USER MOD reduce.3.24.130724 H: found=0, std=0, add=943, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 943 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 69 ASN :FLIP amide:sc= -0.21 F(o=-0.85!,f=1) USER MOD Set 1.2: A 112 TYR OH : rot 172:sc= 1.23 USER MOD Set 2.1: A 105 ASN : amide:sc= -2.72! C(o=-2.6!,f=-2.3!) USER MOD Set 2.2: A 109 THR OG1 : rot 180:sc= 0.0777 USER MOD Set 3.1: A 63 THR OG1 : rot 180:sc= 0.0365 USER MOD Set 3.2: A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot 180:sc= 0.0323 USER MOD Single : A 15 GLN : amide:sc=-0.00737 K(o=-0.0074,f=-0.53) USER MOD Single : A 17 GLN : amide:sc= -0.172 X(o=-0.17,f=-0.01) USER MOD Single : A 20 SER OG : rot 180:sc= 0.071 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot -27:sc= 1.39 USER MOD Single : A 60 SER OG : rot 105:sc= 0.367 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 129:sc= 1.2 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0.662 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot -120:sc= -0.0253 USER MOD Single : A 114 LYS NZ :NH3+ 167:sc= 1.17 (180deg=1.03) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 133 HIS : no HE2:sc= 0.925 K(o=0.92,f=-2.8!) USER MOD Single : A 134 THR OG1 : rot 97:sc= 1.15 USER MOD Single : A 138 SER OG : rot 30:sc= 0.0599 USER MOD Single : A 141 ASN : amide:sc= -0.17 K(o=-0.17,f=-3.6) USER MOD ----------------------------------------------------------------- ATOM 31 N GLY A 4 -16.726 12.495 -1.951 1.00 0.00 N ATOM 32 CA GLY A 4 -15.891 11.901 -0.909 1.00 0.00 C ATOM 33 C GLY A 4 -15.048 12.971 -0.206 1.00 0.00 C ATOM 34 O GLY A 4 -15.460 14.128 -0.105 1.00 0.00 O ATOM 0 HA2 GLY A 4 -16.521 11.391 -0.180 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -15.237 11.147 -1.347 1.00 0.00 H new ATOM 38 N GLU A 5 -13.840 12.608 0.224 1.00 0.00 N ATOM 39 CA GLU A 5 -12.879 13.440 0.937 1.00 0.00 C ATOM 40 C GLU A 5 -11.460 13.102 0.436 1.00 0.00 C ATOM 41 O GLU A 5 -10.820 12.205 0.980 1.00 0.00 O ATOM 42 CB GLU A 5 -13.066 13.185 2.448 1.00 0.00 C ATOM 43 CG GLU A 5 -12.162 14.076 3.307 1.00 0.00 C ATOM 44 CD GLU A 5 -12.443 13.898 4.802 1.00 0.00 C ATOM 45 OE1 GLU A 5 -13.474 14.422 5.282 1.00 0.00 O ATOM 46 OE2 GLU A 5 -11.610 13.293 5.518 1.00 0.00 O ATOM 0 H GLU A 5 -13.487 11.663 0.072 1.00 0.00 H new ATOM 0 HA GLU A 5 -13.034 14.503 0.754 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -14.107 13.362 2.717 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -12.853 12.138 2.666 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -11.118 13.839 3.103 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -12.312 15.120 3.031 1.00 0.00 H new ATOM 53 N PRO A 6 -10.964 13.754 -0.634 1.00 0.00 N ATOM 54 CA PRO A 6 -9.627 13.501 -1.175 1.00 0.00 C ATOM 55 C PRO A 6 -8.541 14.130 -0.277 1.00 0.00 C ATOM 56 O PRO A 6 -8.795 15.160 0.358 1.00 0.00 O ATOM 57 CB PRO A 6 -9.643 14.166 -2.547 1.00 0.00 C ATOM 58 CG PRO A 6 -10.600 15.344 -2.373 1.00 0.00 C ATOM 59 CD PRO A 6 -11.624 14.824 -1.367 1.00 0.00 C ATOM 0 HA PRO A 6 -9.397 12.437 -1.229 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -8.648 14.500 -2.841 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -9.990 13.480 -3.320 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -10.084 16.229 -2.000 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -11.070 15.623 -3.316 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -11.945 15.618 -0.692 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -12.516 14.456 -1.874 1.00 0.00 H new ATOM 67 N LEU A 7 -7.327 13.572 -0.212 1.00 0.00 N ATOM 68 CA LEU A 7 -6.223 14.088 0.584 1.00 0.00 C ATOM 69 C LEU A 7 -5.070 14.246 -0.383 1.00 0.00 C ATOM 70 O LEU A 7 -4.592 13.254 -0.926 1.00 0.00 O ATOM 71 CB LEU A 7 -5.881 13.206 1.797 1.00 0.00 C ATOM 72 CG LEU A 7 -5.409 13.921 3.077 1.00 0.00 C ATOM 73 CD1 LEU A 7 -4.449 15.091 2.830 1.00 0.00 C ATOM 74 CD2 LEU A 7 -6.606 14.378 3.909 1.00 0.00 C ATOM 0 H LEU A 7 -7.085 12.726 -0.728 1.00 0.00 H new ATOM 0 HA LEU A 7 -6.484 15.041 1.044 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -6.763 12.616 2.045 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -5.103 12.504 1.496 1.00 0.00 H new ATOM 0 HG LEU A 7 -4.834 13.180 3.632 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -4.167 15.537 3.783 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -3.556 14.728 2.321 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -4.941 15.840 2.210 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -6.253 14.881 4.809 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -7.214 15.067 3.323 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -7.206 13.512 4.189 1.00 0.00 H new ATOM 86 N VAL A 8 -4.657 15.474 -0.646 1.00 0.00 N ATOM 87 CA VAL A 8 -3.566 15.760 -1.562 1.00 0.00 C ATOM 88 C VAL A 8 -2.468 16.494 -0.792 1.00 0.00 C ATOM 89 O VAL A 8 -2.714 17.536 -0.176 1.00 0.00 O ATOM 90 CB VAL A 8 -4.073 16.520 -2.801 1.00 0.00 C ATOM 91 CG1 VAL A 8 -2.960 16.718 -3.842 1.00 0.00 C ATOM 92 CG2 VAL A 8 -5.205 15.736 -3.483 1.00 0.00 C ATOM 0 H VAL A 8 -5.072 16.306 -0.227 1.00 0.00 H new ATOM 0 HA VAL A 8 -3.136 14.838 -1.953 1.00 0.00 H new ATOM 0 HB VAL A 8 -4.424 17.490 -2.450 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -3.357 17.258 -4.701 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -2.145 17.290 -3.399 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -2.587 15.746 -4.165 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -5.553 16.286 -4.357 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -4.835 14.759 -3.793 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -6.031 15.607 -2.783 1.00 0.00 H new ATOM 102 N GLY A 9 -1.276 15.914 -0.808 1.00 0.00 N ATOM 103 CA GLY A 9 -0.060 16.410 -0.187 1.00 0.00 C ATOM 104 C GLY A 9 0.689 17.290 -1.176 1.00 0.00 C ATOM 105 O GLY A 9 0.078 17.895 -2.070 1.00 0.00 O ATOM 0 H GLY A 9 -1.125 15.026 -1.287 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -0.303 16.978 0.711 1.00 0.00 H new ATOM 0 HA3 GLY A 9 0.569 15.576 0.124 1.00 0.00 H new ATOM 109 N GLY A 10 2.005 17.383 -1.021 1.00 0.00 N ATOM 110 CA GLY A 10 2.836 18.172 -1.901 1.00 0.00 C ATOM 111 C GLY A 10 4.292 17.790 -1.755 1.00 0.00 C ATOM 112 O GLY A 10 4.841 17.130 -2.636 1.00 0.00 O ATOM 0 H GLY A 10 2.519 16.910 -0.278 1.00 0.00 H new ATOM 0 HA2 GLY A 10 2.520 18.026 -2.934 1.00 0.00 H new ATOM 0 HA3 GLY A 10 2.709 19.231 -1.675 1.00 0.00 H new ATOM 116 N ASP A 11 4.902 18.232 -0.654 1.00 0.00 N ATOM 117 CA ASP A 11 6.314 17.973 -0.368 1.00 0.00 C ATOM 118 C ASP A 11 6.714 18.104 1.098 1.00 0.00 C ATOM 119 O ASP A 11 7.753 17.583 1.510 1.00 0.00 O ATOM 120 CB ASP A 11 7.181 18.950 -1.174 1.00 0.00 C ATOM 121 CG ASP A 11 7.071 20.391 -0.649 1.00 0.00 C ATOM 122 OD1 ASP A 11 6.021 21.025 -0.913 1.00 0.00 O ATOM 123 OD2 ASP A 11 8.016 20.885 0.015 1.00 0.00 O ATOM 0 H ASP A 11 4.430 18.780 0.065 1.00 0.00 H new ATOM 0 HA ASP A 11 6.473 16.931 -0.647 1.00 0.00 H new ATOM 0 HB2 ASP A 11 8.222 18.629 -1.133 1.00 0.00 H new ATOM 0 HB3 ASP A 11 6.879 18.922 -2.221 1.00 0.00 H new ATOM 128 N THR A 12 5.941 18.850 1.874 1.00 0.00 N ATOM 129 CA THR A 12 6.179 19.055 3.290 1.00 0.00 C ATOM 130 C THR A 12 5.603 17.846 4.007 1.00 0.00 C ATOM 131 O THR A 12 4.402 17.581 3.912 1.00 0.00 O ATOM 132 CB THR A 12 5.567 20.353 3.804 1.00 0.00 C ATOM 133 OG1 THR A 12 4.326 20.676 3.192 1.00 0.00 O ATOM 134 CG2 THR A 12 6.479 21.546 3.525 1.00 0.00 C ATOM 0 H THR A 12 5.115 19.338 1.527 1.00 0.00 H new ATOM 0 HA THR A 12 7.248 19.152 3.479 1.00 0.00 H new ATOM 0 HB THR A 12 5.427 20.177 4.870 1.00 0.00 H new ATOM 0 HG1 THR A 12 3.986 21.516 3.565 1.00 0.00 H new ATOM 0 HG21 THR A 12 6.014 22.456 3.904 1.00 0.00 H new ATOM 0 HG22 THR A 12 7.438 21.395 4.021 1.00 0.00 H new ATOM 0 HG23 THR A 12 6.637 21.640 2.451 1.00 0.00 H new ATOM 142 N ASP A 13 6.486 17.138 4.691 1.00 0.00 N ATOM 143 CA ASP A 13 6.194 15.930 5.426 1.00 0.00 C ATOM 144 C ASP A 13 5.135 16.124 6.491 1.00 0.00 C ATOM 145 O ASP A 13 5.168 17.074 7.278 1.00 0.00 O ATOM 146 CB ASP A 13 7.455 15.241 5.943 1.00 0.00 C ATOM 147 CG ASP A 13 8.168 15.896 7.119 1.00 0.00 C ATOM 148 OD1 ASP A 13 8.688 17.028 6.958 1.00 0.00 O ATOM 149 OD2 ASP A 13 8.324 15.198 8.149 1.00 0.00 O ATOM 0 H ASP A 13 7.468 17.406 4.748 1.00 0.00 H new ATOM 0 HA ASP A 13 5.752 15.239 4.709 1.00 0.00 H new ATOM 0 HB2 ASP A 13 7.191 14.223 6.231 1.00 0.00 H new ATOM 0 HB3 ASP A 13 8.163 15.165 5.117 1.00 0.00 H new ATOM 154 N ASP A 14 4.157 15.223 6.481 1.00 0.00 N ATOM 155 CA ASP A 14 3.027 15.177 7.400 1.00 0.00 C ATOM 156 C ASP A 14 2.406 13.788 7.267 1.00 0.00 C ATOM 157 O ASP A 14 3.047 12.878 6.726 1.00 0.00 O ATOM 158 CB ASP A 14 1.989 16.275 7.088 1.00 0.00 C ATOM 159 CG ASP A 14 1.375 16.812 8.385 1.00 0.00 C ATOM 160 OD1 ASP A 14 0.764 16.025 9.142 1.00 0.00 O ATOM 161 OD2 ASP A 14 1.535 18.029 8.661 1.00 0.00 O ATOM 0 H ASP A 14 4.131 14.467 5.796 1.00 0.00 H new ATOM 0 HA ASP A 14 3.364 15.361 8.420 1.00 0.00 H new ATOM 0 HB2 ASP A 14 2.464 17.088 6.539 1.00 0.00 H new ATOM 0 HB3 ASP A 14 1.205 15.872 6.446 1.00 0.00 H new ATOM 166 N GLN A 15 1.201 13.614 7.804 1.00 0.00 N ATOM 167 CA GLN A 15 0.406 12.411 7.773 1.00 0.00 C ATOM 168 C GLN A 15 -0.836 12.804 6.975 1.00 0.00 C ATOM 169 O GLN A 15 -1.499 13.792 7.303 1.00 0.00 O ATOM 170 CB GLN A 15 0.084 11.943 9.195 1.00 0.00 C ATOM 171 CG GLN A 15 1.307 11.436 9.977 1.00 0.00 C ATOM 172 CD GLN A 15 1.218 11.594 11.486 1.00 0.00 C ATOM 173 OE1 GLN A 15 0.661 12.545 12.037 1.00 0.00 O ATOM 174 NE2 GLN A 15 1.805 10.654 12.197 1.00 0.00 N ATOM 0 H GLN A 15 0.731 14.368 8.305 1.00 0.00 H new ATOM 0 HA GLN A 15 0.915 11.564 7.312 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -0.370 12.768 9.744 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -0.659 11.147 9.145 1.00 0.00 H new ATOM 0 HG2 GLN A 15 1.455 10.381 9.746 1.00 0.00 H new ATOM 0 HG3 GLN A 15 2.191 11.967 9.623 1.00 0.00 H new ATOM 0 HE21 GLN A 15 2.263 9.872 11.729 1.00 0.00 H new ATOM 0 HE22 GLN A 15 1.802 10.708 13.216 1.00 0.00 H new ATOM 183 N LEU A 16 -1.152 12.034 5.937 1.00 0.00 N ATOM 184 CA LEU A 16 -2.260 12.243 5.023 1.00 0.00 C ATOM 185 C LEU A 16 -3.206 11.052 5.125 1.00 0.00 C ATOM 186 O LEU A 16 -3.005 10.042 4.455 1.00 0.00 O ATOM 187 CB LEU A 16 -1.724 12.399 3.593 1.00 0.00 C ATOM 188 CG LEU A 16 -0.568 13.385 3.335 1.00 0.00 C ATOM 189 CD1 LEU A 16 0.819 12.795 3.642 1.00 0.00 C ATOM 190 CD2 LEU A 16 -0.573 13.692 1.838 1.00 0.00 C ATOM 0 H LEU A 16 -0.609 11.203 5.702 1.00 0.00 H new ATOM 0 HA LEU A 16 -2.803 13.152 5.282 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -1.400 11.415 3.253 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -2.559 12.697 2.959 1.00 0.00 H new ATOM 0 HG LEU A 16 -0.724 14.250 3.979 1.00 0.00 H new ATOM 0 HD11 LEU A 16 1.586 13.543 3.438 1.00 0.00 H new ATOM 0 HD12 LEU A 16 0.866 12.503 4.691 1.00 0.00 H new ATOM 0 HD13 LEU A 16 0.989 11.920 3.014 1.00 0.00 H new ATOM 0 HD21 LEU A 16 0.232 14.389 1.607 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -0.426 12.769 1.277 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -1.529 14.137 1.561 1.00 0.00 H new ATOM 202 N GLN A 17 -4.256 11.149 5.933 1.00 0.00 N ATOM 203 CA GLN A 17 -5.221 10.076 6.140 1.00 0.00 C ATOM 204 C GLN A 17 -6.598 10.495 5.634 1.00 0.00 C ATOM 205 O GLN A 17 -7.223 11.402 6.186 1.00 0.00 O ATOM 206 CB GLN A 17 -5.240 9.652 7.614 1.00 0.00 C ATOM 207 CG GLN A 17 -3.922 8.947 8.011 1.00 0.00 C ATOM 208 CD GLN A 17 -3.345 9.382 9.352 1.00 0.00 C ATOM 209 OE1 GLN A 17 -2.906 8.548 10.146 1.00 0.00 O ATOM 210 NE2 GLN A 17 -3.290 10.673 9.624 1.00 0.00 N ATOM 0 H GLN A 17 -4.464 11.990 6.472 1.00 0.00 H new ATOM 0 HA GLN A 17 -4.920 9.203 5.561 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -5.391 10.528 8.245 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -6.081 8.982 7.792 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -4.095 7.871 8.037 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -3.179 9.131 7.235 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -3.658 11.351 8.956 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -2.880 10.992 10.502 1.00 0.00 H new ATOM 219 N GLY A 18 -7.072 9.860 4.564 1.00 0.00 N ATOM 220 CA GLY A 18 -8.378 10.156 3.996 1.00 0.00 C ATOM 221 C GLY A 18 -9.462 9.653 4.944 1.00 0.00 C ATOM 222 O GLY A 18 -10.367 10.411 5.292 1.00 0.00 O ATOM 0 H GLY A 18 -6.560 9.129 4.070 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -8.485 11.229 3.839 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -8.481 9.679 3.021 1.00 0.00 H new ATOM 226 N GLY A 19 -9.310 8.425 5.444 1.00 0.00 N ATOM 227 CA GLY A 19 -10.222 7.757 6.365 1.00 0.00 C ATOM 228 C GLY A 19 -11.183 6.851 5.600 1.00 0.00 C ATOM 229 O GLY A 19 -11.585 7.181 4.485 1.00 0.00 O ATOM 0 H GLY A 19 -8.507 7.844 5.204 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -9.654 7.169 7.086 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -10.785 8.499 6.931 1.00 0.00 H new ATOM 233 N SER A 20 -11.563 5.728 6.219 1.00 0.00 N ATOM 234 CA SER A 20 -12.460 4.701 5.685 1.00 0.00 C ATOM 235 C SER A 20 -13.650 5.288 4.910 1.00 0.00 C ATOM 236 O SER A 20 -14.441 6.055 5.466 1.00 0.00 O ATOM 237 CB SER A 20 -12.939 3.772 6.805 1.00 0.00 C ATOM 238 OG SER A 20 -12.712 4.279 8.116 1.00 0.00 O ATOM 0 H SER A 20 -11.234 5.500 7.157 1.00 0.00 H new ATOM 0 HA SER A 20 -11.883 4.121 4.965 1.00 0.00 H new ATOM 0 HB2 SER A 20 -14.006 3.587 6.678 1.00 0.00 H new ATOM 0 HB3 SER A 20 -12.435 2.811 6.706 1.00 0.00 H new ATOM 0 HG SER A 20 -13.043 3.636 8.777 1.00 0.00 H new ATOM 244 N GLY A 21 -13.815 4.864 3.660 1.00 0.00 N ATOM 245 CA GLY A 21 -14.835 5.276 2.721 1.00 0.00 C ATOM 246 C GLY A 21 -14.341 4.895 1.326 1.00 0.00 C ATOM 247 O GLY A 21 -13.956 3.735 1.150 1.00 0.00 O ATOM 0 H GLY A 21 -13.187 4.170 3.254 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -15.783 4.785 2.942 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -15.009 6.350 2.788 1.00 0.00 H new ATOM 251 N ALA A 22 -14.686 5.662 0.283 1.00 0.00 N ATOM 252 CA ALA A 22 -14.173 5.429 -1.066 1.00 0.00 C ATOM 253 C ALA A 22 -13.553 6.794 -1.300 1.00 0.00 C ATOM 254 O ALA A 22 -14.232 7.665 -1.852 1.00 0.00 O ATOM 255 CB ALA A 22 -15.269 5.052 -2.070 1.00 0.00 C ATOM 0 H ALA A 22 -15.324 6.455 0.353 1.00 0.00 H new ATOM 0 HA ALA A 22 -13.492 4.586 -1.184 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -14.824 4.892 -3.052 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -15.763 4.137 -1.743 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -16.000 5.858 -2.130 1.00 0.00 H new ATOM 261 N ASP A 23 -12.269 6.962 -1.009 1.00 0.00 N ATOM 262 CA ASP A 23 -11.564 8.240 -1.085 1.00 0.00 C ATOM 263 C ASP A 23 -10.291 8.184 -1.939 1.00 0.00 C ATOM 264 O ASP A 23 -9.956 7.134 -2.503 1.00 0.00 O ATOM 265 CB ASP A 23 -11.577 8.849 0.329 1.00 0.00 C ATOM 266 CG ASP A 23 -13.030 9.264 0.625 1.00 0.00 C ATOM 267 OD1 ASP A 23 -13.577 10.007 -0.220 1.00 0.00 O ATOM 268 OD2 ASP A 23 -13.711 8.776 1.556 1.00 0.00 O ATOM 0 H ASP A 23 -11.671 6.193 -0.705 1.00 0.00 H new ATOM 0 HA ASP A 23 -12.062 8.996 -1.692 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -11.225 8.125 1.064 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -10.911 9.710 0.385 1.00 0.00 H new ATOM 273 N ARG A 24 -9.714 9.353 -2.269 1.00 0.00 N ATOM 274 CA ARG A 24 -8.532 9.457 -3.136 1.00 0.00 C ATOM 275 C ARG A 24 -7.401 10.280 -2.515 1.00 0.00 C ATOM 276 O ARG A 24 -7.474 11.511 -2.448 1.00 0.00 O ATOM 277 CB ARG A 24 -8.914 10.059 -4.498 1.00 0.00 C ATOM 278 CG ARG A 24 -9.973 9.316 -5.333 1.00 0.00 C ATOM 279 CD ARG A 24 -11.408 9.537 -4.845 1.00 0.00 C ATOM 280 NE ARG A 24 -12.412 9.319 -5.898 1.00 0.00 N ATOM 281 CZ ARG A 24 -13.546 8.617 -5.783 1.00 0.00 C ATOM 282 NH1 ARG A 24 -13.765 7.810 -4.752 1.00 0.00 N ATOM 283 NH2 ARG A 24 -14.476 8.736 -6.723 1.00 0.00 N ATOM 0 H ARG A 24 -10.058 10.255 -1.939 1.00 0.00 H new ATOM 0 HA ARG A 24 -8.161 8.441 -3.266 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -9.272 11.075 -4.328 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -8.007 10.137 -5.098 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -9.898 9.640 -6.371 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -9.753 8.249 -5.316 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -11.611 8.864 -4.012 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -11.504 10.554 -4.464 1.00 0.00 H new ATOM 0 HE ARG A 24 -12.226 9.745 -6.806 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -13.060 7.713 -4.022 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -14.639 7.287 -4.690 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -14.321 9.356 -7.518 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -15.346 8.208 -6.650 1.00 0.00 H new ATOM 297 N LEU A 25 -6.334 9.590 -2.137 1.00 0.00 N ATOM 298 CA LEU A 25 -5.126 10.102 -1.508 1.00 0.00 C ATOM 299 C LEU A 25 -4.021 10.293 -2.556 1.00 0.00 C ATOM 300 O LEU A 25 -3.871 9.451 -3.449 1.00 0.00 O ATOM 301 CB LEU A 25 -4.642 8.994 -0.541 1.00 0.00 C ATOM 302 CG LEU A 25 -4.213 9.453 0.848 1.00 0.00 C ATOM 303 CD1 LEU A 25 -3.157 10.546 0.789 1.00 0.00 C ATOM 304 CD2 LEU A 25 -5.413 9.902 1.672 1.00 0.00 C ATOM 0 H LEU A 25 -6.288 8.580 -2.273 1.00 0.00 H new ATOM 0 HA LEU A 25 -5.330 11.052 -1.014 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -5.443 8.264 -0.428 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -3.802 8.477 -1.005 1.00 0.00 H new ATOM 0 HG LEU A 25 -3.760 8.593 1.342 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -2.882 10.841 1.802 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -2.275 10.172 0.268 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -3.556 11.409 0.255 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -5.077 10.224 2.658 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -5.910 10.732 1.169 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -6.111 9.072 1.780 1.00 0.00 H new ATOM 316 N ASP A 26 -3.193 11.328 -2.421 1.00 0.00 N ATOM 317 CA ASP A 26 -2.079 11.627 -3.333 1.00 0.00 C ATOM 318 C ASP A 26 -1.023 12.389 -2.564 1.00 0.00 C ATOM 319 O ASP A 26 -1.265 13.513 -2.147 1.00 0.00 O ATOM 320 CB ASP A 26 -2.629 12.456 -4.514 1.00 0.00 C ATOM 321 CG ASP A 26 -1.713 12.615 -5.732 1.00 0.00 C ATOM 322 OD1 ASP A 26 -0.468 12.637 -5.610 1.00 0.00 O ATOM 323 OD2 ASP A 26 -2.262 12.809 -6.848 1.00 0.00 O ATOM 0 H ASP A 26 -3.276 12.000 -1.658 1.00 0.00 H new ATOM 0 HA ASP A 26 -1.627 10.717 -3.728 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -3.560 11.997 -4.847 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -2.878 13.451 -4.144 1.00 0.00 H new ATOM 328 N GLY A 27 0.118 11.764 -2.297 1.00 0.00 N ATOM 329 CA GLY A 27 1.192 12.403 -1.563 1.00 0.00 C ATOM 330 C GLY A 27 1.876 13.449 -2.427 1.00 0.00 C ATOM 331 O GLY A 27 1.733 14.652 -2.212 1.00 0.00 O ATOM 0 H GLY A 27 0.319 10.806 -2.583 1.00 0.00 H new ATOM 0 HA2 GLY A 27 0.797 12.870 -0.661 1.00 0.00 H new ATOM 0 HA3 GLY A 27 1.918 11.655 -1.243 1.00 0.00 H new ATOM 335 N GLY A 28 2.550 12.991 -3.472 1.00 0.00 N ATOM 336 CA GLY A 28 3.310 13.823 -4.393 1.00 0.00 C ATOM 337 C GLY A 28 4.746 13.318 -4.366 1.00 0.00 C ATOM 338 O GLY A 28 5.159 12.677 -5.334 1.00 0.00 O ATOM 0 H GLY A 28 2.584 12.000 -3.709 1.00 0.00 H new ATOM 0 HA2 GLY A 28 2.898 13.760 -5.400 1.00 0.00 H new ATOM 0 HA3 GLY A 28 3.264 14.870 -4.095 1.00 0.00 H new ATOM 342 N ALA A 29 5.492 13.621 -3.296 1.00 0.00 N ATOM 343 CA ALA A 29 6.875 13.221 -3.061 1.00 0.00 C ATOM 344 C ALA A 29 7.217 13.469 -1.584 1.00 0.00 C ATOM 345 O ALA A 29 6.472 14.193 -0.917 1.00 0.00 O ATOM 346 CB ALA A 29 7.786 14.108 -3.915 1.00 0.00 C ATOM 0 H ALA A 29 5.120 14.184 -2.531 1.00 0.00 H new ATOM 0 HA ALA A 29 7.010 12.169 -3.313 1.00 0.00 H new ATOM 0 HB1 ALA A 29 8.826 13.824 -3.753 1.00 0.00 H new ATOM 0 HB2 ALA A 29 7.535 13.981 -4.968 1.00 0.00 H new ATOM 0 HB3 ALA A 29 7.647 15.151 -3.633 1.00 0.00 H new ATOM 352 N GLY A 30 8.358 12.956 -1.097 1.00 0.00 N ATOM 353 CA GLY A 30 8.803 13.156 0.276 1.00 0.00 C ATOM 354 C GLY A 30 9.027 11.878 1.077 1.00 0.00 C ATOM 355 O GLY A 30 9.292 10.811 0.525 1.00 0.00 O ATOM 0 H GLY A 30 8.996 12.388 -1.655 1.00 0.00 H new ATOM 0 HA2 GLY A 30 9.733 13.724 0.261 1.00 0.00 H new ATOM 0 HA3 GLY A 30 8.065 13.767 0.795 1.00 0.00 H new ATOM 359 N ASP A 31 8.987 12.046 2.399 1.00 0.00 N ATOM 360 CA ASP A 31 9.110 11.091 3.490 1.00 0.00 C ATOM 361 C ASP A 31 7.870 11.272 4.373 1.00 0.00 C ATOM 362 O ASP A 31 7.902 11.454 5.599 1.00 0.00 O ATOM 363 CB ASP A 31 10.419 11.286 4.248 1.00 0.00 C ATOM 364 CG ASP A 31 10.754 10.121 5.200 1.00 0.00 C ATOM 365 OD1 ASP A 31 9.896 9.255 5.477 1.00 0.00 O ATOM 366 OD2 ASP A 31 11.885 10.087 5.748 1.00 0.00 O ATOM 0 H ASP A 31 8.849 12.984 2.774 1.00 0.00 H new ATOM 0 HA ASP A 31 9.150 10.066 3.123 1.00 0.00 H new ATOM 0 HB2 ASP A 31 11.231 11.405 3.531 1.00 0.00 H new ATOM 0 HB3 ASP A 31 10.363 12.211 4.823 1.00 0.00 H new ATOM 371 N ASP A 32 6.741 11.321 3.682 1.00 0.00 N ATOM 372 CA ASP A 32 5.396 11.497 4.187 1.00 0.00 C ATOM 373 C ASP A 32 4.766 10.132 4.400 1.00 0.00 C ATOM 374 O ASP A 32 5.311 9.091 4.024 1.00 0.00 O ATOM 375 CB ASP A 32 4.499 12.300 3.247 1.00 0.00 C ATOM 376 CG ASP A 32 4.969 13.721 2.932 1.00 0.00 C ATOM 377 OD1 ASP A 32 6.169 13.957 2.660 1.00 0.00 O ATOM 378 OD2 ASP A 32 4.115 14.631 3.043 1.00 0.00 O ATOM 0 H ASP A 32 6.748 11.230 2.666 1.00 0.00 H new ATOM 0 HA ASP A 32 5.478 12.057 5.119 1.00 0.00 H new ATOM 0 HB2 ASP A 32 4.405 11.752 2.309 1.00 0.00 H new ATOM 0 HB3 ASP A 32 3.503 12.356 3.685 1.00 0.00 H new ATOM 383 N ILE A 33 3.660 10.140 5.128 1.00 0.00 N ATOM 384 CA ILE A 33 2.893 8.936 5.435 1.00 0.00 C ATOM 385 C ILE A 33 1.470 9.161 4.937 1.00 0.00 C ATOM 386 O ILE A 33 0.801 10.083 5.401 1.00 0.00 O ATOM 387 CB ILE A 33 3.021 8.544 6.922 1.00 0.00 C ATOM 388 CG1 ILE A 33 2.321 7.210 7.247 1.00 0.00 C ATOM 389 CG2 ILE A 33 2.539 9.613 7.856 1.00 0.00 C ATOM 390 CD1 ILE A 33 2.737 6.623 8.604 1.00 0.00 C ATOM 0 H ILE A 33 3.263 10.990 5.528 1.00 0.00 H new ATOM 0 HA ILE A 33 3.289 8.063 4.916 1.00 0.00 H new ATOM 0 HB ILE A 33 4.091 8.417 7.084 1.00 0.00 H new ATOM 0 HG12 ILE A 33 1.242 7.362 7.240 1.00 0.00 H new ATOM 0 HG13 ILE A 33 2.546 6.488 6.462 1.00 0.00 H new ATOM 0 HG21 ILE A 33 2.656 9.276 8.886 1.00 0.00 H new ATOM 0 HG22 ILE A 33 3.123 10.520 7.703 1.00 0.00 H new ATOM 0 HG23 ILE A 33 1.487 9.821 7.659 1.00 0.00 H new ATOM 0 HD11 ILE A 33 2.208 5.685 8.772 1.00 0.00 H new ATOM 0 HD12 ILE A 33 3.811 6.440 8.607 1.00 0.00 H new ATOM 0 HD13 ILE A 33 2.487 7.327 9.397 1.00 0.00 H new ATOM 402 N LEU A 34 1.006 8.374 3.965 1.00 0.00 N ATOM 403 CA LEU A 34 -0.332 8.508 3.408 1.00 0.00 C ATOM 404 C LEU A 34 -1.133 7.227 3.606 1.00 0.00 C ATOM 405 O LEU A 34 -0.591 6.122 3.602 1.00 0.00 O ATOM 406 CB LEU A 34 -0.367 9.064 1.972 1.00 0.00 C ATOM 407 CG LEU A 34 0.506 8.321 0.984 1.00 0.00 C ATOM 408 CD1 LEU A 34 -0.220 8.298 -0.370 1.00 0.00 C ATOM 409 CD2 LEU A 34 1.890 8.960 0.826 1.00 0.00 C ATOM 0 H LEU A 34 1.554 7.624 3.543 1.00 0.00 H new ATOM 0 HA LEU A 34 -0.837 9.287 3.980 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -1.396 9.043 1.614 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -0.059 10.109 1.994 1.00 0.00 H new ATOM 0 HG LEU A 34 0.671 7.311 1.359 1.00 0.00 H new ATOM 0 HD11 LEU A 34 0.390 7.767 -1.101 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -1.179 7.791 -0.260 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -0.387 9.320 -0.711 1.00 0.00 H new ATOM 0 HD21 LEU A 34 2.475 8.388 0.106 1.00 0.00 H new ATOM 0 HD22 LEU A 34 1.779 9.985 0.471 1.00 0.00 H new ATOM 0 HD23 LEU A 34 2.401 8.963 1.789 1.00 0.00 H new ATOM 421 N ASP A 35 -2.441 7.389 3.792 1.00 0.00 N ATOM 422 CA ASP A 35 -3.402 6.321 4.003 1.00 0.00 C ATOM 423 C ASP A 35 -4.728 6.685 3.383 1.00 0.00 C ATOM 424 O ASP A 35 -5.305 7.702 3.765 1.00 0.00 O ATOM 425 CB ASP A 35 -3.666 6.081 5.501 1.00 0.00 C ATOM 426 CG ASP A 35 -4.663 4.933 5.767 1.00 0.00 C ATOM 427 OD1 ASP A 35 -4.829 4.041 4.907 1.00 0.00 O ATOM 428 OD2 ASP A 35 -5.286 4.885 6.860 1.00 0.00 O ATOM 0 H ASP A 35 -2.875 8.312 3.799 1.00 0.00 H new ATOM 0 HA ASP A 35 -2.978 5.425 3.549 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -2.722 5.856 5.998 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -4.051 6.998 5.947 1.00 0.00 H new ATOM 433 N GLY A 36 -5.168 5.924 2.381 1.00 0.00 N ATOM 434 CA GLY A 36 -6.457 6.152 1.751 1.00 0.00 C ATOM 435 C GLY A 36 -7.481 6.054 2.876 1.00 0.00 C ATOM 436 O GLY A 36 -8.151 7.028 3.226 1.00 0.00 O ATOM 0 H GLY A 36 -4.643 5.141 1.990 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -6.492 7.130 1.272 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -6.652 5.410 0.976 1.00 0.00 H new ATOM 440 N GLY A 37 -7.477 4.888 3.507 1.00 0.00 N ATOM 441 CA GLY A 37 -8.300 4.472 4.610 1.00 0.00 C ATOM 442 C GLY A 37 -8.665 3.015 4.367 1.00 0.00 C ATOM 443 O GLY A 37 -8.367 2.444 3.314 1.00 0.00 O ATOM 0 H GLY A 37 -6.834 4.148 3.225 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -7.766 4.584 5.554 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -9.197 5.088 4.676 1.00 0.00 H new ATOM 447 N ALA A 38 -9.300 2.394 5.354 1.00 0.00 N ATOM 448 CA ALA A 38 -9.732 1.016 5.242 1.00 0.00 C ATOM 449 C ALA A 38 -10.964 1.072 4.330 1.00 0.00 C ATOM 450 O ALA A 38 -12.055 1.472 4.752 1.00 0.00 O ATOM 451 CB ALA A 38 -10.048 0.558 6.663 1.00 0.00 C ATOM 0 H ALA A 38 -9.526 2.832 6.247 1.00 0.00 H new ATOM 0 HA ALA A 38 -9.009 0.317 4.822 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -10.381 -0.480 6.645 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -9.153 0.641 7.280 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -10.836 1.185 7.081 1.00 0.00 H new ATOM 457 N GLY A 39 -10.826 0.616 3.092 1.00 0.00 N ATOM 458 CA GLY A 39 -11.871 0.617 2.109 1.00 0.00 C ATOM 459 C GLY A 39 -11.272 0.647 0.714 1.00 0.00 C ATOM 460 O GLY A 39 -10.063 0.507 0.538 1.00 0.00 O ATOM 0 H GLY A 39 -9.950 0.225 2.745 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -12.494 -0.270 2.227 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -12.518 1.482 2.255 1.00 0.00 H new ATOM 464 N ARG A 40 -12.139 0.702 -0.300 1.00 0.00 N ATOM 465 CA ARG A 40 -11.675 0.751 -1.671 1.00 0.00 C ATOM 466 C ARG A 40 -11.294 2.200 -1.934 1.00 0.00 C ATOM 467 O ARG A 40 -12.096 2.991 -2.434 1.00 0.00 O ATOM 468 CB ARG A 40 -12.732 0.193 -2.628 1.00 0.00 C ATOM 469 CG ARG A 40 -14.146 0.798 -2.641 1.00 0.00 C ATOM 470 CD ARG A 40 -15.047 0.294 -1.511 1.00 0.00 C ATOM 471 NE ARG A 40 -16.446 0.656 -1.773 1.00 0.00 N ATOM 472 CZ ARG A 40 -17.174 0.143 -2.772 1.00 0.00 C ATOM 473 NH1 ARG A 40 -16.771 -0.967 -3.390 1.00 0.00 N ATOM 474 NH2 ARG A 40 -18.277 0.752 -3.175 1.00 0.00 N ATOM 0 H ARG A 40 -13.153 0.713 -0.191 1.00 0.00 H new ATOM 0 HA ARG A 40 -10.805 0.117 -1.841 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -12.333 0.278 -3.639 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -12.835 -0.871 -2.414 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -14.067 1.883 -2.573 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -14.618 0.572 -3.597 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -14.956 -0.788 -1.419 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -14.725 0.723 -0.562 1.00 0.00 H new ATOM 0 HE ARG A 40 -16.889 1.338 -1.158 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -15.907 -1.426 -3.102 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -17.327 -1.357 -4.151 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -18.576 1.617 -2.724 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -18.828 0.357 -3.937 1.00 0.00 H new ATOM 488 N ASP A 41 -10.016 2.487 -1.798 1.00 0.00 N ATOM 489 CA ASP A 41 -9.468 3.820 -1.963 1.00 0.00 C ATOM 490 C ASP A 41 -8.389 3.835 -3.019 1.00 0.00 C ATOM 491 O ASP A 41 -7.915 2.782 -3.448 1.00 0.00 O ATOM 492 CB ASP A 41 -8.936 4.299 -0.607 1.00 0.00 C ATOM 493 CG ASP A 41 -10.003 5.077 0.146 1.00 0.00 C ATOM 494 OD1 ASP A 41 -11.174 4.640 0.201 1.00 0.00 O ATOM 495 OD2 ASP A 41 -9.673 6.202 0.559 1.00 0.00 O ATOM 0 H ASP A 41 -9.313 1.786 -1.565 1.00 0.00 H new ATOM 0 HA ASP A 41 -10.248 4.501 -2.304 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -8.617 3.443 -0.013 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -8.058 4.928 -0.757 1.00 0.00 H new ATOM 500 N ARG A 42 -8.083 5.031 -3.528 1.00 0.00 N ATOM 501 CA ARG A 42 -7.039 5.212 -4.521 1.00 0.00 C ATOM 502 C ARG A 42 -5.921 5.980 -3.845 1.00 0.00 C ATOM 503 O ARG A 42 -6.132 7.127 -3.458 1.00 0.00 O ATOM 504 CB ARG A 42 -7.533 5.937 -5.779 1.00 0.00 C ATOM 505 CG ARG A 42 -6.458 5.757 -6.869 1.00 0.00 C ATOM 506 CD ARG A 42 -6.786 6.436 -8.197 1.00 0.00 C ATOM 507 NE ARG A 42 -6.953 7.893 -8.056 1.00 0.00 N ATOM 508 CZ ARG A 42 -7.986 8.625 -8.488 1.00 0.00 C ATOM 509 NH1 ARG A 42 -9.089 8.059 -8.974 1.00 0.00 N ATOM 510 NH2 ARG A 42 -7.933 9.947 -8.423 1.00 0.00 N ATOM 0 H ARG A 42 -8.555 5.895 -3.260 1.00 0.00 H new ATOM 0 HA ARG A 42 -6.694 4.240 -4.873 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -8.487 5.525 -6.109 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -7.697 6.995 -5.573 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -5.512 6.151 -6.498 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -6.312 4.691 -7.046 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -5.990 6.232 -8.913 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -7.700 6.006 -8.606 1.00 0.00 H new ATOM 0 HE ARG A 42 -6.204 8.395 -7.580 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -9.161 7.043 -9.024 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -9.862 8.642 -9.296 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -7.105 10.406 -8.044 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -8.720 10.506 -8.752 1.00 0.00 H new ATOM 524 N LEU A 43 -4.744 5.385 -3.696 1.00 0.00 N ATOM 525 CA LEU A 43 -3.588 6.005 -3.082 1.00 0.00 C ATOM 526 C LEU A 43 -2.438 5.970 -4.075 1.00 0.00 C ATOM 527 O LEU A 43 -2.328 5.034 -4.860 1.00 0.00 O ATOM 528 CB LEU A 43 -3.202 5.337 -1.753 1.00 0.00 C ATOM 529 CG LEU A 43 -3.608 3.866 -1.504 1.00 0.00 C ATOM 530 CD1 LEU A 43 -2.610 3.226 -0.536 1.00 0.00 C ATOM 531 CD2 LEU A 43 -5.001 3.812 -0.859 1.00 0.00 C ATOM 0 H LEU A 43 -4.568 4.431 -4.010 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.833 7.038 -2.834 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -2.118 5.399 -1.657 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -3.628 5.936 -0.948 1.00 0.00 H new ATOM 0 HG LEU A 43 -3.616 3.334 -2.455 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.891 2.188 -0.357 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -1.610 3.261 -0.968 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -2.617 3.772 0.407 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -5.282 2.773 -0.686 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -4.983 4.346 0.091 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -5.728 4.278 -1.524 1.00 0.00 H new ATOM 543 N SER A 44 -1.612 7.011 -4.058 1.00 0.00 N ATOM 544 CA SER A 44 -0.445 7.175 -4.902 1.00 0.00 C ATOM 545 C SER A 44 0.540 7.986 -4.082 1.00 0.00 C ATOM 546 O SER A 44 0.206 9.085 -3.621 1.00 0.00 O ATOM 547 CB SER A 44 -0.807 7.910 -6.198 1.00 0.00 C ATOM 548 OG SER A 44 0.296 7.882 -7.075 1.00 0.00 O ATOM 0 H SER A 44 -1.749 7.798 -3.423 1.00 0.00 H new ATOM 0 HA SER A 44 -0.027 6.213 -5.198 1.00 0.00 H new ATOM 0 HB2 SER A 44 -1.671 7.439 -6.667 1.00 0.00 H new ATOM 0 HB3 SER A 44 -1.086 8.941 -5.979 1.00 0.00 H new ATOM 0 HG SER A 44 0.066 8.350 -7.905 1.00 0.00 H new ATOM 554 N GLY A 45 1.700 7.404 -3.794 1.00 0.00 N ATOM 555 CA GLY A 45 2.736 8.099 -3.056 1.00 0.00 C ATOM 556 C GLY A 45 3.358 9.083 -4.032 1.00 0.00 C ATOM 557 O GLY A 45 3.164 10.291 -3.909 1.00 0.00 O ATOM 0 H GLY A 45 1.942 6.450 -4.063 1.00 0.00 H new ATOM 0 HA2 GLY A 45 2.319 8.617 -2.192 1.00 0.00 H new ATOM 0 HA3 GLY A 45 3.482 7.400 -2.679 1.00 0.00 H new ATOM 561 N GLY A 46 3.954 8.546 -5.094 1.00 0.00 N ATOM 562 CA GLY A 46 4.642 9.311 -6.123 1.00 0.00 C ATOM 563 C GLY A 46 6.122 8.965 -6.015 1.00 0.00 C ATOM 564 O GLY A 46 6.466 7.893 -5.495 1.00 0.00 O ATOM 0 H GLY A 46 3.970 7.540 -5.264 1.00 0.00 H new ATOM 0 HA2 GLY A 46 4.258 9.061 -7.112 1.00 0.00 H new ATOM 0 HA3 GLY A 46 4.484 10.380 -5.980 1.00 0.00 H new ATOM 568 N ALA A 47 6.982 9.800 -6.596 1.00 0.00 N ATOM 569 CA ALA A 47 8.419 9.592 -6.525 1.00 0.00 C ATOM 570 C ALA A 47 8.854 10.149 -5.167 1.00 0.00 C ATOM 571 O ALA A 47 9.044 11.362 -5.016 1.00 0.00 O ATOM 572 CB ALA A 47 9.119 10.320 -7.682 1.00 0.00 C ATOM 0 H ALA A 47 6.703 10.628 -7.122 1.00 0.00 H new ATOM 0 HA ALA A 47 8.686 8.539 -6.616 1.00 0.00 H new ATOM 0 HB1 ALA A 47 10.195 10.156 -7.617 1.00 0.00 H new ATOM 0 HB2 ALA A 47 8.750 9.933 -8.632 1.00 0.00 H new ATOM 0 HB3 ALA A 47 8.910 11.388 -7.619 1.00 0.00 H new ATOM 578 N GLY A 48 9.099 9.262 -4.210 1.00 0.00 N ATOM 579 CA GLY A 48 9.505 9.589 -2.859 1.00 0.00 C ATOM 580 C GLY A 48 9.637 8.304 -2.052 1.00 0.00 C ATOM 581 O GLY A 48 9.413 7.202 -2.567 1.00 0.00 O ATOM 0 H GLY A 48 9.015 8.257 -4.365 1.00 0.00 H new ATOM 0 HA2 GLY A 48 10.454 10.124 -2.871 1.00 0.00 H new ATOM 0 HA3 GLY A 48 8.772 10.250 -2.396 1.00 0.00 H new ATOM 585 N ALA A 49 10.122 8.436 -0.818 1.00 0.00 N ATOM 586 CA ALA A 49 10.312 7.351 0.130 1.00 0.00 C ATOM 587 C ALA A 49 9.158 7.500 1.116 1.00 0.00 C ATOM 588 O ALA A 49 9.361 7.757 2.302 1.00 0.00 O ATOM 589 CB ALA A 49 11.697 7.442 0.788 1.00 0.00 C ATOM 0 H ALA A 49 10.403 9.341 -0.441 1.00 0.00 H new ATOM 0 HA ALA A 49 10.296 6.364 -0.332 1.00 0.00 H new ATOM 0 HB1 ALA A 49 11.819 6.621 1.494 1.00 0.00 H new ATOM 0 HB2 ALA A 49 12.469 7.379 0.021 1.00 0.00 H new ATOM 0 HB3 ALA A 49 11.787 8.391 1.316 1.00 0.00 H new ATOM 595 N ASP A 50 7.946 7.422 0.575 1.00 0.00 N ATOM 596 CA ASP A 50 6.709 7.590 1.312 1.00 0.00 C ATOM 597 C ASP A 50 6.407 6.336 2.108 1.00 0.00 C ATOM 598 O ASP A 50 6.973 5.265 1.882 1.00 0.00 O ATOM 599 CB ASP A 50 5.537 7.968 0.393 1.00 0.00 C ATOM 600 CG ASP A 50 5.742 9.301 -0.341 1.00 0.00 C ATOM 601 OD1 ASP A 50 6.433 9.285 -1.384 1.00 0.00 O ATOM 602 OD2 ASP A 50 5.179 10.324 0.119 1.00 0.00 O ATOM 0 H ASP A 50 7.799 7.235 -0.417 1.00 0.00 H new ATOM 0 HA ASP A 50 6.839 8.421 2.005 1.00 0.00 H new ATOM 0 HB2 ASP A 50 5.391 7.176 -0.342 1.00 0.00 H new ATOM 0 HB3 ASP A 50 4.624 8.025 0.986 1.00 0.00 H new ATOM 607 N THR A 51 5.493 6.473 3.053 1.00 0.00 N ATOM 608 CA THR A 51 5.051 5.426 3.946 1.00 0.00 C ATOM 609 C THR A 51 3.556 5.205 3.716 1.00 0.00 C ATOM 610 O THR A 51 2.779 6.158 3.713 1.00 0.00 O ATOM 611 CB THR A 51 5.425 5.860 5.373 1.00 0.00 C ATOM 612 OG1 THR A 51 6.832 5.989 5.489 1.00 0.00 O ATOM 613 CG2 THR A 51 5.009 4.819 6.403 1.00 0.00 C ATOM 0 H THR A 51 5.019 7.360 3.223 1.00 0.00 H new ATOM 0 HA THR A 51 5.530 4.463 3.768 1.00 0.00 H new ATOM 0 HB THR A 51 4.912 6.804 5.556 1.00 0.00 H new ATOM 0 HG1 THR A 51 7.061 6.267 6.400 1.00 0.00 H new ATOM 0 HG21 THR A 51 5.290 5.161 7.399 1.00 0.00 H new ATOM 0 HG22 THR A 51 3.929 4.675 6.359 1.00 0.00 H new ATOM 0 HG23 THR A 51 5.510 3.875 6.189 1.00 0.00 H new ATOM 621 N PHE A 52 3.125 3.950 3.587 1.00 0.00 N ATOM 622 CA PHE A 52 1.745 3.577 3.352 1.00 0.00 C ATOM 623 C PHE A 52 1.242 2.817 4.569 1.00 0.00 C ATOM 624 O PHE A 52 1.913 1.906 5.076 1.00 0.00 O ATOM 625 CB PHE A 52 1.659 2.760 2.064 1.00 0.00 C ATOM 626 CG PHE A 52 2.229 3.456 0.838 1.00 0.00 C ATOM 627 CD1 PHE A 52 1.741 4.712 0.429 1.00 0.00 C ATOM 628 CD2 PHE A 52 3.238 2.839 0.079 1.00 0.00 C ATOM 629 CE1 PHE A 52 2.259 5.329 -0.726 1.00 0.00 C ATOM 630 CE2 PHE A 52 3.701 3.421 -1.104 1.00 0.00 C ATOM 631 CZ PHE A 52 3.230 4.676 -1.504 1.00 0.00 C ATOM 0 H PHE A 52 3.751 3.147 3.646 1.00 0.00 H new ATOM 0 HA PHE A 52 1.109 4.452 3.217 1.00 0.00 H new ATOM 0 HB2 PHE A 52 2.187 1.818 2.210 1.00 0.00 H new ATOM 0 HB3 PHE A 52 0.614 2.514 1.874 1.00 0.00 H new ATOM 0 HD1 PHE A 52 0.968 5.203 1.002 1.00 0.00 H new ATOM 0 HD2 PHE A 52 3.661 1.903 0.414 1.00 0.00 H new ATOM 0 HE1 PHE A 52 1.908 6.309 -1.015 1.00 0.00 H new ATOM 0 HE2 PHE A 52 4.426 2.900 -1.712 1.00 0.00 H new ATOM 0 HZ PHE A 52 3.609 5.139 -2.403 1.00 0.00 H new ATOM 641 N VAL A 53 0.091 3.231 5.087 1.00 0.00 N ATOM 642 CA VAL A 53 -0.535 2.624 6.255 1.00 0.00 C ATOM 643 C VAL A 53 -1.441 1.473 5.806 1.00 0.00 C ATOM 644 O VAL A 53 -2.468 1.674 5.163 1.00 0.00 O ATOM 645 CB VAL A 53 -1.318 3.680 7.053 1.00 0.00 C ATOM 646 CG1 VAL A 53 -1.777 3.112 8.398 1.00 0.00 C ATOM 647 CG2 VAL A 53 -0.484 4.943 7.333 1.00 0.00 C ATOM 0 H VAL A 53 -0.442 4.010 4.701 1.00 0.00 H new ATOM 0 HA VAL A 53 0.234 2.221 6.914 1.00 0.00 H new ATOM 0 HB VAL A 53 -2.174 3.950 6.435 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -2.329 3.876 8.946 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -2.422 2.250 8.228 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -0.907 2.805 8.979 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -1.083 5.657 7.899 1.00 0.00 H new ATOM 0 HG22 VAL A 53 0.401 4.674 7.910 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -0.178 5.394 6.389 1.00 0.00 H new ATOM 657 N PHE A 54 -1.043 0.257 6.148 1.00 0.00 N ATOM 658 CA PHE A 54 -1.698 -1.014 5.877 1.00 0.00 C ATOM 659 C PHE A 54 -1.718 -1.748 7.199 1.00 0.00 C ATOM 660 O PHE A 54 -0.997 -1.431 8.157 1.00 0.00 O ATOM 661 CB PHE A 54 -0.966 -1.788 4.769 1.00 0.00 C ATOM 662 CG PHE A 54 -1.652 -1.861 3.416 1.00 0.00 C ATOM 663 CD1 PHE A 54 -1.980 -0.688 2.709 1.00 0.00 C ATOM 664 CD2 PHE A 54 -1.924 -3.117 2.839 1.00 0.00 C ATOM 665 CE1 PHE A 54 -2.603 -0.773 1.451 1.00 0.00 C ATOM 666 CE2 PHE A 54 -2.540 -3.201 1.579 1.00 0.00 C ATOM 667 CZ PHE A 54 -2.883 -2.029 0.888 1.00 0.00 C ATOM 0 H PHE A 54 -0.176 0.123 6.669 1.00 0.00 H new ATOM 0 HA PHE A 54 -2.713 -0.886 5.500 1.00 0.00 H new ATOM 0 HB2 PHE A 54 0.015 -1.334 4.628 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -0.798 -2.806 5.120 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -1.753 0.279 3.134 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -1.658 -4.020 3.368 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -2.866 0.128 0.917 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -2.749 -4.167 1.143 1.00 0.00 H new ATOM 0 HZ PHE A 54 -3.363 -2.093 -0.078 1.00 0.00 H new ATOM 677 N SER A 55 -2.607 -2.721 7.241 1.00 0.00 N ATOM 678 CA SER A 55 -2.919 -3.610 8.321 1.00 0.00 C ATOM 679 C SER A 55 -3.987 -2.966 9.214 1.00 0.00 C ATOM 680 O SER A 55 -3.782 -2.808 10.420 1.00 0.00 O ATOM 681 CB SER A 55 -1.681 -4.288 8.943 1.00 0.00 C ATOM 682 OG SER A 55 -0.777 -3.516 9.707 1.00 0.00 O ATOM 0 H SER A 55 -3.186 -2.922 6.426 1.00 0.00 H new ATOM 0 HA SER A 55 -3.409 -4.518 7.970 1.00 0.00 H new ATOM 0 HB2 SER A 55 -2.037 -5.099 9.579 1.00 0.00 H new ATOM 0 HB3 SER A 55 -1.116 -4.745 8.131 1.00 0.00 H new ATOM 0 HG SER A 55 -0.813 -2.582 9.411 1.00 0.00 H new ATOM 688 N ALA A 56 -5.136 -2.592 8.619 1.00 0.00 N ATOM 689 CA ALA A 56 -6.249 -1.958 9.310 1.00 0.00 C ATOM 690 C ALA A 56 -7.502 -2.849 9.317 1.00 0.00 C ATOM 691 O ALA A 56 -7.553 -3.924 8.714 1.00 0.00 O ATOM 692 CB ALA A 56 -6.479 -0.551 8.743 1.00 0.00 C ATOM 0 H ALA A 56 -5.309 -2.730 7.623 1.00 0.00 H new ATOM 0 HA ALA A 56 -5.998 -1.835 10.364 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -7.313 -0.081 9.264 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -5.580 0.049 8.882 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -6.708 -0.620 7.680 1.00 0.00 H new ATOM 698 N ARG A 57 -8.529 -2.377 10.030 1.00 0.00 N ATOM 699 CA ARG A 57 -9.822 -3.029 10.246 1.00 0.00 C ATOM 700 C ARG A 57 -10.499 -3.499 8.964 1.00 0.00 C ATOM 701 O ARG A 57 -10.569 -4.701 8.715 1.00 0.00 O ATOM 702 CB ARG A 57 -10.733 -2.105 11.077 1.00 0.00 C ATOM 703 CG ARG A 57 -10.169 -1.812 12.479 1.00 0.00 C ATOM 704 CD ARG A 57 -10.470 -2.948 13.462 1.00 0.00 C ATOM 705 NE ARG A 57 -11.783 -2.751 14.088 1.00 0.00 N ATOM 706 CZ ARG A 57 -12.355 -3.521 15.015 1.00 0.00 C ATOM 707 NH1 ARG A 57 -11.808 -4.666 15.404 1.00 0.00 N ATOM 708 NH2 ARG A 57 -13.501 -3.117 15.545 1.00 0.00 N ATOM 0 H ARG A 57 -8.475 -1.474 10.500 1.00 0.00 H new ATOM 0 HA ARG A 57 -9.633 -3.945 10.805 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -10.873 -1.165 10.543 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -11.716 -2.565 11.175 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -9.091 -1.664 12.414 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -10.596 -0.883 12.856 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -10.449 -3.904 12.939 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -9.697 -2.987 14.229 1.00 0.00 H new ATOM 0 HE ARG A 57 -12.316 -1.937 13.781 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -10.928 -4.977 14.992 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -12.267 -5.235 16.115 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -13.922 -2.239 15.242 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -13.962 -3.685 16.256 1.00 0.00 H new ATOM 722 N GLU A 58 -11.014 -2.594 8.138 1.00 0.00 N ATOM 723 CA GLU A 58 -11.682 -2.981 6.912 1.00 0.00 C ATOM 724 C GLU A 58 -10.671 -3.355 5.812 1.00 0.00 C ATOM 725 O GLU A 58 -11.072 -3.978 4.836 1.00 0.00 O ATOM 726 CB GLU A 58 -12.655 -1.875 6.455 1.00 0.00 C ATOM 727 CG GLU A 58 -13.414 -1.072 7.534 1.00 0.00 C ATOM 728 CD GLU A 58 -14.296 -1.917 8.462 1.00 0.00 C ATOM 729 OE1 GLU A 58 -15.445 -2.268 8.095 1.00 0.00 O ATOM 730 OE2 GLU A 58 -13.876 -2.194 9.611 1.00 0.00 O ATOM 0 H GLU A 58 -10.979 -1.588 8.300 1.00 0.00 H new ATOM 0 HA GLU A 58 -12.270 -3.877 7.111 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -12.091 -1.166 5.849 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -13.396 -2.334 5.801 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -12.689 -0.529 8.140 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -14.039 -0.327 7.041 1.00 0.00 H new ATOM 737 N ASP A 59 -9.369 -3.045 5.963 1.00 0.00 N ATOM 738 CA ASP A 59 -8.302 -3.323 4.981 1.00 0.00 C ATOM 739 C ASP A 59 -7.903 -4.809 4.872 1.00 0.00 C ATOM 740 O ASP A 59 -7.007 -5.255 4.162 1.00 0.00 O ATOM 741 CB ASP A 59 -7.117 -2.407 5.354 1.00 0.00 C ATOM 742 CG ASP A 59 -5.732 -2.858 4.881 1.00 0.00 C ATOM 743 OD1 ASP A 59 -5.491 -2.906 3.656 1.00 0.00 O ATOM 744 OD2 ASP A 59 -4.906 -3.170 5.770 1.00 0.00 O ATOM 0 H ASP A 59 -9.019 -2.579 6.800 1.00 0.00 H new ATOM 0 HA ASP A 59 -8.667 -3.105 3.977 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -7.311 -1.415 4.946 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -7.091 -2.306 6.439 1.00 0.00 H new ATOM 749 N SER A 60 -8.608 -5.614 5.629 1.00 0.00 N ATOM 750 CA SER A 60 -8.421 -7.038 5.759 1.00 0.00 C ATOM 751 C SER A 60 -8.886 -7.930 4.606 1.00 0.00 C ATOM 752 O SER A 60 -8.177 -8.889 4.289 1.00 0.00 O ATOM 753 CB SER A 60 -9.094 -7.427 7.071 1.00 0.00 C ATOM 754 OG SER A 60 -8.466 -6.802 8.184 1.00 0.00 O ATOM 0 H SER A 60 -9.375 -5.270 6.207 1.00 0.00 H new ATOM 0 HA SER A 60 -7.347 -7.221 5.739 1.00 0.00 H new ATOM 0 HB2 SER A 60 -10.146 -7.144 7.039 1.00 0.00 H new ATOM 0 HB3 SER A 60 -9.059 -8.510 7.192 1.00 0.00 H new ATOM 0 HG SER A 60 -9.026 -6.064 8.504 1.00 0.00 H new ATOM 760 N TYR A 61 -10.108 -7.769 4.089 1.00 0.00 N ATOM 761 CA TYR A 61 -10.637 -8.622 3.018 1.00 0.00 C ATOM 762 C TYR A 61 -11.904 -8.026 2.403 1.00 0.00 C ATOM 763 O TYR A 61 -12.390 -6.974 2.824 1.00 0.00 O ATOM 764 CB TYR A 61 -10.934 -10.030 3.619 1.00 0.00 C ATOM 765 CG TYR A 61 -11.082 -10.117 5.143 1.00 0.00 C ATOM 766 CD1 TYR A 61 -11.979 -9.283 5.843 1.00 0.00 C ATOM 767 CD2 TYR A 61 -10.249 -10.983 5.876 1.00 0.00 C ATOM 768 CE1 TYR A 61 -12.026 -9.299 7.249 1.00 0.00 C ATOM 769 CE2 TYR A 61 -10.294 -11.018 7.279 1.00 0.00 C ATOM 770 CZ TYR A 61 -11.183 -10.171 7.974 1.00 0.00 C ATOM 771 OH TYR A 61 -11.217 -10.176 9.335 1.00 0.00 O ATOM 0 H TYR A 61 -10.757 -7.046 4.399 1.00 0.00 H new ATOM 0 HA TYR A 61 -9.899 -8.698 2.219 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -11.852 -10.405 3.167 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -10.132 -10.704 3.317 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -12.637 -8.625 5.294 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -9.564 -11.631 5.350 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -12.706 -8.645 7.774 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -9.650 -11.692 7.825 1.00 0.00 H new ATOM 0 HH TYR A 61 -10.576 -10.834 9.676 1.00 0.00 H new ATOM 781 N ARG A 62 -12.473 -8.724 1.417 1.00 0.00 N ATOM 782 CA ARG A 62 -13.703 -8.373 0.729 1.00 0.00 C ATOM 783 C ARG A 62 -14.744 -9.451 1.000 1.00 0.00 C ATOM 784 O ARG A 62 -14.420 -10.602 1.313 1.00 0.00 O ATOM 785 CB ARG A 62 -13.515 -8.236 -0.798 1.00 0.00 C ATOM 786 CG ARG A 62 -13.068 -9.494 -1.576 1.00 0.00 C ATOM 787 CD ARG A 62 -13.567 -9.494 -3.033 1.00 0.00 C ATOM 788 NE ARG A 62 -14.993 -9.883 -3.162 1.00 0.00 N ATOM 789 CZ ARG A 62 -15.821 -9.558 -4.169 1.00 0.00 C ATOM 790 NH1 ARG A 62 -15.438 -8.715 -5.122 1.00 0.00 N ATOM 791 NH2 ARG A 62 -17.046 -10.072 -4.231 1.00 0.00 N ATOM 0 H ARG A 62 -12.063 -9.589 1.065 1.00 0.00 H new ATOM 0 HA ARG A 62 -14.024 -7.403 1.109 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -14.458 -7.894 -1.224 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -12.781 -7.451 -0.978 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -11.980 -9.555 -1.568 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -13.441 -10.383 -1.068 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -13.428 -8.500 -3.458 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -12.955 -10.179 -3.620 1.00 0.00 H new ATOM 0 HE ARG A 62 -15.383 -10.454 -2.412 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -14.504 -8.305 -5.095 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -16.078 -8.478 -5.880 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -17.365 -10.719 -3.510 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -17.667 -9.819 -5.000 1.00 0.00 H new ATOM 805 N THR A 63 -15.991 -9.055 0.818 1.00 0.00 N ATOM 806 CA THR A 63 -17.183 -9.867 0.933 1.00 0.00 C ATOM 807 C THR A 63 -18.063 -9.398 -0.218 1.00 0.00 C ATOM 808 O THR A 63 -17.864 -8.307 -0.765 1.00 0.00 O ATOM 809 CB THR A 63 -17.880 -9.763 2.300 1.00 0.00 C ATOM 810 OG1 THR A 63 -18.227 -8.442 2.638 1.00 0.00 O ATOM 811 CG2 THR A 63 -17.023 -10.356 3.408 1.00 0.00 C ATOM 0 H THR A 63 -16.209 -8.090 0.569 1.00 0.00 H new ATOM 0 HA THR A 63 -16.948 -10.930 0.872 1.00 0.00 H new ATOM 0 HB THR A 63 -18.801 -10.339 2.205 1.00 0.00 H new ATOM 0 HG1 THR A 63 -18.667 -8.433 3.513 1.00 0.00 H new ATOM 0 HG21 THR A 63 -17.546 -10.266 4.360 1.00 0.00 H new ATOM 0 HG22 THR A 63 -16.832 -11.408 3.197 1.00 0.00 H new ATOM 0 HG23 THR A 63 -16.076 -9.819 3.462 1.00 0.00 H new ATOM 819 N ASP A 64 -19.059 -10.189 -0.594 1.00 0.00 N ATOM 820 CA ASP A 64 -19.960 -9.840 -1.685 1.00 0.00 C ATOM 821 C ASP A 64 -20.839 -8.644 -1.304 1.00 0.00 C ATOM 822 O ASP A 64 -21.437 -8.025 -2.185 1.00 0.00 O ATOM 823 CB ASP A 64 -20.771 -11.070 -2.126 1.00 0.00 C ATOM 824 CG ASP A 64 -19.965 -12.026 -3.018 1.00 0.00 C ATOM 825 OD1 ASP A 64 -18.711 -11.970 -3.029 1.00 0.00 O ATOM 826 OD2 ASP A 64 -20.594 -12.809 -3.764 1.00 0.00 O ATOM 0 H ASP A 64 -19.265 -11.086 -0.154 1.00 0.00 H new ATOM 0 HA ASP A 64 -19.373 -9.526 -2.548 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -21.115 -11.608 -1.243 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -21.659 -10.740 -2.665 1.00 0.00 H new ATOM 831 N THR A 65 -20.871 -8.244 -0.027 1.00 0.00 N ATOM 832 CA THR A 65 -21.641 -7.116 0.488 1.00 0.00 C ATOM 833 C THR A 65 -20.725 -5.959 0.930 1.00 0.00 C ATOM 834 O THR A 65 -21.196 -4.832 1.107 1.00 0.00 O ATOM 835 CB THR A 65 -22.531 -7.599 1.642 1.00 0.00 C ATOM 836 OG1 THR A 65 -21.736 -8.073 2.709 1.00 0.00 O ATOM 837 CG2 THR A 65 -23.471 -8.733 1.219 1.00 0.00 C ATOM 0 H THR A 65 -20.338 -8.720 0.701 1.00 0.00 H new ATOM 0 HA THR A 65 -22.272 -6.725 -0.310 1.00 0.00 H new ATOM 0 HB THR A 65 -23.128 -6.740 1.949 1.00 0.00 H new ATOM 0 HG1 THR A 65 -22.315 -8.376 3.439 1.00 0.00 H new ATOM 0 HG21 THR A 65 -24.079 -9.039 2.071 1.00 0.00 H new ATOM 0 HG22 THR A 65 -24.121 -8.386 0.415 1.00 0.00 H new ATOM 0 HG23 THR A 65 -22.883 -9.582 0.870 1.00 0.00 H new ATOM 845 N ALA A 66 -19.417 -6.190 1.098 1.00 0.00 N ATOM 846 CA ALA A 66 -18.470 -5.174 1.518 1.00 0.00 C ATOM 847 C ALA A 66 -17.075 -5.428 0.959 1.00 0.00 C ATOM 848 O ALA A 66 -16.208 -6.023 1.605 1.00 0.00 O ATOM 849 CB ALA A 66 -18.453 -5.048 3.045 1.00 0.00 C ATOM 0 H ALA A 66 -18.990 -7.103 0.941 1.00 0.00 H new ATOM 0 HA ALA A 66 -18.802 -4.222 1.105 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -17.736 -4.281 3.339 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -19.446 -4.771 3.398 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -18.164 -6.002 3.486 1.00 0.00 H new ATOM 855 N VAL A 67 -16.872 -5.027 -0.289 1.00 0.00 N ATOM 856 CA VAL A 67 -15.587 -5.141 -0.940 1.00 0.00 C ATOM 857 C VAL A 67 -14.829 -3.904 -0.478 1.00 0.00 C ATOM 858 O VAL A 67 -15.350 -2.796 -0.566 1.00 0.00 O ATOM 859 CB VAL A 67 -15.718 -5.151 -2.472 1.00 0.00 C ATOM 860 CG1 VAL A 67 -14.340 -5.261 -3.138 1.00 0.00 C ATOM 861 CG2 VAL A 67 -16.610 -6.297 -2.971 1.00 0.00 C ATOM 0 H VAL A 67 -17.599 -4.614 -0.874 1.00 0.00 H new ATOM 0 HA VAL A 67 -15.084 -6.074 -0.684 1.00 0.00 H new ATOM 0 HB VAL A 67 -16.186 -4.206 -2.748 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -14.459 -5.266 -4.221 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -13.725 -4.410 -2.844 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -13.856 -6.185 -2.822 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -16.672 -6.263 -4.059 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -16.183 -7.251 -2.662 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -17.609 -6.192 -2.547 1.00 0.00 H new ATOM 871 N PHE A 68 -13.599 -4.094 -0.025 1.00 0.00 N ATOM 872 CA PHE A 68 -12.701 -3.042 0.446 1.00 0.00 C ATOM 873 C PHE A 68 -11.385 -3.131 -0.348 1.00 0.00 C ATOM 874 O PHE A 68 -10.316 -2.807 0.154 1.00 0.00 O ATOM 875 CB PHE A 68 -12.502 -3.184 1.964 1.00 0.00 C ATOM 876 CG PHE A 68 -13.753 -3.075 2.831 1.00 0.00 C ATOM 877 CD1 PHE A 68 -14.571 -1.926 2.805 1.00 0.00 C ATOM 878 CD2 PHE A 68 -14.051 -4.101 3.746 1.00 0.00 C ATOM 879 CE1 PHE A 68 -15.631 -1.791 3.721 1.00 0.00 C ATOM 880 CE2 PHE A 68 -15.143 -3.990 4.622 1.00 0.00 C ATOM 881 CZ PHE A 68 -15.921 -2.823 4.627 1.00 0.00 C ATOM 0 H PHE A 68 -13.179 -5.022 0.028 1.00 0.00 H new ATOM 0 HA PHE A 68 -13.122 -2.051 0.276 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -12.037 -4.151 2.157 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -11.796 -2.420 2.288 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -14.383 -1.148 2.080 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -13.432 -4.986 3.775 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -16.224 -0.889 3.727 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -15.384 -4.803 5.291 1.00 0.00 H new ATOM 0 HZ PHE A 68 -16.739 -2.719 5.324 1.00 0.00 H new ATOM 891 N ASN A 69 -11.465 -3.641 -1.584 1.00 0.00 N ATOM 892 CA ASN A 69 -10.362 -3.820 -2.505 1.00 0.00 C ATOM 893 C ASN A 69 -9.812 -2.460 -2.916 1.00 0.00 C ATOM 894 O ASN A 69 -10.392 -1.800 -3.783 1.00 0.00 O ATOM 895 CB ASN A 69 -10.825 -4.635 -3.727 1.00 0.00 C ATOM 896 CG ASN A 69 -9.745 -4.996 -4.752 1.00 0.00 C ATOM 897 OD1 ASN A 69 -8.872 -4.112 -5.198 1.00 0.00 O flip ATOM 898 ND2 ASN A 69 -9.769 -6.099 -5.289 1.00 0.00 N flip ATOM 0 H ASN A 69 -12.353 -3.953 -1.978 1.00 0.00 H new ATOM 0 HA ASN A 69 -9.561 -4.376 -2.017 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -11.280 -5.559 -3.370 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -11.606 -4.072 -4.237 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -10.431 -6.807 -4.970 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -9.127 -6.308 -6.054 1.00 0.00 H new ATOM 905 N ASP A 70 -8.684 -2.094 -2.320 1.00 0.00 N ATOM 906 CA ASP A 70 -7.920 -0.864 -2.521 1.00 0.00 C ATOM 907 C ASP A 70 -7.231 -0.923 -3.898 1.00 0.00 C ATOM 908 O ASP A 70 -7.168 -1.994 -4.521 1.00 0.00 O ATOM 909 CB ASP A 70 -6.907 -0.731 -1.364 1.00 0.00 C ATOM 910 CG ASP A 70 -5.518 -0.290 -1.834 1.00 0.00 C ATOM 911 OD1 ASP A 70 -5.367 0.904 -2.152 1.00 0.00 O ATOM 912 OD2 ASP A 70 -4.651 -1.180 -1.968 1.00 0.00 O ATOM 0 H ASP A 70 -8.242 -2.698 -1.627 1.00 0.00 H new ATOM 0 HA ASP A 70 -8.564 0.016 -2.514 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -7.285 -0.011 -0.638 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -6.824 -1.688 -0.849 1.00 0.00 H new ATOM 917 N LEU A 71 -6.903 0.246 -4.457 1.00 0.00 N ATOM 918 CA LEU A 71 -6.240 0.383 -5.739 1.00 0.00 C ATOM 919 C LEU A 71 -5.067 1.347 -5.566 1.00 0.00 C ATOM 920 O LEU A 71 -5.242 2.569 -5.578 1.00 0.00 O ATOM 921 CB LEU A 71 -7.254 0.892 -6.776 1.00 0.00 C ATOM 922 CG LEU A 71 -6.629 1.172 -8.157 1.00 0.00 C ATOM 923 CD1 LEU A 71 -6.075 -0.099 -8.817 1.00 0.00 C ATOM 924 CD2 LEU A 71 -7.693 1.805 -9.063 1.00 0.00 C ATOM 0 H LEU A 71 -7.101 1.142 -4.011 1.00 0.00 H new ATOM 0 HA LEU A 71 -5.855 -0.573 -6.095 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -8.049 0.155 -6.888 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -7.717 1.806 -6.403 1.00 0.00 H new ATOM 0 HG LEU A 71 -5.789 1.851 -8.015 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -5.646 0.152 -9.787 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -5.304 -0.533 -8.181 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -6.881 -0.820 -8.953 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -7.262 2.008 -10.043 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -8.534 1.120 -9.171 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -8.040 2.738 -8.619 1.00 0.00 H new ATOM 936 N ILE A 72 -3.855 0.804 -5.519 1.00 0.00 N ATOM 937 CA ILE A 72 -2.651 1.603 -5.369 1.00 0.00 C ATOM 938 C ILE A 72 -2.154 1.941 -6.767 1.00 0.00 C ATOM 939 O ILE A 72 -2.211 1.103 -7.673 1.00 0.00 O ATOM 940 CB ILE A 72 -1.595 0.822 -4.573 1.00 0.00 C ATOM 941 CG1 ILE A 72 -2.019 0.608 -3.109 1.00 0.00 C ATOM 942 CG2 ILE A 72 -0.243 1.553 -4.601 1.00 0.00 C ATOM 943 CD1 ILE A 72 -1.421 -0.662 -2.498 1.00 0.00 C ATOM 0 H ILE A 72 -3.683 -0.199 -5.584 1.00 0.00 H new ATOM 0 HA ILE A 72 -2.854 2.520 -4.817 1.00 0.00 H new ATOM 0 HB ILE A 72 -1.499 -0.153 -5.051 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -1.712 1.470 -2.517 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -3.106 0.555 -3.054 1.00 0.00 H new ATOM 0 HG21 ILE A 72 0.491 0.983 -4.031 1.00 0.00 H new ATOM 0 HG22 ILE A 72 0.096 1.652 -5.632 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -0.356 2.543 -4.159 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -1.755 -0.761 -1.465 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -1.749 -1.530 -3.070 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -0.333 -0.601 -2.524 1.00 0.00 H new ATOM 955 N LEU A 73 -1.713 3.182 -6.945 1.00 0.00 N ATOM 956 CA LEU A 73 -1.174 3.710 -8.184 1.00 0.00 C ATOM 957 C LEU A 73 0.337 3.917 -8.077 1.00 0.00 C ATOM 958 O LEU A 73 0.879 4.080 -6.983 1.00 0.00 O ATOM 959 CB LEU A 73 -1.890 5.022 -8.552 1.00 0.00 C ATOM 960 CG LEU A 73 -3.036 4.886 -9.573 1.00 0.00 C ATOM 961 CD1 LEU A 73 -2.544 4.506 -10.976 1.00 0.00 C ATOM 962 CD2 LEU A 73 -4.110 3.884 -9.130 1.00 0.00 C ATOM 0 H LEU A 73 -1.724 3.873 -6.195 1.00 0.00 H new ATOM 0 HA LEU A 73 -1.350 2.986 -8.979 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -2.289 5.466 -7.640 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -1.153 5.719 -8.950 1.00 0.00 H new ATOM 0 HG LEU A 73 -3.482 5.880 -9.618 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -3.396 4.425 -11.651 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -1.862 5.273 -11.343 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -2.024 3.549 -10.932 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -4.892 3.830 -9.888 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -3.659 2.900 -9.003 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -4.543 4.210 -8.184 1.00 0.00 H new ATOM 974 N ASP A 74 0.957 3.933 -9.259 1.00 0.00 N ATOM 975 CA ASP A 74 2.361 4.128 -9.635 1.00 0.00 C ATOM 976 C ASP A 74 3.372 3.857 -8.503 1.00 0.00 C ATOM 977 O ASP A 74 4.193 4.708 -8.158 1.00 0.00 O ATOM 978 CB ASP A 74 2.501 5.522 -10.292 1.00 0.00 C ATOM 979 CG ASP A 74 1.586 5.688 -11.518 1.00 0.00 C ATOM 980 OD1 ASP A 74 1.739 4.925 -12.503 1.00 0.00 O ATOM 981 OD2 ASP A 74 0.633 6.510 -11.475 1.00 0.00 O ATOM 0 H ASP A 74 0.400 3.787 -10.101 1.00 0.00 H new ATOM 0 HA ASP A 74 2.633 3.365 -10.364 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.263 6.292 -9.558 1.00 0.00 H new ATOM 0 HB3 ASP A 74 3.537 5.677 -10.592 1.00 0.00 H new ATOM 986 N PHE A 75 3.326 2.648 -7.934 1.00 0.00 N ATOM 987 CA PHE A 75 4.183 2.176 -6.841 1.00 0.00 C ATOM 988 C PHE A 75 5.633 1.940 -7.305 1.00 0.00 C ATOM 989 O PHE A 75 5.845 1.405 -8.404 1.00 0.00 O ATOM 990 CB PHE A 75 3.558 0.873 -6.326 1.00 0.00 C ATOM 991 CG PHE A 75 4.134 0.371 -5.020 1.00 0.00 C ATOM 992 CD1 PHE A 75 5.283 -0.440 -5.007 1.00 0.00 C ATOM 993 CD2 PHE A 75 3.489 0.690 -3.813 1.00 0.00 C ATOM 994 CE1 PHE A 75 5.733 -1.002 -3.801 1.00 0.00 C ATOM 995 CE2 PHE A 75 3.944 0.141 -2.608 1.00 0.00 C ATOM 996 CZ PHE A 75 5.054 -0.719 -2.604 1.00 0.00 C ATOM 0 H PHE A 75 2.659 1.938 -8.237 1.00 0.00 H new ATOM 0 HA PHE A 75 4.239 2.929 -6.055 1.00 0.00 H new ATOM 0 HB2 PHE A 75 2.486 1.024 -6.201 1.00 0.00 H new ATOM 0 HB3 PHE A 75 3.684 0.100 -7.084 1.00 0.00 H new ATOM 0 HD1 PHE A 75 5.820 -0.631 -5.925 1.00 0.00 H new ATOM 0 HD2 PHE A 75 2.641 1.359 -3.815 1.00 0.00 H new ATOM 0 HE1 PHE A 75 6.598 -1.649 -3.794 1.00 0.00 H new ATOM 0 HE2 PHE A 75 3.441 0.379 -1.682 1.00 0.00 H new ATOM 0 HZ PHE A 75 5.387 -1.164 -1.678 1.00 0.00 H new ATOM 1006 N GLU A 76 6.617 2.260 -6.452 1.00 0.00 N ATOM 1007 CA GLU A 76 8.051 2.131 -6.699 1.00 0.00 C ATOM 1008 C GLU A 76 8.773 1.653 -5.420 1.00 0.00 C ATOM 1009 O GLU A 76 9.157 2.460 -4.564 1.00 0.00 O ATOM 1010 CB GLU A 76 8.555 3.501 -7.190 1.00 0.00 C ATOM 1011 CG GLU A 76 10.048 3.566 -7.560 1.00 0.00 C ATOM 1012 CD GLU A 76 10.461 2.802 -8.824 1.00 0.00 C ATOM 1013 OE1 GLU A 76 9.613 2.521 -9.695 1.00 0.00 O ATOM 1014 OE2 GLU A 76 11.679 2.524 -8.979 1.00 0.00 O ATOM 0 H GLU A 76 6.418 2.635 -5.524 1.00 0.00 H new ATOM 0 HA GLU A 76 8.261 1.380 -7.461 1.00 0.00 H new ATOM 0 HB2 GLU A 76 7.970 3.792 -8.062 1.00 0.00 H new ATOM 0 HB3 GLU A 76 8.359 4.240 -6.413 1.00 0.00 H new ATOM 0 HG2 GLU A 76 10.326 4.613 -7.685 1.00 0.00 H new ATOM 0 HG3 GLU A 76 10.627 3.180 -6.721 1.00 0.00 H new ATOM 1021 N ALA A 77 9.006 0.337 -5.301 1.00 0.00 N ATOM 1022 CA ALA A 77 9.677 -0.305 -4.162 1.00 0.00 C ATOM 1023 C ALA A 77 11.093 0.227 -3.910 1.00 0.00 C ATOM 1024 O ALA A 77 11.675 -0.022 -2.847 1.00 0.00 O ATOM 1025 CB ALA A 77 9.732 -1.834 -4.348 1.00 0.00 C ATOM 0 H ALA A 77 8.723 -0.331 -6.018 1.00 0.00 H new ATOM 0 HA ALA A 77 9.076 -0.056 -3.287 1.00 0.00 H new ATOM 0 HB1 ALA A 77 10.233 -2.287 -3.492 1.00 0.00 H new ATOM 0 HB2 ALA A 77 8.719 -2.228 -4.425 1.00 0.00 H new ATOM 0 HB3 ALA A 77 10.283 -2.070 -5.258 1.00 0.00 H new ATOM 1031 N SER A 78 11.652 0.954 -4.880 1.00 0.00 N ATOM 1032 CA SER A 78 12.971 1.550 -4.831 1.00 0.00 C ATOM 1033 C SER A 78 13.092 2.622 -3.740 1.00 0.00 C ATOM 1034 O SER A 78 14.215 3.054 -3.476 1.00 0.00 O ATOM 1035 CB SER A 78 13.327 2.109 -6.213 1.00 0.00 C ATOM 1036 OG SER A 78 13.073 1.151 -7.226 1.00 0.00 O ATOM 0 H SER A 78 11.168 1.147 -5.757 1.00 0.00 H new ATOM 0 HA SER A 78 13.686 0.772 -4.563 1.00 0.00 H new ATOM 0 HB2 SER A 78 12.746 3.011 -6.406 1.00 0.00 H new ATOM 0 HB3 SER A 78 14.378 2.396 -6.234 1.00 0.00 H new ATOM 0 HG SER A 78 12.534 1.560 -7.935 1.00 0.00 H new ATOM 1042 N GLU A 79 12.005 3.090 -3.112 1.00 0.00 N ATOM 1043 CA GLU A 79 12.032 4.074 -2.037 1.00 0.00 C ATOM 1044 C GLU A 79 10.800 3.997 -1.135 1.00 0.00 C ATOM 1045 O GLU A 79 10.956 4.133 0.082 1.00 0.00 O ATOM 1046 CB GLU A 79 12.274 5.513 -2.521 1.00 0.00 C ATOM 1047 CG GLU A 79 11.918 5.918 -3.959 1.00 0.00 C ATOM 1048 CD GLU A 79 12.215 7.403 -4.256 1.00 0.00 C ATOM 1049 OE1 GLU A 79 12.692 8.166 -3.372 1.00 0.00 O ATOM 1050 OE2 GLU A 79 12.127 7.771 -5.447 1.00 0.00 O ATOM 0 H GLU A 79 11.061 2.783 -3.348 1.00 0.00 H new ATOM 0 HA GLU A 79 12.899 3.800 -1.436 1.00 0.00 H new ATOM 0 HB2 GLU A 79 11.722 6.175 -1.854 1.00 0.00 H new ATOM 0 HB3 GLU A 79 13.333 5.727 -2.378 1.00 0.00 H new ATOM 0 HG2 GLU A 79 12.478 5.294 -4.656 1.00 0.00 H new ATOM 0 HG3 GLU A 79 10.860 5.722 -4.135 1.00 0.00 H new ATOM 1057 N ASP A 80 9.605 3.777 -1.687 1.00 0.00 N ATOM 1058 CA ASP A 80 8.385 3.723 -0.882 1.00 0.00 C ATOM 1059 C ASP A 80 8.336 2.533 0.094 1.00 0.00 C ATOM 1060 O ASP A 80 9.017 1.513 -0.080 1.00 0.00 O ATOM 1061 CB ASP A 80 7.129 3.914 -1.752 1.00 0.00 C ATOM 1062 CG ASP A 80 6.731 2.771 -2.695 1.00 0.00 C ATOM 1063 OD1 ASP A 80 6.957 1.589 -2.352 1.00 0.00 O ATOM 1064 OD2 ASP A 80 6.094 3.100 -3.732 1.00 0.00 O ATOM 0 H ASP A 80 9.457 3.634 -2.686 1.00 0.00 H new ATOM 0 HA ASP A 80 8.404 4.579 -0.208 1.00 0.00 H new ATOM 0 HB2 ASP A 80 6.287 4.108 -1.087 1.00 0.00 H new ATOM 0 HB3 ASP A 80 7.272 4.811 -2.355 1.00 0.00 H new ATOM 1069 N ARG A 81 7.502 2.652 1.140 1.00 0.00 N ATOM 1070 CA ARG A 81 7.345 1.634 2.201 1.00 0.00 C ATOM 1071 C ARG A 81 5.894 1.343 2.603 1.00 0.00 C ATOM 1072 O ARG A 81 5.065 2.246 2.570 1.00 0.00 O ATOM 1073 CB ARG A 81 8.094 2.091 3.456 1.00 0.00 C ATOM 1074 CG ARG A 81 9.515 2.603 3.183 1.00 0.00 C ATOM 1075 CD ARG A 81 10.308 2.556 4.484 1.00 0.00 C ATOM 1076 NE ARG A 81 11.691 3.028 4.289 1.00 0.00 N ATOM 1077 CZ ARG A 81 12.786 2.515 4.864 1.00 0.00 C ATOM 1078 NH1 ARG A 81 12.702 1.585 5.811 1.00 0.00 N ATOM 1079 NH2 ARG A 81 13.986 2.949 4.502 1.00 0.00 N ATOM 0 H ARG A 81 6.907 3.469 1.278 1.00 0.00 H new ATOM 0 HA ARG A 81 7.750 0.714 1.780 1.00 0.00 H new ATOM 0 HB2 ARG A 81 7.521 2.881 3.941 1.00 0.00 H new ATOM 0 HB3 ARG A 81 8.147 1.259 4.158 1.00 0.00 H new ATOM 0 HG2 ARG A 81 9.999 1.989 2.423 1.00 0.00 H new ATOM 0 HG3 ARG A 81 9.482 3.622 2.797 1.00 0.00 H new ATOM 0 HD2 ARG A 81 9.814 3.172 5.235 1.00 0.00 H new ATOM 0 HD3 ARG A 81 10.321 1.536 4.867 1.00 0.00 H new ATOM 0 HE ARG A 81 11.826 3.818 3.658 1.00 0.00 H new ATOM 0 HH11 ARG A 81 11.789 1.247 6.114 1.00 0.00 H new ATOM 0 HH12 ARG A 81 13.551 1.210 6.234 1.00 0.00 H new ATOM 0 HH21 ARG A 81 14.073 3.672 3.787 1.00 0.00 H new ATOM 0 HH22 ARG A 81 14.822 2.560 4.938 1.00 0.00 H new ATOM 1093 N ILE A 82 5.583 0.150 3.137 1.00 0.00 N ATOM 1094 CA ILE A 82 4.230 -0.249 3.574 1.00 0.00 C ATOM 1095 C ILE A 82 4.256 -0.918 4.956 1.00 0.00 C ATOM 1096 O ILE A 82 5.124 -1.745 5.244 1.00 0.00 O ATOM 1097 CB ILE A 82 3.569 -1.252 2.586 1.00 0.00 C ATOM 1098 CG1 ILE A 82 3.630 -0.855 1.103 1.00 0.00 C ATOM 1099 CG2 ILE A 82 2.089 -1.453 2.977 1.00 0.00 C ATOM 1100 CD1 ILE A 82 3.066 -1.943 0.186 1.00 0.00 C ATOM 0 H ILE A 82 6.279 -0.582 3.281 1.00 0.00 H new ATOM 0 HA ILE A 82 3.651 0.674 3.610 1.00 0.00 H new ATOM 0 HB ILE A 82 4.154 -2.167 2.677 1.00 0.00 H new ATOM 0 HG12 ILE A 82 3.071 0.069 0.953 1.00 0.00 H new ATOM 0 HG13 ILE A 82 4.664 -0.650 0.826 1.00 0.00 H new ATOM 0 HG21 ILE A 82 1.622 -2.156 2.286 1.00 0.00 H new ATOM 0 HG22 ILE A 82 2.031 -1.848 3.991 1.00 0.00 H new ATOM 0 HG23 ILE A 82 1.567 -0.497 2.930 1.00 0.00 H new ATOM 0 HD11 ILE A 82 3.132 -1.615 -0.851 1.00 0.00 H new ATOM 0 HD12 ILE A 82 3.641 -2.860 0.313 1.00 0.00 H new ATOM 0 HD13 ILE A 82 2.023 -2.130 0.442 1.00 0.00 H new ATOM 1112 N ASP A 83 3.298 -0.603 5.834 1.00 0.00 N ATOM 1113 CA ASP A 83 3.242 -1.253 7.154 1.00 0.00 C ATOM 1114 C ASP A 83 2.439 -2.558 7.065 1.00 0.00 C ATOM 1115 O ASP A 83 1.328 -2.544 6.545 1.00 0.00 O ATOM 1116 CB ASP A 83 2.627 -0.374 8.240 1.00 0.00 C ATOM 1117 CG ASP A 83 3.034 -0.853 9.647 1.00 0.00 C ATOM 1118 OD1 ASP A 83 3.132 -2.077 9.904 1.00 0.00 O ATOM 1119 OD2 ASP A 83 3.289 0.040 10.493 1.00 0.00 O ATOM 0 H ASP A 83 2.563 0.083 5.663 1.00 0.00 H new ATOM 0 HA ASP A 83 4.276 -1.448 7.437 1.00 0.00 H new ATOM 0 HB2 ASP A 83 2.946 0.659 8.099 1.00 0.00 H new ATOM 0 HB3 ASP A 83 1.541 -0.387 8.149 1.00 0.00 H new ATOM 1124 N LEU A 84 2.980 -3.699 7.503 1.00 0.00 N ATOM 1125 CA LEU A 84 2.285 -4.995 7.491 1.00 0.00 C ATOM 1126 C LEU A 84 2.461 -5.695 8.846 1.00 0.00 C ATOM 1127 O LEU A 84 2.340 -6.919 8.949 1.00 0.00 O ATOM 1128 CB LEU A 84 2.697 -5.885 6.294 1.00 0.00 C ATOM 1129 CG LEU A 84 2.029 -5.478 4.961 1.00 0.00 C ATOM 1130 CD1 LEU A 84 2.952 -4.629 4.084 1.00 0.00 C ATOM 1131 CD2 LEU A 84 1.613 -6.707 4.144 1.00 0.00 C ATOM 0 H LEU A 84 3.926 -3.752 7.881 1.00 0.00 H new ATOM 0 HA LEU A 84 1.221 -4.808 7.345 1.00 0.00 H new ATOM 0 HB2 LEU A 84 3.780 -5.842 6.176 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.441 -6.921 6.517 1.00 0.00 H new ATOM 0 HG LEU A 84 1.153 -4.893 5.240 1.00 0.00 H new ATOM 0 HD11 LEU A 84 2.437 -4.369 3.159 1.00 0.00 H new ATOM 0 HD12 LEU A 84 3.224 -3.718 4.617 1.00 0.00 H new ATOM 0 HD13 LEU A 84 3.854 -5.195 3.850 1.00 0.00 H new ATOM 0 HD21 LEU A 84 1.147 -6.384 3.213 1.00 0.00 H new ATOM 0 HD22 LEU A 84 2.493 -7.309 3.919 1.00 0.00 H new ATOM 0 HD23 LEU A 84 0.903 -7.302 4.718 1.00 0.00 H new ATOM 1143 N SER A 85 2.752 -4.944 9.915 1.00 0.00 N ATOM 1144 CA SER A 85 2.946 -5.534 11.230 1.00 0.00 C ATOM 1145 C SER A 85 1.693 -6.286 11.726 1.00 0.00 C ATOM 1146 O SER A 85 1.862 -7.312 12.390 1.00 0.00 O ATOM 1147 CB SER A 85 3.517 -4.469 12.189 1.00 0.00 C ATOM 1148 OG SER A 85 3.714 -4.954 13.506 1.00 0.00 O ATOM 0 H SER A 85 2.857 -3.930 9.888 1.00 0.00 H new ATOM 0 HA SER A 85 3.694 -6.325 11.180 1.00 0.00 H new ATOM 0 HB2 SER A 85 4.467 -4.107 11.796 1.00 0.00 H new ATOM 0 HB3 SER A 85 2.839 -3.616 12.220 1.00 0.00 H new ATOM 0 HG SER A 85 4.078 -4.238 14.067 1.00 0.00 H new ATOM 1154 N ALA A 86 0.453 -5.884 11.392 1.00 0.00 N ATOM 1155 CA ALA A 86 -0.747 -6.590 11.877 1.00 0.00 C ATOM 1156 C ALA A 86 -1.454 -7.509 10.879 1.00 0.00 C ATOM 1157 O ALA A 86 -2.276 -8.312 11.326 1.00 0.00 O ATOM 1158 CB ALA A 86 -1.754 -5.578 12.444 1.00 0.00 C ATOM 0 H ALA A 86 0.257 -5.082 10.794 1.00 0.00 H new ATOM 0 HA ALA A 86 -0.366 -7.263 12.645 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -2.639 -6.106 12.801 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -1.297 -5.035 13.271 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -2.042 -4.874 11.663 1.00 0.00 H new ATOM 1164 N LEU A 87 -1.189 -7.421 9.574 1.00 0.00 N ATOM 1165 CA LEU A 87 -1.827 -8.246 8.550 1.00 0.00 C ATOM 1166 C LEU A 87 -0.711 -8.902 7.751 1.00 0.00 C ATOM 1167 O LEU A 87 0.018 -8.205 7.051 1.00 0.00 O ATOM 1168 CB LEU A 87 -2.723 -7.429 7.592 1.00 0.00 C ATOM 1169 CG LEU A 87 -4.222 -7.281 7.928 1.00 0.00 C ATOM 1170 CD1 LEU A 87 -4.581 -6.424 9.151 1.00 0.00 C ATOM 1171 CD2 LEU A 87 -4.915 -6.647 6.717 1.00 0.00 C ATOM 0 H LEU A 87 -0.511 -6.761 9.193 1.00 0.00 H new ATOM 0 HA LEU A 87 -2.476 -8.973 9.038 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -2.300 -6.427 7.517 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -2.649 -7.881 6.603 1.00 0.00 H new ATOM 0 HG LEU A 87 -4.551 -8.291 8.172 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -5.664 -6.402 9.275 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -4.122 -6.852 10.042 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -4.212 -5.409 9.005 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -5.978 -6.530 6.926 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.475 -5.670 6.516 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.785 -7.289 5.846 1.00 0.00 H new ATOM 1183 N GLY A 88 -0.611 -10.230 7.809 1.00 0.00 N ATOM 1184 CA GLY A 88 0.406 -10.977 7.089 1.00 0.00 C ATOM 1185 C GLY A 88 1.478 -11.417 8.065 1.00 0.00 C ATOM 1186 O GLY A 88 2.212 -10.588 8.609 1.00 0.00 O ATOM 0 H GLY A 88 -1.238 -10.815 8.361 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -0.039 -11.845 6.602 1.00 0.00 H new ATOM 0 HA3 GLY A 88 0.842 -10.359 6.304 1.00 0.00 H new ATOM 1190 N PHE A 89 1.528 -12.719 8.327 1.00 0.00 N ATOM 1191 CA PHE A 89 2.480 -13.333 9.239 1.00 0.00 C ATOM 1192 C PHE A 89 3.903 -13.298 8.673 1.00 0.00 C ATOM 1193 O PHE A 89 4.143 -12.918 7.523 1.00 0.00 O ATOM 1194 CB PHE A 89 2.041 -14.775 9.543 1.00 0.00 C ATOM 1195 CG PHE A 89 0.613 -14.899 10.034 1.00 0.00 C ATOM 1196 CD1 PHE A 89 0.325 -14.742 11.402 1.00 0.00 C ATOM 1197 CD2 PHE A 89 -0.430 -15.166 9.127 1.00 0.00 C ATOM 1198 CE1 PHE A 89 -0.997 -14.870 11.859 1.00 0.00 C ATOM 1199 CE2 PHE A 89 -1.750 -15.292 9.586 1.00 0.00 C ATOM 1200 CZ PHE A 89 -2.032 -15.152 10.953 1.00 0.00 C ATOM 0 H PHE A 89 0.891 -13.391 7.899 1.00 0.00 H new ATOM 0 HA PHE A 89 2.493 -12.761 10.167 1.00 0.00 H new ATOM 0 HB2 PHE A 89 2.157 -15.376 8.641 1.00 0.00 H new ATOM 0 HB3 PHE A 89 2.709 -15.196 10.294 1.00 0.00 H new ATOM 0 HD1 PHE A 89 1.120 -14.523 12.100 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -0.213 -15.274 8.074 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -1.218 -14.751 12.909 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -2.548 -15.497 8.888 1.00 0.00 H new ATOM 0 HZ PHE A 89 -3.046 -15.261 11.309 1.00 0.00 H new ATOM 1210 N SER A 90 4.865 -13.737 9.482 1.00 0.00 N ATOM 1211 CA SER A 90 6.267 -13.787 9.102 1.00 0.00 C ATOM 1212 C SER A 90 6.536 -14.898 8.071 1.00 0.00 C ATOM 1213 O SER A 90 7.561 -14.865 7.391 1.00 0.00 O ATOM 1214 CB SER A 90 7.121 -13.982 10.364 1.00 0.00 C ATOM 1215 OG SER A 90 8.184 -13.050 10.369 1.00 0.00 O ATOM 0 H SER A 90 4.686 -14.071 10.429 1.00 0.00 H new ATOM 0 HA SER A 90 6.538 -12.845 8.624 1.00 0.00 H new ATOM 0 HB2 SER A 90 6.506 -13.852 11.255 1.00 0.00 H new ATOM 0 HB3 SER A 90 7.515 -14.998 10.395 1.00 0.00 H new ATOM 0 HG SER A 90 8.726 -13.176 11.176 1.00 0.00 H new ATOM 1221 N GLY A 91 5.634 -15.874 7.926 1.00 0.00 N ATOM 1222 CA GLY A 91 5.795 -16.987 7.005 1.00 0.00 C ATOM 1223 C GLY A 91 4.986 -16.850 5.724 1.00 0.00 C ATOM 1224 O GLY A 91 3.757 -16.991 5.745 1.00 0.00 O ATOM 0 H GLY A 91 4.763 -15.907 8.455 1.00 0.00 H new ATOM 0 HA2 GLY A 91 6.850 -17.083 6.748 1.00 0.00 H new ATOM 0 HA3 GLY A 91 5.504 -17.908 7.510 1.00 0.00 H new ATOM 1228 N LEU A 92 5.659 -16.494 4.629 1.00 0.00 N ATOM 1229 CA LEU A 92 5.056 -16.376 3.297 1.00 0.00 C ATOM 1230 C LEU A 92 4.773 -17.797 2.798 1.00 0.00 C ATOM 1231 O LEU A 92 5.182 -18.773 3.426 1.00 0.00 O ATOM 1232 CB LEU A 92 5.975 -15.618 2.312 1.00 0.00 C ATOM 1233 CG LEU A 92 7.494 -15.903 2.378 1.00 0.00 C ATOM 1234 CD1 LEU A 92 7.857 -17.381 2.208 1.00 0.00 C ATOM 1235 CD2 LEU A 92 8.217 -15.106 1.292 1.00 0.00 C ATOM 0 H LEU A 92 6.655 -16.275 4.641 1.00 0.00 H new ATOM 0 HA LEU A 92 4.135 -15.796 3.358 1.00 0.00 H new ATOM 0 HB2 LEU A 92 5.636 -15.840 1.300 1.00 0.00 H new ATOM 0 HB3 LEU A 92 5.827 -14.550 2.471 1.00 0.00 H new ATOM 0 HG LEU A 92 7.809 -15.603 3.377 1.00 0.00 H new ATOM 0 HD11 LEU A 92 8.939 -17.499 2.266 1.00 0.00 H new ATOM 0 HD12 LEU A 92 7.385 -17.965 2.998 1.00 0.00 H new ATOM 0 HD13 LEU A 92 7.505 -17.733 1.238 1.00 0.00 H new ATOM 0 HD21 LEU A 92 9.287 -15.310 1.342 1.00 0.00 H new ATOM 0 HD22 LEU A 92 7.838 -15.398 0.313 1.00 0.00 H new ATOM 0 HD23 LEU A 92 8.043 -14.041 1.446 1.00 0.00 H new ATOM 1247 N GLY A 93 4.064 -17.952 1.685 1.00 0.00 N ATOM 1248 CA GLY A 93 3.783 -19.287 1.160 1.00 0.00 C ATOM 1249 C GLY A 93 2.950 -19.248 -0.103 1.00 0.00 C ATOM 1250 O GLY A 93 3.508 -18.995 -1.167 1.00 0.00 O ATOM 0 H GLY A 93 3.678 -17.185 1.135 1.00 0.00 H new ATOM 0 HA2 GLY A 93 4.723 -19.799 0.956 1.00 0.00 H new ATOM 0 HA3 GLY A 93 3.261 -19.870 1.918 1.00 0.00 H new ATOM 1254 N ASP A 94 1.631 -19.439 0.018 1.00 0.00 N ATOM 1255 CA ASP A 94 0.707 -19.444 -1.122 1.00 0.00 C ATOM 1256 C ASP A 94 -0.628 -18.737 -0.865 1.00 0.00 C ATOM 1257 O ASP A 94 -1.434 -18.589 -1.784 1.00 0.00 O ATOM 1258 CB ASP A 94 0.488 -20.891 -1.566 1.00 0.00 C ATOM 1259 CG ASP A 94 -0.245 -20.993 -2.901 1.00 0.00 C ATOM 1260 OD1 ASP A 94 0.263 -20.468 -3.919 1.00 0.00 O ATOM 1261 OD2 ASP A 94 -1.280 -21.690 -2.978 1.00 0.00 O ATOM 0 H ASP A 94 1.172 -19.595 0.915 1.00 0.00 H new ATOM 0 HA ASP A 94 1.174 -18.860 -1.915 1.00 0.00 H new ATOM 0 HB2 ASP A 94 1.453 -21.392 -1.647 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -0.082 -21.419 -0.802 1.00 0.00 H new ATOM 1266 N GLY A 95 -0.858 -18.256 0.359 1.00 0.00 N ATOM 1267 CA GLY A 95 -2.083 -17.559 0.740 1.00 0.00 C ATOM 1268 C GLY A 95 -3.242 -18.520 0.982 1.00 0.00 C ATOM 1269 O GLY A 95 -4.316 -18.294 0.430 1.00 0.00 O ATOM 0 H GLY A 95 -0.187 -18.342 1.122 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -1.902 -16.977 1.643 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -2.356 -16.853 -0.044 1.00 0.00 H new ATOM 1273 N TYR A 96 -3.048 -19.561 1.800 1.00 0.00 N ATOM 1274 CA TYR A 96 -4.080 -20.562 2.083 1.00 0.00 C ATOM 1275 C TYR A 96 -4.257 -20.925 3.543 1.00 0.00 C ATOM 1276 O TYR A 96 -5.326 -20.797 4.130 1.00 0.00 O ATOM 1277 CB TYR A 96 -3.799 -21.818 1.247 1.00 0.00 C ATOM 1278 CG TYR A 96 -4.630 -23.033 1.623 1.00 0.00 C ATOM 1279 CD1 TYR A 96 -5.971 -23.145 1.211 1.00 0.00 C ATOM 1280 CD2 TYR A 96 -4.068 -24.031 2.440 1.00 0.00 C ATOM 1281 CE1 TYR A 96 -6.748 -24.245 1.619 1.00 0.00 C ATOM 1282 CE2 TYR A 96 -4.841 -25.122 2.864 1.00 0.00 C ATOM 1283 CZ TYR A 96 -6.188 -25.238 2.458 1.00 0.00 C ATOM 1284 OH TYR A 96 -6.921 -26.307 2.879 1.00 0.00 O ATOM 0 H TYR A 96 -2.167 -19.732 2.285 1.00 0.00 H new ATOM 0 HA TYR A 96 -5.028 -20.101 1.805 1.00 0.00 H new ATOM 0 HB2 TYR A 96 -3.976 -21.585 0.197 1.00 0.00 H new ATOM 0 HB3 TYR A 96 -2.744 -22.073 1.344 1.00 0.00 H new ATOM 0 HD1 TYR A 96 -6.405 -22.384 0.579 1.00 0.00 H new ATOM 0 HD2 TYR A 96 -3.034 -23.957 2.743 1.00 0.00 H new ATOM 0 HE1 TYR A 96 -7.773 -24.332 1.291 1.00 0.00 H new ATOM 0 HE2 TYR A 96 -4.404 -25.875 3.503 1.00 0.00 H new ATOM 0 HH TYR A 96 -6.366 -26.881 3.446 1.00 0.00 H new ATOM 1294 N GLY A 97 -3.162 -21.388 4.092 1.00 0.00 N ATOM 1295 CA GLY A 97 -2.993 -21.863 5.459 1.00 0.00 C ATOM 1296 C GLY A 97 -2.007 -21.018 6.235 1.00 0.00 C ATOM 1297 O GLY A 97 -0.860 -21.416 6.411 1.00 0.00 O ATOM 0 H GLY A 97 -2.294 -21.451 3.561 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -3.957 -21.854 5.968 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -2.650 -22.898 5.443 1.00 0.00 H new ATOM 1301 N GLY A 98 -2.437 -19.834 6.661 1.00 0.00 N ATOM 1302 CA GLY A 98 -1.626 -18.883 7.422 1.00 0.00 C ATOM 1303 C GLY A 98 -0.464 -18.306 6.614 1.00 0.00 C ATOM 1304 O GLY A 98 0.422 -17.652 7.167 1.00 0.00 O ATOM 0 H GLY A 98 -3.384 -19.499 6.483 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -2.261 -18.067 7.767 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -1.233 -19.378 8.310 1.00 0.00 H new ATOM 1308 N THR A 99 -0.477 -18.493 5.298 1.00 0.00 N ATOM 1309 CA THR A 99 0.542 -18.039 4.375 1.00 0.00 C ATOM 1310 C THR A 99 0.065 -16.780 3.641 1.00 0.00 C ATOM 1311 O THR A 99 -1.095 -16.369 3.757 1.00 0.00 O ATOM 1312 CB THR A 99 0.861 -19.216 3.436 1.00 0.00 C ATOM 1313 OG1 THR A 99 -0.330 -19.794 2.924 1.00 0.00 O ATOM 1314 CG2 THR A 99 1.678 -20.298 4.144 1.00 0.00 C ATOM 0 H THR A 99 -1.236 -18.989 4.831 1.00 0.00 H new ATOM 0 HA THR A 99 1.459 -17.747 4.887 1.00 0.00 H new ATOM 0 HB THR A 99 1.452 -18.812 2.614 1.00 0.00 H new ATOM 0 HG1 THR A 99 -0.103 -20.539 2.329 1.00 0.00 H new ATOM 0 HG21 THR A 99 1.883 -21.112 3.449 1.00 0.00 H new ATOM 0 HG22 THR A 99 2.619 -19.873 4.493 1.00 0.00 H new ATOM 0 HG23 THR A 99 1.115 -20.681 4.995 1.00 0.00 H new ATOM 1322 N LEU A 100 0.963 -16.177 2.862 1.00 0.00 N ATOM 1323 CA LEU A 100 0.740 -14.968 2.083 1.00 0.00 C ATOM 1324 C LEU A 100 1.673 -15.047 0.880 1.00 0.00 C ATOM 1325 O LEU A 100 2.839 -15.413 1.045 1.00 0.00 O ATOM 1326 CB LEU A 100 1.084 -13.766 2.986 1.00 0.00 C ATOM 1327 CG LEU A 100 0.764 -12.355 2.447 1.00 0.00 C ATOM 1328 CD1 LEU A 100 0.952 -11.369 3.601 1.00 0.00 C ATOM 1329 CD2 LEU A 100 1.639 -11.878 1.287 1.00 0.00 C ATOM 0 H LEU A 100 1.910 -16.539 2.755 1.00 0.00 H new ATOM 0 HA LEU A 100 -0.288 -14.861 1.738 1.00 0.00 H new ATOM 0 HB2 LEU A 100 0.556 -13.893 3.931 1.00 0.00 H new ATOM 0 HB3 LEU A 100 2.150 -13.807 3.209 1.00 0.00 H new ATOM 0 HG LEU A 100 -0.253 -12.403 2.058 1.00 0.00 H new ATOM 0 HD11 LEU A 100 0.734 -10.359 3.255 1.00 0.00 H new ATOM 0 HD12 LEU A 100 0.275 -11.628 4.415 1.00 0.00 H new ATOM 0 HD13 LEU A 100 1.981 -11.417 3.956 1.00 0.00 H new ATOM 0 HD21 LEU A 100 1.330 -10.877 0.986 1.00 0.00 H new ATOM 0 HD22 LEU A 100 2.682 -11.856 1.603 1.00 0.00 H new ATOM 0 HD23 LEU A 100 1.529 -12.560 0.444 1.00 0.00 H new ATOM 1341 N LEU A 101 1.160 -14.803 -0.323 1.00 0.00 N ATOM 1342 CA LEU A 101 1.915 -14.800 -1.572 1.00 0.00 C ATOM 1343 C LEU A 101 1.351 -13.744 -2.520 1.00 0.00 C ATOM 1344 O LEU A 101 0.173 -13.384 -2.431 1.00 0.00 O ATOM 1345 CB LEU A 101 1.874 -16.188 -2.231 1.00 0.00 C ATOM 1346 CG LEU A 101 2.817 -16.357 -3.449 1.00 0.00 C ATOM 1347 CD1 LEU A 101 4.295 -16.194 -3.074 1.00 0.00 C ATOM 1348 CD2 LEU A 101 2.607 -17.700 -4.152 1.00 0.00 C ATOM 0 H LEU A 101 0.171 -14.594 -0.459 1.00 0.00 H new ATOM 0 HA LEU A 101 2.954 -14.557 -1.352 1.00 0.00 H new ATOM 0 HB2 LEU A 101 2.132 -16.938 -1.483 1.00 0.00 H new ATOM 0 HB3 LEU A 101 0.852 -16.394 -2.549 1.00 0.00 H new ATOM 0 HG LEU A 101 2.553 -15.556 -4.140 1.00 0.00 H new ATOM 0 HD11 LEU A 101 4.912 -16.322 -3.963 1.00 0.00 H new ATOM 0 HD12 LEU A 101 4.458 -15.199 -2.659 1.00 0.00 H new ATOM 0 HD13 LEU A 101 4.567 -16.945 -2.332 1.00 0.00 H new ATOM 0 HD21 LEU A 101 3.288 -17.777 -5.000 1.00 0.00 H new ATOM 0 HD22 LEU A 101 2.805 -18.512 -3.452 1.00 0.00 H new ATOM 0 HD23 LEU A 101 1.578 -17.769 -4.505 1.00 0.00 H new ATOM 1360 N LEU A 102 2.187 -13.260 -3.432 1.00 0.00 N ATOM 1361 CA LEU A 102 1.867 -12.284 -4.452 1.00 0.00 C ATOM 1362 C LEU A 102 2.159 -12.863 -5.831 1.00 0.00 C ATOM 1363 O LEU A 102 2.994 -13.760 -5.989 1.00 0.00 O ATOM 1364 CB LEU A 102 2.617 -10.977 -4.206 1.00 0.00 C ATOM 1365 CG LEU A 102 4.115 -10.960 -4.552 1.00 0.00 C ATOM 1366 CD1 LEU A 102 4.595 -9.533 -4.334 1.00 0.00 C ATOM 1367 CD2 LEU A 102 4.946 -11.901 -3.672 1.00 0.00 C ATOM 0 H LEU A 102 3.161 -13.560 -3.477 1.00 0.00 H new ATOM 0 HA LEU A 102 0.803 -12.051 -4.406 1.00 0.00 H new ATOM 0 HB2 LEU A 102 2.127 -10.191 -4.781 1.00 0.00 H new ATOM 0 HB3 LEU A 102 2.509 -10.717 -3.153 1.00 0.00 H new ATOM 0 HG LEU A 102 4.242 -11.301 -5.579 1.00 0.00 H new ATOM 0 HD11 LEU A 102 5.658 -9.467 -4.567 1.00 0.00 H new ATOM 0 HD12 LEU A 102 4.038 -8.858 -4.985 1.00 0.00 H new ATOM 0 HD13 LEU A 102 4.433 -9.250 -3.294 1.00 0.00 H new ATOM 0 HD21 LEU A 102 5.994 -11.843 -3.966 1.00 0.00 H new ATOM 0 HD22 LEU A 102 4.845 -11.606 -2.628 1.00 0.00 H new ATOM 0 HD23 LEU A 102 4.590 -12.924 -3.796 1.00 0.00 H new ATOM 1379 N LYS A 103 1.454 -12.328 -6.821 1.00 0.00 N ATOM 1380 CA LYS A 103 1.509 -12.683 -8.226 1.00 0.00 C ATOM 1381 C LYS A 103 1.284 -11.413 -9.031 1.00 0.00 C ATOM 1382 O LYS A 103 0.920 -10.370 -8.479 1.00 0.00 O ATOM 1383 CB LYS A 103 0.411 -13.728 -8.532 1.00 0.00 C ATOM 1384 CG LYS A 103 0.917 -14.948 -9.314 1.00 0.00 C ATOM 1385 CD LYS A 103 1.938 -15.765 -8.512 1.00 0.00 C ATOM 1386 CE LYS A 103 2.183 -17.106 -9.206 1.00 0.00 C ATOM 1387 NZ LYS A 103 3.083 -17.982 -8.434 1.00 0.00 N ATOM 0 H LYS A 103 0.782 -11.581 -6.645 1.00 0.00 H new ATOM 0 HA LYS A 103 2.474 -13.118 -8.486 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -0.027 -14.066 -7.593 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -0.385 -13.248 -9.101 1.00 0.00 H new ATOM 0 HG2 LYS A 103 0.072 -15.584 -9.579 1.00 0.00 H new ATOM 0 HG3 LYS A 103 1.372 -14.617 -10.248 1.00 0.00 H new ATOM 0 HD2 LYS A 103 2.874 -15.213 -8.426 1.00 0.00 H new ATOM 0 HD3 LYS A 103 1.571 -15.930 -7.499 1.00 0.00 H new ATOM 0 HE2 LYS A 103 1.230 -17.613 -9.358 1.00 0.00 H new ATOM 0 HE3 LYS A 103 2.611 -16.929 -10.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 3.218 -18.878 -8.945 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 4.002 -17.512 -8.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 2.664 -18.175 -7.502 1.00 0.00 H new ATOM 1401 N THR A 104 1.459 -11.485 -10.338 1.00 0.00 N ATOM 1402 CA THR A 104 1.259 -10.344 -11.216 1.00 0.00 C ATOM 1403 C THR A 104 0.212 -10.707 -12.273 1.00 0.00 C ATOM 1404 O THR A 104 -0.036 -11.889 -12.539 1.00 0.00 O ATOM 1405 CB THR A 104 2.612 -9.894 -11.791 1.00 0.00 C ATOM 1406 OG1 THR A 104 3.221 -10.983 -12.459 1.00 0.00 O ATOM 1407 CG2 THR A 104 3.574 -9.380 -10.714 1.00 0.00 C ATOM 0 H THR A 104 1.744 -12.336 -10.822 1.00 0.00 H new ATOM 0 HA THR A 104 0.865 -9.484 -10.674 1.00 0.00 H new ATOM 0 HB THR A 104 2.410 -9.070 -12.476 1.00 0.00 H new ATOM 0 HG1 THR A 104 4.083 -10.699 -12.828 1.00 0.00 H new ATOM 0 HG21 THR A 104 4.512 -9.077 -11.179 1.00 0.00 H new ATOM 0 HG22 THR A 104 3.128 -8.525 -10.206 1.00 0.00 H new ATOM 0 HG23 THR A 104 3.767 -10.172 -9.991 1.00 0.00 H new ATOM 1415 N ASN A 105 -0.436 -9.691 -12.851 1.00 0.00 N ATOM 1416 CA ASN A 105 -1.457 -9.874 -13.894 1.00 0.00 C ATOM 1417 C ASN A 105 -0.848 -10.464 -15.177 1.00 0.00 C ATOM 1418 O ASN A 105 0.349 -10.738 -15.222 1.00 0.00 O ATOM 1419 CB ASN A 105 -2.198 -8.556 -14.192 1.00 0.00 C ATOM 1420 CG ASN A 105 -1.562 -7.728 -15.303 1.00 0.00 C ATOM 1421 OD1 ASN A 105 -2.022 -7.741 -16.435 1.00 0.00 O ATOM 1422 ND2 ASN A 105 -0.461 -7.057 -15.039 1.00 0.00 N ATOM 0 H ASN A 105 -0.269 -8.714 -12.610 1.00 0.00 H new ATOM 0 HA ASN A 105 -2.187 -10.588 -13.512 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -3.228 -8.784 -14.466 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -2.235 -7.957 -13.282 1.00 0.00 H new ATOM 0 HD21 ASN A 105 0.014 -6.544 -15.782 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -0.083 -7.050 -14.092 1.00 0.00 H new ATOM 1429 N ALA A 106 -1.660 -10.649 -16.224 1.00 0.00 N ATOM 1430 CA ALA A 106 -1.239 -11.188 -17.512 1.00 0.00 C ATOM 1431 C ALA A 106 0.008 -10.477 -18.056 1.00 0.00 C ATOM 1432 O ALA A 106 0.962 -11.143 -18.459 1.00 0.00 O ATOM 1433 CB ALA A 106 -2.394 -11.080 -18.511 1.00 0.00 C ATOM 0 H ALA A 106 -2.654 -10.420 -16.193 1.00 0.00 H new ATOM 0 HA ALA A 106 -0.972 -12.235 -17.369 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -2.081 -11.483 -19.474 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -3.249 -11.647 -18.142 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -2.676 -10.034 -18.629 1.00 0.00 H new ATOM 1439 N GLU A 107 0.028 -9.143 -18.040 1.00 0.00 N ATOM 1440 CA GLU A 107 1.143 -8.329 -18.529 1.00 0.00 C ATOM 1441 C GLU A 107 2.297 -8.298 -17.520 1.00 0.00 C ATOM 1442 O GLU A 107 3.458 -8.097 -17.882 1.00 0.00 O ATOM 1443 CB GLU A 107 0.643 -6.902 -18.786 1.00 0.00 C ATOM 1444 CG GLU A 107 -0.446 -6.876 -19.867 1.00 0.00 C ATOM 1445 CD GLU A 107 -0.929 -5.458 -20.122 1.00 0.00 C ATOM 1446 OE1 GLU A 107 -1.718 -4.935 -19.295 1.00 0.00 O ATOM 1447 OE2 GLU A 107 -0.499 -4.845 -21.122 1.00 0.00 O ATOM 0 H GLU A 107 -0.747 -8.586 -17.679 1.00 0.00 H new ATOM 0 HA GLU A 107 1.518 -8.771 -19.452 1.00 0.00 H new ATOM 0 HB2 GLU A 107 0.250 -6.481 -17.861 1.00 0.00 H new ATOM 0 HB3 GLU A 107 1.478 -6.272 -19.093 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -0.056 -7.302 -20.791 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -1.285 -7.499 -19.558 1.00 0.00 H new ATOM 1454 N GLY A 108 1.995 -8.490 -16.238 1.00 0.00 N ATOM 1455 CA GLY A 108 2.951 -8.507 -15.143 1.00 0.00 C ATOM 1456 C GLY A 108 3.149 -7.162 -14.444 1.00 0.00 C ATOM 1457 O GLY A 108 3.751 -7.120 -13.375 1.00 0.00 O ATOM 0 H GLY A 108 1.036 -8.644 -15.925 1.00 0.00 H new ATOM 0 HA2 GLY A 108 2.624 -9.239 -14.405 1.00 0.00 H new ATOM 0 HA3 GLY A 108 3.914 -8.847 -15.525 1.00 0.00 H new ATOM 1461 N THR A 109 2.651 -6.066 -15.007 1.00 0.00 N ATOM 1462 CA THR A 109 2.774 -4.712 -14.471 1.00 0.00 C ATOM 1463 C THR A 109 1.942 -4.533 -13.199 1.00 0.00 C ATOM 1464 O THR A 109 2.374 -3.954 -12.207 1.00 0.00 O ATOM 1465 CB THR A 109 2.317 -3.759 -15.582 1.00 0.00 C ATOM 1466 OG1 THR A 109 1.109 -4.251 -16.150 1.00 0.00 O ATOM 1467 CG2 THR A 109 3.365 -3.646 -16.694 1.00 0.00 C ATOM 0 H THR A 109 2.130 -6.096 -15.883 1.00 0.00 H new ATOM 0 HA THR A 109 3.804 -4.503 -14.182 1.00 0.00 H new ATOM 0 HB THR A 109 2.170 -2.773 -15.140 1.00 0.00 H new ATOM 0 HG1 THR A 109 0.811 -3.645 -16.860 1.00 0.00 H new ATOM 0 HG21 THR A 109 3.007 -2.962 -17.464 1.00 0.00 H new ATOM 0 HG22 THR A 109 4.298 -3.266 -16.277 1.00 0.00 H new ATOM 0 HG23 THR A 109 3.537 -4.629 -17.133 1.00 0.00 H new ATOM 1475 N ARG A 110 0.719 -5.061 -13.195 1.00 0.00 N ATOM 1476 CA ARG A 110 -0.161 -4.971 -12.039 1.00 0.00 C ATOM 1477 C ARG A 110 0.172 -6.156 -11.173 1.00 0.00 C ATOM 1478 O ARG A 110 0.346 -7.265 -11.689 1.00 0.00 O ATOM 1479 CB ARG A 110 -1.641 -5.040 -12.434 1.00 0.00 C ATOM 1480 CG ARG A 110 -2.181 -3.699 -12.928 1.00 0.00 C ATOM 1481 CD ARG A 110 -3.674 -3.829 -13.243 1.00 0.00 C ATOM 1482 NE ARG A 110 -3.899 -4.523 -14.524 1.00 0.00 N ATOM 1483 CZ ARG A 110 -5.023 -5.142 -14.894 1.00 0.00 C ATOM 1484 NH1 ARG A 110 -6.059 -5.236 -14.068 1.00 0.00 N ATOM 1485 NH2 ARG A 110 -5.130 -5.664 -16.106 1.00 0.00 N ATOM 0 H ARG A 110 0.316 -5.559 -13.989 1.00 0.00 H new ATOM 0 HA ARG A 110 -0.012 -4.018 -11.531 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -1.770 -5.789 -13.215 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -2.227 -5.370 -11.576 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -2.025 -2.931 -12.170 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -1.638 -3.383 -13.818 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -4.170 -4.375 -12.440 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -4.126 -2.838 -13.281 1.00 0.00 H new ATOM 0 HE ARG A 110 -3.125 -4.531 -15.189 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -6.004 -4.832 -13.133 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -6.909 -5.713 -14.369 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -4.352 -5.594 -16.762 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -5.991 -6.136 -16.384 1.00 0.00 H new ATOM 1499 N THR A 111 0.217 -5.925 -9.875 1.00 0.00 N ATOM 1500 CA THR A 111 0.520 -6.914 -8.873 1.00 0.00 C ATOM 1501 C THR A 111 -0.753 -7.157 -8.067 1.00 0.00 C ATOM 1502 O THR A 111 -1.491 -6.239 -7.711 1.00 0.00 O ATOM 1503 CB THR A 111 1.693 -6.393 -8.036 1.00 0.00 C ATOM 1504 OG1 THR A 111 2.758 -5.995 -8.871 1.00 0.00 O ATOM 1505 CG2 THR A 111 2.224 -7.409 -7.022 1.00 0.00 C ATOM 0 H THR A 111 0.035 -5.003 -9.479 1.00 0.00 H new ATOM 0 HA THR A 111 0.828 -7.872 -9.291 1.00 0.00 H new ATOM 0 HB THR A 111 1.298 -5.545 -7.477 1.00 0.00 H new ATOM 0 HG1 THR A 111 3.556 -6.522 -8.657 1.00 0.00 H new ATOM 0 HG21 THR A 111 3.053 -6.970 -6.467 1.00 0.00 H new ATOM 0 HG22 THR A 111 1.428 -7.682 -6.330 1.00 0.00 H new ATOM 0 HG23 THR A 111 2.570 -8.300 -7.546 1.00 0.00 H new ATOM 1513 N TYR A 112 -1.010 -8.426 -7.789 1.00 0.00 N ATOM 1514 CA TYR A 112 -2.146 -8.918 -7.029 1.00 0.00 C ATOM 1515 C TYR A 112 -1.575 -9.824 -5.936 1.00 0.00 C ATOM 1516 O TYR A 112 -0.916 -10.823 -6.238 1.00 0.00 O ATOM 1517 CB TYR A 112 -3.083 -9.648 -7.999 1.00 0.00 C ATOM 1518 CG TYR A 112 -4.448 -9.008 -8.138 1.00 0.00 C ATOM 1519 CD1 TYR A 112 -4.610 -7.743 -8.738 1.00 0.00 C ATOM 1520 CD2 TYR A 112 -5.568 -9.700 -7.655 1.00 0.00 C ATOM 1521 CE1 TYR A 112 -5.895 -7.176 -8.857 1.00 0.00 C ATOM 1522 CE2 TYR A 112 -6.844 -9.141 -7.764 1.00 0.00 C ATOM 1523 CZ TYR A 112 -7.020 -7.869 -8.348 1.00 0.00 C ATOM 1524 OH TYR A 112 -8.276 -7.362 -8.475 1.00 0.00 O ATOM 0 H TYR A 112 -0.399 -9.179 -8.105 1.00 0.00 H new ATOM 0 HA TYR A 112 -2.732 -8.132 -6.553 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -2.611 -9.690 -8.981 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -3.208 -10.677 -7.661 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -3.748 -7.207 -9.107 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -5.444 -10.670 -7.196 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -6.021 -6.216 -9.335 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -7.701 -9.687 -7.399 1.00 0.00 H new ATOM 0 HH TYR A 112 -8.930 -8.032 -8.186 1.00 0.00 H new ATOM 1534 N LEU A 113 -1.792 -9.481 -4.666 1.00 0.00 N ATOM 1535 CA LEU A 113 -1.312 -10.225 -3.500 1.00 0.00 C ATOM 1536 C LEU A 113 -2.469 -10.514 -2.551 1.00 0.00 C ATOM 1537 O LEU A 113 -3.435 -9.750 -2.526 1.00 0.00 O ATOM 1538 CB LEU A 113 -0.189 -9.460 -2.768 1.00 0.00 C ATOM 1539 CG LEU A 113 -0.556 -8.147 -2.036 1.00 0.00 C ATOM 1540 CD1 LEU A 113 0.497 -7.855 -0.962 1.00 0.00 C ATOM 1541 CD2 LEU A 113 -0.611 -6.946 -2.993 1.00 0.00 C ATOM 0 H LEU A 113 -2.325 -8.649 -4.412 1.00 0.00 H new ATOM 0 HA LEU A 113 -0.895 -11.170 -3.849 1.00 0.00 H new ATOM 0 HB2 LEU A 113 0.253 -10.137 -2.037 1.00 0.00 H new ATOM 0 HB3 LEU A 113 0.587 -9.229 -3.498 1.00 0.00 H new ATOM 0 HG LEU A 113 -1.544 -8.284 -1.597 1.00 0.00 H new ATOM 0 HD11 LEU A 113 0.242 -6.930 -0.444 1.00 0.00 H new ATOM 0 HD12 LEU A 113 0.524 -8.676 -0.246 1.00 0.00 H new ATOM 0 HD13 LEU A 113 1.475 -7.750 -1.431 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -0.872 -6.047 -2.434 1.00 0.00 H new ATOM 0 HD22 LEU A 113 0.363 -6.811 -3.463 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -1.363 -7.127 -3.761 1.00 0.00 H new ATOM 1553 N LYS A 114 -2.423 -11.624 -1.809 1.00 0.00 N ATOM 1554 CA LYS A 114 -3.442 -11.985 -0.847 1.00 0.00 C ATOM 1555 C LYS A 114 -2.850 -12.714 0.346 1.00 0.00 C ATOM 1556 O LYS A 114 -2.003 -13.602 0.186 1.00 0.00 O ATOM 1557 CB LYS A 114 -4.604 -12.710 -1.517 1.00 0.00 C ATOM 1558 CG LYS A 114 -4.449 -14.167 -1.972 1.00 0.00 C ATOM 1559 CD LYS A 114 -3.839 -14.221 -3.377 1.00 0.00 C ATOM 1560 CE LYS A 114 -3.744 -15.629 -3.962 1.00 0.00 C ATOM 1561 NZ LYS A 114 -5.081 -16.203 -4.191 1.00 0.00 N ATOM 0 H LYS A 114 -1.662 -12.300 -1.868 1.00 0.00 H new ATOM 0 HA LYS A 114 -3.871 -11.072 -0.435 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -5.447 -12.676 -0.827 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -4.886 -12.127 -2.394 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -3.814 -14.709 -1.271 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -5.420 -14.661 -1.970 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -4.437 -13.601 -4.045 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -2.841 -13.784 -3.345 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -3.193 -15.599 -4.902 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -3.182 -16.270 -3.283 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -4.997 -17.054 -4.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -5.510 -16.458 -3.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -5.681 -15.504 -4.673 1.00 0.00 H new ATOM 1575 N SER A 115 -3.330 -12.351 1.529 1.00 0.00 N ATOM 1576 CA SER A 115 -2.939 -12.893 2.813 1.00 0.00 C ATOM 1577 C SER A 115 -4.082 -13.780 3.284 1.00 0.00 C ATOM 1578 O SER A 115 -5.241 -13.366 3.174 1.00 0.00 O ATOM 1579 CB SER A 115 -2.706 -11.719 3.773 1.00 0.00 C ATOM 1580 OG SER A 115 -2.200 -12.164 5.013 1.00 0.00 O ATOM 0 H SER A 115 -4.044 -11.628 1.617 1.00 0.00 H new ATOM 0 HA SER A 115 -2.022 -13.480 2.762 1.00 0.00 H new ATOM 0 HB2 SER A 115 -2.007 -11.013 3.325 1.00 0.00 H new ATOM 0 HB3 SER A 115 -3.642 -11.184 3.931 1.00 0.00 H new ATOM 0 HG SER A 115 -2.060 -11.395 5.604 1.00 0.00 H new ATOM 1586 N PHE A 116 -3.737 -14.985 3.755 1.00 0.00 N ATOM 1587 CA PHE A 116 -4.587 -16.047 4.294 1.00 0.00 C ATOM 1588 C PHE A 116 -6.069 -15.889 3.920 1.00 0.00 C ATOM 1589 O PHE A 116 -6.871 -15.402 4.722 1.00 0.00 O ATOM 1590 CB PHE A 116 -4.364 -16.086 5.820 1.00 0.00 C ATOM 1591 CG PHE A 116 -5.238 -17.088 6.556 1.00 0.00 C ATOM 1592 CD1 PHE A 116 -5.223 -18.443 6.191 1.00 0.00 C ATOM 1593 CD2 PHE A 116 -6.100 -16.662 7.582 1.00 0.00 C ATOM 1594 CE1 PHE A 116 -6.026 -19.376 6.872 1.00 0.00 C ATOM 1595 CE2 PHE A 116 -6.920 -17.589 8.252 1.00 0.00 C ATOM 1596 CZ PHE A 116 -6.878 -18.948 7.902 1.00 0.00 C ATOM 0 H PHE A 116 -2.756 -15.265 3.768 1.00 0.00 H new ATOM 0 HA PHE A 116 -4.304 -17.000 3.846 1.00 0.00 H new ATOM 0 HB2 PHE A 116 -3.318 -16.321 6.016 1.00 0.00 H new ATOM 0 HB3 PHE A 116 -4.549 -15.092 6.228 1.00 0.00 H new ATOM 0 HD1 PHE A 116 -4.590 -18.772 5.381 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -6.133 -15.618 7.857 1.00 0.00 H new ATOM 0 HE1 PHE A 116 -5.987 -20.421 6.602 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -7.583 -17.254 9.037 1.00 0.00 H new ATOM 0 HZ PHE A 116 -7.499 -19.661 8.423 1.00 0.00 H new ATOM 1606 N GLU A 117 -6.440 -16.219 2.681 1.00 0.00 N ATOM 1607 CA GLU A 117 -7.828 -16.084 2.248 1.00 0.00 C ATOM 1608 C GLU A 117 -8.633 -17.344 2.579 1.00 0.00 C ATOM 1609 O GLU A 117 -8.052 -18.419 2.771 1.00 0.00 O ATOM 1610 CB GLU A 117 -7.886 -15.694 0.764 1.00 0.00 C ATOM 1611 CG GLU A 117 -7.699 -16.877 -0.199 1.00 0.00 C ATOM 1612 CD GLU A 117 -7.586 -16.441 -1.659 1.00 0.00 C ATOM 1613 OE1 GLU A 117 -8.139 -15.387 -2.045 1.00 0.00 O ATOM 1614 OE2 GLU A 117 -6.921 -17.148 -2.445 1.00 0.00 O ATOM 0 H GLU A 117 -5.805 -16.578 1.968 1.00 0.00 H new ATOM 0 HA GLU A 117 -8.302 -15.275 2.803 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -8.847 -15.221 0.560 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -7.115 -14.950 0.564 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -6.802 -17.429 0.081 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -8.540 -17.562 -0.093 1.00 0.00 H new ATOM 1621 N ALA A 118 -9.964 -17.222 2.612 1.00 0.00 N ATOM 1622 CA ALA A 118 -10.880 -18.315 2.904 1.00 0.00 C ATOM 1623 C ALA A 118 -11.813 -18.552 1.709 1.00 0.00 C ATOM 1624 O ALA A 118 -11.371 -18.592 0.559 1.00 0.00 O ATOM 1625 CB ALA A 118 -11.592 -18.075 4.247 1.00 0.00 C ATOM 0 H ALA A 118 -10.439 -16.338 2.431 1.00 0.00 H new ATOM 0 HA ALA A 118 -10.332 -19.248 3.036 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -12.273 -18.901 4.450 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -10.852 -18.010 5.045 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -12.156 -17.143 4.199 1.00 0.00 H new ATOM 1631 N ASP A 119 -13.088 -18.797 1.981 1.00 0.00 N ATOM 1632 CA ASP A 119 -14.152 -19.074 1.032 1.00 0.00 C ATOM 1633 C ASP A 119 -14.885 -17.806 0.610 1.00 0.00 C ATOM 1634 O ASP A 119 -14.920 -16.800 1.325 1.00 0.00 O ATOM 1635 CB ASP A 119 -15.136 -20.091 1.647 1.00 0.00 C ATOM 1636 CG ASP A 119 -15.876 -19.632 2.916 1.00 0.00 C ATOM 1637 OD1 ASP A 119 -15.339 -18.800 3.678 1.00 0.00 O ATOM 1638 OD2 ASP A 119 -16.972 -20.178 3.189 1.00 0.00 O ATOM 0 H ASP A 119 -13.428 -18.807 2.943 1.00 0.00 H new ATOM 0 HA ASP A 119 -13.704 -19.496 0.132 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -15.878 -20.351 0.892 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -14.586 -21.003 1.881 1.00 0.00 H new ATOM 1643 N ALA A 120 -15.493 -17.861 -0.576 1.00 0.00 N ATOM 1644 CA ALA A 120 -16.272 -16.794 -1.201 1.00 0.00 C ATOM 1645 C ALA A 120 -17.552 -16.468 -0.417 1.00 0.00 C ATOM 1646 O ALA A 120 -18.289 -15.566 -0.809 1.00 0.00 O ATOM 1647 CB ALA A 120 -16.630 -17.197 -2.634 1.00 0.00 C ATOM 0 H ALA A 120 -15.452 -18.698 -1.157 1.00 0.00 H new ATOM 0 HA ALA A 120 -15.657 -15.894 -1.203 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -17.211 -16.402 -3.101 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -15.716 -17.362 -3.205 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -17.218 -18.115 -2.618 1.00 0.00 H new ATOM 1653 N GLU A 121 -17.843 -17.198 0.662 1.00 0.00 N ATOM 1654 CA GLU A 121 -19.031 -17.023 1.487 1.00 0.00 C ATOM 1655 C GLU A 121 -18.708 -16.485 2.880 1.00 0.00 C ATOM 1656 O GLU A 121 -19.615 -16.058 3.594 1.00 0.00 O ATOM 1657 CB GLU A 121 -19.752 -18.384 1.541 1.00 0.00 C ATOM 1658 CG GLU A 121 -21.192 -18.360 2.077 1.00 0.00 C ATOM 1659 CD GLU A 121 -22.036 -17.205 1.531 1.00 0.00 C ATOM 1660 OE1 GLU A 121 -21.954 -16.903 0.316 1.00 0.00 O ATOM 1661 OE2 GLU A 121 -22.735 -16.539 2.329 1.00 0.00 O ATOM 0 H GLU A 121 -17.237 -17.949 0.992 1.00 0.00 H new ATOM 0 HA GLU A 121 -19.680 -16.267 1.045 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -19.766 -18.806 0.536 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -19.165 -19.060 2.163 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -21.678 -19.303 1.827 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -21.164 -18.294 3.165 1.00 0.00 H new ATOM 1668 N GLY A 122 -17.431 -16.486 3.262 1.00 0.00 N ATOM 1669 CA GLY A 122 -16.962 -16.015 4.547 1.00 0.00 C ATOM 1670 C GLY A 122 -16.237 -14.694 4.388 1.00 0.00 C ATOM 1671 O GLY A 122 -16.714 -13.674 4.879 1.00 0.00 O ATOM 0 H GLY A 122 -16.680 -16.826 2.662 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -17.804 -15.896 5.228 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -16.294 -16.753 4.991 1.00 0.00 H new ATOM 1675 N ARG A 123 -15.062 -14.724 3.746 1.00 0.00 N ATOM 1676 CA ARG A 123 -14.209 -13.546 3.501 1.00 0.00 C ATOM 1677 C ARG A 123 -13.030 -13.950 2.636 1.00 0.00 C ATOM 1678 O ARG A 123 -12.473 -15.036 2.838 1.00 0.00 O ATOM 1679 CB ARG A 123 -13.664 -12.959 4.822 1.00 0.00 C ATOM 1680 CG ARG A 123 -14.350 -11.659 5.247 1.00 0.00 C ATOM 1681 CD ARG A 123 -14.366 -11.517 6.770 1.00 0.00 C ATOM 1682 NE ARG A 123 -15.582 -12.122 7.337 1.00 0.00 N ATOM 1683 CZ ARG A 123 -16.701 -11.461 7.659 1.00 0.00 C ATOM 1684 NH1 ARG A 123 -16.810 -10.147 7.481 1.00 0.00 N ATOM 1685 NH2 ARG A 123 -17.719 -12.119 8.198 1.00 0.00 N ATOM 0 H ARG A 123 -14.666 -15.586 3.372 1.00 0.00 H new ATOM 0 HA ARG A 123 -14.817 -12.791 3.004 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -13.783 -13.698 5.614 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -12.595 -12.777 4.714 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -13.831 -10.809 4.805 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -15.371 -11.642 4.866 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -13.484 -11.997 7.194 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -14.318 -10.463 7.042 1.00 0.00 H new ATOM 0 HE ARG A 123 -15.571 -13.129 7.498 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -16.030 -9.619 7.091 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -17.674 -9.668 7.735 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -17.646 -13.123 8.365 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -18.574 -11.621 8.446 1.00 0.00 H new ATOM 1699 N ARG A 124 -12.649 -13.113 1.670 1.00 0.00 N ATOM 1700 CA ARG A 124 -11.518 -13.385 0.785 1.00 0.00 C ATOM 1701 C ARG A 124 -10.717 -12.103 0.606 1.00 0.00 C ATOM 1702 O ARG A 124 -11.307 -11.048 0.411 1.00 0.00 O ATOM 1703 CB ARG A 124 -12.019 -13.990 -0.532 1.00 0.00 C ATOM 1704 CG ARG A 124 -11.511 -15.438 -0.649 1.00 0.00 C ATOM 1705 CD ARG A 124 -12.360 -16.274 -1.595 1.00 0.00 C ATOM 1706 NE ARG A 124 -12.480 -15.648 -2.918 1.00 0.00 N ATOM 1707 CZ ARG A 124 -11.613 -15.736 -3.931 1.00 0.00 C ATOM 1708 NH1 ARG A 124 -10.547 -16.530 -3.871 1.00 0.00 N ATOM 1709 NH2 ARG A 124 -11.830 -15.014 -5.016 1.00 0.00 N ATOM 0 H ARG A 124 -13.117 -12.227 1.480 1.00 0.00 H new ATOM 0 HA ARG A 124 -10.847 -14.126 1.219 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -13.108 -13.970 -0.564 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -11.665 -13.398 -1.376 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -10.479 -15.431 -1.000 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -11.509 -15.901 0.338 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -11.918 -17.265 -1.701 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -13.353 -16.412 -1.167 1.00 0.00 H new ATOM 0 HE ARG A 124 -13.315 -15.085 -3.081 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -10.375 -17.091 -3.037 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -9.902 -16.578 -4.659 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -12.646 -14.405 -5.068 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -11.181 -15.066 -5.801 1.00 0.00 H new ATOM 1723 N PHE A 125 -9.392 -12.163 0.679 1.00 0.00 N ATOM 1724 CA PHE A 125 -8.527 -11.000 0.532 1.00 0.00 C ATOM 1725 C PHE A 125 -8.327 -10.714 -0.955 1.00 0.00 C ATOM 1726 O PHE A 125 -7.909 -11.616 -1.684 1.00 0.00 O ATOM 1727 CB PHE A 125 -7.201 -11.291 1.257 1.00 0.00 C ATOM 1728 CG PHE A 125 -6.185 -10.156 1.341 1.00 0.00 C ATOM 1729 CD1 PHE A 125 -5.663 -9.536 0.186 1.00 0.00 C ATOM 1730 CD2 PHE A 125 -5.725 -9.733 2.603 1.00 0.00 C ATOM 1731 CE1 PHE A 125 -4.734 -8.489 0.296 1.00 0.00 C ATOM 1732 CE2 PHE A 125 -4.799 -8.682 2.713 1.00 0.00 C ATOM 1733 CZ PHE A 125 -4.311 -8.050 1.560 1.00 0.00 C ATOM 0 H PHE A 125 -8.883 -13.031 0.844 1.00 0.00 H new ATOM 0 HA PHE A 125 -8.971 -10.110 0.979 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -7.435 -11.610 2.273 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -6.723 -12.135 0.760 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -5.981 -9.870 -0.791 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -6.088 -10.221 3.495 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -4.344 -8.020 -0.595 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -4.462 -8.360 3.687 1.00 0.00 H new ATOM 0 HZ PHE A 125 -3.613 -7.230 1.644 1.00 0.00 H new ATOM 1743 N GLU A 126 -8.638 -9.501 -1.419 1.00 0.00 N ATOM 1744 CA GLU A 126 -8.448 -9.107 -2.824 1.00 0.00 C ATOM 1745 C GLU A 126 -8.059 -7.625 -2.852 1.00 0.00 C ATOM 1746 O GLU A 126 -8.780 -6.804 -2.286 1.00 0.00 O ATOM 1747 CB GLU A 126 -9.692 -9.368 -3.710 1.00 0.00 C ATOM 1748 CG GLU A 126 -9.267 -9.395 -5.196 1.00 0.00 C ATOM 1749 CD GLU A 126 -10.379 -9.309 -6.256 1.00 0.00 C ATOM 1750 OE1 GLU A 126 -11.589 -9.355 -5.941 1.00 0.00 O ATOM 1751 OE2 GLU A 126 -10.052 -9.189 -7.468 1.00 0.00 O ATOM 0 H GLU A 126 -9.029 -8.762 -0.834 1.00 0.00 H new ATOM 0 HA GLU A 126 -7.658 -9.726 -3.249 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -10.155 -10.316 -3.436 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -10.438 -8.590 -3.548 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -8.578 -8.567 -5.364 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -8.708 -10.315 -5.369 1.00 0.00 H new ATOM 1758 N VAL A 127 -6.928 -7.284 -3.477 1.00 0.00 N ATOM 1759 CA VAL A 127 -6.423 -5.918 -3.599 1.00 0.00 C ATOM 1760 C VAL A 127 -5.807 -5.745 -4.992 1.00 0.00 C ATOM 1761 O VAL A 127 -5.568 -6.739 -5.683 1.00 0.00 O ATOM 1762 CB VAL A 127 -5.442 -5.647 -2.444 1.00 0.00 C ATOM 1763 CG1 VAL A 127 -4.030 -6.205 -2.678 1.00 0.00 C ATOM 1764 CG2 VAL A 127 -5.361 -4.162 -2.103 1.00 0.00 C ATOM 0 H VAL A 127 -6.323 -7.973 -3.924 1.00 0.00 H new ATOM 0 HA VAL A 127 -7.218 -5.178 -3.513 1.00 0.00 H new ATOM 0 HB VAL A 127 -5.860 -6.189 -1.596 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -3.400 -5.973 -1.819 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -4.083 -7.286 -2.807 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -3.604 -5.753 -3.574 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -4.658 -4.015 -1.283 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -5.021 -3.606 -2.977 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -6.346 -3.803 -1.805 1.00 0.00 H new ATOM 1774 N ALA A 128 -5.541 -4.506 -5.413 1.00 0.00 N ATOM 1775 CA ALA A 128 -4.961 -4.189 -6.718 1.00 0.00 C ATOM 1776 C ALA A 128 -3.820 -3.179 -6.568 1.00 0.00 C ATOM 1777 O ALA A 128 -4.028 -2.086 -6.057 1.00 0.00 O ATOM 1778 CB ALA A 128 -6.062 -3.653 -7.647 1.00 0.00 C ATOM 0 H ALA A 128 -5.727 -3.680 -4.844 1.00 0.00 H new ATOM 0 HA ALA A 128 -4.541 -5.093 -7.159 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -5.633 -3.416 -8.621 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -6.837 -4.410 -7.767 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -6.498 -2.753 -7.213 1.00 0.00 H new ATOM 1784 N LEU A 129 -2.619 -3.526 -7.034 1.00 0.00 N ATOM 1785 CA LEU A 129 -1.426 -2.684 -6.979 1.00 0.00 C ATOM 1786 C LEU A 129 -0.940 -2.407 -8.398 1.00 0.00 C ATOM 1787 O LEU A 129 -0.758 -3.349 -9.176 1.00 0.00 O ATOM 1788 CB LEU A 129 -0.355 -3.416 -6.153 1.00 0.00 C ATOM 1789 CG LEU A 129 1.030 -2.742 -6.082 1.00 0.00 C ATOM 1790 CD1 LEU A 129 0.927 -1.385 -5.418 1.00 0.00 C ATOM 1791 CD2 LEU A 129 1.951 -3.622 -5.235 1.00 0.00 C ATOM 0 H LEU A 129 -2.446 -4.430 -7.474 1.00 0.00 H new ATOM 0 HA LEU A 129 -1.644 -1.727 -6.505 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -0.730 -3.536 -5.137 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -0.228 -4.416 -6.567 1.00 0.00 H new ATOM 0 HG LEU A 129 1.419 -2.618 -7.093 1.00 0.00 H new ATOM 0 HD11 LEU A 129 1.914 -0.924 -5.377 1.00 0.00 H new ATOM 0 HD12 LEU A 129 0.253 -0.749 -5.992 1.00 0.00 H new ATOM 0 HD13 LEU A 129 0.539 -1.504 -4.406 1.00 0.00 H new ATOM 0 HD21 LEU A 129 2.937 -3.162 -5.172 1.00 0.00 H new ATOM 0 HD22 LEU A 129 1.535 -3.726 -4.233 1.00 0.00 H new ATOM 0 HD23 LEU A 129 2.038 -4.606 -5.695 1.00 0.00 H new ATOM 1803 N ASP A 130 -0.817 -1.138 -8.773 1.00 0.00 N ATOM 1804 CA ASP A 130 -0.343 -0.675 -10.077 1.00 0.00 C ATOM 1805 C ASP A 130 1.059 -0.091 -9.865 1.00 0.00 C ATOM 1806 O ASP A 130 1.222 0.794 -9.025 1.00 0.00 O ATOM 1807 CB ASP A 130 -1.336 0.337 -10.672 1.00 0.00 C ATOM 1808 CG ASP A 130 -1.188 0.511 -12.181 1.00 0.00 C ATOM 1809 OD1 ASP A 130 -1.589 -0.421 -12.924 1.00 0.00 O ATOM 1810 OD2 ASP A 130 -0.764 1.583 -12.659 1.00 0.00 O ATOM 0 H ASP A 130 -1.055 -0.367 -8.149 1.00 0.00 H new ATOM 0 HA ASP A 130 -0.280 -1.488 -10.800 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -2.352 0.013 -10.448 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -1.195 1.303 -10.186 1.00 0.00 H new ATOM 1815 N GLY A 131 2.084 -0.606 -10.546 1.00 0.00 N ATOM 1816 CA GLY A 131 3.462 -0.137 -10.416 1.00 0.00 C ATOM 1817 C GLY A 131 4.339 -0.844 -11.448 1.00 0.00 C ATOM 1818 O GLY A 131 3.814 -1.402 -12.414 1.00 0.00 O ATOM 0 H GLY A 131 1.977 -1.371 -11.212 1.00 0.00 H new ATOM 0 HA2 GLY A 131 3.506 0.942 -10.564 1.00 0.00 H new ATOM 0 HA3 GLY A 131 3.832 -0.336 -9.410 1.00 0.00 H new ATOM 1822 N ASP A 132 5.660 -0.803 -11.273 1.00 0.00 N ATOM 1823 CA ASP A 132 6.608 -1.456 -12.181 1.00 0.00 C ATOM 1824 C ASP A 132 7.644 -2.193 -11.345 1.00 0.00 C ATOM 1825 O ASP A 132 7.669 -3.426 -11.316 1.00 0.00 O ATOM 1826 CB ASP A 132 7.234 -0.429 -13.129 1.00 0.00 C ATOM 1827 CG ASP A 132 7.995 -1.084 -14.279 1.00 0.00 C ATOM 1828 OD1 ASP A 132 8.741 -2.050 -14.040 1.00 0.00 O ATOM 1829 OD2 ASP A 132 7.827 -0.652 -15.449 1.00 0.00 O ATOM 0 H ASP A 132 6.106 -0.315 -10.496 1.00 0.00 H new ATOM 0 HA ASP A 132 6.098 -2.183 -12.813 1.00 0.00 H new ATOM 0 HB2 ASP A 132 6.451 0.212 -13.534 1.00 0.00 H new ATOM 0 HB3 ASP A 132 7.913 0.213 -12.567 1.00 0.00 H new ATOM 1834 N HIS A 133 8.473 -1.428 -10.633 1.00 0.00 N ATOM 1835 CA HIS A 133 9.521 -1.881 -9.745 1.00 0.00 C ATOM 1836 C HIS A 133 8.840 -2.158 -8.418 1.00 0.00 C ATOM 1837 O HIS A 133 9.033 -1.474 -7.419 1.00 0.00 O ATOM 1838 CB HIS A 133 10.616 -0.822 -9.610 1.00 0.00 C ATOM 1839 CG HIS A 133 11.328 -0.471 -10.888 1.00 0.00 C ATOM 1840 ND1 HIS A 133 12.064 0.671 -11.076 1.00 0.00 N ATOM 1841 CD2 HIS A 133 11.398 -1.213 -12.035 1.00 0.00 C ATOM 1842 CE1 HIS A 133 12.612 0.607 -12.299 1.00 0.00 C ATOM 1843 NE2 HIS A 133 12.248 -0.535 -12.920 1.00 0.00 N ATOM 0 H HIS A 133 8.419 -0.410 -10.671 1.00 0.00 H new ATOM 0 HA HIS A 133 10.017 -2.774 -10.124 1.00 0.00 H new ATOM 0 HB2 HIS A 133 10.173 0.085 -9.198 1.00 0.00 H new ATOM 0 HB3 HIS A 133 11.352 -1.174 -8.887 1.00 0.00 H new ATOM 0 HD1 HIS A 133 12.175 1.432 -10.406 1.00 0.00 H new ATOM 0 HD2 HIS A 133 10.892 -2.148 -12.224 1.00 0.00 H new ATOM 0 HE1 HIS A 133 13.254 1.363 -12.727 1.00 0.00 H new ATOM 1851 N THR A 134 7.967 -3.144 -8.449 1.00 0.00 N ATOM 1852 CA THR A 134 7.203 -3.602 -7.315 1.00 0.00 C ATOM 1853 C THR A 134 7.324 -5.122 -7.232 1.00 0.00 C ATOM 1854 O THR A 134 7.831 -5.789 -8.135 1.00 0.00 O ATOM 1855 CB THR A 134 5.769 -3.053 -7.420 1.00 0.00 C ATOM 1856 OG1 THR A 134 5.082 -3.268 -6.200 1.00 0.00 O ATOM 1857 CG2 THR A 134 4.965 -3.641 -8.581 1.00 0.00 C ATOM 0 H THR A 134 7.765 -3.667 -9.301 1.00 0.00 H new ATOM 0 HA THR A 134 7.585 -3.222 -6.368 1.00 0.00 H new ATOM 0 HB THR A 134 5.863 -1.986 -7.624 1.00 0.00 H new ATOM 0 HG1 THR A 134 5.129 -2.458 -5.651 1.00 0.00 H new ATOM 0 HG21 THR A 134 3.966 -3.206 -8.589 1.00 0.00 H new ATOM 0 HG22 THR A 134 5.467 -3.415 -9.522 1.00 0.00 H new ATOM 0 HG23 THR A 134 4.889 -4.722 -8.460 1.00 0.00 H new ATOM 1865 N GLY A 135 6.848 -5.687 -6.131 1.00 0.00 N ATOM 1866 CA GLY A 135 6.868 -7.103 -5.846 1.00 0.00 C ATOM 1867 C GLY A 135 7.981 -7.386 -4.856 1.00 0.00 C ATOM 1868 O GLY A 135 7.772 -8.153 -3.910 1.00 0.00 O ATOM 0 H GLY A 135 6.420 -5.141 -5.383 1.00 0.00 H new ATOM 0 HA2 GLY A 135 5.909 -7.419 -5.436 1.00 0.00 H new ATOM 0 HA3 GLY A 135 7.025 -7.671 -6.763 1.00 0.00 H new ATOM 1872 N ASP A 136 9.155 -6.791 -5.064 1.00 0.00 N ATOM 1873 CA ASP A 136 10.298 -6.973 -4.185 1.00 0.00 C ATOM 1874 C ASP A 136 10.054 -6.240 -2.872 1.00 0.00 C ATOM 1875 O ASP A 136 9.777 -5.039 -2.827 1.00 0.00 O ATOM 1876 CB ASP A 136 11.623 -6.571 -4.832 1.00 0.00 C ATOM 1877 CG ASP A 136 11.873 -5.072 -4.886 1.00 0.00 C ATOM 1878 OD1 ASP A 136 11.347 -4.451 -5.837 1.00 0.00 O ATOM 1879 OD2 ASP A 136 12.708 -4.607 -4.078 1.00 0.00 O ATOM 0 H ASP A 136 9.336 -6.168 -5.851 1.00 0.00 H new ATOM 0 HA ASP A 136 10.396 -8.039 -3.981 1.00 0.00 H new ATOM 0 HB2 ASP A 136 12.438 -7.042 -4.283 1.00 0.00 H new ATOM 0 HB3 ASP A 136 11.652 -6.967 -5.847 1.00 0.00 H new ATOM 1884 N LEU A 137 10.090 -7.007 -1.789 1.00 0.00 N ATOM 1885 CA LEU A 137 9.894 -6.554 -0.438 1.00 0.00 C ATOM 1886 C LEU A 137 11.013 -7.091 0.437 1.00 0.00 C ATOM 1887 O LEU A 137 11.420 -8.249 0.302 1.00 0.00 O ATOM 1888 CB LEU A 137 8.496 -7.027 -0.019 1.00 0.00 C ATOM 1889 CG LEU A 137 8.357 -8.367 0.736 1.00 0.00 C ATOM 1890 CD1 LEU A 137 8.606 -8.240 2.246 1.00 0.00 C ATOM 1891 CD2 LEU A 137 6.938 -8.914 0.548 1.00 0.00 C ATOM 0 H LEU A 137 10.266 -8.010 -1.844 1.00 0.00 H new ATOM 0 HA LEU A 137 9.936 -5.469 -0.338 1.00 0.00 H new ATOM 0 HB2 LEU A 137 8.059 -6.249 0.607 1.00 0.00 H new ATOM 0 HB3 LEU A 137 7.886 -7.092 -0.920 1.00 0.00 H new ATOM 0 HG LEU A 137 9.113 -9.033 0.319 1.00 0.00 H new ATOM 0 HD11 LEU A 137 8.493 -9.217 2.717 1.00 0.00 H new ATOM 0 HD12 LEU A 137 9.616 -7.869 2.418 1.00 0.00 H new ATOM 0 HD13 LEU A 137 7.886 -7.544 2.676 1.00 0.00 H new ATOM 0 HD21 LEU A 137 6.839 -9.860 1.081 1.00 0.00 H new ATOM 0 HD22 LEU A 137 6.217 -8.198 0.943 1.00 0.00 H new ATOM 0 HD23 LEU A 137 6.747 -9.074 -0.513 1.00 0.00 H new ATOM 1903 N SER A 138 11.457 -6.272 1.374 1.00 0.00 N ATOM 1904 CA SER A 138 12.473 -6.532 2.351 1.00 0.00 C ATOM 1905 C SER A 138 12.157 -5.606 3.527 1.00 0.00 C ATOM 1906 O SER A 138 11.182 -4.846 3.552 1.00 0.00 O ATOM 1907 CB SER A 138 13.887 -6.315 1.787 1.00 0.00 C ATOM 1908 OG SER A 138 14.377 -7.457 1.112 1.00 0.00 O ATOM 0 H SER A 138 11.076 -5.330 1.470 1.00 0.00 H new ATOM 0 HA SER A 138 12.468 -7.576 2.666 1.00 0.00 H new ATOM 0 HB2 SER A 138 13.876 -5.467 1.102 1.00 0.00 H new ATOM 0 HB3 SER A 138 14.565 -6.058 2.601 1.00 0.00 H new ATOM 0 HG SER A 138 13.627 -7.953 0.721 1.00 0.00 H new ATOM 1914 N ALA A 139 13.027 -5.696 4.514 1.00 0.00 N ATOM 1915 CA ALA A 139 13.039 -4.997 5.788 1.00 0.00 C ATOM 1916 C ALA A 139 13.119 -3.464 5.709 1.00 0.00 C ATOM 1917 O ALA A 139 13.279 -2.827 6.754 1.00 0.00 O ATOM 1918 CB ALA A 139 14.205 -5.548 6.606 1.00 0.00 C ATOM 0 H ALA A 139 13.826 -6.325 4.437 1.00 0.00 H new ATOM 0 HA ALA A 139 12.073 -5.183 6.258 1.00 0.00 H new ATOM 0 HB1 ALA A 139 14.243 -5.043 7.571 1.00 0.00 H new ATOM 0 HB2 ALA A 139 14.067 -6.618 6.761 1.00 0.00 H new ATOM 0 HB3 ALA A 139 15.139 -5.377 6.070 1.00 0.00 H new ATOM 1924 N ALA A 140 13.106 -2.872 4.515 1.00 0.00 N ATOM 1925 CA ALA A 140 13.152 -1.435 4.283 1.00 0.00 C ATOM 1926 C ALA A 140 12.034 -0.982 3.337 1.00 0.00 C ATOM 1927 O ALA A 140 11.912 0.203 3.060 1.00 0.00 O ATOM 1928 CB ALA A 140 14.524 -1.032 3.764 1.00 0.00 C ATOM 0 H ALA A 140 13.061 -3.407 3.648 1.00 0.00 H new ATOM 0 HA ALA A 140 12.984 -0.928 5.233 1.00 0.00 H new ATOM 0 HB1 ALA A 140 14.547 0.044 3.594 1.00 0.00 H new ATOM 0 HB2 ALA A 140 15.284 -1.300 4.498 1.00 0.00 H new ATOM 0 HB3 ALA A 140 14.726 -1.552 2.827 1.00 0.00 H new ATOM 1934 N ASN A 141 11.214 -1.918 2.863 1.00 0.00 N ATOM 1935 CA ASN A 141 10.090 -1.712 1.967 1.00 0.00 C ATOM 1936 C ASN A 141 8.807 -2.060 2.715 1.00 0.00 C ATOM 1937 O ASN A 141 7.728 -1.580 2.382 1.00 0.00 O ATOM 1938 CB ASN A 141 10.211 -2.602 0.713 1.00 0.00 C ATOM 1939 CG ASN A 141 11.635 -2.858 0.234 1.00 0.00 C ATOM 1940 OD1 ASN A 141 12.382 -3.558 0.914 1.00 0.00 O ATOM 1941 ND2 ASN A 141 12.039 -2.343 -0.911 1.00 0.00 N ATOM 0 H ASN A 141 11.329 -2.900 3.113 1.00 0.00 H new ATOM 0 HA ASN A 141 10.078 -0.671 1.643 1.00 0.00 H new ATOM 0 HB2 ASN A 141 9.737 -3.561 0.921 1.00 0.00 H new ATOM 0 HB3 ASN A 141 9.650 -2.138 -0.098 1.00 0.00 H new ATOM 0 HD21 ASN A 141 12.986 -2.523 -1.246 1.00 0.00 H new ATOM 0 HD22 ASN A 141 11.405 -1.764 -1.462 1.00 0.00 H new ATOM 1948 N VAL A 142 8.920 -2.891 3.752 1.00 0.00 N ATOM 1949 CA VAL A 142 7.819 -3.344 4.578 1.00 0.00 C ATOM 1950 C VAL A 142 8.201 -3.251 6.053 1.00 0.00 C ATOM 1951 O VAL A 142 9.364 -3.437 6.426 1.00 0.00 O ATOM 1952 CB VAL A 142 7.413 -4.769 4.154 1.00 0.00 C ATOM 1953 CG1 VAL A 142 6.349 -5.366 5.082 1.00 0.00 C ATOM 1954 CG2 VAL A 142 6.842 -4.770 2.726 1.00 0.00 C ATOM 0 H VAL A 142 9.818 -3.277 4.044 1.00 0.00 H new ATOM 0 HA VAL A 142 6.949 -2.702 4.437 1.00 0.00 H new ATOM 0 HB VAL A 142 8.319 -5.373 4.208 1.00 0.00 H new ATOM 0 HG11 VAL A 142 6.094 -6.371 4.744 1.00 0.00 H new ATOM 0 HG12 VAL A 142 6.738 -5.413 6.099 1.00 0.00 H new ATOM 0 HG13 VAL A 142 5.457 -4.740 5.063 1.00 0.00 H new ATOM 0 HG21 VAL A 142 6.562 -5.786 2.447 1.00 0.00 H new ATOM 0 HG22 VAL A 142 5.963 -4.127 2.685 1.00 0.00 H new ATOM 0 HG23 VAL A 142 7.596 -4.398 2.032 1.00 0.00 H new ATOM 1964 N VAL A 143 7.216 -2.983 6.911 1.00 0.00 N ATOM 1965 CA VAL A 143 7.407 -2.882 8.347 1.00 0.00 C ATOM 1966 C VAL A 143 7.008 -4.213 8.976 1.00 0.00 C ATOM 1967 O VAL A 143 5.894 -4.722 8.813 1.00 0.00 O ATOM 1968 CB VAL A 143 6.673 -1.682 8.964 1.00 0.00 C ATOM 1969 CG1 VAL A 143 7.023 -1.516 10.450 1.00 0.00 C ATOM 1970 CG2 VAL A 143 7.044 -0.394 8.224 1.00 0.00 C ATOM 0 H VAL A 143 6.251 -2.829 6.617 1.00 0.00 H new ATOM 0 HA VAL A 143 8.459 -2.688 8.558 1.00 0.00 H new ATOM 0 HB VAL A 143 5.604 -1.872 8.871 1.00 0.00 H new ATOM 0 HG11 VAL A 143 6.487 -0.658 10.856 1.00 0.00 H new ATOM 0 HG12 VAL A 143 6.735 -2.415 10.994 1.00 0.00 H new ATOM 0 HG13 VAL A 143 8.096 -1.357 10.555 1.00 0.00 H new ATOM 0 HG21 VAL A 143 6.516 0.448 8.672 1.00 0.00 H new ATOM 0 HG22 VAL A 143 8.119 -0.229 8.297 1.00 0.00 H new ATOM 0 HG23 VAL A 143 6.761 -0.483 7.175 1.00 0.00 H new ATOM 1980 N PHE A 144 7.971 -4.791 9.684 1.00 0.00 N ATOM 1981 CA PHE A 144 7.909 -6.032 10.423 1.00 0.00 C ATOM 1982 C PHE A 144 7.126 -5.819 11.700 1.00 0.00 C ATOM 1983 O PHE A 144 6.180 -6.536 12.019 1.00 0.00 O ATOM 1984 CB PHE A 144 9.359 -6.371 10.739 1.00 0.00 C ATOM 1985 CG PHE A 144 10.302 -5.362 11.370 1.00 0.00 C ATOM 1986 CD1 PHE A 144 10.970 -4.434 10.545 1.00 0.00 C ATOM 1987 CD2 PHE A 144 10.645 -5.458 12.730 1.00 0.00 C ATOM 1988 CE1 PHE A 144 11.958 -3.593 11.074 1.00 0.00 C ATOM 1989 CE2 PHE A 144 11.660 -4.639 13.252 1.00 0.00 C ATOM 1990 CZ PHE A 144 12.308 -3.698 12.430 1.00 0.00 C ATOM 0 H PHE A 144 8.893 -4.360 9.758 1.00 0.00 H new ATOM 0 HA PHE A 144 7.418 -6.831 9.867 1.00 0.00 H new ATOM 0 HB2 PHE A 144 9.342 -7.240 11.397 1.00 0.00 H new ATOM 0 HB3 PHE A 144 9.819 -6.688 9.803 1.00 0.00 H new ATOM 0 HD1 PHE A 144 10.718 -4.371 9.497 1.00 0.00 H new ATOM 0 HD2 PHE A 144 10.130 -6.159 13.371 1.00 0.00 H new ATOM 0 HE1 PHE A 144 12.448 -2.867 10.442 1.00 0.00 H new ATOM 0 HE2 PHE A 144 11.945 -4.732 14.290 1.00 0.00 H new ATOM 0 HZ PHE A 144 13.074 -3.057 12.842 1.00 0.00 H new