USER MOD reduce.3.24.130724 H: found=0, std=0, add=734, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 732 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 63 GLN : amide:sc= 0.417 K(o=0.45,f=-0.15) USER MOD Set 1.2: A 65 GLN : amide:sc= 0.0308 K(o=0.45,f=-0.059) USER MOD Set 2.1: A 1 MET N :NH3+ 153:sc= 1.22 (180deg=1.09) USER MOD Set 2.2: A 16 SER OG : rot -28:sc= 0.206 USER MOD Single : A 1 MET CE :methyl -160:sc= -0.465 (180deg=-1.79) USER MOD Single : A 7 ASN : amide:sc= 1.04 K(o=1,f=-9.6!) USER MOD Single : A 9 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 1.3 (180deg=1.3) USER MOD Single : A 14 TYR OH : rot 180:sc=-0.00797 USER MOD Single : A 15 MET CE :methyl -165:sc= -0.112 (180deg=-0.578) USER MOD Single : A 17 TYR OH : rot 114:sc= 0.262 USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= 1.73 K(o=1.7,f=0) USER MOD Single : A 37 SER OG : rot -63:sc= 1.29 USER MOD Single : A 45 MET CE :methyl 144:sc= 0 (180deg=-0.288) USER MOD Single : A 49 HIS : no HE2:sc= -0.0773 X(o=-0.077,f=-0.085) USER MOD Single : A 69 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00125) USER MOD Single : A 76 THR OG1 : rot 180:sc= -0.854 USER MOD Single : A 77 LYS NZ :NH3+ -172:sc= 1.26 (180deg=1.14) USER MOD Single : A 79 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ 174:sc= 1.28 (180deg=1.14) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 6.888 0.273 -5.766 1.00 0.00 N ATOM 2 CA MET A 1 5.685 -0.528 -5.389 1.00 0.00 C ATOM 3 C MET A 1 4.433 0.127 -5.994 1.00 0.00 C ATOM 4 O MET A 1 4.367 1.351 -6.110 1.00 0.00 O ATOM 5 CB MET A 1 5.587 -0.696 -3.852 1.00 0.00 C ATOM 6 CG MET A 1 4.422 -1.548 -3.317 1.00 0.00 C ATOM 7 SD MET A 1 4.639 -3.330 -3.580 1.00 0.00 S ATOM 8 CE MET A 1 3.279 -4.004 -2.589 1.00 0.00 C ATOM 0 H1 MET A 1 7.628 0.149 -5.046 1.00 0.00 H new ATOM 0 H2 MET A 1 7.245 -0.050 -6.688 1.00 0.00 H new ATOM 0 H3 MET A 1 6.630 1.279 -5.827 1.00 0.00 H new ATOM 0 HA MET A 1 5.770 -1.535 -5.797 1.00 0.00 H new ATOM 0 HB2 MET A 1 6.519 -1.136 -3.499 1.00 0.00 H new ATOM 0 HB3 MET A 1 5.514 0.296 -3.406 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.306 -1.359 -2.250 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.498 -1.228 -3.800 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.481 -5.050 -2.358 1.00 0.00 H new ATOM 0 HE2 MET A 1 3.190 -3.439 -1.661 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.348 -3.929 -3.151 1.00 0.00 H new ATOM 20 N GLU A 2 3.464 -0.683 -6.421 1.00 0.00 N ATOM 21 CA GLU A 2 2.369 -0.280 -7.298 1.00 0.00 C ATOM 22 C GLU A 2 1.142 -1.090 -6.881 1.00 0.00 C ATOM 23 O GLU A 2 1.307 -2.281 -6.653 1.00 0.00 O ATOM 24 CB GLU A 2 2.800 -0.634 -8.742 1.00 0.00 C ATOM 25 CG GLU A 2 2.540 0.525 -9.708 1.00 0.00 C ATOM 26 CD GLU A 2 3.000 0.191 -11.138 1.00 0.00 C ATOM 27 OE1 GLU A 2 2.204 -0.387 -11.919 1.00 0.00 O ATOM 28 OE2 GLU A 2 4.150 0.537 -11.505 1.00 0.00 O ATOM 0 H GLU A 2 3.420 -1.667 -6.157 1.00 0.00 H new ATOM 0 HA GLU A 2 2.137 0.783 -7.237 1.00 0.00 H new ATOM 0 HB2 GLU A 2 3.860 -0.888 -8.754 1.00 0.00 H new ATOM 0 HB3 GLU A 2 2.257 -1.517 -9.078 1.00 0.00 H new ATOM 0 HG2 GLU A 2 1.476 0.761 -9.714 1.00 0.00 H new ATOM 0 HG3 GLU A 2 3.062 1.415 -9.357 1.00 0.00 H new ATOM 35 N ILE A 3 -0.058 -0.507 -6.785 1.00 0.00 N ATOM 36 CA ILE A 3 -1.294 -1.193 -6.375 1.00 0.00 C ATOM 37 C ILE A 3 -2.322 -1.037 -7.510 1.00 0.00 C ATOM 38 O ILE A 3 -2.319 -0.016 -8.208 1.00 0.00 O ATOM 39 CB ILE A 3 -1.845 -0.603 -5.056 1.00 0.00 C ATOM 40 CG1 ILE A 3 -0.803 -0.489 -3.926 1.00 0.00 C ATOM 41 CG2 ILE A 3 -3.060 -1.404 -4.535 1.00 0.00 C ATOM 42 CD1 ILE A 3 -0.165 -1.788 -3.414 1.00 0.00 C ATOM 0 H ILE A 3 -0.203 0.481 -6.995 1.00 0.00 H new ATOM 0 HA ILE A 3 -1.089 -2.248 -6.194 1.00 0.00 H new ATOM 0 HB ILE A 3 -2.147 0.410 -5.322 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -0.002 0.165 -4.272 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -1.278 0.008 -3.080 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -3.419 -0.959 -3.607 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -3.856 -1.382 -5.279 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -2.763 -2.437 -4.351 1.00 0.00 H new ATOM 0 HD11 ILE A 3 0.547 -1.556 -2.622 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -0.942 -2.445 -3.023 1.00 0.00 H new ATOM 0 HD13 ILE A 3 0.353 -2.286 -4.233 1.00 0.00 H new ATOM 54 N GLU A 4 -3.237 -2.000 -7.667 1.00 0.00 N ATOM 55 CA GLU A 4 -4.334 -1.953 -8.623 1.00 0.00 C ATOM 56 C GLU A 4 -5.605 -2.582 -8.034 1.00 0.00 C ATOM 57 O GLU A 4 -5.544 -3.531 -7.245 1.00 0.00 O ATOM 58 CB GLU A 4 -3.891 -2.722 -9.864 1.00 0.00 C ATOM 59 CG GLU A 4 -4.895 -2.683 -11.006 1.00 0.00 C ATOM 60 CD GLU A 4 -5.214 -1.260 -11.499 1.00 0.00 C ATOM 61 OE1 GLU A 4 -6.107 -0.611 -10.903 1.00 0.00 O ATOM 62 OE2 GLU A 4 -4.584 -0.794 -12.480 1.00 0.00 O ATOM 0 H GLU A 4 -3.229 -2.856 -7.113 1.00 0.00 H new ATOM 0 HA GLU A 4 -4.570 -0.918 -8.871 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -2.943 -2.313 -10.213 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -3.708 -3.761 -9.589 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -4.507 -3.269 -11.839 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -5.819 -3.162 -10.683 1.00 0.00 H new ATOM 69 N ARG A 5 -6.765 -2.115 -8.507 1.00 0.00 N ATOM 70 CA ARG A 5 -8.103 -2.571 -8.140 1.00 0.00 C ATOM 71 C ARG A 5 -8.730 -3.129 -9.425 1.00 0.00 C ATOM 72 O ARG A 5 -9.361 -2.386 -10.178 1.00 0.00 O ATOM 73 CB ARG A 5 -8.892 -1.387 -7.538 1.00 0.00 C ATOM 74 CG ARG A 5 -10.310 -1.733 -7.037 1.00 0.00 C ATOM 75 CD ARG A 5 -10.371 -2.535 -5.726 1.00 0.00 C ATOM 76 NE ARG A 5 -9.782 -1.783 -4.599 1.00 0.00 N ATOM 77 CZ ARG A 5 -10.445 -1.062 -3.676 1.00 0.00 C ATOM 78 NH1 ARG A 5 -11.771 -1.014 -3.635 1.00 0.00 N ATOM 79 NH2 ARG A 5 -9.762 -0.376 -2.768 1.00 0.00 N ATOM 0 H ARG A 5 -6.793 -1.364 -9.197 1.00 0.00 H new ATOM 0 HA ARG A 5 -8.100 -3.351 -7.378 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -8.320 -0.975 -6.707 1.00 0.00 H new ATOM 0 HB3 ARG A 5 -8.971 -0.603 -8.291 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -10.865 -0.805 -6.901 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -10.823 -2.300 -7.814 1.00 0.00 H new ATOM 0 HD2 ARG A 5 -11.408 -2.781 -5.497 1.00 0.00 H new ATOM 0 HD3 ARG A 5 -9.840 -3.479 -5.851 1.00 0.00 H new ATOM 0 HE ARG A 5 -8.766 -1.813 -4.511 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -12.322 -1.535 -4.318 1.00 0.00 H new ATOM 0 HH12 ARG A 5 -12.239 -0.457 -2.921 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -8.742 -0.398 -2.773 1.00 0.00 H new ATOM 0 HH22 ARG A 5 -10.257 0.173 -2.065 1.00 0.00 H new ATOM 93 N ILE A 6 -8.496 -4.417 -9.717 1.00 0.00 N ATOM 94 CA ILE A 6 -9.024 -5.075 -10.918 1.00 0.00 C ATOM 95 C ILE A 6 -10.548 -4.950 -10.930 1.00 0.00 C ATOM 96 O ILE A 6 -11.153 -4.473 -11.893 1.00 0.00 O ATOM 97 CB ILE A 6 -8.604 -6.562 -10.918 1.00 0.00 C ATOM 98 CG1 ILE A 6 -7.079 -6.731 -10.794 1.00 0.00 C ATOM 99 CG2 ILE A 6 -9.153 -7.310 -12.145 1.00 0.00 C ATOM 100 CD1 ILE A 6 -6.267 -6.022 -11.879 1.00 0.00 C ATOM 0 H ILE A 6 -7.935 -5.031 -9.126 1.00 0.00 H new ATOM 0 HA ILE A 6 -8.621 -4.598 -11.812 1.00 0.00 H new ATOM 0 HB ILE A 6 -9.051 -7.014 -10.033 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -6.764 -6.356 -9.820 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -6.842 -7.795 -10.818 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -8.836 -8.352 -12.108 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -10.242 -7.262 -12.143 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -8.771 -6.847 -13.055 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -5.204 -6.197 -11.711 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -6.548 -6.412 -12.857 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -6.469 -4.951 -11.843 1.00 0.00 H new ATOM 112 N ASN A 7 -11.136 -5.380 -9.817 1.00 0.00 N ATOM 113 CA ASN A 7 -12.546 -5.283 -9.479 1.00 0.00 C ATOM 114 C ASN A 7 -12.621 -5.254 -7.948 1.00 0.00 C ATOM 115 O ASN A 7 -11.600 -5.037 -7.292 1.00 0.00 O ATOM 116 CB ASN A 7 -13.352 -6.427 -10.145 1.00 0.00 C ATOM 117 CG ASN A 7 -13.183 -7.822 -9.543 1.00 0.00 C ATOM 118 OD1 ASN A 7 -12.437 -8.033 -8.597 1.00 0.00 O ATOM 119 ND2 ASN A 7 -13.883 -8.810 -10.068 1.00 0.00 N ATOM 0 H ASN A 7 -10.600 -5.836 -9.079 1.00 0.00 H new ATOM 0 HA ASN A 7 -13.009 -4.376 -9.867 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -14.410 -6.165 -10.108 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -13.072 -6.474 -11.197 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -13.803 -9.752 -9.685 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -14.505 -8.632 -10.857 1.00 0.00 H new ATOM 126 N GLU A 8 -13.797 -5.452 -7.355 1.00 0.00 N ATOM 127 CA GLU A 8 -13.955 -5.288 -5.910 1.00 0.00 C ATOM 128 C GLU A 8 -13.425 -6.483 -5.089 1.00 0.00 C ATOM 129 O GLU A 8 -13.509 -6.467 -3.858 1.00 0.00 O ATOM 130 CB GLU A 8 -15.426 -4.967 -5.598 1.00 0.00 C ATOM 131 CG GLU A 8 -15.559 -3.970 -4.438 1.00 0.00 C ATOM 132 CD GLU A 8 -15.163 -2.539 -4.853 1.00 0.00 C ATOM 133 OE1 GLU A 8 -13.951 -2.209 -4.843 1.00 0.00 O ATOM 134 OE2 GLU A 8 -16.067 -1.733 -5.187 1.00 0.00 O ATOM 0 H GLU A 8 -14.648 -5.724 -7.847 1.00 0.00 H new ATOM 0 HA GLU A 8 -13.331 -4.451 -5.597 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -15.905 -4.556 -6.487 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -15.954 -5.887 -5.348 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -16.587 -3.970 -4.077 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -14.930 -4.294 -3.609 1.00 0.00 H new ATOM 141 N HIS A 9 -12.882 -7.518 -5.742 1.00 0.00 N ATOM 142 CA HIS A 9 -12.493 -8.776 -5.104 1.00 0.00 C ATOM 143 C HIS A 9 -11.055 -9.174 -5.453 1.00 0.00 C ATOM 144 O HIS A 9 -10.276 -9.491 -4.552 1.00 0.00 O ATOM 145 CB HIS A 9 -13.490 -9.870 -5.518 1.00 0.00 C ATOM 146 CG HIS A 9 -14.933 -9.564 -5.177 1.00 0.00 C ATOM 147 ND1 HIS A 9 -16.001 -9.624 -6.048 1.00 0.00 N ATOM 148 CD2 HIS A 9 -15.432 -9.174 -3.961 1.00 0.00 C ATOM 149 CE1 HIS A 9 -17.111 -9.274 -5.373 1.00 0.00 C ATOM 150 NE2 HIS A 9 -16.817 -8.995 -4.089 1.00 0.00 N ATOM 0 H HIS A 9 -12.699 -7.502 -6.745 1.00 0.00 H new ATOM 0 HA HIS A 9 -12.521 -8.646 -4.022 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -13.410 -10.029 -6.593 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -13.206 -10.805 -5.035 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -14.857 -9.029 -3.059 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -18.101 -9.224 -5.802 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -17.469 -8.711 -3.358 1.00 0.00 H new ATOM 158 N THR A 10 -10.674 -9.131 -6.728 1.00 0.00 N ATOM 159 CA THR A 10 -9.293 -9.282 -7.155 1.00 0.00 C ATOM 160 C THR A 10 -8.608 -7.929 -6.994 1.00 0.00 C ATOM 161 O THR A 10 -9.116 -6.900 -7.446 1.00 0.00 O ATOM 162 CB THR A 10 -9.228 -9.762 -8.614 1.00 0.00 C ATOM 163 OG1 THR A 10 -9.967 -10.970 -8.730 1.00 0.00 O ATOM 164 CG2 THR A 10 -7.794 -10.021 -9.099 1.00 0.00 C ATOM 0 H THR A 10 -11.326 -8.989 -7.499 1.00 0.00 H new ATOM 0 HA THR A 10 -8.786 -10.032 -6.548 1.00 0.00 H new ATOM 0 HB THR A 10 -9.645 -8.968 -9.234 1.00 0.00 H new ATOM 0 HG1 THR A 10 -9.935 -11.286 -9.657 1.00 0.00 H new ATOM 0 HG21 THR A 10 -7.816 -10.357 -10.136 1.00 0.00 H new ATOM 0 HG22 THR A 10 -7.214 -9.101 -9.028 1.00 0.00 H new ATOM 0 HG23 THR A 10 -7.333 -10.789 -8.478 1.00 0.00 H new ATOM 172 N VAL A 11 -7.401 -7.951 -6.444 1.00 0.00 N ATOM 173 CA VAL A 11 -6.481 -6.824 -6.487 1.00 0.00 C ATOM 174 C VAL A 11 -5.158 -7.381 -6.997 1.00 0.00 C ATOM 175 O VAL A 11 -4.906 -8.588 -6.901 1.00 0.00 O ATOM 176 CB VAL A 11 -6.394 -6.105 -5.118 1.00 0.00 C ATOM 177 CG1 VAL A 11 -7.753 -5.508 -4.719 1.00 0.00 C ATOM 178 CG2 VAL A 11 -5.898 -6.994 -3.971 1.00 0.00 C ATOM 0 H VAL A 11 -7.030 -8.762 -5.950 1.00 0.00 H new ATOM 0 HA VAL A 11 -6.821 -6.038 -7.161 1.00 0.00 H new ATOM 0 HB VAL A 11 -5.654 -5.319 -5.266 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -7.662 -5.009 -3.754 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -8.068 -4.786 -5.472 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -8.493 -6.305 -4.648 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -5.866 -6.414 -3.049 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -6.576 -7.838 -3.846 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -4.899 -7.362 -4.202 1.00 0.00 H new ATOM 188 N LYS A 12 -4.307 -6.527 -7.551 1.00 0.00 N ATOM 189 CA LYS A 12 -2.935 -6.918 -7.829 1.00 0.00 C ATOM 190 C LYS A 12 -2.022 -5.791 -7.407 1.00 0.00 C ATOM 191 O LYS A 12 -2.482 -4.677 -7.154 1.00 0.00 O ATOM 192 CB LYS A 12 -2.747 -7.363 -9.288 1.00 0.00 C ATOM 193 CG LYS A 12 -2.624 -6.263 -10.336 1.00 0.00 C ATOM 194 CD LYS A 12 -2.322 -6.885 -11.707 1.00 0.00 C ATOM 195 CE LYS A 12 -2.031 -5.757 -12.695 1.00 0.00 C ATOM 196 NZ LYS A 12 -1.455 -6.247 -13.975 1.00 0.00 N ATOM 0 H LYS A 12 -4.541 -5.570 -7.814 1.00 0.00 H new ATOM 0 HA LYS A 12 -2.671 -7.801 -7.247 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -1.852 -7.983 -9.341 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -3.590 -7.998 -9.560 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -3.548 -5.687 -10.383 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -1.830 -5.570 -10.058 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -1.468 -7.558 -11.638 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -3.169 -7.479 -12.049 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -2.953 -5.214 -12.901 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -1.339 -5.049 -12.238 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -1.277 -5.440 -14.607 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -0.560 -6.742 -13.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -2.124 -6.902 -14.429 1.00 0.00 H new ATOM 210 N PHE A 13 -0.735 -6.075 -7.352 1.00 0.00 N ATOM 211 CA PHE A 13 0.278 -5.094 -7.056 1.00 0.00 C ATOM 212 C PHE A 13 1.552 -5.494 -7.786 1.00 0.00 C ATOM 213 O PHE A 13 1.691 -6.630 -8.248 1.00 0.00 O ATOM 214 CB PHE A 13 0.457 -4.983 -5.535 1.00 0.00 C ATOM 215 CG PHE A 13 0.851 -6.247 -4.818 1.00 0.00 C ATOM 216 CD1 PHE A 13 -0.136 -7.154 -4.395 1.00 0.00 C ATOM 217 CD2 PHE A 13 2.199 -6.465 -4.501 1.00 0.00 C ATOM 218 CE1 PHE A 13 0.230 -8.253 -3.598 1.00 0.00 C ATOM 219 CE2 PHE A 13 2.561 -7.538 -3.677 1.00 0.00 C ATOM 220 CZ PHE A 13 1.571 -8.413 -3.195 1.00 0.00 C ATOM 0 H PHE A 13 -0.363 -7.011 -7.515 1.00 0.00 H new ATOM 0 HA PHE A 13 -0.008 -4.101 -7.404 1.00 0.00 H new ATOM 0 HB2 PHE A 13 1.214 -4.225 -5.334 1.00 0.00 H new ATOM 0 HB3 PHE A 13 -0.478 -4.623 -5.105 1.00 0.00 H new ATOM 0 HD1 PHE A 13 -1.167 -7.008 -4.680 1.00 0.00 H new ATOM 0 HD2 PHE A 13 2.959 -5.805 -4.893 1.00 0.00 H new ATOM 0 HE1 PHE A 13 -0.515 -8.973 -3.295 1.00 0.00 H new ATOM 0 HE2 PHE A 13 3.597 -7.693 -3.413 1.00 0.00 H new ATOM 0 HZ PHE A 13 1.839 -9.208 -2.515 1.00 0.00 H new ATOM 230 N TYR A 14 2.489 -4.563 -7.875 1.00 0.00 N ATOM 231 CA TYR A 14 3.801 -4.790 -8.425 1.00 0.00 C ATOM 232 C TYR A 14 4.796 -4.303 -7.387 1.00 0.00 C ATOM 233 O TYR A 14 4.676 -3.191 -6.874 1.00 0.00 O ATOM 234 CB TYR A 14 3.935 -4.146 -9.803 1.00 0.00 C ATOM 235 CG TYR A 14 5.373 -4.102 -10.245 1.00 0.00 C ATOM 236 CD1 TYR A 14 5.964 -5.237 -10.817 1.00 0.00 C ATOM 237 CD2 TYR A 14 6.144 -2.970 -9.935 1.00 0.00 C ATOM 238 CE1 TYR A 14 7.335 -5.248 -11.111 1.00 0.00 C ATOM 239 CE2 TYR A 14 7.529 -2.976 -10.203 1.00 0.00 C ATOM 240 CZ TYR A 14 8.124 -4.111 -10.813 1.00 0.00 C ATOM 241 OH TYR A 14 9.457 -4.124 -11.109 1.00 0.00 O ATOM 0 H TYR A 14 2.346 -3.605 -7.556 1.00 0.00 H new ATOM 0 HA TYR A 14 3.997 -5.845 -8.616 1.00 0.00 H new ATOM 0 HB2 TYR A 14 3.346 -4.707 -10.528 1.00 0.00 H new ATOM 0 HB3 TYR A 14 3.529 -3.135 -9.776 1.00 0.00 H new ATOM 0 HD1 TYR A 14 5.361 -6.107 -11.032 1.00 0.00 H new ATOM 0 HD2 TYR A 14 5.680 -2.100 -9.494 1.00 0.00 H new ATOM 0 HE1 TYR A 14 7.787 -6.119 -11.562 1.00 0.00 H new ATOM 0 HE2 TYR A 14 8.135 -2.120 -9.945 1.00 0.00 H new ATOM 0 HH TYR A 14 9.859 -3.270 -10.845 1.00 0.00 H new ATOM 251 N MET A 15 5.755 -5.156 -7.054 1.00 0.00 N ATOM 252 CA MET A 15 6.687 -4.970 -5.963 1.00 0.00 C ATOM 253 C MET A 15 8.094 -5.049 -6.521 1.00 0.00 C ATOM 254 O MET A 15 8.506 -6.090 -7.028 1.00 0.00 O ATOM 255 CB MET A 15 6.457 -6.072 -4.925 1.00 0.00 C ATOM 256 CG MET A 15 7.279 -5.839 -3.678 1.00 0.00 C ATOM 257 SD MET A 15 6.822 -6.937 -2.318 1.00 0.00 S ATOM 258 CE MET A 15 6.778 -5.741 -0.961 1.00 0.00 C ATOM 0 H MET A 15 5.906 -6.029 -7.559 1.00 0.00 H new ATOM 0 HA MET A 15 6.543 -4.001 -5.485 1.00 0.00 H new ATOM 0 HB2 MET A 15 5.400 -6.111 -4.663 1.00 0.00 H new ATOM 0 HB3 MET A 15 6.715 -7.039 -5.356 1.00 0.00 H new ATOM 0 HG2 MET A 15 8.334 -5.980 -3.913 1.00 0.00 H new ATOM 0 HG3 MET A 15 7.159 -4.804 -3.358 1.00 0.00 H new ATOM 0 HE1 MET A 15 6.776 -6.271 -0.009 1.00 0.00 H new ATOM 0 HE2 MET A 15 7.655 -5.096 -1.016 1.00 0.00 H new ATOM 0 HE3 MET A 15 5.876 -5.134 -1.040 1.00 0.00 H new ATOM 268 N SER A 16 8.843 -3.957 -6.420 1.00 0.00 N ATOM 269 CA SER A 16 10.216 -3.938 -6.909 1.00 0.00 C ATOM 270 C SER A 16 11.122 -4.648 -5.895 1.00 0.00 C ATOM 271 O SER A 16 10.831 -4.650 -4.697 1.00 0.00 O ATOM 272 CB SER A 16 10.644 -2.489 -7.162 1.00 0.00 C ATOM 273 OG SER A 16 9.613 -1.750 -7.811 1.00 0.00 O ATOM 0 H SER A 16 8.526 -3.080 -6.007 1.00 0.00 H new ATOM 0 HA SER A 16 10.298 -4.473 -7.855 1.00 0.00 H new ATOM 0 HB2 SER A 16 10.896 -2.011 -6.215 1.00 0.00 H new ATOM 0 HB3 SER A 16 11.545 -2.476 -7.775 1.00 0.00 H new ATOM 0 HG SER A 16 9.065 -2.357 -8.351 1.00 0.00 H new ATOM 279 N TYR A 17 12.249 -5.213 -6.337 1.00 0.00 N ATOM 280 CA TYR A 17 13.211 -5.855 -5.431 1.00 0.00 C ATOM 281 C TYR A 17 13.732 -4.891 -4.366 1.00 0.00 C ATOM 282 O TYR A 17 13.900 -5.277 -3.209 1.00 0.00 O ATOM 283 CB TYR A 17 14.382 -6.455 -6.216 1.00 0.00 C ATOM 284 CG TYR A 17 14.021 -7.524 -7.228 1.00 0.00 C ATOM 285 CD1 TYR A 17 12.912 -8.371 -7.039 1.00 0.00 C ATOM 286 CD2 TYR A 17 14.826 -7.680 -8.370 1.00 0.00 C ATOM 287 CE1 TYR A 17 12.617 -9.366 -7.979 1.00 0.00 C ATOM 288 CE2 TYR A 17 14.517 -8.658 -9.331 1.00 0.00 C ATOM 289 CZ TYR A 17 13.413 -9.522 -9.133 1.00 0.00 C ATOM 290 OH TYR A 17 13.097 -10.496 -10.032 1.00 0.00 O ATOM 0 H TYR A 17 12.520 -5.240 -7.320 1.00 0.00 H new ATOM 0 HA TYR A 17 12.677 -6.656 -4.919 1.00 0.00 H new ATOM 0 HB2 TYR A 17 14.897 -5.648 -6.737 1.00 0.00 H new ATOM 0 HB3 TYR A 17 15.091 -6.879 -5.505 1.00 0.00 H new ATOM 0 HD1 TYR A 17 12.287 -8.253 -6.166 1.00 0.00 H new ATOM 0 HD2 TYR A 17 15.688 -7.044 -8.510 1.00 0.00 H new ATOM 0 HE1 TYR A 17 11.772 -10.020 -7.819 1.00 0.00 H new ATOM 0 HE2 TYR A 17 15.122 -8.750 -10.221 1.00 0.00 H new ATOM 0 HH TYR A 17 12.817 -10.084 -10.876 1.00 0.00 H new ATOM 300 N GLY A 18 13.928 -3.623 -4.725 1.00 0.00 N ATOM 301 CA GLY A 18 14.381 -2.612 -3.783 1.00 0.00 C ATOM 302 C GLY A 18 13.349 -2.333 -2.695 1.00 0.00 C ATOM 303 O GLY A 18 13.727 -2.031 -1.569 1.00 0.00 O ATOM 0 H GLY A 18 13.777 -3.274 -5.671 1.00 0.00 H new ATOM 0 HA2 GLY A 18 15.313 -2.939 -3.322 1.00 0.00 H new ATOM 0 HA3 GLY A 18 14.598 -1.689 -4.320 1.00 0.00 H new ATOM 307 N ASP A 19 12.052 -2.487 -2.981 1.00 0.00 N ATOM 308 CA ASP A 19 10.989 -2.299 -1.989 1.00 0.00 C ATOM 309 C ASP A 19 11.011 -3.431 -0.960 1.00 0.00 C ATOM 310 O ASP A 19 10.763 -3.203 0.224 1.00 0.00 O ATOM 311 CB ASP A 19 9.614 -2.242 -2.681 1.00 0.00 C ATOM 312 CG ASP A 19 9.133 -0.806 -2.888 1.00 0.00 C ATOM 313 OD1 ASP A 19 8.834 -0.122 -1.884 1.00 0.00 O ATOM 314 OD2 ASP A 19 8.993 -0.394 -4.063 1.00 0.00 O ATOM 0 H ASP A 19 11.710 -2.745 -3.907 1.00 0.00 H new ATOM 0 HA ASP A 19 11.163 -1.354 -1.474 1.00 0.00 H new ATOM 0 HB2 ASP A 19 9.673 -2.747 -3.645 1.00 0.00 H new ATOM 0 HB3 ASP A 19 8.884 -2.785 -2.081 1.00 0.00 H new ATOM 319 N ILE A 20 11.305 -4.649 -1.408 1.00 0.00 N ATOM 320 CA ILE A 20 11.413 -5.842 -0.571 1.00 0.00 C ATOM 321 C ILE A 20 12.624 -5.701 0.356 1.00 0.00 C ATOM 322 O ILE A 20 12.510 -5.879 1.570 1.00 0.00 O ATOM 323 CB ILE A 20 11.507 -7.064 -1.522 1.00 0.00 C ATOM 324 CG1 ILE A 20 10.102 -7.338 -2.085 1.00 0.00 C ATOM 325 CG2 ILE A 20 12.088 -8.318 -0.869 1.00 0.00 C ATOM 326 CD1 ILE A 20 10.060 -8.150 -3.385 1.00 0.00 C ATOM 0 H ILE A 20 11.480 -4.839 -2.395 1.00 0.00 H new ATOM 0 HA ILE A 20 10.546 -5.977 0.076 1.00 0.00 H new ATOM 0 HB ILE A 20 12.208 -6.815 -2.318 1.00 0.00 H new ATOM 0 HG12 ILE A 20 9.523 -7.866 -1.328 1.00 0.00 H new ATOM 0 HG13 ILE A 20 9.606 -6.383 -2.257 1.00 0.00 H new ATOM 0 HG21 ILE A 20 12.120 -9.127 -1.599 1.00 0.00 H new ATOM 0 HG22 ILE A 20 13.097 -8.109 -0.514 1.00 0.00 H new ATOM 0 HG23 ILE A 20 11.461 -8.614 -0.028 1.00 0.00 H new ATOM 0 HD11 ILE A 20 9.024 -8.286 -3.695 1.00 0.00 H new ATOM 0 HD12 ILE A 20 10.605 -7.618 -4.164 1.00 0.00 H new ATOM 0 HD13 ILE A 20 10.521 -9.124 -3.221 1.00 0.00 H new ATOM 338 N GLU A 21 13.764 -5.331 -0.219 1.00 0.00 N ATOM 339 CA GLU A 21 14.994 -5.051 0.471 1.00 0.00 C ATOM 340 C GLU A 21 14.807 -3.930 1.484 1.00 0.00 C ATOM 341 O GLU A 21 15.367 -3.998 2.580 1.00 0.00 O ATOM 342 CB GLU A 21 15.954 -4.658 -0.633 1.00 0.00 C ATOM 343 CG GLU A 21 17.214 -3.977 -0.170 1.00 0.00 C ATOM 344 CD GLU A 21 18.048 -4.736 0.882 1.00 0.00 C ATOM 345 OE1 GLU A 21 18.133 -5.984 0.830 1.00 0.00 O ATOM 346 OE2 GLU A 21 18.689 -4.071 1.731 1.00 0.00 O ATOM 0 H GLU A 21 13.847 -5.216 -1.229 1.00 0.00 H new ATOM 0 HA GLU A 21 15.360 -5.901 1.047 1.00 0.00 H new ATOM 0 HB2 GLU A 21 16.227 -5.553 -1.192 1.00 0.00 H new ATOM 0 HB3 GLU A 21 15.435 -3.996 -1.326 1.00 0.00 H new ATOM 0 HG2 GLU A 21 17.844 -3.793 -1.040 1.00 0.00 H new ATOM 0 HG3 GLU A 21 16.947 -3.004 0.241 1.00 0.00 H new ATOM 353 N ASP A 22 14.024 -2.905 1.139 1.00 0.00 N ATOM 354 CA ASP A 22 13.867 -1.758 2.013 1.00 0.00 C ATOM 355 C ASP A 22 13.153 -2.158 3.303 1.00 0.00 C ATOM 356 O ASP A 22 13.530 -1.761 4.409 1.00 0.00 O ATOM 357 CB ASP A 22 13.038 -0.661 1.351 1.00 0.00 C ATOM 358 CG ASP A 22 12.917 0.558 2.278 1.00 0.00 C ATOM 359 OD1 ASP A 22 13.928 1.272 2.476 1.00 0.00 O ATOM 360 OD2 ASP A 22 11.804 0.815 2.798 1.00 0.00 O ATOM 0 H ASP A 22 13.497 -2.853 0.267 1.00 0.00 H new ATOM 0 HA ASP A 22 14.870 -1.387 2.226 1.00 0.00 H new ATOM 0 HB2 ASP A 22 13.502 -0.365 0.410 1.00 0.00 H new ATOM 0 HB3 ASP A 22 12.045 -1.042 1.111 1.00 0.00 H new ATOM 365 N ARG A 23 12.135 -3.004 3.129 1.00 0.00 N ATOM 366 CA ARG A 23 11.396 -3.664 4.203 1.00 0.00 C ATOM 367 C ARG A 23 12.263 -4.685 4.949 1.00 0.00 C ATOM 368 O ARG A 23 11.847 -5.188 5.995 1.00 0.00 O ATOM 369 CB ARG A 23 10.131 -4.315 3.618 1.00 0.00 C ATOM 370 CG ARG A 23 9.101 -3.291 3.137 1.00 0.00 C ATOM 371 CD ARG A 23 8.114 -3.911 2.140 1.00 0.00 C ATOM 372 NE ARG A 23 7.077 -2.941 1.754 1.00 0.00 N ATOM 373 CZ ARG A 23 7.219 -1.902 0.924 1.00 0.00 C ATOM 374 NH1 ARG A 23 8.393 -1.627 0.368 1.00 0.00 N ATOM 375 NH2 ARG A 23 6.169 -1.137 0.659 1.00 0.00 N ATOM 0 H ARG A 23 11.792 -3.256 2.202 1.00 0.00 H new ATOM 0 HA ARG A 23 11.104 -2.916 4.940 1.00 0.00 H new ATOM 0 HB2 ARG A 23 10.412 -4.959 2.784 1.00 0.00 H new ATOM 0 HB3 ARG A 23 9.675 -4.954 4.374 1.00 0.00 H new ATOM 0 HG2 ARG A 23 8.554 -2.894 3.992 1.00 0.00 H new ATOM 0 HG3 ARG A 23 9.613 -2.451 2.668 1.00 0.00 H new ATOM 0 HD2 ARG A 23 8.651 -4.248 1.253 1.00 0.00 H new ATOM 0 HD3 ARG A 23 7.648 -4.791 2.584 1.00 0.00 H new ATOM 0 HE ARG A 23 6.152 -3.075 2.163 1.00 0.00 H new ATOM 0 HH11 ARG A 23 9.203 -2.212 0.572 1.00 0.00 H new ATOM 0 HH12 ARG A 23 8.484 -0.831 -0.263 1.00 0.00 H new ATOM 0 HH21 ARG A 23 5.266 -1.344 1.086 1.00 0.00 H new ATOM 0 HH22 ARG A 23 6.264 -0.341 0.028 1.00 0.00 H new ATOM 389 N GLY A 24 13.463 -4.990 4.450 1.00 0.00 N ATOM 390 CA GLY A 24 14.420 -5.879 5.084 1.00 0.00 C ATOM 391 C GLY A 24 14.136 -7.359 4.809 1.00 0.00 C ATOM 392 O GLY A 24 14.740 -8.227 5.443 1.00 0.00 O ATOM 0 H GLY A 24 13.799 -4.609 3.565 1.00 0.00 H new ATOM 0 HA2 GLY A 24 15.422 -5.636 4.732 1.00 0.00 H new ATOM 0 HA3 GLY A 24 14.410 -5.707 6.160 1.00 0.00 H new ATOM 396 N PHE A 25 13.230 -7.647 3.872 1.00 0.00 N ATOM 397 CA PHE A 25 13.062 -8.985 3.304 1.00 0.00 C ATOM 398 C PHE A 25 14.053 -9.130 2.131 1.00 0.00 C ATOM 399 O PHE A 25 14.867 -8.235 1.884 1.00 0.00 O ATOM 400 CB PHE A 25 11.588 -9.197 2.901 1.00 0.00 C ATOM 401 CG PHE A 25 10.592 -9.042 4.042 1.00 0.00 C ATOM 402 CD1 PHE A 25 10.201 -7.751 4.444 1.00 0.00 C ATOM 403 CD2 PHE A 25 10.057 -10.156 4.721 1.00 0.00 C ATOM 404 CE1 PHE A 25 9.360 -7.561 5.552 1.00 0.00 C ATOM 405 CE2 PHE A 25 9.221 -9.963 5.833 1.00 0.00 C ATOM 406 CZ PHE A 25 8.877 -8.670 6.260 1.00 0.00 C ATOM 0 H PHE A 25 12.589 -6.954 3.484 1.00 0.00 H new ATOM 0 HA PHE A 25 13.289 -9.767 4.029 1.00 0.00 H new ATOM 0 HB2 PHE A 25 11.334 -8.486 2.115 1.00 0.00 H new ATOM 0 HB3 PHE A 25 11.481 -10.195 2.475 1.00 0.00 H new ATOM 0 HD1 PHE A 25 10.554 -6.893 3.891 1.00 0.00 H new ATOM 0 HD2 PHE A 25 10.290 -11.156 4.386 1.00 0.00 H new ATOM 0 HE1 PHE A 25 9.086 -6.562 5.858 1.00 0.00 H new ATOM 0 HE2 PHE A 25 8.838 -10.820 6.367 1.00 0.00 H new ATOM 0 HZ PHE A 25 8.246 -8.532 7.126 1.00 0.00 H new ATOM 416 N ASP A 26 14.001 -10.240 1.389 1.00 0.00 N ATOM 417 CA ASP A 26 14.789 -10.411 0.165 1.00 0.00 C ATOM 418 C ASP A 26 13.932 -11.140 -0.858 1.00 0.00 C ATOM 419 O ASP A 26 13.018 -11.874 -0.485 1.00 0.00 O ATOM 420 CB ASP A 26 16.088 -11.192 0.409 1.00 0.00 C ATOM 421 CG ASP A 26 17.218 -10.724 -0.532 1.00 0.00 C ATOM 422 OD1 ASP A 26 16.950 -10.477 -1.734 1.00 0.00 O ATOM 423 OD2 ASP A 26 18.381 -10.631 -0.072 1.00 0.00 O ATOM 0 H ASP A 26 13.414 -11.042 1.618 1.00 0.00 H new ATOM 0 HA ASP A 26 15.078 -9.425 -0.199 1.00 0.00 H new ATOM 0 HB2 ASP A 26 16.401 -11.064 1.445 1.00 0.00 H new ATOM 0 HB3 ASP A 26 15.907 -12.256 0.259 1.00 0.00 H new ATOM 428 N ARG A 27 14.201 -10.940 -2.144 1.00 0.00 N ATOM 429 CA ARG A 27 13.311 -11.366 -3.224 1.00 0.00 C ATOM 430 C ARG A 27 13.157 -12.880 -3.315 1.00 0.00 C ATOM 431 O ARG A 27 12.110 -13.342 -3.756 1.00 0.00 O ATOM 432 CB ARG A 27 13.786 -10.741 -4.550 1.00 0.00 C ATOM 433 CG ARG A 27 15.107 -11.343 -5.066 1.00 0.00 C ATOM 434 CD ARG A 27 15.764 -10.448 -6.123 1.00 0.00 C ATOM 435 NE ARG A 27 17.013 -11.036 -6.643 1.00 0.00 N ATOM 436 CZ ARG A 27 18.222 -11.035 -6.059 1.00 0.00 C ATOM 437 NH1 ARG A 27 18.402 -10.537 -4.835 1.00 0.00 N ATOM 438 NH2 ARG A 27 19.262 -11.542 -6.716 1.00 0.00 N ATOM 0 H ARG A 27 15.048 -10.475 -2.471 1.00 0.00 H new ATOM 0 HA ARG A 27 12.308 -11.002 -3.000 1.00 0.00 H new ATOM 0 HB2 ARG A 27 13.013 -10.877 -5.306 1.00 0.00 H new ATOM 0 HB3 ARG A 27 13.913 -9.667 -4.413 1.00 0.00 H new ATOM 0 HG2 ARG A 27 15.793 -11.484 -4.231 1.00 0.00 H new ATOM 0 HG3 ARG A 27 14.916 -12.328 -5.491 1.00 0.00 H new ATOM 0 HD2 ARG A 27 15.068 -10.288 -6.946 1.00 0.00 H new ATOM 0 HD3 ARG A 27 15.976 -9.470 -5.690 1.00 0.00 H new ATOM 0 HE ARG A 27 16.951 -11.496 -7.551 1.00 0.00 H new ATOM 0 HH11 ARG A 27 17.612 -10.146 -4.322 1.00 0.00 H new ATOM 0 HH12 ARG A 27 19.330 -10.547 -4.412 1.00 0.00 H new ATOM 0 HH21 ARG A 27 19.136 -11.926 -7.653 1.00 0.00 H new ATOM 0 HH22 ARG A 27 20.186 -11.547 -6.283 1.00 0.00 H new ATOM 452 N GLU A 28 14.167 -13.645 -2.901 1.00 0.00 N ATOM 453 CA GLU A 28 14.041 -15.092 -2.758 1.00 0.00 C ATOM 454 C GLU A 28 13.501 -15.402 -1.363 1.00 0.00 C ATOM 455 O GLU A 28 12.583 -16.202 -1.226 1.00 0.00 O ATOM 456 CB GLU A 28 15.400 -15.767 -2.981 1.00 0.00 C ATOM 457 CG GLU A 28 15.918 -15.578 -4.410 1.00 0.00 C ATOM 458 CD GLU A 28 17.195 -16.400 -4.665 1.00 0.00 C ATOM 459 OE1 GLU A 28 18.309 -15.922 -4.335 1.00 0.00 O ATOM 460 OE2 GLU A 28 17.097 -17.525 -5.215 1.00 0.00 O ATOM 0 H GLU A 28 15.088 -13.281 -2.657 1.00 0.00 H new ATOM 0 HA GLU A 28 13.350 -15.481 -3.506 1.00 0.00 H new ATOM 0 HB2 GLU A 28 16.125 -15.358 -2.277 1.00 0.00 H new ATOM 0 HB3 GLU A 28 15.313 -16.832 -2.767 1.00 0.00 H new ATOM 0 HG2 GLU A 28 15.146 -15.875 -5.120 1.00 0.00 H new ATOM 0 HG3 GLU A 28 16.123 -14.522 -4.586 1.00 0.00 H new ATOM 467 N GLU A 29 14.034 -14.745 -0.329 1.00 0.00 N ATOM 468 CA GLU A 29 13.754 -15.050 1.074 1.00 0.00 C ATOM 469 C GLU A 29 12.275 -14.974 1.413 1.00 0.00 C ATOM 470 O GLU A 29 11.797 -15.787 2.204 1.00 0.00 O ATOM 471 CB GLU A 29 14.525 -14.069 1.957 1.00 0.00 C ATOM 472 CG GLU A 29 16.029 -14.341 1.948 1.00 0.00 C ATOM 473 CD GLU A 29 16.404 -15.642 2.689 1.00 0.00 C ATOM 474 OE1 GLU A 29 16.123 -15.765 3.906 1.00 0.00 O ATOM 475 OE2 GLU A 29 16.967 -16.561 2.048 1.00 0.00 O ATOM 0 H GLU A 29 14.686 -13.970 -0.448 1.00 0.00 H new ATOM 0 HA GLU A 29 14.071 -16.077 1.255 1.00 0.00 H new ATOM 0 HB2 GLU A 29 14.340 -13.051 1.613 1.00 0.00 H new ATOM 0 HB3 GLU A 29 14.152 -14.133 2.979 1.00 0.00 H new ATOM 0 HG2 GLU A 29 16.377 -14.402 0.917 1.00 0.00 H new ATOM 0 HG3 GLU A 29 16.549 -13.502 2.410 1.00 0.00 H new ATOM 482 N ILE A 30 11.570 -14.031 0.791 1.00 0.00 N ATOM 483 CA ILE A 30 10.109 -13.938 0.795 1.00 0.00 C ATOM 484 C ILE A 30 9.509 -15.341 0.610 1.00 0.00 C ATOM 485 O ILE A 30 8.744 -15.799 1.451 1.00 0.00 O ATOM 486 CB ILE A 30 9.635 -12.949 -0.298 1.00 0.00 C ATOM 487 CG1 ILE A 30 9.957 -11.492 0.093 1.00 0.00 C ATOM 488 CG2 ILE A 30 8.148 -13.090 -0.687 1.00 0.00 C ATOM 489 CD1 ILE A 30 8.888 -10.733 0.902 1.00 0.00 C ATOM 0 H ILE A 30 12.013 -13.286 0.253 1.00 0.00 H new ATOM 0 HA ILE A 30 9.761 -13.548 1.752 1.00 0.00 H new ATOM 0 HB ILE A 30 10.200 -13.219 -1.190 1.00 0.00 H new ATOM 0 HG12 ILE A 30 10.882 -11.492 0.670 1.00 0.00 H new ATOM 0 HG13 ILE A 30 10.152 -10.931 -0.821 1.00 0.00 H new ATOM 0 HG21 ILE A 30 7.903 -12.359 -1.458 1.00 0.00 H new ATOM 0 HG22 ILE A 30 7.965 -14.095 -1.068 1.00 0.00 H new ATOM 0 HG23 ILE A 30 7.524 -12.916 0.190 1.00 0.00 H new ATOM 0 HD11 ILE A 30 9.239 -9.722 1.111 1.00 0.00 H new ATOM 0 HD12 ILE A 30 7.963 -10.684 0.327 1.00 0.00 H new ATOM 0 HD13 ILE A 30 8.704 -11.254 1.841 1.00 0.00 H new ATOM 501 N TRP A 31 9.880 -16.040 -0.459 1.00 0.00 N ATOM 502 CA TRP A 31 9.295 -17.323 -0.849 1.00 0.00 C ATOM 503 C TRP A 31 9.781 -18.506 -0.008 1.00 0.00 C ATOM 504 O TRP A 31 9.168 -19.575 -0.068 1.00 0.00 O ATOM 505 CB TRP A 31 9.590 -17.574 -2.331 1.00 0.00 C ATOM 506 CG TRP A 31 9.206 -16.433 -3.217 1.00 0.00 C ATOM 507 CD1 TRP A 31 10.076 -15.676 -3.916 1.00 0.00 C ATOM 508 CD2 TRP A 31 7.892 -15.821 -3.422 1.00 0.00 C ATOM 509 NE1 TRP A 31 9.414 -14.609 -4.485 1.00 0.00 N ATOM 510 CE2 TRP A 31 8.071 -14.618 -4.168 1.00 0.00 C ATOM 511 CE3 TRP A 31 6.571 -16.138 -3.027 1.00 0.00 C ATOM 512 CZ2 TRP A 31 7.010 -13.744 -4.441 1.00 0.00 C ATOM 513 CZ3 TRP A 31 5.487 -15.301 -3.365 1.00 0.00 C ATOM 514 CH2 TRP A 31 5.702 -14.096 -4.056 1.00 0.00 C ATOM 0 H TRP A 31 10.613 -15.724 -1.094 1.00 0.00 H new ATOM 0 HA TRP A 31 8.222 -17.253 -0.670 1.00 0.00 H new ATOM 0 HB2 TRP A 31 10.654 -17.776 -2.452 1.00 0.00 H new ATOM 0 HB3 TRP A 31 9.057 -18.469 -2.653 1.00 0.00 H new ATOM 0 HD1 TRP A 31 11.133 -15.876 -4.015 1.00 0.00 H new ATOM 0 HE1 TRP A 31 9.861 -13.901 -5.068 1.00 0.00 H new ATOM 0 HE3 TRP A 31 6.389 -17.037 -2.457 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 7.194 -12.806 -4.944 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 4.483 -15.589 -3.090 1.00 0.00 H new ATOM 0 HH2 TRP A 31 4.872 -13.446 -4.290 1.00 0.00 H new ATOM 525 N TYR A 32 10.859 -18.339 0.768 1.00 0.00 N ATOM 526 CA TYR A 32 11.575 -19.437 1.417 1.00 0.00 C ATOM 527 C TYR A 32 11.589 -19.307 2.946 1.00 0.00 C ATOM 528 O TYR A 32 12.202 -20.124 3.634 1.00 0.00 O ATOM 529 CB TYR A 32 12.977 -19.569 0.790 1.00 0.00 C ATOM 530 CG TYR A 32 12.957 -19.827 -0.708 1.00 0.00 C ATOM 531 CD1 TYR A 32 12.233 -20.920 -1.222 1.00 0.00 C ATOM 532 CD2 TYR A 32 13.631 -18.966 -1.593 1.00 0.00 C ATOM 533 CE1 TYR A 32 12.146 -21.133 -2.607 1.00 0.00 C ATOM 534 CE2 TYR A 32 13.520 -19.147 -2.982 1.00 0.00 C ATOM 535 CZ TYR A 32 12.777 -20.234 -3.499 1.00 0.00 C ATOM 536 OH TYR A 32 12.684 -20.406 -4.852 1.00 0.00 O ATOM 0 H TYR A 32 11.262 -17.423 0.964 1.00 0.00 H new ATOM 0 HA TYR A 32 11.041 -20.370 1.235 1.00 0.00 H new ATOM 0 HB2 TYR A 32 13.539 -18.656 0.985 1.00 0.00 H new ATOM 0 HB3 TYR A 32 13.510 -20.382 1.282 1.00 0.00 H new ATOM 0 HD1 TYR A 32 11.740 -21.601 -0.544 1.00 0.00 H new ATOM 0 HD2 TYR A 32 14.237 -18.162 -1.203 1.00 0.00 H new ATOM 0 HE1 TYR A 32 11.599 -21.981 -2.991 1.00 0.00 H new ATOM 0 HE2 TYR A 32 14.003 -18.455 -3.656 1.00 0.00 H new ATOM 0 HH TYR A 32 13.179 -19.693 -5.307 1.00 0.00 H new ATOM 546 N ASN A 33 10.861 -18.327 3.491 1.00 0.00 N ATOM 547 CA ASN A 33 10.577 -18.144 4.903 1.00 0.00 C ATOM 548 C ASN A 33 9.064 -17.976 4.983 1.00 0.00 C ATOM 549 O ASN A 33 8.568 -16.858 4.864 1.00 0.00 O ATOM 550 CB ASN A 33 11.295 -16.895 5.420 1.00 0.00 C ATOM 551 CG ASN A 33 12.806 -17.027 5.462 1.00 0.00 C ATOM 552 OD1 ASN A 33 13.394 -17.488 6.438 1.00 0.00 O ATOM 553 ND2 ASN A 33 13.452 -16.581 4.404 1.00 0.00 N ATOM 0 H ASN A 33 10.432 -17.601 2.917 1.00 0.00 H new ATOM 0 HA ASN A 33 10.920 -18.981 5.512 1.00 0.00 H new ATOM 0 HB2 ASN A 33 11.032 -16.048 4.786 1.00 0.00 H new ATOM 0 HB3 ASN A 33 10.932 -16.668 6.422 1.00 0.00 H new ATOM 0 HD21 ASN A 33 14.471 -16.612 4.378 1.00 0.00 H new ATOM 0 HD22 ASN A 33 12.933 -16.205 3.611 1.00 0.00 H new ATOM 560 N ARG A 34 8.318 -19.086 5.065 1.00 0.00 N ATOM 561 CA ARG A 34 6.871 -19.126 4.808 1.00 0.00 C ATOM 562 C ARG A 34 6.058 -18.099 5.596 1.00 0.00 C ATOM 563 O ARG A 34 5.052 -17.582 5.110 1.00 0.00 O ATOM 564 CB ARG A 34 6.347 -20.545 5.023 1.00 0.00 C ATOM 565 CG ARG A 34 6.221 -21.006 6.482 1.00 0.00 C ATOM 566 CD ARG A 34 5.783 -22.471 6.463 1.00 0.00 C ATOM 567 NE ARG A 34 5.572 -23.005 7.822 1.00 0.00 N ATOM 568 CZ ARG A 34 4.433 -22.981 8.532 1.00 0.00 C ATOM 569 NH1 ARG A 34 3.328 -22.424 8.040 1.00 0.00 N ATOM 570 NH2 ARG A 34 4.405 -23.519 9.750 1.00 0.00 N ATOM 0 H ARG A 34 8.708 -19.995 5.315 1.00 0.00 H new ATOM 0 HA ARG A 34 6.734 -18.838 3.766 1.00 0.00 H new ATOM 0 HB2 ARG A 34 5.367 -20.623 4.553 1.00 0.00 H new ATOM 0 HB3 ARG A 34 7.007 -21.237 4.501 1.00 0.00 H new ATOM 0 HG2 ARG A 34 7.172 -20.897 7.002 1.00 0.00 H new ATOM 0 HG3 ARG A 34 5.493 -20.395 7.016 1.00 0.00 H new ATOM 0 HD2 ARG A 34 4.861 -22.566 5.890 1.00 0.00 H new ATOM 0 HD3 ARG A 34 6.539 -23.068 5.953 1.00 0.00 H new ATOM 0 HE ARG A 34 6.379 -23.439 8.270 1.00 0.00 H new ATOM 0 HH11 ARG A 34 3.338 -22.006 7.109 1.00 0.00 H new ATOM 0 HH12 ARG A 34 2.471 -22.415 8.594 1.00 0.00 H new ATOM 0 HH21 ARG A 34 5.246 -23.946 10.138 1.00 0.00 H new ATOM 0 HH22 ARG A 34 3.543 -23.504 10.294 1.00 0.00 H new ATOM 584 N GLU A 35 6.480 -17.824 6.824 1.00 0.00 N ATOM 585 CA GLU A 35 5.820 -16.863 7.694 1.00 0.00 C ATOM 586 C GLU A 35 6.209 -15.422 7.344 1.00 0.00 C ATOM 587 O GLU A 35 5.386 -14.512 7.460 1.00 0.00 O ATOM 588 CB GLU A 35 6.077 -17.192 9.176 1.00 0.00 C ATOM 589 CG GLU A 35 7.526 -17.082 9.688 1.00 0.00 C ATOM 590 CD GLU A 35 8.415 -18.266 9.258 1.00 0.00 C ATOM 591 OE1 GLU A 35 8.951 -18.240 8.125 1.00 0.00 O ATOM 592 OE2 GLU A 35 8.579 -19.224 10.053 1.00 0.00 O ATOM 0 H GLU A 35 7.297 -18.266 7.246 1.00 0.00 H new ATOM 0 HA GLU A 35 4.746 -16.944 7.527 1.00 0.00 H new ATOM 0 HB2 GLU A 35 5.456 -16.531 9.780 1.00 0.00 H new ATOM 0 HB3 GLU A 35 5.732 -18.209 9.359 1.00 0.00 H new ATOM 0 HG2 GLU A 35 7.965 -16.155 9.320 1.00 0.00 H new ATOM 0 HG3 GLU A 35 7.516 -17.020 10.776 1.00 0.00 H new ATOM 599 N ARG A 36 7.435 -15.204 6.863 1.00 0.00 N ATOM 600 CA ARG A 36 7.898 -13.894 6.440 1.00 0.00 C ATOM 601 C ARG A 36 7.390 -13.555 5.044 1.00 0.00 C ATOM 602 O ARG A 36 7.403 -12.380 4.683 1.00 0.00 O ATOM 603 CB ARG A 36 9.421 -13.827 6.500 1.00 0.00 C ATOM 604 CG ARG A 36 10.017 -13.953 7.916 1.00 0.00 C ATOM 605 CD ARG A 36 9.255 -13.169 9.000 1.00 0.00 C ATOM 606 NE ARG A 36 9.920 -13.246 10.313 1.00 0.00 N ATOM 607 CZ ARG A 36 9.384 -12.854 11.478 1.00 0.00 C ATOM 608 NH1 ARG A 36 8.155 -12.340 11.538 1.00 0.00 N ATOM 609 NH2 ARG A 36 10.089 -12.985 12.601 1.00 0.00 N ATOM 0 H ARG A 36 8.133 -15.940 6.758 1.00 0.00 H new ATOM 0 HA ARG A 36 7.493 -13.150 7.126 1.00 0.00 H new ATOM 0 HB2 ARG A 36 9.831 -14.622 5.876 1.00 0.00 H new ATOM 0 HB3 ARG A 36 9.747 -12.881 6.066 1.00 0.00 H new ATOM 0 HG2 ARG A 36 10.039 -15.006 8.195 1.00 0.00 H new ATOM 0 HG3 ARG A 36 11.050 -13.607 7.894 1.00 0.00 H new ATOM 0 HD2 ARG A 36 9.169 -12.125 8.699 1.00 0.00 H new ATOM 0 HD3 ARG A 36 8.241 -13.561 9.084 1.00 0.00 H new ATOM 0 HE ARG A 36 10.865 -13.629 10.338 1.00 0.00 H new ATOM 0 HH11 ARG A 36 7.603 -12.238 10.687 1.00 0.00 H new ATOM 0 HH12 ARG A 36 7.767 -12.048 12.435 1.00 0.00 H new ATOM 0 HH21 ARG A 36 11.029 -13.381 12.570 1.00 0.00 H new ATOM 0 HH22 ARG A 36 9.689 -12.689 13.492 1.00 0.00 H new ATOM 623 N SER A 37 6.914 -14.529 4.269 1.00 0.00 N ATOM 624 CA SER A 37 6.185 -14.209 3.052 1.00 0.00 C ATOM 625 C SER A 37 4.941 -13.410 3.440 1.00 0.00 C ATOM 626 O SER A 37 4.721 -12.333 2.896 1.00 0.00 O ATOM 627 CB SER A 37 5.789 -15.452 2.234 1.00 0.00 C ATOM 628 OG SER A 37 6.542 -16.601 2.566 1.00 0.00 O ATOM 0 H SER A 37 7.019 -15.525 4.460 1.00 0.00 H new ATOM 0 HA SER A 37 6.842 -13.627 2.406 1.00 0.00 H new ATOM 0 HB2 SER A 37 4.731 -15.661 2.392 1.00 0.00 H new ATOM 0 HB3 SER A 37 5.916 -15.236 1.173 1.00 0.00 H new ATOM 0 HG SER A 37 7.486 -16.447 2.350 1.00 0.00 H new ATOM 634 N GLU A 38 4.157 -13.910 4.403 1.00 0.00 N ATOM 635 CA GLU A 38 2.823 -13.431 4.742 1.00 0.00 C ATOM 636 C GLU A 38 2.794 -11.928 5.049 1.00 0.00 C ATOM 637 O GLU A 38 1.812 -11.258 4.734 1.00 0.00 O ATOM 638 CB GLU A 38 2.295 -14.270 5.917 1.00 0.00 C ATOM 639 CG GLU A 38 0.778 -14.429 5.820 1.00 0.00 C ATOM 640 CD GLU A 38 0.207 -15.222 7.012 1.00 0.00 C ATOM 641 OE1 GLU A 38 0.252 -16.478 6.988 1.00 0.00 O ATOM 642 OE2 GLU A 38 -0.308 -14.599 7.973 1.00 0.00 O ATOM 0 H GLU A 38 4.453 -14.692 4.988 1.00 0.00 H new ATOM 0 HA GLU A 38 2.170 -13.555 3.878 1.00 0.00 H new ATOM 0 HB2 GLU A 38 2.771 -15.251 5.914 1.00 0.00 H new ATOM 0 HB3 GLU A 38 2.557 -13.791 6.861 1.00 0.00 H new ATOM 0 HG2 GLU A 38 0.311 -13.445 5.782 1.00 0.00 H new ATOM 0 HG3 GLU A 38 0.525 -14.938 4.890 1.00 0.00 H new ATOM 649 N GLU A 39 3.875 -11.383 5.608 1.00 0.00 N ATOM 650 CA GLU A 39 3.994 -9.989 6.012 1.00 0.00 C ATOM 651 C GLU A 39 3.788 -9.045 4.819 1.00 0.00 C ATOM 652 O GLU A 39 3.192 -7.973 4.960 1.00 0.00 O ATOM 653 CB GLU A 39 5.393 -9.742 6.609 1.00 0.00 C ATOM 654 CG GLU A 39 6.038 -10.872 7.421 1.00 0.00 C ATOM 655 CD GLU A 39 5.436 -11.170 8.809 1.00 0.00 C ATOM 656 OE1 GLU A 39 4.244 -10.878 9.069 1.00 0.00 O ATOM 657 OE2 GLU A 39 6.197 -11.689 9.665 1.00 0.00 O ATOM 0 H GLU A 39 4.720 -11.923 5.797 1.00 0.00 H new ATOM 0 HA GLU A 39 3.223 -9.786 6.755 1.00 0.00 H new ATOM 0 HB2 GLU A 39 6.067 -9.493 5.789 1.00 0.00 H new ATOM 0 HB3 GLU A 39 5.332 -8.863 7.250 1.00 0.00 H new ATOM 0 HG2 GLU A 39 5.990 -11.785 6.828 1.00 0.00 H new ATOM 0 HG3 GLU A 39 7.093 -10.634 7.554 1.00 0.00 H new ATOM 664 N LEU A 40 4.269 -9.464 3.643 1.00 0.00 N ATOM 665 CA LEU A 40 4.072 -8.766 2.379 1.00 0.00 C ATOM 666 C LEU A 40 2.571 -8.619 2.129 1.00 0.00 C ATOM 667 O LEU A 40 2.048 -7.512 1.995 1.00 0.00 O ATOM 668 CB LEU A 40 4.780 -9.547 1.254 1.00 0.00 C ATOM 669 CG LEU A 40 4.702 -9.032 -0.202 1.00 0.00 C ATOM 670 CD1 LEU A 40 4.063 -10.082 -1.115 1.00 0.00 C ATOM 671 CD2 LEU A 40 4.008 -7.682 -0.412 1.00 0.00 C ATOM 0 H LEU A 40 4.818 -10.318 3.548 1.00 0.00 H new ATOM 0 HA LEU A 40 4.507 -7.767 2.408 1.00 0.00 H new ATOM 0 HB2 LEU A 40 5.835 -9.615 1.519 1.00 0.00 H new ATOM 0 HB3 LEU A 40 4.383 -10.562 1.262 1.00 0.00 H new ATOM 0 HG LEU A 40 5.745 -8.857 -0.467 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.018 -9.699 -2.134 1.00 0.00 H new ATOM 0 HD12 LEU A 40 4.661 -10.993 -1.096 1.00 0.00 H new ATOM 0 HD13 LEU A 40 3.054 -10.303 -0.766 1.00 0.00 H new ATOM 0 HD21 LEU A 40 4.017 -7.429 -1.472 1.00 0.00 H new ATOM 0 HD22 LEU A 40 2.977 -7.744 -0.062 1.00 0.00 H new ATOM 0 HD23 LEU A 40 4.535 -6.911 0.149 1.00 0.00 H new ATOM 683 N PHE A 41 1.879 -9.755 2.094 1.00 0.00 N ATOM 684 CA PHE A 41 0.473 -9.842 1.746 1.00 0.00 C ATOM 685 C PHE A 41 -0.377 -9.077 2.761 1.00 0.00 C ATOM 686 O PHE A 41 -1.371 -8.453 2.393 1.00 0.00 O ATOM 687 CB PHE A 41 0.062 -11.310 1.634 1.00 0.00 C ATOM 688 CG PHE A 41 0.952 -12.075 0.676 1.00 0.00 C ATOM 689 CD1 PHE A 41 0.647 -12.152 -0.696 1.00 0.00 C ATOM 690 CD2 PHE A 41 2.167 -12.594 1.147 1.00 0.00 C ATOM 691 CE1 PHE A 41 1.555 -12.772 -1.576 1.00 0.00 C ATOM 692 CE2 PHE A 41 3.071 -13.208 0.268 1.00 0.00 C ATOM 693 CZ PHE A 41 2.760 -13.309 -1.096 1.00 0.00 C ATOM 0 H PHE A 41 2.296 -10.660 2.313 1.00 0.00 H new ATOM 0 HA PHE A 41 0.305 -9.375 0.776 1.00 0.00 H new ATOM 0 HB2 PHE A 41 0.105 -11.775 2.619 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -0.973 -11.372 1.297 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -0.277 -11.738 -1.071 1.00 0.00 H new ATOM 0 HD2 PHE A 41 2.409 -12.520 2.197 1.00 0.00 H new ATOM 0 HE1 PHE A 41 1.322 -12.835 -2.629 1.00 0.00 H new ATOM 0 HE2 PHE A 41 4.005 -13.602 0.641 1.00 0.00 H new ATOM 0 HZ PHE A 41 3.444 -13.798 -1.774 1.00 0.00 H new ATOM 703 N TRP A 42 0.032 -9.074 4.030 1.00 0.00 N ATOM 704 CA TRP A 42 -0.618 -8.279 5.054 1.00 0.00 C ATOM 705 C TRP A 42 -0.523 -6.777 4.778 1.00 0.00 C ATOM 706 O TRP A 42 -1.490 -6.069 5.048 1.00 0.00 O ATOM 707 CB TRP A 42 -0.063 -8.658 6.432 1.00 0.00 C ATOM 708 CG TRP A 42 -0.760 -9.839 7.032 1.00 0.00 C ATOM 709 CD1 TRP A 42 -0.226 -11.064 7.222 1.00 0.00 C ATOM 710 CD2 TRP A 42 -2.156 -9.949 7.452 1.00 0.00 C ATOM 711 NE1 TRP A 42 -1.180 -11.916 7.736 1.00 0.00 N ATOM 712 CE2 TRP A 42 -2.399 -11.289 7.882 1.00 0.00 C ATOM 713 CE3 TRP A 42 -3.252 -9.057 7.474 1.00 0.00 C ATOM 714 CZ2 TRP A 42 -3.666 -11.719 8.315 1.00 0.00 C ATOM 715 CZ3 TRP A 42 -4.527 -9.481 7.897 1.00 0.00 C ATOM 716 CH2 TRP A 42 -4.738 -10.807 8.318 1.00 0.00 C ATOM 0 H TRP A 42 0.822 -9.623 4.369 1.00 0.00 H new ATOM 0 HA TRP A 42 -1.684 -8.507 5.039 1.00 0.00 H new ATOM 0 HB2 TRP A 42 1.001 -8.876 6.343 1.00 0.00 H new ATOM 0 HB3 TRP A 42 -0.158 -7.805 7.104 1.00 0.00 H new ATOM 0 HD1 TRP A 42 0.796 -11.336 7.004 1.00 0.00 H new ATOM 0 HE1 TRP A 42 -1.005 -12.891 7.979 1.00 0.00 H new ATOM 0 HE3 TRP A 42 -3.110 -8.033 7.161 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 -3.815 -12.738 8.642 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 -5.350 -8.782 7.898 1.00 0.00 H new ATOM 0 HH2 TRP A 42 -5.718 -11.124 8.642 1.00 0.00 H new ATOM 727 N GLU A 43 0.578 -6.267 4.219 1.00 0.00 N ATOM 728 CA GLU A 43 0.717 -4.847 3.918 1.00 0.00 C ATOM 729 C GLU A 43 -0.207 -4.450 2.762 1.00 0.00 C ATOM 730 O GLU A 43 -0.879 -3.418 2.820 1.00 0.00 O ATOM 731 CB GLU A 43 2.181 -4.539 3.564 1.00 0.00 C ATOM 732 CG GLU A 43 2.429 -3.029 3.497 1.00 0.00 C ATOM 733 CD GLU A 43 3.799 -2.698 2.888 1.00 0.00 C ATOM 734 OE1 GLU A 43 4.844 -3.091 3.458 1.00 0.00 O ATOM 735 OE2 GLU A 43 3.852 -2.033 1.826 1.00 0.00 O ATOM 0 H GLU A 43 1.392 -6.827 3.965 1.00 0.00 H new ATOM 0 HA GLU A 43 0.431 -4.267 4.795 1.00 0.00 H new ATOM 0 HB2 GLU A 43 2.840 -4.986 4.309 1.00 0.00 H new ATOM 0 HB3 GLU A 43 2.429 -4.994 2.605 1.00 0.00 H new ATOM 0 HG2 GLU A 43 1.645 -2.559 2.903 1.00 0.00 H new ATOM 0 HG3 GLU A 43 2.366 -2.606 4.500 1.00 0.00 H new ATOM 742 N VAL A 44 -0.274 -5.259 1.703 1.00 0.00 N ATOM 743 CA VAL A 44 -1.104 -4.933 0.560 1.00 0.00 C ATOM 744 C VAL A 44 -2.587 -5.067 0.889 1.00 0.00 C ATOM 745 O VAL A 44 -3.395 -4.254 0.445 1.00 0.00 O ATOM 746 CB VAL A 44 -0.721 -5.798 -0.633 1.00 0.00 C ATOM 747 CG1 VAL A 44 0.656 -5.377 -1.151 1.00 0.00 C ATOM 748 CG2 VAL A 44 -0.650 -7.287 -0.346 1.00 0.00 C ATOM 0 H VAL A 44 0.236 -6.138 1.620 1.00 0.00 H new ATOM 0 HA VAL A 44 -0.928 -3.890 0.299 1.00 0.00 H new ATOM 0 HB VAL A 44 -1.518 -5.640 -1.360 1.00 0.00 H new ATOM 0 HG11 VAL A 44 0.929 -5.997 -2.005 1.00 0.00 H new ATOM 0 HG12 VAL A 44 0.626 -4.331 -1.457 1.00 0.00 H new ATOM 0 HG13 VAL A 44 1.396 -5.502 -0.361 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -0.370 -7.820 -1.255 1.00 0.00 H new ATOM 0 HG22 VAL A 44 0.095 -7.473 0.428 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -1.624 -7.639 -0.004 1.00 0.00 H new ATOM 758 N MET A 45 -2.958 -6.068 1.676 1.00 0.00 N ATOM 759 CA MET A 45 -4.290 -6.168 2.218 1.00 0.00 C ATOM 760 C MET A 45 -4.576 -4.971 3.138 1.00 0.00 C ATOM 761 O MET A 45 -5.670 -4.421 3.062 1.00 0.00 O ATOM 762 CB MET A 45 -4.449 -7.524 2.905 1.00 0.00 C ATOM 763 CG MET A 45 -5.785 -7.663 3.627 1.00 0.00 C ATOM 764 SD MET A 45 -7.301 -7.234 2.710 1.00 0.00 S ATOM 765 CE MET A 45 -7.093 -8.116 1.135 1.00 0.00 C ATOM 0 H MET A 45 -2.338 -6.829 1.952 1.00 0.00 H new ATOM 0 HA MET A 45 -5.037 -6.122 1.426 1.00 0.00 H new ATOM 0 HB2 MET A 45 -4.358 -8.316 2.162 1.00 0.00 H new ATOM 0 HB3 MET A 45 -3.638 -7.662 3.620 1.00 0.00 H new ATOM 0 HG2 MET A 45 -5.878 -8.696 3.962 1.00 0.00 H new ATOM 0 HG3 MET A 45 -5.748 -7.041 4.521 1.00 0.00 H new ATOM 0 HE1 MET A 45 -8.061 -8.481 0.792 1.00 0.00 H new ATOM 0 HE2 MET A 45 -6.676 -7.438 0.391 1.00 0.00 H new ATOM 0 HE3 MET A 45 -6.417 -8.959 1.277 1.00 0.00 H new ATOM 775 N ASP A 46 -3.624 -4.509 3.955 1.00 0.00 N ATOM 776 CA ASP A 46 -3.810 -3.315 4.778 1.00 0.00 C ATOM 777 C ASP A 46 -4.147 -2.090 3.924 1.00 0.00 C ATOM 778 O ASP A 46 -5.029 -1.307 4.289 1.00 0.00 O ATOM 779 CB ASP A 46 -2.593 -3.025 5.648 1.00 0.00 C ATOM 780 CG ASP A 46 -2.827 -1.746 6.466 1.00 0.00 C ATOM 781 OD1 ASP A 46 -3.615 -1.787 7.442 1.00 0.00 O ATOM 782 OD2 ASP A 46 -2.210 -0.699 6.155 1.00 0.00 O ATOM 0 H ASP A 46 -2.710 -4.950 4.062 1.00 0.00 H new ATOM 0 HA ASP A 46 -4.654 -3.523 5.436 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -2.405 -3.865 6.316 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -1.707 -2.910 5.023 1.00 0.00 H new ATOM 787 N GLU A 47 -3.513 -1.968 2.755 1.00 0.00 N ATOM 788 CA GLU A 47 -3.786 -0.958 1.743 1.00 0.00 C ATOM 789 C GLU A 47 -5.241 -0.986 1.219 1.00 0.00 C ATOM 790 O GLU A 47 -5.653 -0.063 0.511 1.00 0.00 O ATOM 791 CB GLU A 47 -2.787 -1.159 0.584 1.00 0.00 C ATOM 792 CG GLU A 47 -1.686 -0.108 0.479 1.00 0.00 C ATOM 793 CD GLU A 47 -2.233 1.312 0.225 1.00 0.00 C ATOM 794 OE1 GLU A 47 -2.486 1.674 -0.949 1.00 0.00 O ATOM 795 OE2 GLU A 47 -2.392 2.086 1.201 1.00 0.00 O ATOM 0 H GLU A 47 -2.762 -2.602 2.481 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.663 0.023 2.202 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -2.322 -2.138 0.694 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -3.343 -1.173 -0.354 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -1.102 -0.108 1.399 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -1.007 -0.380 -0.329 1.00 0.00 H new ATOM 802 N VAL A 48 -6.021 -2.013 1.565 1.00 0.00 N ATOM 803 CA VAL A 48 -7.391 -2.256 1.104 1.00 0.00 C ATOM 804 C VAL A 48 -8.327 -2.516 2.302 1.00 0.00 C ATOM 805 O VAL A 48 -9.543 -2.553 2.128 1.00 0.00 O ATOM 806 CB VAL A 48 -7.402 -3.443 0.098 1.00 0.00 C ATOM 807 CG1 VAL A 48 -8.746 -3.595 -0.633 1.00 0.00 C ATOM 808 CG2 VAL A 48 -6.355 -3.339 -1.026 1.00 0.00 C ATOM 0 H VAL A 48 -5.697 -2.736 2.208 1.00 0.00 H new ATOM 0 HA VAL A 48 -7.762 -1.370 0.589 1.00 0.00 H new ATOM 0 HB VAL A 48 -7.185 -4.292 0.747 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -8.693 -4.439 -1.321 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -9.538 -3.770 0.095 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -8.961 -2.684 -1.192 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -6.435 -4.208 -1.679 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -6.531 -2.432 -1.605 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -5.356 -3.303 -0.591 1.00 0.00 H new ATOM 818 N HIS A 49 -7.804 -2.679 3.521 1.00 0.00 N ATOM 819 CA HIS A 49 -8.533 -3.376 4.571 1.00 0.00 C ATOM 820 C HIS A 49 -9.839 -2.689 4.984 1.00 0.00 C ATOM 821 O HIS A 49 -10.786 -3.377 5.363 1.00 0.00 O ATOM 822 CB HIS A 49 -7.635 -3.649 5.780 1.00 0.00 C ATOM 823 CG HIS A 49 -8.179 -4.721 6.694 1.00 0.00 C ATOM 824 ND1 HIS A 49 -8.320 -4.658 8.062 1.00 0.00 N ATOM 825 CD2 HIS A 49 -8.581 -5.971 6.306 1.00 0.00 C ATOM 826 CE1 HIS A 49 -8.796 -5.844 8.485 1.00 0.00 C ATOM 827 NE2 HIS A 49 -8.976 -6.684 7.446 1.00 0.00 N ATOM 0 H HIS A 49 -6.884 -2.338 3.799 1.00 0.00 H new ATOM 0 HA HIS A 49 -8.833 -4.331 4.140 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -6.646 -3.946 5.431 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -7.509 -2.727 6.347 1.00 0.00 H new ATOM 0 HD1 HIS A 49 -8.102 -3.854 8.651 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -8.592 -6.344 5.293 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -9.005 -6.089 9.516 1.00 0.00 H new ATOM 835 N GLU A 50 -9.938 -1.362 4.850 1.00 0.00 N ATOM 836 CA GLU A 50 -11.168 -0.618 5.144 1.00 0.00 C ATOM 837 C GLU A 50 -12.351 -1.063 4.257 1.00 0.00 C ATOM 838 O GLU A 50 -13.504 -0.773 4.583 1.00 0.00 O ATOM 839 CB GLU A 50 -10.928 0.893 4.987 1.00 0.00 C ATOM 840 CG GLU A 50 -9.919 1.444 6.006 1.00 0.00 C ATOM 841 CD GLU A 50 -9.793 2.975 5.897 1.00 0.00 C ATOM 842 OE1 GLU A 50 -8.946 3.464 5.111 1.00 0.00 O ATOM 843 OE2 GLU A 50 -10.527 3.706 6.606 1.00 0.00 O ATOM 0 H GLU A 50 -9.167 -0.773 4.534 1.00 0.00 H new ATOM 0 HA GLU A 50 -11.437 -0.839 6.177 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -10.567 1.096 3.979 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -11.875 1.420 5.099 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -10.233 1.174 7.014 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -8.945 0.984 5.841 1.00 0.00 H new ATOM 850 N GLU A 51 -12.083 -1.777 3.157 1.00 0.00 N ATOM 851 CA GLU A 51 -13.059 -2.274 2.195 1.00 0.00 C ATOM 852 C GLU A 51 -13.108 -3.817 2.211 1.00 0.00 C ATOM 853 O GLU A 51 -13.778 -4.424 1.373 1.00 0.00 O ATOM 854 CB GLU A 51 -12.706 -1.733 0.800 1.00 0.00 C ATOM 855 CG GLU A 51 -12.908 -0.215 0.716 1.00 0.00 C ATOM 856 CD GLU A 51 -12.394 0.336 -0.623 1.00 0.00 C ATOM 857 OE1 GLU A 51 -13.145 0.319 -1.626 1.00 0.00 O ATOM 858 OE2 GLU A 51 -11.215 0.754 -0.710 1.00 0.00 O ATOM 0 H GLU A 51 -11.128 -2.034 2.906 1.00 0.00 H new ATOM 0 HA GLU A 51 -14.054 -1.922 2.467 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -11.670 -1.976 0.566 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -13.326 -2.225 0.051 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -13.966 0.021 0.828 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -12.384 0.271 1.539 1.00 0.00 H new ATOM 865 N GLU A 52 -12.400 -4.458 3.150 1.00 0.00 N ATOM 866 CA GLU A 52 -12.216 -5.908 3.215 1.00 0.00 C ATOM 867 C GLU A 52 -12.461 -6.469 4.619 1.00 0.00 C ATOM 868 O GLU A 52 -12.713 -7.664 4.753 1.00 0.00 O ATOM 869 CB GLU A 52 -10.796 -6.255 2.767 1.00 0.00 C ATOM 870 CG GLU A 52 -10.611 -6.183 1.250 1.00 0.00 C ATOM 871 CD GLU A 52 -11.036 -7.461 0.495 1.00 0.00 C ATOM 872 OE1 GLU A 52 -11.848 -8.268 1.008 1.00 0.00 O ATOM 873 OE2 GLU A 52 -10.561 -7.672 -0.645 1.00 0.00 O ATOM 0 H GLU A 52 -11.927 -3.964 3.907 1.00 0.00 H new ATOM 0 HA GLU A 52 -12.952 -6.363 2.552 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -10.093 -5.573 3.246 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -10.548 -7.260 3.110 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -11.186 -5.340 0.866 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -9.562 -5.979 1.033 1.00 0.00 H new ATOM 880 N GLU A 53 -12.437 -5.647 5.670 1.00 0.00 N ATOM 881 CA GLU A 53 -12.584 -6.092 7.059 1.00 0.00 C ATOM 882 C GLU A 53 -13.913 -6.827 7.318 1.00 0.00 C ATOM 883 O GLU A 53 -13.998 -7.644 8.237 1.00 0.00 O ATOM 884 CB GLU A 53 -12.395 -4.902 8.016 1.00 0.00 C ATOM 885 CG GLU A 53 -13.438 -3.786 7.849 1.00 0.00 C ATOM 886 CD GLU A 53 -13.231 -2.675 8.895 1.00 0.00 C ATOM 887 OE1 GLU A 53 -13.784 -2.784 10.018 1.00 0.00 O ATOM 888 OE2 GLU A 53 -12.538 -1.670 8.601 1.00 0.00 O ATOM 0 H GLU A 53 -12.313 -4.639 5.580 1.00 0.00 H new ATOM 0 HA GLU A 53 -11.802 -6.826 7.252 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -12.431 -5.267 9.043 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -11.401 -4.481 7.862 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -13.367 -3.364 6.846 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -14.440 -4.202 7.949 1.00 0.00 H new ATOM 895 N PHE A 54 -14.931 -6.577 6.485 1.00 0.00 N ATOM 896 CA PHE A 54 -16.254 -7.197 6.541 1.00 0.00 C ATOM 897 C PHE A 54 -16.387 -8.357 5.532 1.00 0.00 C ATOM 898 O PHE A 54 -17.477 -8.913 5.379 1.00 0.00 O ATOM 899 CB PHE A 54 -17.317 -6.103 6.324 1.00 0.00 C ATOM 900 CG PHE A 54 -17.113 -5.251 5.081 1.00 0.00 C ATOM 901 CD1 PHE A 54 -17.536 -5.719 3.819 1.00 0.00 C ATOM 902 CD2 PHE A 54 -16.492 -3.991 5.183 1.00 0.00 C ATOM 903 CE1 PHE A 54 -17.328 -4.933 2.671 1.00 0.00 C ATOM 904 CE2 PHE A 54 -16.293 -3.206 4.035 1.00 0.00 C ATOM 905 CZ PHE A 54 -16.711 -3.676 2.777 1.00 0.00 C ATOM 0 H PHE A 54 -14.848 -5.907 5.721 1.00 0.00 H new ATOM 0 HA PHE A 54 -16.406 -7.647 7.522 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -18.297 -6.576 6.266 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -17.329 -5.450 7.197 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -18.020 -6.681 3.734 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -16.168 -3.627 6.147 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -17.644 -5.298 1.705 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -15.818 -2.240 4.119 1.00 0.00 H new ATOM 0 HZ PHE A 54 -16.558 -3.072 1.895 1.00 0.00 H new ATOM 915 N ALA A 55 -15.302 -8.728 4.839 1.00 0.00 N ATOM 916 CA ALA A 55 -15.295 -9.698 3.746 1.00 0.00 C ATOM 917 C ALA A 55 -14.165 -10.733 3.871 1.00 0.00 C ATOM 918 O ALA A 55 -14.256 -11.787 3.241 1.00 0.00 O ATOM 919 CB ALA A 55 -15.208 -8.952 2.409 1.00 0.00 C ATOM 0 H ALA A 55 -14.376 -8.346 5.034 1.00 0.00 H new ATOM 0 HA ALA A 55 -16.226 -10.262 3.796 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -15.202 -9.672 1.590 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -16.068 -8.291 2.305 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -14.291 -8.363 2.380 1.00 0.00 H new ATOM 925 N VAL A 56 -13.138 -10.515 4.704 1.00 0.00 N ATOM 926 CA VAL A 56 -12.100 -11.524 4.980 1.00 0.00 C ATOM 927 C VAL A 56 -12.587 -12.687 5.863 1.00 0.00 C ATOM 928 O VAL A 56 -11.833 -13.609 6.173 1.00 0.00 O ATOM 929 CB VAL A 56 -10.799 -10.873 5.510 1.00 0.00 C ATOM 930 CG1 VAL A 56 -10.127 -10.019 4.425 1.00 0.00 C ATOM 931 CG2 VAL A 56 -11.013 -10.037 6.781 1.00 0.00 C ATOM 0 H VAL A 56 -13.001 -9.637 5.205 1.00 0.00 H new ATOM 0 HA VAL A 56 -11.862 -11.984 4.021 1.00 0.00 H new ATOM 0 HB VAL A 56 -10.141 -11.699 5.779 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -9.216 -9.574 4.825 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -9.879 -10.647 3.569 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -10.809 -9.229 4.110 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -10.062 -9.609 7.099 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -11.721 -9.234 6.574 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -11.408 -10.673 7.573 1.00 0.00 H new ATOM 941 N GLU A 57 -13.874 -12.681 6.214 1.00 0.00 N ATOM 942 CA GLU A 57 -14.631 -13.874 6.580 1.00 0.00 C ATOM 943 C GLU A 57 -14.630 -14.950 5.480 1.00 0.00 C ATOM 944 O GLU A 57 -14.890 -16.123 5.763 1.00 0.00 O ATOM 945 CB GLU A 57 -16.068 -13.460 6.938 1.00 0.00 C ATOM 946 CG GLU A 57 -16.700 -12.551 5.867 1.00 0.00 C ATOM 947 CD GLU A 57 -18.221 -12.410 6.065 1.00 0.00 C ATOM 948 OE1 GLU A 57 -18.660 -11.896 7.124 1.00 0.00 O ATOM 949 OE2 GLU A 57 -18.993 -12.823 5.163 1.00 0.00 O ATOM 0 H GLU A 57 -14.429 -11.826 6.252 1.00 0.00 H new ATOM 0 HA GLU A 57 -14.143 -14.329 7.442 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -16.681 -14.353 7.061 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -16.066 -12.941 7.896 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -16.235 -11.566 5.905 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -16.498 -12.960 4.877 1.00 0.00 H new ATOM 956 N GLY A 58 -14.331 -14.561 4.242 1.00 0.00 N ATOM 957 CA GLY A 58 -14.275 -15.432 3.080 1.00 0.00 C ATOM 958 C GLY A 58 -12.832 -15.668 2.615 1.00 0.00 C ATOM 959 O GLY A 58 -11.883 -15.208 3.260 1.00 0.00 O ATOM 0 H GLY A 58 -14.113 -13.590 4.017 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -14.741 -16.388 3.319 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -14.852 -14.991 2.267 1.00 0.00 H new ATOM 963 N PRO A 59 -12.657 -16.424 1.518 1.00 0.00 N ATOM 964 CA PRO A 59 -11.358 -16.901 1.067 1.00 0.00 C ATOM 965 C PRO A 59 -10.485 -15.783 0.478 1.00 0.00 C ATOM 966 O PRO A 59 -10.946 -14.677 0.177 1.00 0.00 O ATOM 967 CB PRO A 59 -11.666 -17.987 0.034 1.00 0.00 C ATOM 968 CG PRO A 59 -13.006 -17.549 -0.539 1.00 0.00 C ATOM 969 CD PRO A 59 -13.716 -16.952 0.669 1.00 0.00 C ATOM 0 HA PRO A 59 -10.772 -17.287 1.902 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -10.897 -18.041 -0.736 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -11.727 -18.974 0.493 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -12.884 -16.817 -1.338 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -13.560 -18.389 -0.958 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -14.408 -16.165 0.369 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -14.301 -17.707 1.194 1.00 0.00 H new ATOM 977 N LEU A 60 -9.218 -16.130 0.243 1.00 0.00 N ATOM 978 CA LEU A 60 -8.239 -15.353 -0.509 1.00 0.00 C ATOM 979 C LEU A 60 -7.374 -16.359 -1.263 1.00 0.00 C ATOM 980 O LEU A 60 -7.206 -17.499 -0.819 1.00 0.00 O ATOM 981 CB LEU A 60 -7.370 -14.521 0.452 1.00 0.00 C ATOM 982 CG LEU A 60 -6.424 -13.503 -0.221 1.00 0.00 C ATOM 983 CD1 LEU A 60 -7.171 -12.449 -1.050 1.00 0.00 C ATOM 984 CD2 LEU A 60 -5.591 -12.788 0.849 1.00 0.00 C ATOM 0 H LEU A 60 -8.830 -17.007 0.592 1.00 0.00 H new ATOM 0 HA LEU A 60 -8.728 -14.661 -1.195 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -8.027 -13.983 1.135 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -6.771 -15.203 1.056 1.00 0.00 H new ATOM 0 HG LEU A 60 -5.787 -14.069 -0.901 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -6.453 -11.762 -1.498 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -7.741 -12.942 -1.837 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -7.851 -11.893 -0.404 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.924 -12.070 0.371 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -6.255 -12.265 1.537 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -5.001 -13.520 1.400 1.00 0.00 H new ATOM 996 N TRP A 61 -6.805 -15.921 -2.379 1.00 0.00 N ATOM 997 CA TRP A 61 -6.050 -16.732 -3.321 1.00 0.00 C ATOM 998 C TRP A 61 -4.888 -15.881 -3.811 1.00 0.00 C ATOM 999 O TRP A 61 -5.032 -14.661 -3.860 1.00 0.00 O ATOM 1000 CB TRP A 61 -6.975 -17.032 -4.500 1.00 0.00 C ATOM 1001 CG TRP A 61 -8.153 -17.912 -4.227 1.00 0.00 C ATOM 1002 CD1 TRP A 61 -9.342 -17.499 -3.734 1.00 0.00 C ATOM 1003 CD2 TRP A 61 -8.294 -19.341 -4.460 1.00 0.00 C ATOM 1004 NE1 TRP A 61 -10.198 -18.579 -3.623 1.00 0.00 N ATOM 1005 CE2 TRP A 61 -9.600 -19.745 -4.059 1.00 0.00 C ATOM 1006 CE3 TRP A 61 -7.437 -20.328 -4.980 1.00 0.00 C ATOM 1007 CZ2 TRP A 61 -10.030 -21.078 -4.160 1.00 0.00 C ATOM 1008 CZ3 TRP A 61 -7.853 -21.670 -5.082 1.00 0.00 C ATOM 1009 CH2 TRP A 61 -9.148 -22.045 -4.674 1.00 0.00 C ATOM 0 H TRP A 61 -6.861 -14.943 -2.664 1.00 0.00 H new ATOM 0 HA TRP A 61 -5.688 -17.657 -2.873 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -7.343 -16.084 -4.893 1.00 0.00 H new ATOM 0 HB3 TRP A 61 -6.381 -17.494 -5.288 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -9.586 -16.481 -3.468 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -11.151 -18.522 -3.264 1.00 0.00 H new ATOM 0 HE3 TRP A 61 -6.445 -20.053 -5.306 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 -11.025 -21.357 -3.847 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 -7.176 -22.414 -5.475 1.00 0.00 H new ATOM 0 HH2 TRP A 61 -9.463 -23.075 -4.756 1.00 0.00 H new ATOM 1020 N ILE A 62 -3.764 -16.484 -4.197 1.00 0.00 N ATOM 1021 CA ILE A 62 -2.529 -15.759 -4.495 1.00 0.00 C ATOM 1022 C ILE A 62 -1.893 -16.401 -5.741 1.00 0.00 C ATOM 1023 O ILE A 62 -1.844 -17.631 -5.839 1.00 0.00 O ATOM 1024 CB ILE A 62 -1.547 -15.844 -3.287 1.00 0.00 C ATOM 1025 CG1 ILE A 62 -2.148 -15.783 -1.854 1.00 0.00 C ATOM 1026 CG2 ILE A 62 -0.443 -14.781 -3.412 1.00 0.00 C ATOM 1027 CD1 ILE A 62 -2.695 -14.429 -1.383 1.00 0.00 C ATOM 0 H ILE A 62 -3.684 -17.494 -4.312 1.00 0.00 H new ATOM 0 HA ILE A 62 -2.745 -14.707 -4.679 1.00 0.00 H new ATOM 0 HB ILE A 62 -1.161 -16.860 -3.372 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -2.955 -16.513 -1.794 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -1.378 -16.100 -1.150 1.00 0.00 H new ATOM 0 HG21 ILE A 62 0.232 -14.856 -2.560 1.00 0.00 H new ATOM 0 HG22 ILE A 62 0.116 -14.944 -4.334 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -0.894 -13.789 -3.431 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -3.083 -14.526 -0.369 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -1.895 -13.689 -1.396 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -3.496 -14.109 -2.049 1.00 0.00 H new ATOM 1039 N GLN A 63 -1.356 -15.584 -6.653 1.00 0.00 N ATOM 1040 CA GLN A 63 -0.395 -15.994 -7.680 1.00 0.00 C ATOM 1041 C GLN A 63 0.619 -14.862 -7.913 1.00 0.00 C ATOM 1042 O GLN A 63 0.420 -13.739 -7.446 1.00 0.00 O ATOM 1043 CB GLN A 63 -1.106 -16.422 -8.979 1.00 0.00 C ATOM 1044 CG GLN A 63 -2.065 -15.361 -9.544 1.00 0.00 C ATOM 1045 CD GLN A 63 -1.828 -15.114 -11.035 1.00 0.00 C ATOM 1046 OE1 GLN A 63 -1.029 -14.257 -11.412 1.00 0.00 O ATOM 1047 NE2 GLN A 63 -2.485 -15.862 -11.909 1.00 0.00 N ATOM 0 H GLN A 63 -1.585 -14.591 -6.698 1.00 0.00 H new ATOM 0 HA GLN A 63 0.149 -16.872 -7.331 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -0.354 -16.656 -9.733 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -1.665 -17.339 -8.791 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -3.095 -15.683 -9.389 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -1.937 -14.427 -8.996 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -3.144 -16.568 -11.582 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -2.332 -15.732 -12.909 1.00 0.00 H new ATOM 1056 N VAL A 64 1.715 -15.141 -8.622 1.00 0.00 N ATOM 1057 CA VAL A 64 2.858 -14.232 -8.735 1.00 0.00 C ATOM 1058 C VAL A 64 3.465 -14.328 -10.146 1.00 0.00 C ATOM 1059 O VAL A 64 3.249 -15.312 -10.858 1.00 0.00 O ATOM 1060 CB VAL A 64 3.848 -14.552 -7.592 1.00 0.00 C ATOM 1061 CG1 VAL A 64 4.492 -15.943 -7.711 1.00 0.00 C ATOM 1062 CG2 VAL A 64 4.938 -13.487 -7.449 1.00 0.00 C ATOM 0 H VAL A 64 1.835 -16.012 -9.139 1.00 0.00 H new ATOM 0 HA VAL A 64 2.560 -13.190 -8.618 1.00 0.00 H new ATOM 0 HB VAL A 64 3.236 -14.550 -6.690 1.00 0.00 H new ATOM 0 HG11 VAL A 64 5.175 -16.100 -6.876 1.00 0.00 H new ATOM 0 HG12 VAL A 64 3.714 -16.707 -7.693 1.00 0.00 H new ATOM 0 HG13 VAL A 64 5.044 -16.009 -8.649 1.00 0.00 H new ATOM 0 HG21 VAL A 64 5.607 -13.759 -6.633 1.00 0.00 H new ATOM 0 HG22 VAL A 64 5.506 -13.421 -8.377 1.00 0.00 H new ATOM 0 HG23 VAL A 64 4.478 -12.522 -7.235 1.00 0.00 H new ATOM 1072 N GLN A 65 4.227 -13.317 -10.560 1.00 0.00 N ATOM 1073 CA GLN A 65 5.162 -13.322 -11.676 1.00 0.00 C ATOM 1074 C GLN A 65 6.453 -12.730 -11.130 1.00 0.00 C ATOM 1075 O GLN A 65 6.388 -11.790 -10.343 1.00 0.00 O ATOM 1076 CB GLN A 65 4.703 -12.398 -12.823 1.00 0.00 C ATOM 1077 CG GLN A 65 3.538 -12.902 -13.667 1.00 0.00 C ATOM 1078 CD GLN A 65 2.153 -12.536 -13.131 1.00 0.00 C ATOM 1079 OE1 GLN A 65 1.582 -11.502 -13.468 1.00 0.00 O ATOM 1080 NE2 GLN A 65 1.577 -13.410 -12.327 1.00 0.00 N ATOM 0 H GLN A 65 4.203 -12.412 -10.090 1.00 0.00 H new ATOM 0 HA GLN A 65 5.255 -14.335 -12.066 1.00 0.00 H new ATOM 0 HB2 GLN A 65 4.425 -11.434 -12.396 1.00 0.00 H new ATOM 0 HB3 GLN A 65 5.553 -12.222 -13.482 1.00 0.00 H new ATOM 0 HG2 GLN A 65 3.639 -12.502 -14.676 1.00 0.00 H new ATOM 0 HG3 GLN A 65 3.607 -13.987 -13.745 1.00 0.00 H new ATOM 0 HE21 GLN A 65 2.071 -14.262 -12.061 1.00 0.00 H new ATOM 0 HE22 GLN A 65 0.637 -13.234 -11.971 1.00 0.00 H new ATOM 1089 N ALA A 66 7.608 -13.191 -11.607 1.00 0.00 N ATOM 1090 CA ALA A 66 8.885 -12.528 -11.367 1.00 0.00 C ATOM 1091 C ALA A 66 9.326 -11.900 -12.690 1.00 0.00 C ATOM 1092 O ALA A 66 9.285 -12.546 -13.740 1.00 0.00 O ATOM 1093 CB ALA A 66 9.901 -13.516 -10.785 1.00 0.00 C ATOM 0 H ALA A 66 7.683 -14.037 -12.172 1.00 0.00 H new ATOM 0 HA ALA A 66 8.798 -11.738 -10.622 1.00 0.00 H new ATOM 0 HB1 ALA A 66 10.848 -13.005 -10.612 1.00 0.00 H new ATOM 0 HB2 ALA A 66 9.525 -13.911 -9.842 1.00 0.00 H new ATOM 0 HB3 ALA A 66 10.054 -14.336 -11.487 1.00 0.00 H new ATOM 1099 N LEU A 67 9.683 -10.623 -12.623 1.00 0.00 N ATOM 1100 CA LEU A 67 9.942 -9.723 -13.740 1.00 0.00 C ATOM 1101 C LEU A 67 11.404 -9.252 -13.651 1.00 0.00 C ATOM 1102 O LEU A 67 12.194 -9.809 -12.886 1.00 0.00 O ATOM 1103 CB LEU A 67 8.928 -8.556 -13.704 1.00 0.00 C ATOM 1104 CG LEU A 67 7.465 -8.996 -13.927 1.00 0.00 C ATOM 1105 CD1 LEU A 67 6.729 -9.233 -12.622 1.00 0.00 C ATOM 1106 CD2 LEU A 67 6.684 -7.936 -14.706 1.00 0.00 C ATOM 0 H LEU A 67 9.808 -10.157 -11.724 1.00 0.00 H new ATOM 0 HA LEU A 67 9.810 -10.225 -14.699 1.00 0.00 H new ATOM 0 HB2 LEU A 67 9.003 -8.051 -12.741 1.00 0.00 H new ATOM 0 HB3 LEU A 67 9.199 -7.827 -14.468 1.00 0.00 H new ATOM 0 HG LEU A 67 7.520 -9.928 -14.489 1.00 0.00 H new ATOM 0 HD11 LEU A 67 5.705 -9.540 -12.833 1.00 0.00 H new ATOM 0 HD12 LEU A 67 7.234 -10.016 -12.057 1.00 0.00 H new ATOM 0 HD13 LEU A 67 6.719 -8.313 -12.038 1.00 0.00 H new ATOM 0 HD21 LEU A 67 5.657 -8.272 -14.849 1.00 0.00 H new ATOM 0 HD22 LEU A 67 6.685 -7.000 -14.148 1.00 0.00 H new ATOM 0 HD23 LEU A 67 7.153 -7.780 -15.678 1.00 0.00 H new ATOM 1118 N ASP A 68 11.793 -8.262 -14.460 1.00 0.00 N ATOM 1119 CA ASP A 68 13.205 -7.894 -14.627 1.00 0.00 C ATOM 1120 C ASP A 68 13.868 -7.451 -13.316 1.00 0.00 C ATOM 1121 O ASP A 68 14.983 -7.889 -13.022 1.00 0.00 O ATOM 1122 CB ASP A 68 13.346 -6.798 -15.686 1.00 0.00 C ATOM 1123 CG ASP A 68 14.825 -6.521 -16.025 1.00 0.00 C ATOM 1124 OD1 ASP A 68 15.552 -7.466 -16.417 1.00 0.00 O ATOM 1125 OD2 ASP A 68 15.249 -5.342 -15.959 1.00 0.00 O ATOM 0 H ASP A 68 11.147 -7.698 -15.013 1.00 0.00 H new ATOM 0 HA ASP A 68 13.726 -8.793 -14.956 1.00 0.00 H new ATOM 0 HB2 ASP A 68 12.815 -7.095 -16.590 1.00 0.00 H new ATOM 0 HB3 ASP A 68 12.877 -5.882 -15.327 1.00 0.00 H new ATOM 1130 N LYS A 69 13.174 -6.630 -12.509 1.00 0.00 N ATOM 1131 CA LYS A 69 13.685 -6.064 -11.247 1.00 0.00 C ATOM 1132 C LYS A 69 12.604 -5.995 -10.157 1.00 0.00 C ATOM 1133 O LYS A 69 12.665 -5.159 -9.252 1.00 0.00 O ATOM 1134 CB LYS A 69 14.320 -4.688 -11.497 1.00 0.00 C ATOM 1135 CG LYS A 69 15.616 -4.700 -12.321 1.00 0.00 C ATOM 1136 CD LYS A 69 16.786 -5.420 -11.620 1.00 0.00 C ATOM 1137 CE LYS A 69 18.112 -5.283 -12.387 1.00 0.00 C ATOM 1138 NZ LYS A 69 18.677 -3.904 -12.352 1.00 0.00 N ATOM 0 H LYS A 69 12.221 -6.334 -12.720 1.00 0.00 H new ATOM 0 HA LYS A 69 14.455 -6.738 -10.873 1.00 0.00 H new ATOM 0 HB2 LYS A 69 13.591 -4.058 -12.007 1.00 0.00 H new ATOM 0 HB3 LYS A 69 14.526 -4.222 -10.534 1.00 0.00 H new ATOM 0 HG2 LYS A 69 15.424 -5.184 -13.278 1.00 0.00 H new ATOM 0 HG3 LYS A 69 15.909 -3.673 -12.537 1.00 0.00 H new ATOM 0 HD2 LYS A 69 16.908 -5.014 -10.616 1.00 0.00 H new ATOM 0 HD3 LYS A 69 16.543 -6.477 -11.509 1.00 0.00 H new ATOM 0 HE2 LYS A 69 18.840 -5.977 -11.966 1.00 0.00 H new ATOM 0 HE3 LYS A 69 17.955 -5.577 -13.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 19.577 -3.884 -12.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 18.007 -3.243 -12.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 18.842 -3.621 -11.365 1.00 0.00 H new ATOM 1152 N GLY A 70 11.590 -6.848 -10.235 1.00 0.00 N ATOM 1153 CA GLY A 70 10.479 -6.857 -9.301 1.00 0.00 C ATOM 1154 C GLY A 70 9.578 -8.041 -9.604 1.00 0.00 C ATOM 1155 O GLY A 70 9.923 -8.896 -10.419 1.00 0.00 O ATOM 0 H GLY A 70 11.519 -7.562 -10.960 1.00 0.00 H new ATOM 0 HA2 GLY A 70 10.850 -6.920 -8.278 1.00 0.00 H new ATOM 0 HA3 GLY A 70 9.916 -5.927 -9.379 1.00 0.00 H new ATOM 1159 N LEU A 71 8.414 -8.086 -8.968 1.00 0.00 N ATOM 1160 CA LEU A 71 7.419 -9.138 -9.125 1.00 0.00 C ATOM 1161 C LEU A 71 6.049 -8.490 -9.250 1.00 0.00 C ATOM 1162 O LEU A 71 5.777 -7.511 -8.558 1.00 0.00 O ATOM 1163 CB LEU A 71 7.399 -10.064 -7.896 1.00 0.00 C ATOM 1164 CG LEU A 71 8.725 -10.802 -7.627 1.00 0.00 C ATOM 1165 CD1 LEU A 71 9.269 -10.345 -6.270 1.00 0.00 C ATOM 1166 CD2 LEU A 71 8.554 -12.320 -7.648 1.00 0.00 C ATOM 0 H LEU A 71 8.127 -7.365 -8.306 1.00 0.00 H new ATOM 0 HA LEU A 71 7.667 -9.725 -10.010 1.00 0.00 H new ATOM 0 HB2 LEU A 71 7.142 -9.473 -7.017 1.00 0.00 H new ATOM 0 HB3 LEU A 71 6.608 -10.802 -8.026 1.00 0.00 H new ATOM 0 HG LEU A 71 9.428 -10.555 -8.422 1.00 0.00 H new ATOM 0 HD11 LEU A 71 10.208 -10.858 -6.063 1.00 0.00 H new ATOM 0 HD12 LEU A 71 9.440 -9.269 -6.290 1.00 0.00 H new ATOM 0 HD13 LEU A 71 8.546 -10.583 -5.489 1.00 0.00 H new ATOM 0 HD21 LEU A 71 9.515 -12.797 -7.454 1.00 0.00 H new ATOM 0 HD22 LEU A 71 7.840 -12.616 -6.880 1.00 0.00 H new ATOM 0 HD23 LEU A 71 8.186 -12.631 -8.626 1.00 0.00 H new ATOM 1178 N GLU A 72 5.168 -9.048 -10.076 1.00 0.00 N ATOM 1179 CA GLU A 72 3.739 -8.763 -9.970 1.00 0.00 C ATOM 1180 C GLU A 72 3.150 -9.845 -9.081 1.00 0.00 C ATOM 1181 O GLU A 72 3.529 -11.011 -9.195 1.00 0.00 O ATOM 1182 CB GLU A 72 2.992 -8.769 -11.313 1.00 0.00 C ATOM 1183 CG GLU A 72 3.142 -7.475 -12.115 1.00 0.00 C ATOM 1184 CD GLU A 72 2.262 -7.492 -13.376 1.00 0.00 C ATOM 1185 OE1 GLU A 72 1.058 -7.152 -13.282 1.00 0.00 O ATOM 1186 OE2 GLU A 72 2.773 -7.812 -14.477 1.00 0.00 O ATOM 0 H GLU A 72 5.416 -9.697 -10.823 1.00 0.00 H new ATOM 0 HA GLU A 72 3.624 -7.755 -9.571 1.00 0.00 H new ATOM 0 HB2 GLU A 72 3.355 -9.602 -11.915 1.00 0.00 H new ATOM 0 HB3 GLU A 72 1.933 -8.948 -11.127 1.00 0.00 H new ATOM 0 HG2 GLU A 72 2.869 -6.624 -11.490 1.00 0.00 H new ATOM 0 HG3 GLU A 72 4.186 -7.340 -12.399 1.00 0.00 H new ATOM 1193 N ILE A 73 2.209 -9.476 -8.220 1.00 0.00 N ATOM 1194 CA ILE A 73 1.487 -10.404 -7.384 1.00 0.00 C ATOM 1195 C ILE A 73 0.015 -10.085 -7.634 1.00 0.00 C ATOM 1196 O ILE A 73 -0.392 -8.927 -7.543 1.00 0.00 O ATOM 1197 CB ILE A 73 1.866 -10.240 -5.896 1.00 0.00 C ATOM 1198 CG1 ILE A 73 3.352 -10.331 -5.455 1.00 0.00 C ATOM 1199 CG2 ILE A 73 1.099 -11.289 -5.070 1.00 0.00 C ATOM 1200 CD1 ILE A 73 4.327 -9.291 -6.010 1.00 0.00 C ATOM 0 H ILE A 73 1.928 -8.505 -8.087 1.00 0.00 H new ATOM 0 HA ILE A 73 1.723 -11.441 -7.622 1.00 0.00 H new ATOM 0 HB ILE A 73 1.603 -9.197 -5.720 1.00 0.00 H new ATOM 0 HG12 ILE A 73 3.382 -10.271 -4.367 1.00 0.00 H new ATOM 0 HG13 ILE A 73 3.723 -11.318 -5.731 1.00 0.00 H new ATOM 0 HG21 ILE A 73 1.358 -11.183 -4.017 1.00 0.00 H new ATOM 0 HG22 ILE A 73 0.027 -11.139 -5.197 1.00 0.00 H new ATOM 0 HG23 ILE A 73 1.368 -12.289 -5.411 1.00 0.00 H new ATOM 0 HD11 ILE A 73 5.325 -9.481 -5.615 1.00 0.00 H new ATOM 0 HD12 ILE A 73 4.349 -9.357 -7.098 1.00 0.00 H new ATOM 0 HD13 ILE A 73 4.003 -8.294 -5.713 1.00 0.00 H new ATOM 1212 N ILE A 74 -0.788 -11.095 -7.957 1.00 0.00 N ATOM 1213 CA ILE A 74 -2.220 -10.976 -8.217 1.00 0.00 C ATOM 1214 C ILE A 74 -2.867 -11.824 -7.117 1.00 0.00 C ATOM 1215 O ILE A 74 -2.420 -12.944 -6.869 1.00 0.00 O ATOM 1216 CB ILE A 74 -2.550 -11.484 -9.647 1.00 0.00 C ATOM 1217 CG1 ILE A 74 -2.087 -10.614 -10.838 1.00 0.00 C ATOM 1218 CG2 ILE A 74 -4.067 -11.678 -9.829 1.00 0.00 C ATOM 1219 CD1 ILE A 74 -0.586 -10.332 -10.952 1.00 0.00 C ATOM 0 H ILE A 74 -0.448 -12.052 -8.048 1.00 0.00 H new ATOM 0 HA ILE A 74 -2.589 -9.951 -8.191 1.00 0.00 H new ATOM 0 HB ILE A 74 -1.977 -12.410 -9.686 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -2.411 -11.100 -11.758 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -2.608 -9.658 -10.782 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -4.270 -12.034 -10.839 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -4.430 -12.409 -9.107 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -4.577 -10.728 -9.670 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -0.398 -9.712 -11.829 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -0.245 -9.809 -10.058 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -0.045 -11.273 -11.050 1.00 0.00 H new ATOM 1231 N VAL A 75 -3.916 -11.325 -6.460 1.00 0.00 N ATOM 1232 CA VAL A 75 -4.595 -12.040 -5.387 1.00 0.00 C ATOM 1233 C VAL A 75 -6.105 -11.970 -5.642 1.00 0.00 C ATOM 1234 O VAL A 75 -6.615 -10.925 -6.052 1.00 0.00 O ATOM 1235 CB VAL A 75 -4.121 -11.569 -3.993 1.00 0.00 C ATOM 1236 CG1 VAL A 75 -2.590 -11.583 -3.851 1.00 0.00 C ATOM 1237 CG2 VAL A 75 -4.543 -10.148 -3.655 1.00 0.00 C ATOM 0 H VAL A 75 -4.317 -10.409 -6.661 1.00 0.00 H new ATOM 0 HA VAL A 75 -4.328 -13.097 -5.386 1.00 0.00 H new ATOM 0 HB VAL A 75 -4.594 -12.283 -3.318 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -2.314 -11.243 -2.853 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -2.220 -12.597 -4.004 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -2.150 -10.919 -4.595 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -4.176 -9.886 -2.663 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -4.126 -9.460 -4.390 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -5.631 -10.078 -3.669 1.00 0.00 H new ATOM 1247 N THR A 76 -6.805 -13.097 -5.494 1.00 0.00 N ATOM 1248 CA THR A 76 -8.086 -13.349 -6.154 1.00 0.00 C ATOM 1249 C THR A 76 -9.116 -13.888 -5.147 1.00 0.00 C ATOM 1250 O THR A 76 -8.777 -14.147 -3.987 1.00 0.00 O ATOM 1251 CB THR A 76 -7.882 -14.281 -7.387 1.00 0.00 C ATOM 1252 OG1 THR A 76 -7.762 -15.644 -7.072 1.00 0.00 O ATOM 1253 CG2 THR A 76 -6.615 -13.980 -8.198 1.00 0.00 C ATOM 0 H THR A 76 -6.493 -13.869 -4.905 1.00 0.00 H new ATOM 0 HA THR A 76 -8.493 -12.412 -6.534 1.00 0.00 H new ATOM 0 HB THR A 76 -8.790 -14.075 -7.953 1.00 0.00 H new ATOM 0 HG1 THR A 76 -7.639 -16.160 -7.896 1.00 0.00 H new ATOM 0 HG21 THR A 76 -6.547 -14.672 -9.037 1.00 0.00 H new ATOM 0 HG22 THR A 76 -6.658 -12.957 -8.573 1.00 0.00 H new ATOM 0 HG23 THR A 76 -5.739 -14.096 -7.560 1.00 0.00 H new ATOM 1261 N LYS A 77 -10.374 -14.067 -5.577 1.00 0.00 N ATOM 1262 CA LYS A 77 -11.430 -14.724 -4.810 1.00 0.00 C ATOM 1263 C LYS A 77 -12.168 -15.763 -5.648 1.00 0.00 C ATOM 1264 O LYS A 77 -11.971 -15.873 -6.860 1.00 0.00 O ATOM 1265 CB LYS A 77 -12.388 -13.688 -4.217 1.00 0.00 C ATOM 1266 CG LYS A 77 -11.611 -12.779 -3.263 1.00 0.00 C ATOM 1267 CD LYS A 77 -12.563 -12.085 -2.301 1.00 0.00 C ATOM 1268 CE LYS A 77 -11.860 -10.960 -1.521 1.00 0.00 C ATOM 1269 NZ LYS A 77 -12.666 -10.503 -0.360 1.00 0.00 N ATOM 0 H LYS A 77 -10.688 -13.748 -6.494 1.00 0.00 H new ATOM 0 HA LYS A 77 -10.964 -15.260 -3.983 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -12.843 -13.098 -5.012 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -13.199 -14.186 -3.686 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -10.882 -13.366 -2.704 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -11.053 -12.036 -3.832 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -13.405 -11.672 -2.856 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -12.970 -12.815 -1.601 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -10.889 -11.312 -1.173 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -11.674 -10.118 -2.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -12.226 -9.658 0.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -13.629 -10.271 -0.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -12.708 -11.259 0.353 1.00 0.00 H new ATOM 1283 N ALA A 78 -13.006 -16.532 -4.949 1.00 0.00 N ATOM 1284 CA ALA A 78 -13.842 -17.578 -5.525 1.00 0.00 C ATOM 1285 C ALA A 78 -14.946 -16.975 -6.410 1.00 0.00 C ATOM 1286 O ALA A 78 -15.177 -15.763 -6.403 1.00 0.00 O ATOM 1287 CB ALA A 78 -14.446 -18.419 -4.387 1.00 0.00 C ATOM 0 H ALA A 78 -13.122 -16.439 -3.940 1.00 0.00 H new ATOM 0 HA ALA A 78 -13.231 -18.218 -6.161 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -15.073 -19.204 -4.808 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -13.644 -18.870 -3.802 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -15.049 -17.779 -3.743 1.00 0.00 H new ATOM 1293 N GLN A 79 -15.667 -17.848 -7.120 1.00 0.00 N ATOM 1294 CA GLN A 79 -16.840 -17.526 -7.930 1.00 0.00 C ATOM 1295 C GLN A 79 -17.938 -18.560 -7.629 1.00 0.00 C ATOM 1296 O GLN A 79 -17.667 -19.599 -7.017 1.00 0.00 O ATOM 1297 CB GLN A 79 -16.469 -17.519 -9.427 1.00 0.00 C ATOM 1298 CG GLN A 79 -15.456 -16.425 -9.800 1.00 0.00 C ATOM 1299 CD GLN A 79 -15.186 -16.409 -11.305 1.00 0.00 C ATOM 1300 OE1 GLN A 79 -14.331 -17.138 -11.805 1.00 0.00 O ATOM 1301 NE2 GLN A 79 -15.905 -15.591 -12.066 1.00 0.00 N ATOM 0 H GLN A 79 -15.437 -18.841 -7.145 1.00 0.00 H new ATOM 0 HA GLN A 79 -17.209 -16.531 -7.683 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -16.058 -18.492 -9.696 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -17.375 -17.382 -10.018 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -15.835 -15.453 -9.486 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -14.523 -16.592 -9.262 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -16.612 -14.990 -11.642 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -15.750 -15.564 -13.074 1.00 0.00 H new ATOM 1310 N LEU A 80 -19.173 -18.285 -8.065 1.00 0.00 N ATOM 1311 CA LEU A 80 -20.365 -19.075 -7.737 1.00 0.00 C ATOM 1312 C LEU A 80 -21.205 -19.325 -9.000 1.00 0.00 C ATOM 1313 O LEU A 80 -22.433 -19.398 -8.950 1.00 0.00 O ATOM 1314 CB LEU A 80 -21.127 -18.371 -6.588 1.00 0.00 C ATOM 1315 CG LEU A 80 -22.245 -19.184 -5.894 1.00 0.00 C ATOM 1316 CD1 LEU A 80 -21.780 -20.563 -5.407 1.00 0.00 C ATOM 1317 CD2 LEU A 80 -22.777 -18.387 -4.698 1.00 0.00 C ATOM 0 H LEU A 80 -19.376 -17.489 -8.669 1.00 0.00 H new ATOM 0 HA LEU A 80 -20.095 -20.067 -7.375 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -20.402 -18.075 -5.830 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -21.567 -17.455 -6.983 1.00 0.00 H new ATOM 0 HG LEU A 80 -23.023 -19.353 -6.638 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -22.613 -21.080 -4.930 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -21.427 -21.149 -6.256 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -20.969 -20.441 -4.689 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -23.566 -18.955 -4.204 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -21.966 -18.204 -3.993 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -23.178 -17.435 -5.045 1.00 0.00 H new ATOM 1329 N SER A 81 -20.548 -19.444 -10.159 1.00 0.00 N ATOM 1330 CA SER A 81 -21.158 -19.676 -11.471 1.00 0.00 C ATOM 1331 C SER A 81 -21.642 -21.137 -11.629 1.00 0.00 C ATOM 1332 O SER A 81 -21.372 -21.788 -12.644 1.00 0.00 O ATOM 1333 CB SER A 81 -20.162 -19.257 -12.567 1.00 0.00 C ATOM 1334 OG SER A 81 -19.567 -17.997 -12.268 1.00 0.00 O ATOM 0 H SER A 81 -19.531 -19.378 -10.209 1.00 0.00 H new ATOM 0 HA SER A 81 -22.054 -19.063 -11.568 1.00 0.00 H new ATOM 0 HB2 SER A 81 -19.385 -20.015 -12.665 1.00 0.00 H new ATOM 0 HB3 SER A 81 -20.676 -19.201 -13.527 1.00 0.00 H new ATOM 0 HG SER A 81 -18.937 -17.756 -12.979 1.00 0.00 H new ATOM 1340 N LYS A 82 -22.317 -21.687 -10.607 1.00 0.00 N ATOM 1341 CA LYS A 82 -22.880 -23.044 -10.619 1.00 0.00 C ATOM 1342 C LYS A 82 -23.910 -23.240 -11.739 1.00 0.00 C ATOM 1343 O LYS A 82 -24.154 -24.369 -12.167 1.00 0.00 O ATOM 1344 CB LYS A 82 -23.458 -23.400 -9.237 1.00 0.00 C ATOM 1345 CG LYS A 82 -24.666 -22.545 -8.812 1.00 0.00 C ATOM 1346 CD LYS A 82 -25.178 -22.955 -7.423 1.00 0.00 C ATOM 1347 CE LYS A 82 -26.396 -22.099 -7.036 1.00 0.00 C ATOM 1348 NZ LYS A 82 -26.957 -22.485 -5.713 1.00 0.00 N ATOM 0 H LYS A 82 -22.489 -21.190 -9.733 1.00 0.00 H new ATOM 0 HA LYS A 82 -22.066 -23.736 -10.834 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -23.754 -24.449 -9.240 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -22.672 -23.293 -8.490 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -24.384 -21.492 -8.802 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -25.467 -22.653 -9.544 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -25.451 -24.010 -7.424 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -24.387 -22.831 -6.684 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -26.107 -21.048 -7.014 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -27.167 -22.201 -7.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -27.775 -21.882 -5.494 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -27.258 -23.480 -5.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -26.231 -22.363 -4.979 1.00 0.00 H new ATOM 1362 N ASP A 83 -24.476 -22.143 -12.239 1.00 0.00 N ATOM 1363 CA ASP A 83 -25.173 -22.052 -13.515 1.00 0.00 C ATOM 1364 C ASP A 83 -24.684 -20.760 -14.173 1.00 0.00 C ATOM 1365 O ASP A 83 -24.239 -19.834 -13.483 1.00 0.00 O ATOM 1366 CB ASP A 83 -26.693 -22.057 -13.316 1.00 0.00 C ATOM 1367 CG ASP A 83 -27.469 -21.822 -14.628 1.00 0.00 C ATOM 1368 OD1 ASP A 83 -27.027 -22.298 -15.705 1.00 0.00 O ATOM 1369 OD2 ASP A 83 -28.536 -21.164 -14.559 1.00 0.00 O ATOM 0 H ASP A 83 -24.459 -21.254 -11.740 1.00 0.00 H new ATOM 0 HA ASP A 83 -24.959 -22.911 -14.150 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -26.995 -23.012 -12.887 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -26.963 -21.284 -12.596 1.00 0.00 H new ATOM 1374 N LEU A 84 -24.707 -20.728 -15.505 1.00 0.00 N ATOM 1375 CA LEU A 84 -24.155 -19.669 -16.343 1.00 0.00 C ATOM 1376 C LEU A 84 -24.750 -19.761 -17.755 1.00 0.00 C ATOM 1377 O LEU A 84 -24.965 -18.735 -18.403 1.00 0.00 O ATOM 1378 CB LEU A 84 -22.621 -19.823 -16.408 1.00 0.00 C ATOM 1379 CG LEU A 84 -21.895 -18.685 -17.153 1.00 0.00 C ATOM 1380 CD1 LEU A 84 -22.046 -17.334 -16.437 1.00 0.00 C ATOM 1381 CD2 LEU A 84 -20.403 -19.019 -17.257 1.00 0.00 C ATOM 0 H LEU A 84 -25.132 -21.476 -16.053 1.00 0.00 H new ATOM 0 HA LEU A 84 -24.405 -18.697 -15.918 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -22.231 -19.882 -15.392 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -22.384 -20.769 -16.895 1.00 0.00 H new ATOM 0 HG LEU A 84 -22.348 -18.599 -18.141 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -21.518 -16.563 -16.999 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -23.102 -17.074 -16.369 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -21.625 -17.405 -15.434 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -19.886 -18.216 -17.783 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -19.983 -19.126 -16.257 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -20.276 -19.953 -17.805 1.00 0.00 H new ATOM 1393 N ASP A 85 -25.010 -20.987 -18.237 1.00 0.00 N ATOM 1394 CA ASP A 85 -25.628 -21.218 -19.543 1.00 0.00 C ATOM 1395 C ASP A 85 -27.090 -20.759 -19.563 1.00 0.00 C ATOM 1396 O ASP A 85 -27.533 -20.179 -20.559 1.00 0.00 O ATOM 1397 CB ASP A 85 -25.555 -22.700 -19.906 1.00 0.00 C ATOM 1398 CG ASP A 85 -26.181 -22.976 -21.284 1.00 0.00 C ATOM 1399 OD1 ASP A 85 -25.645 -22.494 -22.312 1.00 0.00 O ATOM 1400 OD2 ASP A 85 -27.190 -23.719 -21.341 1.00 0.00 O ATOM 0 H ASP A 85 -24.795 -21.844 -17.728 1.00 0.00 H new ATOM 0 HA ASP A 85 -25.075 -20.632 -20.277 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -24.514 -23.024 -19.907 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -26.071 -23.287 -19.147 1.00 0.00 H new ATOM 1405 N LYS A 86 -27.828 -20.966 -18.462 1.00 0.00 N ATOM 1406 CA LYS A 86 -29.140 -20.351 -18.258 1.00 0.00 C ATOM 1407 C LYS A 86 -28.971 -19.057 -17.463 1.00 0.00 C ATOM 1408 O LYS A 86 -27.890 -18.753 -16.945 1.00 0.00 O ATOM 1409 CB LYS A 86 -30.107 -21.339 -17.570 1.00 0.00 C ATOM 1410 CG LYS A 86 -30.993 -22.126 -18.534 1.00 0.00 C ATOM 1411 CD LYS A 86 -30.280 -23.029 -19.551 1.00 0.00 C ATOM 1412 CE LYS A 86 -29.572 -24.188 -18.842 1.00 0.00 C ATOM 1413 NZ LYS A 86 -29.002 -25.159 -19.810 1.00 0.00 N ATOM 0 H LYS A 86 -27.529 -21.564 -17.692 1.00 0.00 H new ATOM 0 HA LYS A 86 -29.584 -20.102 -19.222 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -29.526 -22.042 -16.973 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -30.743 -20.785 -16.880 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -31.669 -22.746 -17.945 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -31.610 -21.416 -19.085 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -31.003 -23.421 -20.267 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -29.555 -22.445 -20.118 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -28.776 -23.795 -18.209 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -30.277 -24.699 -18.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -28.445 -25.873 -19.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -29.773 -25.627 -20.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -28.388 -24.658 -20.483 1.00 0.00 H new ATOM 1427 N LEU A 87 -30.042 -18.260 -17.420 1.00 0.00 N ATOM 1428 CA LEU A 87 -30.029 -16.887 -16.932 1.00 0.00 C ATOM 1429 C LEU A 87 -31.357 -16.580 -16.236 1.00 0.00 C ATOM 1430 O LEU A 87 -32.369 -17.226 -16.522 1.00 0.00 O ATOM 1431 CB LEU A 87 -29.776 -15.955 -18.119 1.00 0.00 C ATOM 1432 CG LEU A 87 -29.372 -14.520 -17.728 1.00 0.00 C ATOM 1433 CD1 LEU A 87 -28.213 -14.461 -16.717 1.00 0.00 C ATOM 1434 CD2 LEU A 87 -28.910 -13.845 -19.010 1.00 0.00 C ATOM 0 H LEU A 87 -30.964 -18.564 -17.733 1.00 0.00 H new ATOM 0 HA LEU A 87 -29.235 -16.739 -16.200 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -28.990 -16.384 -18.741 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -30.678 -15.912 -18.730 1.00 0.00 H new ATOM 0 HG LEU A 87 -30.227 -14.037 -17.255 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -27.983 -13.421 -16.488 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -28.501 -14.979 -15.802 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -27.333 -14.942 -17.144 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -28.610 -12.820 -18.794 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -28.063 -14.392 -19.424 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -29.726 -13.839 -19.733 1.00 0.00 H new ATOM 1446 N VAL A 88 -31.366 -15.578 -15.355 1.00 0.00 N ATOM 1447 CA VAL A 88 -32.536 -15.121 -14.607 1.00 0.00 C ATOM 1448 C VAL A 88 -32.539 -13.574 -14.634 1.00 0.00 C ATOM 1449 O VAL A 88 -31.487 -12.977 -14.898 1.00 0.00 O ATOM 1450 CB VAL A 88 -32.525 -15.721 -13.175 1.00 0.00 C ATOM 1451 CG1 VAL A 88 -32.449 -17.258 -13.174 1.00 0.00 C ATOM 1452 CG2 VAL A 88 -31.393 -15.163 -12.308 1.00 0.00 C ATOM 0 H VAL A 88 -30.526 -15.043 -15.135 1.00 0.00 H new ATOM 0 HA VAL A 88 -33.465 -15.468 -15.060 1.00 0.00 H new ATOM 0 HB VAL A 88 -33.478 -15.419 -12.742 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -32.444 -17.621 -12.146 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -33.313 -17.665 -13.699 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -31.536 -17.577 -13.676 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -31.435 -15.618 -11.318 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -30.433 -15.391 -12.772 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -31.504 -14.083 -12.216 1.00 0.00 H new ATOM 1462 N PRO A 89 -33.687 -12.911 -14.400 1.00 0.00 N ATOM 1463 CA PRO A 89 -33.788 -11.460 -14.485 1.00 0.00 C ATOM 1464 C PRO A 89 -33.135 -10.780 -13.272 1.00 0.00 C ATOM 1465 O PRO A 89 -32.860 -11.421 -12.249 1.00 0.00 O ATOM 1466 CB PRO A 89 -35.287 -11.168 -14.585 1.00 0.00 C ATOM 1467 CG PRO A 89 -35.932 -12.323 -13.830 1.00 0.00 C ATOM 1468 CD PRO A 89 -34.979 -13.489 -14.075 1.00 0.00 C ATOM 0 HA PRO A 89 -33.254 -11.061 -15.347 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -35.538 -10.207 -14.137 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -35.620 -11.133 -15.622 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -36.030 -12.102 -12.767 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -36.933 -12.538 -14.205 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -34.908 -14.123 -13.191 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -35.338 -14.117 -14.890 1.00 0.00 H new ATOM 1476 N ARG A 90 -32.893 -9.470 -13.394 1.00 0.00 N ATOM 1477 CA ARG A 90 -32.419 -8.627 -12.301 1.00 0.00 C ATOM 1478 C ARG A 90 -33.415 -8.674 -11.144 1.00 0.00 C ATOM 1479 O ARG A 90 -34.639 -8.553 -11.395 1.00 0.00 O ATOM 1480 CB ARG A 90 -32.195 -7.196 -12.778 1.00 0.00 C ATOM 1481 CG ARG A 90 -31.096 -7.091 -13.850 1.00 0.00 C ATOM 1482 CD ARG A 90 -29.704 -7.617 -13.457 1.00 0.00 C ATOM 1483 NE ARG A 90 -29.158 -6.939 -12.265 1.00 0.00 N ATOM 1484 CZ ARG A 90 -28.035 -7.273 -11.612 1.00 0.00 C ATOM 1485 NH1 ARG A 90 -27.280 -8.293 -12.022 1.00 0.00 N ATOM 1486 NH2 ARG A 90 -27.665 -6.574 -10.540 1.00 0.00 N ATOM 1487 OXT ARG A 90 -32.973 -8.806 -9.978 1.00 0.00 O ATOM 0 H ARG A 90 -33.024 -8.963 -14.269 1.00 0.00 H new ATOM 0 HA ARG A 90 -31.460 -9.008 -11.950 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -33.128 -6.802 -13.181 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -31.926 -6.572 -11.926 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -31.429 -7.634 -14.735 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -30.997 -6.044 -14.137 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -29.765 -8.688 -13.265 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -29.019 -7.481 -14.294 1.00 0.00 H new ATOM 0 HE ARG A 90 -29.683 -6.143 -11.904 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -27.554 -8.832 -12.843 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -26.429 -8.534 -11.514 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -28.235 -5.790 -10.221 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -26.812 -6.822 -10.039 1.00 0.00 H new TER 1501 ARG A 90