A 90 -2.736 0.024 7.395 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -1.138 0.459 9.921 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -2.829 0.806 9.617 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -1.620 -3.028 10.643 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -0.466 -1.851 10.006 1.00 0.00 H new ATOM 1378 N LYS A 91 -1.623 2.282 7.115 1.00 0.00 N ATOM 1379 CA LYS A 91 -0.946 3.492 6.664 1.00 0.00 C ATOM 1380 C LYS A 91 0.230 3.830 7.575 1.00 0.00 C ATOM 1381 O LYS A 91 0.046 4.134 8.754 1.00 0.00 O ATOM 1382 CB LYS A 91 -1.927 4.665 6.623 1.00 0.00 C ATOM 1383 CG LYS A 91 -2.867 4.631 5.431 1.00 0.00 C ATOM 1384 CD LYS A 91 -2.200 5.175 4.179 1.00 0.00 C ATOM 1385 CE LYS A 91 -3.160 5.194 2.999 1.00 0.00 C ATOM 1386 NZ LYS A 91 -3.978 6.437 2.970 1.00 0.00 N ATOM 0 H LYS A 91 -2.640 2.351 7.136 1.00 0.00 H new ATOM 0 HA LYS A 91 -0.564 3.311 5.659 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -2.517 4.667 7.540 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -1.364 5.598 6.604 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -3.195 3.607 5.254 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -3.759 5.217 5.653 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -1.836 6.185 4.369 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -1.332 4.564 3.933 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -2.596 5.109 2.070 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -3.818 4.327 3.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -4.619 6.412 2.152 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -4.536 6.506 3.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -3.351 7.263 2.893 1.00 0.00 H new ATOM 1400 N ALA A 92 1.437 3.776 7.021 1.00 0.00 N ATOM 1401 CA ALA A 92 2.641 4.080 7.784 1.00 0.00 C ATOM 1402 C ALA A 92 2.568 5.476 8.393 1.00 0.00 C ATOM 1403 O ALA A 92 3.012 5.696 9.520 1.00 0.00 O ATOM 1404 CB ALA A 92 3.872 3.953 6.899 1.00 0.00 C ATOM 0 H ALA A 92 1.607 3.525 6.047 1.00 0.00 H new ATOM 0 HA ALA A 92 2.716 3.360 8.599 1.00 0.00 H new ATOM 0 HB1 ALA A 92 4.764 4.183 7.482 1.00 0.00 H new ATOM 0 HB2 ALA A 92 3.941 2.935 6.516 1.00 0.00 H new ATOM 0 HB3 ALA A 92 3.794 4.650 6.065 1.00 0.00 H new ATOM 1410 N SER A 93 2.005 6.416 7.641 1.00 0.00 N ATOM 1411 CA SER A 93 1.878 7.793 8.105 1.00 0.00 C ATOM 1412 C SER A 93 1.022 7.863 9.367 1.00 0.00 C ATOM 1413 O SER A 93 1.302 8.642 10.277 1.00 0.00 O ATOM 1414 CB SER A 93 1.265 8.668 7.011 1.00 0.00 C ATOM 1415 OG SER A 93 -0.094 8.334 6.791 1.00 0.00 O ATOM 0 H SER A 93 1.629 6.249 6.707 1.00 0.00 H new ATOM 0 HA SER A 93 2.875 8.165 8.341 1.00 0.00 H new ATOM 0 HB2 SER A 93 1.343 9.718 7.294 1.00 0.00 H new ATOM 0 HB3 SER A 93 1.827 8.545 6.085 1.00 0.00 H new ATOM 0 HG SER A 93 -0.421 8.802 5.994 1.00 0.00 H new ATOM 1421 N ALA A 94 -0.023 7.043 9.412 1.00 0.00 N ATOM 1422 CA ALA A 94 -0.919 7.010 10.561 1.00 0.00 C ATOM 1423 C ALA A 94 -0.234 6.386 11.773 1.00 0.00 C ATOM 1424 O ALA A 94 -0.567 5.273 12.182 1.00 0.00 O ATOM 1425 CB ALA A 94 -2.189 6.246 10.219 1.00 0.00 C ATOM 0 H ALA A 94 -0.270 6.393 8.666 1.00 0.00 H new ATOM 0 HA ALA A 94 -1.183 8.037 10.814 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -2.849 6.230 11.087 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -2.695 6.736 9.387 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -1.934 5.224 9.938 1.00 0.00 H new ATOM 1431 N HIS A 95 0.724 7.109 12.343 1.00 0.00 N ATOM 1432 CA HIS A 95 1.456 6.625 13.509 1.00 0.00 C ATOM 1433 C HIS A 95 1.352 7.615 14.665 1.00 0.00 C ATOM 1434 O HIS A 95 1.097 8.801 14.458 1.00 0.00 O ATOM 1435 CB HIS A 95 2.924 6.389 13.154 1.00 0.00 C ATOM 1436 CG HIS A 95 3.207 5.003 12.664 1.00 0.00 C ATOM 1437 ND1 HIS A 95 4.476 4.465 12.616 1.00 0.00 N ATOM 1438 CD2 HIS A 95 2.375 4.041 12.200 1.00 0.00 C ATOM 1439 CE1 HIS A 95 4.413 3.234 12.143 1.00 0.00 C ATOM 1440 NE2 HIS A 95 3.149 2.952 11.883 1.00 0.00 N ATOM 0 H HIS A 95 1.012 8.032 12.017 1.00 0.00 H new ATOM 0 HA HIS A 95 1.010 5.681 13.821 1.00 0.00 H new ATOM 0 HB2 HIS A 95 3.223 7.104 12.388 1.00 0.00 H new ATOM 0 HB3 HIS A 95 3.538 6.587 14.033 1.00 0.00 H new ATOM 0 HD2 HIS A 95 1.302 4.116 12.098 1.00 0.00 H new ATOM 0 HE1 HIS A 95 5.252 2.571 11.994 1.00 0.00 H new ATOM 0 HE2 HIS A 95 2.804 2.069 11.508 1.00 0.00 H new ATOM 1448 N ASN A 96 1.549 7.119 15.882 1.00 0.00 N ATOM 1449 CA ASN A 96 1.477 7.960 17.071 1.00 0.00 C ATOM 1450 C ASN A 96 2.710 8.852 17.183 1.00 0.00 C ATOM 1451 O ASN A 96 3.607 8.592 17.985 1.00 0.00 O ATOM 1452 CB ASN A 96 1.344 7.095 18.326 1.00 0.00 C ATOM 1453 CG ASN A 96 2.333 5.946 18.344 1.00 0.00 C ATOM 1454 OD1 ASN A 96 3.502 6.124 18.687 1.00 0.00 O ATOM 1455 ND2 ASN A 96 1.868 4.759 17.973 1.00 0.00 N ATOM 0 H ASN A 96 1.760 6.139 16.071 1.00 0.00 H new ATOM 0 HA ASN A 96 0.597 8.597 16.982 1.00 0.00 H new ATOM 0 HB2 ASN A 96 1.496 7.715 19.209 1.00 0.00 H new ATOM 0 HB3 ASN A 96 0.330 6.699 18.385 1.00 0.00 H new ATOM 0 HD21 ASN A 96 2.487 3.949 17.965 1.00 0.00 H new ATOM 0 HD22 ASN A 96 0.891 4.658 17.696 1.00 0.00 H new ATOM 1462 N LYS A 97 2.747 9.905 16.374 1.00 0.00 N ATOM 1463 CA LYS A 97 3.868 10.837 16.382 1.00 0.00 C ATOM 1464 C LYS A 97 3.557 12.054 17.248 1.00 0.00 C ATOM 1465 O LYS A 97 2.541 12.721 17.056 1.00 0.00 O ATOM 1466 CB LYS A 97 4.196 11.284 14.956 1.00 0.00 C ATOM 1467 CG LYS A 97 5.310 12.314 14.882 1.00 0.00 C ATOM 1468 CD LYS A 97 6.680 11.659 14.933 1.00 0.00 C ATOM 1469 CE LYS A 97 7.788 12.692 15.063 1.00 0.00 C ATOM 1470 NZ LYS A 97 7.941 13.167 16.466 1.00 0.00 N ATOM 0 H LYS A 97 2.013 10.134 15.704 1.00 0.00 H new ATOM 0 HA LYS A 97 4.732 10.324 16.804 1.00 0.00 H new ATOM 0 HB2 LYS A 97 4.479 10.412 14.367 1.00 0.00 H new ATOM 0 HB3 LYS A 97 3.298 11.699 14.499 1.00 0.00 H new ATOM 0 HG2 LYS A 97 5.215 12.889 13.961 1.00 0.00 H new ATOM 0 HG3 LYS A 97 5.211 13.018 15.708 1.00 0.00 H new ATOM 0 HD2 LYS A 97 6.723 10.970 15.776 1.00 0.00 H new ATOM 0 HD3 LYS A 97 6.836 11.069 14.030 1.00 0.00 H new ATOM 0 HE2 LYS A 97 8.729 12.261 14.721 1.00 0.00 H new ATOM 0 HE3 LYS A 97 7.572 13.540 14.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 8.706 13.870 16.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 7.051 13.602 16.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 8.173 12.362 17.082 1.00 0.00 H new ATOM 1484 N ASN A 98 4.439 12.337 18.201 1.00 0.00 N ATOM 1485 CA ASN A 98 4.259 13.475 19.096 1.00 0.00 C ATOM 1486 C ASN A 98 4.402 14.791 18.338 1.00 0.00 C ATOM 1487 O ASN A 98 5.513 15.232 18.043 1.00 0.00 O ATOM 1488 CB ASN A 98 5.275 13.418 20.238 1.00 0.00 C ATOM 1489 CG ASN A 98 4.936 14.377 21.362 1.00 0.00 C ATOM 1490 OD1 ASN A 98 4.472 13.966 22.426 1.00 0.00 O ATOM 1491 ND2 ASN A 98 5.166 15.664 21.131 1.00 0.00 N ATOM 0 H ASN A 98 5.285 11.794 18.374 1.00 0.00 H new ATOM 0 HA ASN A 98 3.253 13.423 19.511 1.00 0.00 H new ATOM 0 HB2 ASN A 98 5.319 12.402 20.631 1.00 0.00 H new ATOM 0 HB3 ASN A 98 6.266 13.653 19.851 1.00 0.00 H new ATOM 0 HD21 ASN A 98 4.957 16.357 21.850 1.00 0.00 H new ATOM 0 HD22 ASN A 98 5.552 15.960 20.234 1.00 0.00 H new ATOM 1498 N LEU A 99 3.270 15.414 18.027 1.00 0.00 N ATOM 1499 CA LEU A 99 3.268 16.681 17.304 1.00 0.00 C ATOM 1500 C LEU A 99 2.876 17.832 18.224 1.00 0.00 C ATOM 1501 O LEU A 99 1.889 17.747 18.956 1.00 0.00 O ATOM 1502 CB LEU A 99 2.307 16.612 16.116 1.00 0.00 C ATOM 1503 CG LEU A 99 2.623 17.538 14.942 1.00 0.00 C ATOM 1504 CD1 LEU A 99 2.674 18.986 15.403 1.00 0.00 C ATOM 1505 CD2 LEU A 99 3.937 17.139 14.287 1.00 0.00 C ATOM 0 H LEU A 99 2.342 15.062 18.264 1.00 0.00 H new ATOM 0 HA LEU A 99 4.278 16.862 16.936 1.00 0.00 H new ATOM 0 HB2 LEU A 99 2.289 15.586 15.749 1.00 0.00 H new ATOM 0 HB3 LEU A 99 1.303 16.841 16.473 1.00 0.00 H new ATOM 0 HG LEU A 99 1.827 17.441 14.203 1.00 0.00 H new ATOM 0 HD11 LEU A 99 2.900 19.631 14.554 1.00 0.00 H new ATOM 0 HD12 LEU A 99 1.709 19.268 15.825 1.00 0.00 H new ATOM 0 HD13 LEU A 99 3.449 19.099 16.161 1.00 0.00 H new ATOM 0 HD21 LEU A 99 4.146 17.809 13.453 1.00 0.00 H new ATOM 0 HD22 LEU A 99 4.743 17.207 15.018 1.00 0.00 H new ATOM 0 HD23 LEU A 99 3.865 16.115 13.920 1.00 0.00 H new ATOM 1517 N SER A 100 3.653 18.909 18.181 1.00 0.00 N ATOM 1518 CA SER A 100 3.388 20.078 19.012 1.00 0.00 C ATOM 1519 C SER A 100 2.694 21.172 18.206 1.00 0.00 C ATOM 1520 O SER A 100 3.339 22.087 17.697 1.00 0.00 O ATOM 1521 CB SER A 100 4.691 20.615 19.605 1.00 0.00 C ATOM 1522 OG SER A 100 5.044 19.912 20.784 1.00 0.00 O ATOM 0 H SER A 100 4.472 18.997 17.579 1.00 0.00 H new ATOM 0 HA SER A 100 2.727 19.773 19.823 1.00 0.00 H new ATOM 0 HB2 SER A 100 5.492 20.525 18.871 1.00 0.00 H new ATOM 0 HB3 SER A 100 4.582 21.676 19.830 1.00 0.00 H new ATOM 0 HG SER A 100 5.881 20.274 21.142 1.00 0.00 H new ATOM 1528 N GLY A 101 1.373 21.068 18.094 1.00 0.00 N ATOM 1529 CA GLY A 101 0.612 22.054 17.349 1.00 0.00 C ATOM 1530 C GLY A 101 -0.750 21.538 16.928 1.00 0.00 C ATOM 1531 O GLY A 101 -1.014 21.312 15.747 1.00 0.00 O ATOM 0 H GLY A 101 0.817 20.319 18.506 1.00 0.00 H new ATOM 0 HA2 GLY A 101 0.486 22.948 17.960 1.00 0.00 H new ATOM 0 HA3 GLY A 101 1.175 22.350 16.464 1.00 0.00 H new ATOM 1535 N PRO A 102 -1.642 21.343 17.910 1.00 0.00 N ATOM 1536 CA PRO A 102 -2.999 20.848 17.660 1.00 0.00 C ATOM 1537 C PRO A 102 -3.868 21.874 16.941 1.00 0.00 C ATOM 1538 O PRO A 102 -3.523 23.054 16.872 1.00 0.00 O ATOM 1539 CB PRO A 102 -3.543 20.578 19.065 1.00 0.00 C ATOM 1540 CG PRO A 102 -2.765 21.486 19.953 1.00 0.00 C ATOM 1541 CD PRO A 102 -1.396 21.593 19.340 1.00 0.00 C ATOM 0 HA PRO A 102 -2.999 19.972 17.012 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -4.611 20.787 19.123 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -3.407 19.534 19.349 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -3.239 22.465 20.022 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -2.709 21.087 20.966 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -0.957 22.577 19.506 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -0.708 20.861 19.763 1.00 0.00 H new ATOM 1549 N SER A 103 -4.996 21.417 16.407 1.00 0.00 N ATOM 1550 CA SER A 103 -5.913 22.296 15.690 1.00 0.00 C ATOM 1551 C SER A 103 -7.206 21.565 15.343 1.00 0.00 C ATOM 1552 O SER A 103 -7.216 20.346 15.168 1.00 0.00 O ATOM 1553 CB SER A 103 -5.254 22.823 14.413 1.00 0.00 C ATOM 1554 OG SER A 103 -6.101 23.741 13.744 1.00 0.00 O ATOM 0 H SER A 103 -5.297 20.444 16.457 1.00 0.00 H new ATOM 0 HA SER A 103 -6.154 23.137 16.340 1.00 0.00 H new ATOM 0 HB2 SER A 103 -4.310 23.308 14.661 1.00 0.00 H new ATOM 0 HB3 SER A 103 -5.020 21.990 13.750 1.00 0.00 H new ATOM 0 HG SER A 103 -5.657 24.064 12.933 1.00 0.00 H new ATOM 1560 N SER A 104 -8.297 22.318 15.246 1.00 0.00 N ATOM 1561 CA SER A 104 -9.598 21.743 14.924 1.00 0.00 C ATOM 1562 C SER A 104 -10.413 22.696 14.055 1.00 0.00 C ATOM 1563 O SER A 104 -10.361 23.912 14.231 1.00 0.00 O ATOM 1564 CB SER A 104 -10.367 21.419 16.206 1.00 0.00 C ATOM 1565 OG SER A 104 -9.725 20.390 16.940 1.00 0.00 O ATOM 0 H SER A 104 -8.306 23.328 15.386 1.00 0.00 H new ATOM 0 HA SER A 104 -9.433 20.822 14.365 1.00 0.00 H new ATOM 0 HB2 SER A 104 -10.446 22.314 16.822 1.00 0.00 H new ATOM 0 HB3 SER A 104 -11.383 21.113 15.957 1.00 0.00 H new ATOM 0 HG SER A 104 -10.235 20.203 17.755 1.00 0.00 H new ATOM 1571 N GLY A 105 -11.167 22.132 13.116 1.00 0.00 N ATOM 1572 CA GLY A 105 -11.983 22.944 12.233 1.00 0.00 C ATOM 1573 C GLY A 105 -12.889 22.110 11.350 1.00 0.00 C ATOM 1574 O GLY A 105 -12.656 21.990 10.147 1.00 0.00 O ATOM 0 H GLY A 105 -11.227 21.127 12.951 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -12.589 23.626 12.829 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -11.335 23.558 11.607 1.00 0.00 H new TER 1578 GLY A 105